A0A3Q0KS74_SCHMA Loading...

Ion_trans_2 domain-containing protein

AlphaFold DB (A0A5K4EUY1), UniProt , Accession A0A3Q0KS74, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,259 aa.

						>A0A3Q0KS74_SCHMA|A0A3Q0KS74
MPCIRDPFPWWLPLALSCSIVLITIFIGIFRWLYKIYSRHKRLKIRSSRQFIQYKQLSPLSIDNQRTLSLQSTNDDLTDDYPGLFADYKDDQEFDEFTESEENIDSMHKNCSPSRYLISRNKKLRRIKTISSKKPDISTLPIIKINDIHLPHHHHHYQQQQEEQEQQPHKPLLHKSNSVNSSKTPLSDLQSSPSCLETQSDTTYINDFFTVKPTNNHILLSENSTPSYWEESNRCNWFVNWFKYTRLGMSARQQLNMKLYCERFTTVSYPAGKIMLTIYIVLSTVSWLFYVVENRNNPPVSIRGICHTLRSKILSWINFGINLFCLGYYILKLCAATDRVRFVLSFSSLIDIISIPPALCSVFETHRHIDLNFLRSMCFLYYVDTLTYLGVITSNQGIQSARIVFTLFTIWMVGSGIMHVIEHLGDFWLNENHRGTWSYFESCYFLLVTLSTVGYGDYVTHSTLGRLFICIFIPVAMGVSASFVPELFRNFNNNYTNSSDRYEPISGERHVIVCGNFDNESIRAFIKGFLYGCQAKGRMRINMVLLRPIPLDYALKAILSPYHAWVRYFLGTPNNPHDLARTKLKEARAAFILATPNTKFRDDEDSANIMQAIAIKARKKNLRVILQLHYFRNKCLMNNFPRWTYLANDMVVCMEELKLGLMAYNCLAPGFSTLIVNLLNAHGSKPRVFEYERWRIEYEYGFRMQLHDVGISHEFSNLFIRDLAIFVYEKWNLILLAVRINGLEKSSILINPIEVNCPVNNNSMRAIVISSDYSSALNLQYYCVTCEGHLIGQPCRCSRPVLEKRRKITIARDLALYEQIGKARENAVKAETWSYDTRSTHFFRHSFTATSPNLLHDTRNLLFDQPRGRSETRKMDINSRNLGLPNNIPVRCMNCSPIRTPSHSSQVDRTGSFHWVPDIPLTRATLSPNQAASLNFSRHFLVCVAGKSTNGPLNLENFIMPLRFHWQRVRDIVILGDSHLIGPLEWVKLKNLPRIFIVDGDPCSFNDLHSVHLCQCNACVVLGYSAEEPHSQCVDPSLQDRVTLLCAMNIRSLLQKEQHLVHLTTELHYEKNAYLFSSGDIHENDYKLPVWFSEPFARGIIFSNTLLYSCLSSFFYNDNIFRFLRVLISGQSTDELEASFSVGAGLQQQATPQSTRMAGVKVSLRGFRHAPFKFLTRISLRKPLTFKDVYIRCITCWQILCLGLYRWQENGFRYVIANPMPDTQIYENDMFYCFMPIDQDDSNKNWKFSEIIQPQNEST
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.1	Very low	42.7	Very low	230 Å²	230	146.5 Å²	146.5	100%	1.133	72%	0.718	S	S	*	*				0	127.9	0	-75.6	-174.7	164.6	0	0	107.6	C3	M1-C3 PolarHBondContact O-N 3.02Å
2	P	39	Very low	43.3	Very low	120 Å²	120	142.9 Å²	142.9	78%	0.779	70%	0.703	S	S	*	*			trans	-67.1	120.9	177.9	28.4	-30	0	0	0	108.8	I4	P2-I4 PolarHBondContact O-N 3.08Å; P2-I4 VanDerWaalsContact O-N 3.09Å
3	C	35.5	Very low	44.4	Very low	74 Å²	74	138.8 Å²	138.8	50%	0.5	69%	0.693	S	S	.	*			trans	-68.4	100.3	174.4	-65.1	0	0	0	0	107.1	M1 C306	M1-C3 PolarHBondContact O-N 3.02Å; C3-C306 WeakPolarHBondContact CB-SG 3.47Å; C3-C306 WeakPolarHBondContact SG-CB 3.35Å; C3-C306 CovalentContact SG-SG 2.11Å; C3-C306 PolarHBondContact SG-SG 3.14Å
4	I	40.9	Very low	45.2	Very low	142 Å²	142	136.1 Å²	136.1	73%	0.728	68%	0.682	S	S	*	*			trans	-66.8	135.3	177.4	-69.2	168.3	0	0	0	109.3	P2	P2-I4 PolarHBondContact O-N 3.08Å; P2-I4 VanDerWaalsContact O-N 3.09Å
5	R	33.7	Very low	45.8	Very low	235 Å²	235	128.9 Å²	128.9	89%	0.887	65%	0.652	S	S	*	*			trans	-98.6	97.7	-169.5	-172.1	-173.5	-160.8	-174.1	4.3	109.3
6	D	36.7	Very low	46.6	Very low	149 Å²	149	127.6 Å²	127.6	80%	0.797	65%	0.646	S	S	*	*			trans	-101.2	122.9	166.9	-74.1	-22.9	0	0	0	109.9
7	P	40.9	Very low	47.4	Very low	108 Å²	108	123.2 Å²	123.2	70%	0.701	63%	0.63	S	S	*	*			trans	-82.7	151.2	172.3	33.8	-29.1	0	0	0	110.2
8	F	46.3	Very low	47.7	Very low	190 Å²	190	120.2 Å²	120.2	83%	0.833	62%	0.621	S	S	*	*			trans	86.2	118	169.4	-100.3	-98.7	0	0	0	119.2	W10	F8-W10 PolarHBondContact O-N 3.13Å
9	P	52.1	Low	48.3	Very low	59 Å²	59	116.8 Å²	116.8	38%	0.383	61%	0.609	S	S	.	*			trans	-88.4	85.4	-178.5	36	-31.7	0	0	0	111.2	W11 L12	P9-W11 HydrophobicContact CB-CD2 4.31Å; P9-W11 HydrophobicContact CB-CG 4.36Å; P9-W11 HydrophobicContact CB-CZ2 4.2Å; P9-W11 VanDerWaalsContact CB-NE1 3.35Å; P9-W11 PolarHBondContact O-N 2.88Å; P9-L12 HydrophobicContact CB-CD1 4.35Å; P9-L12 HydrophobicContact CG-CD1 4.15Å
10	W	52	Low	49.1	Very low	215 Å²	215	116.3 Å²	116.3	81%	0.814	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-8.4	165.5	54	-73	0	0	0	112.9	F8 P13	F8-W10 PolarHBondContact O-N 3.13Å; W10-P13 WeakPolarHBondContact O-CD 3.43Å
11	W	55.6	Low	49.9	Very low	90 Å²	90	114.4 Å²	114.4	34%	0.341	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.1	-4.9	-178.3	58.1	-93	0	0	0	114.6	P9 P13 L14 A15 F363	P9-W11 HydrophobicContact CB-CD2 4.31Å; P9-W11 HydrophobicContact CB-CG 4.36Å; P9-W11 HydrophobicContact CB-CZ2 4.2Å; P9-W11 VanDerWaalsContact CB-NE1 3.35Å; P9-W11 PolarHBondContact O-N 2.88Å; W11-P13 VanDerWaalsContact C-CD 3.46Å; W11-L14 CarbonylContact O-C 3.48Å; W11-L14 WeakPolarHBondContact O-CA 3.41Å; W11-L14 WeakPolarHBondContact O-CB 3.35Å; W11-L14 PolarHBondContact O-N 3.31Å; W11-A15 HydrophobicContact CE3-CB 3.84Å; W11-A15 HydrophobicContact CZ3-CB 4Å; W11-A15 PolarHBondContact O-N 3.05Å; W11-F363 HydrophobicContact CH2-CB 4.09Å; W11-F363 HydrophobicContact CZ3-CB 4.19Å
12	L	50.2	Low	51.1	Low	103 Å²	103	106.7 Å²	106.7	54%	0.539	56%	0.562	S	S	.	*	H	α-helix	trans	-54.5	-42.6	177.8	-133	102.7	0	0	0	113.7	P9 L14 L16	P9-L12 HydrophobicContact CB-CD1 4.35Å; P9-L12 HydrophobicContact CG-CD1 4.15Å; L12-L14 VanDerWaalsContact C-N 3.33Å; L12-L16 PolarHBondContact O-N 3.12Å; L12-L16 VanDerWaalsContact O-N 3.13Å
13	P	57.2	Low	52.3	Low	89 Å²	89	105.7 Å²	105.7	58%	0.578	55%	0.549	S	S	*	.	H	α-helix	trans	-68	-33.6	173.6	-16.2	30.4	0	0	0	112.4	W10 W11 L16 S17	W10-P13 WeakPolarHBondContact O-CD 3.43Å; W11-P13 VanDerWaalsContact C-CD 3.46Å; P13-L16 PolarHBondContact O-N 3.23Å; P13-S17 PolarHBondContact O-N 2.88Å
14	L	55.8	Low	53.8	Low	101 Å²	101	106 Å²	106	53%	0.529	55%	0.549	S	S	.	.	H	α-helix	trans	-70.2	-39.4	178.4	-108.6	148.7	0	0	0	111.6	W11 L12 S17 C18	W11-L14 CarbonylContact O-C 3.48Å; W11-L14 WeakPolarHBondContact O-CA 3.41Å; W11-L14 WeakPolarHBondContact O-CB 3.35Å; W11-L14 PolarHBondContact O-N 3.31Å; L12-L14 VanDerWaalsContact C-N 3.33Å; L14-S17 WeakPolarHBondContact CA-OG 3.2Å; L14-S17 PolarHBondContact O-N 2.99Å; L14-S17 PolarHBondContact O-OG 2.97Å; L14-C18 WeakPolarHBondContact O-CB 3.45Å; L14-C18 PolarHBondContact O-N 3.13Å
15	A	53.9	Low	55.1	Low	28 Å²	28	103.2 Å²	103.2	23%	0.231	54%	0.535	C	S	.	.	H	α-helix	trans	-65.3	-41.3	172.3	0	0	0	0	0	111.8	W11 S17 C18 S19	W11-A15 HydrophobicContact CE3-CB 3.84Å; W11-A15 HydrophobicContact CZ3-CB 4Å; W11-A15 PolarHBondContact O-N 3.05Å; A15-S17 VanDerWaalsContact C-N 3.32Å; A15-S17 PolarHBondContact O-N 3.18Å; A15-C18 PolarHBondContact O-N 2.06Å; A15-S19 WeakPolarHBondContact O-CB 3Å; A15-S19 PolarHBondContact O-N 3.14Å; A15-S19 PolarHBondContact O-OG 3.01Å
16	L	58.5	Low	56.4	Low	108 Å²	108	96.2 Å²	96.2	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-60.1	-42.6	170.9	-85.3	158.9	0	0	0	111.4	L12 P13 S19 I20	L12-L16 PolarHBondContact O-N 3.12Å; L12-L16 VanDerWaalsContact O-N 3.13Å; P13-L16 PolarHBondContact O-N 3.23Å; L16-S19 WeakPolarHBondContact O-CB 3.36Å; L16-S19 PolarHBondContact O-N 3.32Å; L16-I20 WeakPolarHBondContact O-CG1 3.41Å; L16-I20 PolarHBondContact O-N 3.17Å
17	S	60.1	Low	57.9	Low	54 Å²	54	93.4 Å²	93.4	38%	0.378	50%	0.495	S	S	.	.	H	α-helix	trans	-65.8	-42.3	176.7	79.3	0	0	0	0	112.6	P13 L14 A15 S19 I20 V21	P13-S17 PolarHBondContact O-N 2.88Å; L14-S17 WeakPolarHBondContact CA-OG 3.2Å; L14-S17 PolarHBondContact O-N 2.99Å; L14-S17 PolarHBondContact O-OG 2.97Å; A15-S17 VanDerWaalsContact C-N 3.32Å; A15-S17 PolarHBondContact O-N 3.18Å; S17-S19 VanDerWaalsContact C-N 3.32Å; S17-S19 PolarHBondContact O-N 3.24Å; S17-I20 PolarHBondContact O-N 3.42Å; S17-V21 VanDerWaalsContact O-CG2 3.31Å; S17-V21 WeakPolarHBondContact O-CG2 3.46Å; S17-V21 PolarHBondContact O-N 3.05Å
18	C	54.2	Low	59.3	Low	68 Å²	68	90 Å²	90	46%	0.459	48%	0.48	S	S	.	.	H	α-helix	trans	-64.8	-35.9	174.1	-95.8	0	0	0	0	111.9	L14 A15 V21 L22	L14-C18 WeakPolarHBondContact O-CB 3.45Å; L14-C18 PolarHBondContact O-N 3.13Å; A15-C18 PolarHBondContact O-N 2.06Å; C18-V21 PolarHBondContact O-N 3.22Å; C18-L22 WeakPolarHBondContact O-CB 3.19Å; C18-L22 VanDerWaalsContact O-CG 3.29Å; C18-L22 WeakPolarHBondContact O-CG 3.49Å; C18-L22 PolarHBondContact O-N 2.98Å
19	S	57.5	Low	60.4	Low	57 Å²	57	85.1 Å²	85.1	40%	0.399	46%	0.461	S	S	.	.	H	α-helix	trans	-62.5	-45.6	174.6	-53.7	0	0	0	0	110.7	A15 L16 S17 L22 I23	A15-S19 WeakPolarHBondContact O-CB 3Å; A15-S19 PolarHBondContact O-N 3.14Å; A15-S19 PolarHBondContact O-OG 3.01Å; L16-S19 WeakPolarHBondContact O-CB 3.36Å; L16-S19 PolarHBondContact O-N 3.32Å; S17-S19 VanDerWaalsContact C-N 3.32Å; S17-S19 PolarHBondContact O-N 3.24Å; S19-L22 PolarHBondContact O-N 2.52Å; S19-I23 WeakPolarHBondContact O-CB 3.42Å; S19-I23 WeakPolarHBondContact O-CD1 3.34Å; S19-I23 WeakPolarHBondContact O-CG1 3.28Å; S19-I23 PolarHBondContact O-N 3.19Å
20	I	64.6	Low	60.8	Low	106 Å²	106	86 Å²	86	54%	0.544	46%	0.459	S	S	.	.	H	α-helix	trans	-62.9	-44.8	175.8	-65.9	163.6	0	0	0	110.2	L16 S17 L22 I23 T24	L16-I20 WeakPolarHBondContact O-CG1 3.41Å; L16-I20 PolarHBondContact O-N 3.17Å; S17-I20 PolarHBondContact O-N 3.42Å; I20-L22 PolarHBondContact O-N 3.38Å; I20-I23 PolarHBondContact O-N 3.31Å; I20-T24 WeakPolarHBondContact O-CG2 3.44Å; I20-T24 PolarHBondContact O-N 3.49Å
21	V	65.9	Low	61.5	Low	77 Å²	77	84.7 Å²	84.7	47%	0.467	45%	0.454	S	S	.	.	H	α-helix	trans	-61.1	-46.3	176.8	172.4	0	0	0	0	111.1	S17 C18 I23 T24 I25	S17-V21 VanDerWaalsContact O-CG2 3.31Å; S17-V21 WeakPolarHBondContact O-CG2 3.46Å; S17-V21 PolarHBondContact O-N 3.05Å; C18-V21 PolarHBondContact O-N 3.22Å; V21-I23 VanDerWaalsContact C-N 3.33Å; V21-I23 PolarHBondContact O-N 3.39Å; V21-T24 WeakPolarHBondContact CA-OG1 3.29Å; V21-T24 PolarHBondContact O-N 3.47Å; V21-T24 VanDerWaalsContact O-N 3.11Å; V21-T24 PolarHBondContact O-OG1 3.5Å; V21-I25 HydrophobicContact CG1-CD1 3.84Å; V21-I25 HydrophobicContact CG1-CG1 4.4Å; V21-I25 WeakPolarHBondContact O-CG1 3.48Å; V21-I25 PolarHBondContact O-N 3.38Å
22	L	62.1	Low	62.1	Low	68 Å²	68	88.1 Å²	88.1	36%	0.356	47%	0.467	S	S	.	.	H	α-helix	trans	-62.3	-39.1	176.3	-75.3	169	0	0	0	112	C18 S19 I20 I25 F26	C18-L22 WeakPolarHBondContact O-CB 3.19Å; C18-L22 VanDerWaalsContact O-CG 3.29Å; C18-L22 WeakPolarHBondContact O-CG 3.49Å; C18-L22 PolarHBondContact O-N 2.98Å; S19-L22 PolarHBondContact O-N 2.52Å; I20-L22 PolarHBondContact O-N 3.38Å; L22-I25 PolarHBondContact O-N 3.38Å; L22-F26 WeakPolarHBondContact O-CB 3.47Å; L22-F26 PolarHBondContact O-N 3.05Å
23	I	64.9	Low	62.8	Low	99 Å²	99	87.6 Å²	87.6	51%	0.508	46%	0.464	S	S	.	.	H	α-helix	trans	-62.5	-42.7	172.7	-69.8	162.7	0	0	0	110.4	S19 I20 V21 F26 I27	S19-I23 WeakPolarHBondContact O-CB 3.42Å; S19-I23 WeakPolarHBondContact O-CD1 3.34Å; S19-I23 WeakPolarHBondContact O-CG1 3.28Å; S19-I23 PolarHBondContact O-N 3.19Å; I20-I23 PolarHBondContact O-N 3.31Å; V21-I23 VanDerWaalsContact C-N 3.33Å; V21-I23 PolarHBondContact O-N 3.39Å; I23-F26 PolarHBondContact O-N 3.05Å; I23-I27 HydrophobicContact CG2-CD1 3.8Å; I23-I27 HydrophobicContact CG2-CG1 4.44Å; I23-I27 WeakPolarHBondContact O-CB 3.29Å; I23-I27 VanDerWaalsContact O-CG1 3.24Å; I23-I27 WeakPolarHBondContact O-CG1 3.23Å; I23-I27 PolarHBondContact O-N 3.2Å
24	T	66.7	Low	63	Low	79 Å²	79	89.5 Å²	89.5	49%	0.485	46%	0.461	S	S	.	.	H	α-helix	trans	-66.5	-37.3	176.5	63.5	0	0	0	0	112.9	I20 V21 I27 G28	I20-T24 WeakPolarHBondContact O-CG2 3.44Å; I20-T24 PolarHBondContact O-N 3.49Å; V21-T24 WeakPolarHBondContact CA-OG1 3.29Å; V21-T24 PolarHBondContact O-N 3.47Å; V21-T24 VanDerWaalsContact O-N 3.11Å; V21-T24 PolarHBondContact O-OG1 3.5Å; T24-I27 PolarHBondContact O-N 3.21Å; T24-G28 PolarHBondContact O-N 3.44Å
25	I	68.7	Low	63.6	Low	84 Å²	84	91.4 Å²	91.4	43%	0.431	47%	0.465	S	S	.	.	H	α-helix	trans	-64.9	-43.7	173.1	-68.4	168.3	0	0	0	109.6	V21 L22 I27 G28 I29	V21-I25 HydrophobicContact CG1-CD1 3.84Å; V21-I25 HydrophobicContact CG1-CG1 4.4Å; V21-I25 WeakPolarHBondContact O-CG1 3.48Å; V21-I25 PolarHBondContact O-N 3.38Å; L22-I25 PolarHBondContact O-N 3.38Å; I25-I27 PolarHBondContact O-N 3.21Å; I25-G28 CarbonylContact O-C 3.5Å; I25-G28 WeakPolarHBondContact O-CA 3.38Å; I25-G28 PolarHBondContact O-N 3.19Å; I25-G28 VanDerWaalsContact O-N 3.1Å; I25-I29 HydrophobicContact CG2-CD1 3.82Å; I25-I29 HydrophobicContact CG2-CG1 4.35Å; I25-I29 WeakPolarHBondContact O-CG1 3.35Å; I25-I29 PolarHBondContact O-N 3.21Å
26	F	61.2	Low	64.3	Low	88 Å²	88	93.4 Å²	93.4	39%	0.386	47%	0.471	S	S	.	.	H	α-helix	trans	-60.9	-45.9	175.9	-118.7	-88.7	0	0	0	111.5	L22 I23 G28 I29 F30 L323	L22-F26 WeakPolarHBondContact O-CB 3.47Å; L22-F26 PolarHBondContact O-N 3.05Å; I23-F26 PolarHBondContact O-N 3.05Å; F26-G28 VanDerWaalsContact C-N 3.26Å; F26-G28 PolarHBondContact O-N 2.96Å; F26-I29 PolarHBondContact O-N 3.42Å; F26-F30 VanDerWaalsContact O-CB 3.27Å; F26-F30 WeakPolarHBondContact O-CB 3.29Å; F26-F30 PolarHBondContact O-N 3.18Å; F26-L323 HydrophobicContact CE2-CD1 4.37Å; F26-L323 HydrophobicContact CE2-CD2 3.98Å; F26-L323 HydrophobicContact CE2-CG 3.97Å
27	I	68.7	Low	64.7	Low	91 Å²	91	94.6 Å²	94.6	47%	0.467	47%	0.469	S	S	.	.	H	α-helix	trans	-61.3	-37.2	174	-67.9	165.6	0	0	0	110.7	I23 T24 I25 F30 R31	I23-I27 HydrophobicContact CG2-CD1 3.8Å; I23-I27 HydrophobicContact CG2-CG1 4.44Å; I23-I27 WeakPolarHBondContact O-CB 3.29Å; I23-I27 VanDerWaalsContact O-CG1 3.24Å; I23-I27 WeakPolarHBondContact O-CG1 3.23Å; I23-I27 PolarHBondContact O-N 3.2Å; T24-I27 PolarHBondContact O-N 3.21Å; I25-I27 PolarHBondContact O-N 3.21Å; I27-F30 PolarHBondContact O-N 3.36Å; I27-R31 WeakPolarHBondContact O-CB 3.37Å; I27-R31 PolarHBondContact O-N 3.16Å
28	G	68.9	Low	65	Low	37 Å²	37	93.2 Å²	93.2	38%	0.381	46%	0.459	S	S	.	.	H	α-helix	trans	-64.1	-48.9	175.1	0	0	0	0	0	113	T24 I25 F26 F30 R31 W32	T24-G28 PolarHBondContact O-N 3.44Å; I25-G28 CarbonylContact O-C 3.5Å; I25-G28 WeakPolarHBondContact O-CA 3.38Å; I25-G28 PolarHBondContact O-N 3.19Å; I25-G28 VanDerWaalsContact O-N 3.1Å; F26-G28 VanDerWaalsContact C-N 3.26Å; F26-G28 PolarHBondContact O-N 2.96Å; G28-F30 VanDerWaalsContact C-N 3.3Å; G28-F30 PolarHBondContact O-N 3.35Å; G28-R31 PolarHBondContact O-N 3.02Å; G28-W32 WeakPolarHBondContact O-CB 3.23Å; G28-W32 PolarHBondContact O-N 2.87Å
29	I	70	Confident	65.3	Low	86 Å²	86	98.5 Å²	98.5	44%	0.441	47%	0.469	S	S	.	.	H	α-helix	trans	-60.9	-42.4	174.3	-67.4	167	0	0	0	109.8	I25 F26 W32 L33	I25-I29 HydrophobicContact CG2-CD1 3.82Å; I25-I29 HydrophobicContact CG2-CG1 4.35Å; I25-I29 WeakPolarHBondContact O-CG1 3.35Å; I25-I29 PolarHBondContact O-N 3.21Å; F26-I29 PolarHBondContact O-N 3.42Å; I29-W32 PolarHBondContact O-N 3.41Å; I29-L33 HydrophobicContact CG2-CD1 3.9Å; I29-L33 HydrophobicContact CG2-CG 4.33Å; I29-L33 WeakPolarHBondContact O-CB 3.49Å; I29-L33 WeakPolarHBondContact O-CG 3.41Å; I29-L33 PolarHBondContact O-N 2.61Å
30	F	60.1	Low	65.5	Low	78 Å²	78	101.9 Å²	101.9	34%	0.342	48%	0.479	S	S	.	.	H	α-helix	trans	-63.7	-42.2	177.2	-147.3	-96.4	0	0	0	112.1	F26 I27 G28 Y34 Y260 L331	F26-F30 VanDerWaalsContact O-CB 3.27Å; F26-F30 WeakPolarHBondContact O-CB 3.29Å; F26-F30 PolarHBondContact O-N 3.18Å; I27-F30 PolarHBondContact O-N 3.36Å; G28-F30 VanDerWaalsContact C-N 3.3Å; G28-F30 PolarHBondContact O-N 3.35Å; F30-Y34 WeakPolarHBondContact O-CB 3.47Å; F30-Y34 PolarHBondContact O-N 3.28Å; F30-Y260 HydrophobicContact CD1-CE1 4.49Å; F30-Y260 HydrophobicContact CE1-CD1 4.08Å; F30-Y260 AromaticContact CE1-CE1 3.25Å; F30-Y260 HydrophobicContact CE1-CE1 3.25Å; F30-Y260 AromaticContact CE1-CZ 3.78Å; F30-Y260 HydrophobicContact CZ-CD1 4.24Å; F30-Y260 AromaticContact CZ-CE1 3.4Å; F30-Y260 HydrophobicContact CZ-CE1 3.4Å; F30-L331 HydrophobicContact CZ-CD2 4.38Å
31	R	66.2	Low	64.8	Low	187 Å²	187	100.9 Å²	100.9	71%	0.706	47%	0.47	S	S	*	.	H	α-helix	trans	-63.6	-38.9	172.9	-91.4	-179	157.1	166.7	-4	112.1	I27 G28 Y34 K35	I27-R31 WeakPolarHBondContact O-CB 3.37Å; I27-R31 PolarHBondContact O-N 3.16Å; G28-R31 PolarHBondContact O-N 3.02Å; R31-Y34 WeakPolarHBondContact O-CB 3.47Å; R31-Y34 PolarHBondContact O-N 3.46Å; R31-K35 WeakPolarHBondContact O-CB 3.49Å; R31-K35 PolarHBondContact O-N 3.22Å
32	W	69.3	Low	64.3	Low	162 Å²	162	106.4 Å²	106.4	61%	0.614	48%	0.483	S	S	*	.	H	α-helix	trans	-69.1	-47.4	178.3	-175.6	82.1	0	0	0	111.8	G28 I29 Y34 K35 I36	G28-W32 WeakPolarHBondContact O-CB 3.23Å; G28-W32 PolarHBondContact O-N 2.87Å; I29-W32 PolarHBondContact O-N 3.41Å; W32-Y34 VanDerWaalsContact C-N 3.28Å; W32-Y34 PolarHBondContact O-N 2.94Å; W32-K35 WeakPolarHBondContact O-CB 3.32Å; W32-K35 PolarHBondContact O-N 3.38Å; W32-I36 HydrophobicContact CD2-CD1 3.67Å; W32-I36 HydrophobicContact CE3-CD1 3.65Å; W32-I36 HydrophobicContact CH2-CD1 3.41Å; W32-I36 VanDerWaalsContact CH2-CD1 3.41Å; W32-I36 HydrophobicContact CZ2-CD1 3.44Å; W32-I36 VanDerWaalsContact CZ2-CD1 3.44Å; W32-I36 HydrophobicContact CZ3-CD1 3.51Å; W32-I36 PolarHBondContact O-N 3.31Å
33	L	64.1	Low	63.8	Low	92 Å²	92	109.2 Å²	109.2	48%	0.482	50%	0.498	S	S	.	.	H	α-helix	trans	-59.4	-39.2	171.7	-72.7	172.6	0	0	0	111.4	I29 I36 Y37	I29-L33 HydrophobicContact CG2-CD1 3.9Å; I29-L33 HydrophobicContact CG2-CG 4.33Å; I29-L33 WeakPolarHBondContact O-CB 3.49Å; I29-L33 WeakPolarHBondContact O-CG 3.41Å; I29-L33 PolarHBondContact O-N 2.61Å; L33-I36 PolarHBondContact O-N 2.92Å; L33-Y37 WeakPolarHBondContact O-CB 3.45Å; L33-Y37 PolarHBondContact O-N 2.7Å
34	Y	60.8	Low	63	Low	130 Å²	130	111.7 Å²	111.7	51%	0.51	51%	0.505	S	S	.	.	H	α-helix	trans	-62.6	-40.9	172.7	179.5	-96	0	0	0	112	F30 R31 W32 Y37 S38 Y260	F30-Y34 WeakPolarHBondContact O-CB 3.47Å; F30-Y34 PolarHBondContact O-N 3.28Å; R31-Y34 WeakPolarHBondContact O-CB 3.47Å; R31-Y34 PolarHBondContact O-N 3.46Å; W32-Y34 VanDerWaalsContact C-N 3.28Å; W32-Y34 PolarHBondContact O-N 2.94Å; Y34-Y37 PolarHBondContact O-N 3.15Å; Y34-S38 WeakPolarHBondContact O-CB 3.49Å; Y34-S38 PolarHBondContact O-N 2.99Å; Y34-S38 PolarHBondContact O-OG 3.43Å; Y34-Y260 HydrophobicContact CD2-CE2 4.15Å; Y34-Y260 HydrophobicContact CE2-CE2 4.38Å
35	K	68.6	Low	62.3	Low	141 Å²	141	111.3 Å²	111.3	61%	0.613	50%	0.499	S	S	*	.	H	α-helix	trans	-64.7	-43.8	177.7	-139	175	-173.9	178.6	0	110.9	R31 W32 S38 R39	R31-K35 WeakPolarHBondContact O-CB 3.49Å; R31-K35 PolarHBondContact O-N 3.22Å; W32-K35 WeakPolarHBondContact O-CB 3.32Å; W32-K35 PolarHBondContact O-N 3.38Å; K35-S38 PolarHBondContact O-OG 3.13Å; K35-S38 VanDerWaalsContact O-OG 3.04Å; K35-R39 WeakPolarHBondContact O-CB 3.36Å; K35-R39 PolarHBondContact O-N 3.16Å
36	I	70.1	Confident	61	Low	69 Å²	69	117.9 Å²	117.9	35%	0.354	52%	0.518	S	S	.	.	H	α-helix	trans	-64.2	-49.7	175.5	-68.1	172.6	0	0	0	110.9	W32 L33 S38 R39 H40	W32-I36 HydrophobicContact CD2-CD1 3.67Å; W32-I36 HydrophobicContact CE3-CD1 3.65Å; W32-I36 HydrophobicContact CH2-CD1 3.41Å; W32-I36 VanDerWaalsContact CH2-CD1 3.41Å; W32-I36 HydrophobicContact CZ2-CD1 3.44Å; W32-I36 VanDerWaalsContact CZ2-CD1 3.44Å; W32-I36 HydrophobicContact CZ3-CD1 3.51Å; W32-I36 PolarHBondContact O-N 3.31Å; L33-I36 PolarHBondContact O-N 2.92Å; I36-S38 VanDerWaalsContact C-N 3.34Å; I36-S38 PolarHBondContact O-N 3.17Å; I36-R39 PolarHBondContact O-N 3.22Å; I36-H40 PolarHBondContact O-N 3.3Å
37	Y	65.1	Low	60.3	Low	134 Å²	134	116.8 Å²	116.8	53%	0.525	52%	0.522	S	S	.	.	H	α-helix	trans	-62.4	-40.4	178.8	-178.1	-106.5	0	0	0	111.8	L33 Y34 R39 H40 K41	L33-Y37 WeakPolarHBondContact O-CB 3.45Å; L33-Y37 PolarHBondContact O-N 2.7Å; Y34-Y37 PolarHBondContact O-N 3.15Å; Y37-R39 PolarHBondContact O-N 3.29Å; Y37-H40 PolarHBondContact O-N 2.87Å; Y37-K41 HydrophobicContact CE1-CD 4.17Å; Y37-K41 VanDerWaalsContact O-CB 3.23Å; Y37-K41 WeakPolarHBondContact O-CB 3.4Å; Y37-K41 PolarHBondContact O-N 3.34Å
38	S	67.3	Low	59	Low	25 Å²	25	114.8 Å²	114.8	18%	0.175	52%	0.516	C	S	.	.	H	α-helix	trans	-67	-35.3	176.7	84.3	0	0	0	0	112.5	Y34 K35 I36 R42	Y34-S38 WeakPolarHBondContact O-CB 3.49Å; Y34-S38 PolarHBondContact O-N 2.99Å; Y34-S38 PolarHBondContact O-OG 3.43Å; K35-S38 PolarHBondContact O-OG 3.13Å; K35-S38 VanDerWaalsContact O-OG 3.04Å; I36-S38 VanDerWaalsContact C-N 3.34Å; I36-S38 PolarHBondContact O-N 3.17Å; S38-R42 WeakPolarHBondContact O-CG 3.23Å; S38-R42 PolarHBondContact O-N 3.47Å
39	R	59.8	Low	57.7	Low	178 Å²	178	122 Å²	122	67%	0.672	53%	0.532	S	S	*	.	H	α-helix	trans	-66.6	-46.3	173	-84.5	-177.3	167.4	177.3	-4.3	110.7	K35 I36 Y37 K41 R42 L43	K35-R39 WeakPolarHBondContact O-CB 3.36Å; K35-R39 PolarHBondContact O-N 3.16Å; I36-R39 PolarHBondContact O-N 3.22Å; Y37-R39 PolarHBondContact O-N 3.29Å; R39-K41 VanDerWaalsContact C-N 3.33Å; R39-K41 PolarHBondContact O-N 3.25Å; R39-R42 PolarHBondContact O-N 3.29Å; R39-L43 PolarHBondContact O-N 3.49Å; R39-L43 VanDerWaalsContact O-N 3.13Å
40	H	62	Low	56.3	Low	128 Å²	128	125.1 Å²	125.1	59%	0.593	54%	0.544	S	S	*	.	H	α-helix	trans	-64.1	-36.7	176.4	-118.1	-70.8	0	0	0	112.5	I36 Y37 L43 K44	I36-H40 PolarHBondContact O-N 3.3Å; Y37-H40 PolarHBondContact O-N 2.87Å; H40-L43 PolarHBondContact O-N 3.05Å; H40-K44 WeakPolarHBondContact O-CB 3.32Å; H40-K44 PolarHBondContact O-N 3.43Å
41	K	51.2	Low	55.1	Low	85 Å²	85	129.9 Å²	129.9	37%	0.37	57%	0.565	S	S	.	*	H	α-helix	trans	-72.1	-36.4	178.4	-161	-178.2	-175.6	-175.8	0	112.3	Y37 R39 L43 K44 I45	Y37-K41 HydrophobicContact CE1-CD 4.17Å; Y37-K41 VanDerWaalsContact O-CB 3.23Å; Y37-K41 WeakPolarHBondContact O-CB 3.4Å; Y37-K41 PolarHBondContact O-N 3.34Å; R39-K41 VanDerWaalsContact C-N 3.33Å; R39-K41 PolarHBondContact O-N 3.25Å; K41-L43 VanDerWaalsContact C-N 3.33Å; K41-K44 PolarHBondContact O-N 2.96Å; K41-I45 HydrophobicContact CD-CD1 4.24Å; K41-I45 HydrophobicContact CG-CD1 3.69Å; K41-I45 HydrophobicContact CG-CG1 4.24Å; K41-I45 VanDerWaalsContact O-CB 3.27Å; K41-I45 WeakPolarHBondContact O-CB 3.3Å; K41-I45 WeakPolarHBondContact O-CG1 3.18Å; K41-I45 PolarHBondContact O-N 3.47Å
42	R	53.7	Low	53.8	Low	193 Å²	193	126.7 Å²	126.7	73%	0.728	56%	0.56	S	S	*	*	H	α-helix	trans	-65.4	-35.6	171.4	-76.4	-170.8	-136.6	-159.2	3.2	112.2	S38 R39 R46	S38-R42 WeakPolarHBondContact O-CG 3.23Å; S38-R42 PolarHBondContact O-N 3.47Å; R39-R42 PolarHBondContact O-N 3.29Å; R42-R46 PolarHBondContact O-N 3.34Å
43	L	52.2	Low	52.2	Low	128 Å²	128	126.4 Å²	126.4	67%	0.67	57%	0.566	S	S	*	*	H	α-helix	trans	-70.4	-41.2	174.8	-78.9	155.9	0	0	0	112.1	R39 H40 K41 S47	R39-L43 PolarHBondContact O-N 3.49Å; R39-L43 VanDerWaalsContact O-N 3.13Å; H40-L43 PolarHBondContact O-N 3.05Å; K41-L43 VanDerWaalsContact C-N 3.33Å; L43-S47 PolarHBondContact O-N 3.03Å
44	K	48.3	Very low	50.8	Low	151 Å²	151	132.7 Å²	132.7	66%	0.657	59%	0.585	S	S	*	*	H	α-helix	trans	-77	-28.3	-179.8	-137.4	173.9	-173	178.7	0	113.9	H40 K41 S47 S48	H40-K44 WeakPolarHBondContact O-CB 3.32Å; H40-K44 PolarHBondContact O-N 3.43Å; K41-K44 PolarHBondContact O-N 2.96Å; K44-S47 PolarHBondContact O-N 3.44Å; K44-S47 PolarHBondContact O-OG 3.37Å; K44-S47 VanDerWaalsContact O-OG 3.09Å; K44-S48 WeakPolarHBondContact O-CB 3.31Å; K44-S48 PolarHBondContact O-N 2.93Å; K44-S48 PolarHBondContact O-OG 3Å
45	I	51.1	Low	49.4	Very low	71 Å²	71	136 Å²	136	36%	0.364	60%	0.602	S	S	.	*	H	α-helix	trans	-75.1	-27.5	174.5	-70.5	171.2	0	0	0	111.9	K41 R49	K41-I45 HydrophobicContact CD-CD1 4.24Å; K41-I45 HydrophobicContact CG-CD1 3.69Å; K41-I45 HydrophobicContact CG-CG1 4.24Å; K41-I45 VanDerWaalsContact O-CB 3.27Å; K41-I45 WeakPolarHBondContact O-CB 3.3Å; K41-I45 WeakPolarHBondContact O-CG1 3.18Å; K41-I45 PolarHBondContact O-N 3.47Å; I45-R49 WeakPolarHBondContact O-CB 3.34Å; I45-R49 WeakPolarHBondContact O-CG 3.44Å; I45-R49 PolarHBondContact O-N 3.48Å
46	R	43.1	Very low	47.6	Very low	221 Å²	221	137.2 Å²	137.2	83%	0.834	61%	0.61	S	S	*	*	H	α-helix	trans	-72.2	-31	171.2	-112.2	178.5	176.9	168.6	-1.9	112.3	R42	R42-R46 PolarHBondContact O-N 3.34Å
47	S	45.3	Very low	45.7	Very low	66 Å²	66	141.8 Å²	141.8	46%	0.462	63%	0.634	S	S	.	*	H	α-helix	trans	-87.4	-26.4	176.7	70.8	0	0	0	0	114.1	L43 K44	L43-S47 PolarHBondContact O-N 3.03Å; K44-S47 PolarHBondContact O-N 3.44Å; K44-S47 PolarHBondContact O-OG 3.37Å; K44-S47 VanDerWaalsContact O-OG 3.09Å
48	S	42	Very low	43.9	Very low	48 Å²	48	141 Å²	141	34%	0.336	65%	0.648	S	S	.	*	H	α-helix	trans	-87.5	-17.6	179.1	63.5	0	0	0	0	114.5	K44 Q50 F51 I52	K44-S48 WeakPolarHBondContact O-CB 3.31Å; K44-S48 PolarHBondContact O-N 2.93Å; K44-S48 PolarHBondContact O-OG 3Å; S48-Q50 VanDerWaalsContact C-N 3.29Å; S48-Q50 PolarHBondContact O-N 3.26Å; S48-F51 PolarHBondContact O-N 2.87Å; S48-I52 WeakPolarHBondContact O-CG1 3.31Å
49	R	41.1	Very low	42.2	Very low	190 Å²	190	145.2 Å²	145.2	72%	0.717	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-21.2	172	-85.3	-177.4	171.1	-173.2	-3.7	113.8	I45	I45-R49 WeakPolarHBondContact O-CB 3.34Å; I45-R49 WeakPolarHBondContact O-CG 3.44Å; I45-R49 PolarHBondContact O-N 3.48Å
50	Q	40.7	Very low	40.7	Very low	150 Å²	150	144.6 Å²	144.6	70%	0.701	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-18.4	172.1	-80.3	177.3	-30.1	0	0	113.6	S48	S48-Q50 VanDerWaalsContact C-N 3.29Å; S48-Q50 PolarHBondContact O-N 3.26Å
51	F	36	Very low	39.1	Very low	178 Å²	178	143.2 Å²	143.2	78%	0.781	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-17.2	-179.5	-104	-87.2	0	0	0	114.3	S48	S48-F51 PolarHBondContact O-N 2.87Å
52	I	39.1	Very low	38	Very low	120 Å²	120	147.4 Å²	147.4	62%	0.615	71%	0.713	S	S	*	*	S	Bend	trans	-87.2	-16.9	-178.2	-66.6	168.3	0	0	0	111.8	S48 Y54	S48-I52 WeakPolarHBondContact O-CG1 3.31Å; I52-Y54 VanDerWaalsContact C-N 3.33Å; I52-Y54 PolarHBondContact O-N 3.28Å
53	Q	35.1	Very low	36.7	Very low	157 Å²	157	145 Å²	145	73%	0.734	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-5.6	179.7	-136	169	-4.4	0	0	114.1
54	Y	34.3	Very low	35.5	Very low	224 Å²	224	145.9 Å²	145.9	88%	0.878	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	3.3	-178.9	-100.1	-84.4	0	0	0	114.9	I52	I52-Y54 VanDerWaalsContact C-N 3.33Å; I52-Y54 PolarHBondContact O-N 3.28Å
55	K	32.1	Very low	34.6	Very low	199 Å²	199	147.1 Å²	147.1	87%	0.865	73%	0.729	S	S	*	*	S	Bend	trans	-115.7	15.8	-177.7	-139.1	180	-175.7	-175.2	0	114.3
56	Q	30.8	Very low	33.4	Very low	166 Å²	166	155.2 Å²	155.2	78%	0.776	76%	0.755	S	S	*	*			trans	-117.5	23.3	-170.3	-106.4	-175.3	-27.6	0	0	114.9
57	L	29.5	Very low	32.6	Very low	166 Å²	166	150.8 Å²	150.8	87%	0.869	75%	0.752	S	S	*	*			trans	-138	91.3	178	-84.6	155	0	0	0	111.6
58	S	28.5	Very low	31.9	Very low	117 Å²	117	155.6 Å²	155.6	82%	0.818	77%	0.772	S	S	*	*			trans	179.1	109.8	133.6	57.9	0	0	0	0	109.6
59	P	31	Very low	31.3	Very low	113 Å²	113	158.1 Å²	158.1	73%	0.734	79%	0.79	S	S	*	*			trans	-95.3	151.7	177.6	36.4	-29.6	0	0	0	111.4
60	L	27.9	Very low	30.6	Very low	165 Å²	165	156.7 Å²	156.7	86%	0.864	80%	0.795	S	S	*	*			trans	172.7	121.8	131.1	-97.5	146.5	0	0	0	111.9
61	S	27.6	Very low	29.9	Very low	99 Å²	99	158 Å²	158	69%	0.692	80%	0.801	S	S	*	*			trans	56.5	110	154.4	66.2	0	0	0	0	119.3
62	I	29.9	Very low	29.5	Very low	173 Å²	173	154.4 Å²	154.4	89%	0.887	80%	0.799	S	S	*	*				-160.8	99.9	109.8	-84.7	142.1	0	0	0	105.4
63	D	25.8	Very low	28.8	Very low	144 Å²	144	154.6 Å²	154.6	77%	0.77	81%	0.805	S	S	*	*			trans	-81.3	153.8	166.1	-89.6	-38	0	0	0	109.8
64	N	27.7	Very low	28.4	Very low	145 Å²	145	153.7 Å²	153.7	78%	0.775	81%	0.806	S	S	*	*			trans	99.8	118.8	150.9	-67.7	-24.2	0	0	0	119.9
65	Q	28.1	Very low	28.2	Very low	178 Å²	178	150.6 Å²	150.6	83%	0.832	80%	0.804	S	S	*	*			trans	92.1	100.9	152	-65	173.5	-6	0	0	116.9
66	R	26.2	Very low	27.9	Very low	241 Å²	241	148.1 Å²	148.1	91%	0.909	80%	0.801	S	S	*	*				-169.6	119	90.7	-94.4	171.5	-172.1	-174.2	1.3	112.2
67	T	26.3	Very low	27.8	Very low	127 Å²	127	147.6 Å²	147.6	78%	0.779	80%	0.802	S	S	*	*			trans	-130.5	146.5	151	40.2	0	0	0	0	106.7
68	L	30.2	Very low	27.6	Very low	167 Å²	167	145.8 Å²	145.8	87%	0.874	80%	0.798	S	S	*	*			trans	86	128.7	-179.3	-51.6	158.1	0	0	0	112.6
69	S	30	Very low	27.7	Very low	102 Å²	102	146.5 Å²	146.5	71%	0.713	79%	0.793	S	S	*	*			cis	-174.2	126.3	6.4	36.7	0	0	0	0	105.8
70	L	25.2	Very low	27.5	Very low	159 Å²	159	147.9 Å²	147.9	83%	0.832	79%	0.794	S	S	*	*				39.4	104.4	111	-89.3	161.7	0	0	0	115.9
71	Q	26.1	Very low	27.5	Very low	177 Å²	177	150.3 Å²	150.3	83%	0.827	79%	0.793	S	S	*	*				152.5	148.3	117.6	-89.7	171.8	-42.6	0	0	113.2
72	S	28	Very low	27.4	Very low	104 Å²	104	150.2 Å²	150.2	73%	0.727	79%	0.791	S	S	*	*			trans	64	108.8	170.3	60.9	0	0	0	0	117.8
73	T	25.3	Very low	27.2	Very low	123 Å²	123	145.7 Å²	145.7	76%	0.755	79%	0.787	S	S	*	*				65.9	127.4	63.5	66.8	0	0	0	0	115.2
74	N	25.6	Very low	27.1	Very low	138 Å²	138	145.9 Å²	145.9	74%	0.738	79%	0.787	S	S	*	*			trans	88.8	105	165.3	-55.2	-0.1	0	0	0	115.6
75	D	29.9	Very low	27.1	Very low	160 Å²	160	149.4 Å²	149.4	86%	0.856	80%	0.795	S	S	*	*				-170.9	132.3	90.1	-86	-27	0	0	0	111.1
76	D	26.4	Very low	27.2	Very low	147 Å²	147	144.6 Å²	144.6	79%	0.786	79%	0.786	S	S	*	*			trans	-69.7	148.7	-179.9	-64.5	-55.9	0	0	0	112.5
77	L	28.2	Very low	27.1	Very low	154 Å²	154	140.5 Å²	140.5	81%	0.806	78%	0.783	S	S	*	*			trans	-173.2	63	147.9	-99.9	156.4	0	0	0	108.5
78	T	26.4	Very low	27.2	Very low	128 Å²	128	144.3 Å²	144.3	79%	0.785	78%	0.784	S	S	*	*			trans	-113.1	86.6	150.9	46.5	0	0	0	0	105.9	D80	T78-D80 PolarHBondContact O-N 3.31Å
79	D	29.4	Very low	27	Very low	133 Å²	133	145.5 Å²	145.5	71%	0.711	78%	0.782	S	S	*	*			trans	-75.8	104.3	168.9	-80.4	-23.9	0	0	0	108.6
80	D	26.7	Very low	27	Very low	141 Å²	141	146.9 Å²	146.9	75%	0.754	78%	0.782	S	S	*	*			trans	-42.5	133.7	141.5	-73.7	-45.7	0	0	0	110.5	T78	T78-D80 PolarHBondContact O-N 3.31Å
81	Y	28	Very low	27	Very low	216 Å²	216	146.2 Å²	146.2	85%	0.847	78%	0.779	S	S	*	*			trans	-129.9	138.3	137.8	-98.4	-85.6	0	0	0	109.8
82	P	25.7	Very low	27.1	Very low	98 Å²	98	146.2 Å²	146.2	64%	0.636	78%	0.779	S	S	*	*			trans	-92.2	166.9	-158.8	21.2	-3.8	0	0	0	111.6	L84	P82-L84 PolarHBondContact O-N 3.18Å
83	G	26.4	Very low	27	Very low	78 Å²	78	149.5 Å²	149.5	80%	0.804	78%	0.783	S	S	*	*			trans	-52.8	122.5	165.7	0	0	0	0	0	111.2
84	L	24.2	Very low	27.1	Very low	147 Å²	147	153.8 Å²	153.8	77%	0.77	79%	0.791	S	S	*	*			trans	-142.9	73.5	161.7	-124.9	123.2	0	0	0	107.2	P82	P82-L84 PolarHBondContact O-N 3.18Å
85	F	28	Very low	27	Very low	219 Å²	219	155 Å²	155	96%	0.961	80%	0.798	S	S	*	*			trans	-104.2	82.1	155.5	-85.9	-79	0	0	0	106.3
86	A	28.3	Very low	26.9	Very low	78 Å²	78	155.2 Å²	155.2	65%	0.645	79%	0.794	S	S	*	*			trans	-78.8	145.9	163.6	0	0	0	0	0	108.8	Y88	A86-Y88 PolarHBondContact O-N 3.44Å
87	D	25.8	Very low	27.1	Very low	155 Å²	155	154.7 Å²	154.7	83%	0.829	79%	0.785	S	S	*	*			trans	-39.3	124	174.4	-68.4	-56.1	0	0	0	113.4
88	Y	27.5	Very low	26.9	Very low	207 Å²	207	154.4 Å²	154.4	81%	0.812	79%	0.79	S	S	*	*			trans	-135.1	93.5	145.3	-108.3	-89	0	0	0	107.6	A86 D90	A86-Y88 PolarHBondContact O-N 3.44Å; Y88-D90 HydrophobicContact CD1-CB 4.38Å; Y88-D90 WeakPolarHBondContact CE1-OD2 3.31Å
89	K	26	Very low	27	Very low	191 Å²	191	155.2 Å²	155.2	83%	0.83	78%	0.784	S	S	*	*			trans	-60.5	117.5	136.8	-79.9	176	171.9	177.1	0	105.4
90	D	30.2	Very low	27	Very low	132 Å²	132	153.8 Å²	153.8	71%	0.706	79%	0.785	S	S	*	*			trans	-149.7	124.9	137.5	-90.9	-31.9	0	0	0	108	Y88	Y88-D90 HydrophobicContact CD1-CB 4.38Å; Y88-D90 WeakPolarHBondContact CE1-OD2 3.31Å
91	D	25.8	Very low	27.1	Very low	144 Å²	144	155 Å²	155	77%	0.77	79%	0.786	S	S	*	*			trans	-61.7	135.7	171.5	-56.1	-63	0	0	0	109.2
92	Q	27.4	Very low	27.1	Very low	177 Å²	177	153.2 Å²	153.2	83%	0.827	79%	0.786	S	S	*	*			trans	160.6	124.7	134.9	-87.5	166	-4.1	0	0	111.2
93	E	25.4	Very low	27.3	Very low	173 Å²	173	152.5 Å²	152.5	81%	0.808	78%	0.776	S	S	*	*			trans	71.2	80.6	152.8	-61.6	179.5	171.5	0	0	118.5
94	F	27.4	Very low	27.6	Very low	213 Å²	213	155.9 Å²	155.9	93%	0.934	77%	0.774	S	S	*	*			trans	-141.8	60.8	143.3	-109	-80.9	0	0	0	109.3
95	D	24.8	Very low	27.8	Very low	164 Å²	164	155.6 Å²	155.6	88%	0.877	77%	0.774	S	S	*	*			trans	-89	94.3	157.9	-84.3	-30.7	0	0	0	107.3
96	E	27.7	Very low	28	Very low	165 Å²	165	147.8 Å²	147.8	77%	0.771	75%	0.746	S	S	*	*			trans	-174.7	137.3	151.4	-109	173.1	-175.2	0	0	110.3
97	F	30.1	Very low	28.1	Very low	136 Å²	136	152 Å²	152	60%	0.596	76%	0.755	S	S	*	*			trans	87.1	41.6	-172.7	-63.5	-81.6	0	0	0	118.2	K1087	F97-K1087 HydrophobicContact CE1-CD 4.47Å; F97-K1087 HydrophobicContact CZ-CD 4.22Å
98	T	24.7	Very low	28.3	Very low	148 Å²	148	152.6 Å²	152.6	91%	0.908	75%	0.752	S	S	*	*				-88.4	82.5	129.5	42.5	0	0	0	0	109.2
99	E	27.2	Very low	28.3	Very low	144 Å²	144	151.3 Å²	151.3	67%	0.673	75%	0.751	S	S	*	*			trans	-138	133.6	166.7	-80	-170.2	156	0	0	109.9
100	S	29.4	Very low	28.4	Very low	104 Å²	104	149.9 Å²	149.9	73%	0.727	75%	0.752	S	S	*	*			trans	75.7	81.4	-173.4	72.8	0	0	0	0	114.5
101	E	29.2	Very low	28.2	Very low	166 Å²	166	149.9 Å²	149.9	78%	0.776	76%	0.761	S	S	*	*				45.1	121.6	62.1	-71.4	-172.3	154	0	0	113
102	E	28.6	Very low	28.3	Very low	179 Å²	179	148.6 Å²	148.6	84%	0.836	76%	0.763	S	S	*	*			trans	59.2	57.2	148.5	-57.5	-169.8	159.1	0	0	118.5
103	N	29.2	Very low	28.4	Very low	83 Å²	83	145.5 Å²	145.5	44%	0.444	76%	0.759	S	S	.	*			trans	-136.8	6.8	165.3	-85.7	-56.4	0	0	0	116.5	R687	N103-R687 PolarHBondContact OD1-NH1 3.17Å
104	I	33.2	Very low	28.5	Very low	149 Å²	149	143.2 Å²	143.2	76%	0.764	76%	0.762	S	S	*	*	S	Bend	trans	-89.6	-15.2	179.2	-64.4	176.7	0	0	0	113
105	D	28.4	Very low	28.5	Very low	141 Å²	141	143.8 Å²	143.8	75%	0.754	76%	0.758	S	S	*	*	S	Bend	trans	-97.4	5.4	-178	-82.6	-22.4	0	0	0	116.2
106	S	31.1	Very low	28.7	Very low	55 Å²	55	146.5 Å²	146.5	39%	0.385	76%	0.757	S	S	.	*	S	Bend	trans	-115.7	-2.2	-179.1	62.2	0	0	0	0	115.6	H108 R687	S106-H108 VanDerWaalsContact C-N 3.25Å; S106-R687 VanDerWaalsContact OG-CZ 3.3Å; S106-R687 PolarHBondContact OG-NH1 3.37Å; S106-R687 PolarHBondContact OG-NH2 3.44Å
107	M	30.5	Very low	28.8	Very low	166 Å²	166	146.8 Å²	146.8	82%	0.818	76%	0.763	S	S	*	*	S	Bend	trans	-81.8	-4.4	162.5	-76.8	-159.5	102.8	0	0	112.9
108	H	31.2	Very low	28.6	Very low	167 Å²	167	148.6 Å²	148.6	77%	0.773	78%	0.777	S	S	*	*	S	Bend	trans	-102.3	5.4	-175.4	-94.7	-68.2	0	0	0	116.1	S106	S106-H108 VanDerWaalsContact C-N 3.25Å
109	K	27.9	Very low	28.8	Very low	180 Å²	180	146 Å²	146	78%	0.783	77%	0.765	S	S	*	*	S	Bend	trans	-121.1	1.8	-169.7	-89.6	179.4	178.1	172.5	0	119.6
110	N	27.7	Very low	28.8	Very low	162 Å²	162	149.7 Å²	149.7	87%	0.866	77%	0.773	S	S	*	*	S	Bend	trans	-128.7	40.7	178.2	-83.5	-16.5	0	0	0	115.7
111	C	26.5	Very low	28.8	Very low	131 Å²	131	151.9 Å²	151.9	89%	0.885	78%	0.777	S	S	*	*			trans	-140	79.3	160.8	-90.2	0	0	0	0	109.9
112	S	26.7	Very low	28.7	Very low	117 Å²	117	154.1 Å²	154.1	82%	0.818	78%	0.784	S	S	*	*			trans	-68.7	152.5	165.2	49.6	0	0	0	0	111.3
113	P	28.7	Very low	28.6	Very low	113 Å²	113	154.7 Å²	154.7	73%	0.734	78%	0.783	S	S	*	*			trans	-109.2	142.4	-138.5	36.1	-27.3	0	0	0	113.8	R115	P113-R115 PolarHBondContact O-N 2.92Å
114	S	29.1	Very low	28.5	Very low	125 Å²	125	158 Å²	158	87%	0.874	80%	0.8	S	S	*	*			trans	-87.3	104.5	157.4	52.1	0	0	0	0	109.6
115	R	26.9	Very low	28.3	Very low	224 Å²	224	162.1 Å²	162.1	85%	0.845	81%	0.806	S	S	*	*			trans	-42.6	130.6	166.9	-67.2	168.6	178.1	169.3	-1.3	110.9	P113	P113-R115 PolarHBondContact O-N 2.92Å
116	Y	29.4	Very low	28.1	Very low	221 Å²	221	166.3 Å²	166.3	87%	0.867	81%	0.811	S	S	*	*				179.8	132.7	123.8	-94.6	-71.2	0	0	0	109.7
117	L	28.8	Very low	28	Very low	171 Å²	171	171 Å²	171	90%	0.895	83%	0.831	S	S	*	*			trans	82.8	67.5	169.8	-58.9	166.1	0	0	0	117.9
118	I	26.7	Very low	27.8	Very low	174 Å²	174	171.9 Å²	171.9	89%	0.892	83%	0.83	S	S	*	*			trans	-91.5	116.4	144.5	-67.1	168.5	0	0	0	107.3
119	S	28.3	Very low	27.6	Very low	94 Å²	94	169.3 Å²	169.3	66%	0.657	83%	0.826	S	S	*	*			trans	-166.9	134	135.3	81.6	0	0	0	0	110.5
120	R	27.8	Very low	27.6	Very low	222 Å²	222	168.1 Å²	168.1	84%	0.838	83%	0.826	S	S	*	*			trans	69.3	115.8	159.3	-67.3	171.5	171.4	169.4	-2.7	115.2
121	N	30	Very low	27.7	Very low	150 Å²	150	165.4 Å²	165.4	80%	0.802	82%	0.82	S	S	*	*			cis	-163.5	122.4	36.1	-83	-39.9	0	0	0	110.5
122	K	25.9	Very low	27.6	Very low	213 Å²	213	163.6 Å²	163.6	93%	0.926	81%	0.809	S	S	*	*			trans	-98.3	106.6	148	-94.9	-178.1	176.4	177	0	106.2
123	K	26.7	Very low	27.7	Very low	190 Å²	190	167.5 Å²	167.5	83%	0.826	81%	0.811	S	S	*	*			trans	180	147.1	151.7	-108.7	171.1	-178.8	180	0	110.3
124	L	27.8	Very low	27.7	Very low	152 Å²	152	171.3 Å²	171.3	80%	0.796	82%	0.816	S	S	*	*			trans	95.3	83.1	161	-66.4	141.2	0	0	0	117.6
125	R	27.4	Very low	27.7	Very low	237 Å²	237	171.3 Å²	171.3	89%	0.894	81%	0.814	S	S	*	*				-57.4	147	128.5	-73.7	178.1	173.4	176.6	-2.9	110
126	R	24.1	Very low	27.9	Very low	229 Å²	229	167.7 Å²	167.7	86%	0.864	81%	0.811	S	S	*	*			trans	92.5	142.9	161.2	-61	-173.2	179.7	174.7	1.1	118.7
127	I	30.9	Very low	27.9	Very low	154 Å²	154	164.2 Å²	164.2	79%	0.79	81%	0.806	S	S	*	*			trans	95.2	89.6	163	-51.1	162.2	0	0	0	112.9
128	K	25.7	Very low	27.9	Very low	183 Å²	183	161.6 Å²	161.6	80%	0.796	80%	0.802	S	S	*	*				50.4	125.4	89.2	-95.1	-173.3	-179.7	179.5	0	115.2
129	T	26	Very low	28	Very low	114 Å²	114	159.7 Å²	159.7	70%	0.699	80%	0.798	S	S	*	*			trans	86.3	119.7	139.5	46.4	0	0	0	0	121.9
130	I	29.2	Very low	27.9	Very low	154 Å²	154	162.7 Å²	162.7	79%	0.79	81%	0.806	S	S	*	*			trans	107.8	123.8	132.4	-69.4	155.1	0	0	0	118.1
131	S	28.4	Very low	27.9	Very low	105 Å²	105	157.4 Å²	157.4	73%	0.734	80%	0.801	S	S	*	*			trans	76	139.7	149.9	174.3	0	0	0	0	117.9
132	S	26	Very low	27.8	Very low	93 Å²	93	158.2 Å²	158.2	65%	0.65	80%	0.803	S	S	*	*			cis	-177.7	140.4	-20.4	51.8	0	0	0	0	104.6
133	K	29	Very low	27.9	Very low	199 Å²	199	154 Å²	154	87%	0.865	79%	0.79	S	S	*	*			trans	165.5	102	142.9	-92.5	169.1	-178.7	-178	0	112.1
134	K	27.2	Very low	27.9	Very low	193 Å²	193	153.5 Å²	153.5	84%	0.839	79%	0.787	S	S	*	*			trans	39	124.3	141.7	-65.5	-177.6	174.2	-175.7	0	120.9
135	P	30.3	Very low	27.9	Very low	126 Å²	126	151.3 Å²	151.3	82%	0.818	78%	0.775	S	S	*	*			trans	-105.7	131.8	153	34.4	-22	0	0	0	111.9
136	D	29.5	Very low	27.8	Very low	148 Å²	148	146.5 Å²	146.5	79%	0.791	77%	0.768	S	S	*	*			trans	-95.8	112.6	168.8	-79.9	-31.4	0	0	0	110.9
137	I	31.1	Very low	27.9	Very low	148 Å²	148	142.9 Å²	142.9	76%	0.759	77%	0.765	S	S	*	*				40.5	104.9	129.1	-51.9	163.3	0	0	0	118.5
138	S	28.3	Very low	27.7	Very low	116 Å²	116	141.5 Å²	141.5	81%	0.811	76%	0.758	S	S	*	*				-161	89.6	123.2	65.4	0	0	0	0	110.1
139	T	28.9	Very low	27.8	Very low	133 Å²	133	141.9 Å²	141.9	82%	0.816	76%	0.762	S	S	*	*			trans	-79.1	119.7	173.8	43.3	0	0	0	0	111.1
140	L	26.2	Very low	27.9	Very low	158 Å²	158	143.3 Å²	143.3	83%	0.827	77%	0.765	S	S	*	*			trans	-102.9	128.6	152	-93.6	156.4	0	0	0	107.3	I142	L140-I142 PolarHBondContact O-N 3.15Å
141	P	28.1	Very low	27.9	Very low	111 Å²	111	141.3 Å²	141.3	72%	0.721	76%	0.762	S	S	*	*			trans	-78.9	108.9	-179.7	31.6	-28.6	0	0	0	108.4	I143	P141-I143 PolarHBondContact O-N 2.58Å
142	I	27.6	Very low	27.8	Very low	166 Å²	166	144.6 Å²	144.6	85%	0.851	77%	0.765	S	S	*	*			trans	-79.6	105.1	166.1	-60.9	174.3	0	0	0	106.5	L140 K144	L140-I142 PolarHBondContact O-N 3.15Å; I142-K144 PolarHBondContact O-N 3Å
143	I	27.9	Very low	27.9	Very low	126 Å²	126	148.4 Å²	148.4	65%	0.646	77%	0.773	S	S	*	*			trans	-57	121.5	170	-57	169.6	0	0	0	107.2	P141 I145	P141-I143 PolarHBondContact O-N 2.58Å; I143-I145 VanDerWaalsContact C-N 3.3Å; I143-I145 HydrophobicContact CB-CD1 4.48Å; I143-I145 HydrophobicContact CB-CG1 4.08Å; I143-I145 HydrophobicContact CG2-CD1 4.05Å; I143-I145 HydrophobicContact CG2-CG1 3.4Å; I143-I145 PolarHBondContact O-N 3.27Å
144	K	26.5	Very low	27.9	Very low	179 Å²	179	147.1 Å²	147.1	78%	0.778	77%	0.769	S	S	*	*			trans	-68.4	94.8	161.6	-83.8	-176	174.5	-178.1	0	107.1	I142	I142-K144 PolarHBondContact O-N 3Å
145	I	27.9	Very low	28	Very low	105 Å²	105	145.4 Å²	145.4	54%	0.538	76%	0.764	S	S	.	*			trans	-97.9	89.5	163.5	-52.9	178.1	0	0	0	105.1	I143 I148	I143-I145 VanDerWaalsContact C-N 3.3Å; I143-I145 HydrophobicContact CB-CD1 4.48Å; I143-I145 HydrophobicContact CB-CG1 4.08Å; I143-I145 HydrophobicContact CG2-CD1 4.05Å; I143-I145 HydrophobicContact CG2-CG1 3.4Å; I143-I145 PolarHBondContact O-N 3.27Å; I145-I148 HydrophobicContact CG2-CD1 3.86Å; I145-I148 HydrophobicContact CG2-CG1 3.84Å
146	N	26.3	Very low	27.8	Very low	137 Å²	137	146.9 Å²	146.9	73%	0.733	76%	0.76	S	S	*	*			trans	-82.4	140.3	151.4	-75.4	1.7	0	0	0	105.5
147	D	25.6	Very low	27.7	Very low	153 Å²	153	151.3 Å²	151.3	82%	0.818	77%	0.767	S	S	*	*			trans	94.3	74	-178.4	-47.9	-20.9	0	0	0	115
148	I	27.1	Very low	27.4	Very low	125 Å²	125	153.2 Å²	153.2	64%	0.641	77%	0.773	S	S	*	*			trans	-138.2	93.3	153.4	-56.2	179.5	0	0	0	108.1	I145 L150	I145-I148 HydrophobicContact CG2-CD1 3.86Å; I145-I148 HydrophobicContact CG2-CG1 3.84Å; I148-L150 HydrophobicContact CG2-CD1 4Å; I148-L150 PolarHBondContact O-N 3.22Å
149	H	27.5	Very low	27.2	Very low	191 Å²	191	156.3 Å²	156.3	88%	0.884	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-66.5	118.8	159.6	-96.7	-83.5	0	0	0	108.6
150	L	28.1	Very low	27	Very low	144 Å²	144	158 Å²	158	75%	0.754	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-95	132.1	160.2	-95.7	107.5	0	0	0	108.7	I148	I148-L150 HydrophobicContact CG2-CD1 4Å; I148-L150 PolarHBondContact O-N 3.22Å
151	P	27.9	Very low	27	Very low	111 Å²	111	158.7 Å²	158.7	72%	0.721	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-82.9	138.6	-176	32.9	-31.5	0	0	0	111.3	H153	P151-H153 PolarHBondContact O-N 3.01Å
152	H	27.2	Very low	27	Very low	174 Å²	174	162 Å²	162	81%	0.806	78%	0.778	S	S	*	*			trans	-68.5	115.4	163.1	-86.5	-84.4	0	0	0	109.4	H154	H152-H154 PolarHBondContact O-N 2.88Å
153	H	28.6	Very low	26.8	Very low	174 Å²	174	163 Å²	163	81%	0.806	78%	0.779	S	S	*	*			trans	-71.7	100.3	156.1	-98.2	-83.9	0	0	0	108.1	P151	P151-H153 PolarHBondContact O-N 3.01Å
154	H	29	Very low	26.7	Very low	171 Å²	171	165.4 Å²	165.4	79%	0.792	79%	0.787	S	S	*	*			trans	-86.7	115.4	154	-97.3	-78.2	0	0	0	108	H152	H152-H154 PolarHBondContact O-N 2.88Å
155	H	29.4	Very low	26.7	Very low	157 Å²	157	164.6 Å²	164.6	73%	0.727	79%	0.786	S	S	*	*			trans	-72.3	122.4	165	-105.3	-82.1	0	0	0	109.1
156	H	25.9	Very low	26.8	Very low	158 Å²	158	169.2 Å²	169.2	73%	0.731	81%	0.806	S	S	*	*			trans	28.8	110.6	139.6	-80.4	-84.5	0	0	0	117.8
157	Y	26.8	Very low	26.7	Very low	240 Å²	240	169.6 Å²	169.6	94%	0.941	80%	0.803	S	S	*	*				-163.2	93.8	122.4	-103.7	-77.5	0	0	0	107.9
158	Q	24.1	Very low	27	Very low	189 Å²	189	168.3 Å²	168.3	88%	0.883	80%	0.803	S	S	*	*			trans	-130.1	110.9	159	-100.8	-174.6	-13.2	0	0	105.8
159	Q	24.6	Very low	26.9	Very low	180 Å²	180	169.8 Å²	169.8	84%	0.841	81%	0.807	S	S	*	*			trans	-168.8	129	146.9	-108.8	172.4	15.9	0	0	108.2
160	Q	24.4	Very low	26.9	Very low	168 Å²	168	170.2 Å²	170.2	79%	0.785	81%	0.806	S	S	*	*			trans	96.4	129.7	164.2	-58.7	174.4	-9.2	0	0	117
161	Q	25.8	Very low	27.1	Very low	173 Å²	173	168.3 Å²	168.3	81%	0.808	80%	0.802	S	S	*	*			trans	81.7	116.2	164.5	-65.7	166.7	-3.6	0	0	113.4
162	E	27.9	Very low	27	Very low	181 Å²	181	170.2 Å²	170.2	85%	0.846	81%	0.806	S	S	*	*			cis	-150.8	125.1	29.7	-88.6	145.4	179.5	0	0	111.7
163	E	23.8	Very low	26.9	Very low	186 Å²	186	168.3 Å²	168.3	87%	0.869	80%	0.801	S	S	*	*			trans	-84.5	124.1	138.1	-76.2	176.2	150.1	0	0	106
164	Q	26.1	Very low	26.7	Very low	177 Å²	177	166.9 Å²	166.9	83%	0.827	79%	0.794	S	S	*	*			trans	168	141.4	136	-93.5	169.4	10.2	0	0	113.2
165	E	27.5	Very low	26.6	Very low	163 Å²	163	166.9 Å²	166.9	76%	0.762	79%	0.792	S	S	*	*			trans	86.1	90.2	157.9	-69.2	179	168.8	0	0	120.1
166	Q	28.5	Very low	26.3	Very low	202 Å²	202	163.5 Å²	163.5	94%	0.944	79%	0.786	S	S	*	*				-140.7	109.6	111.1	-101.5	173.3	18.8	0	0	110.6
167	Q	25.5	Very low	26.3	Very low	145 Å²	145	162.8 Å²	162.8	68%	0.678	79%	0.787	S	S	*	*			trans	-57.1	158.7	160.9	-99.9	179.9	21.7	0	0	110.8
168	P	30.3	Very low	26.2	Very low	125 Å²	125	155.7 Å²	155.7	81%	0.812	77%	0.773	S	S	*	*				-141.5	139.1	61.7	31.2	-9.2	0	0	0	117.2
169	H	26.3	Very low	26.4	Very low	156 Å²	156	152.1 Å²	152.1	72%	0.722	76%	0.764	S	S	*	*			trans	-54.7	138.2	155.6	-81.8	-82.4	0	0	0	111.6
170	K	27.9	Very low	26.6	Very low	200 Å²	200	149.7 Å²	149.7	87%	0.87	76%	0.756	S	S	*	*				-167.7	129.6	120.4	-106.7	168.4	-175.5	178.4	0	110.7
171	P	32.3	Very low	26.7	Very low	105 Å²	105	146.1 Å²	146.1	68%	0.682	75%	0.75	S	S	*	*			trans	-92	170.9	169.5	36.6	-29.2	0	0	0	110.6
172	L	24.8	Very low	27	Very low	151 Å²	151	142.9 Å²	142.9	79%	0.791	75%	0.747	S	S	*	*			trans	104.4	108.8	161.9	-58.6	161.5	0	0	0	116.6
173	L	24.9	Very low	27.1	Very low	133 Å²	133	143.1 Å²	143.1	70%	0.696	75%	0.745	S	S	*	*				70.2	127.3	128.3	-97.4	80.7	0	0	0	120.2
174	H	25.9	Very low	27.3	Very low	144 Å²	144	140.2 Å²	140.2	67%	0.667	74%	0.74	S	S	*	*			trans	83.8	121.6	141.1	-84.8	-50.3	0	0	0	119.3
175	K	25.1	Very low	27.7	Very low	172 Å²	172	136.8 Å²	136.8	75%	0.748	73%	0.733	S	S	*	*			trans	72.5	97.8	133.5	-80.2	176.3	177.2	178.3	0	113.7
176	S	24.1	Very low	27.8	Very low	86 Å²	86	136.5 Å²	136.5	60%	0.601	74%	0.736	S	S	*	*				91.2	135	82.8	67.2	0	0	0	0	110.4
177	N	24.9	Very low	28	Very low	142 Å²	142	131.6 Å²	131.6	76%	0.759	72%	0.724	S	S	*	*			trans	77.7	98.6	147.8	-63.7	-7	0	0	0	114.4
178	S	26.2	Very low	28.2	Very low	91 Å²	91	131.6 Å²	131.6	64%	0.636	73%	0.729	S	S	*	*				99.5	159.1	65.9	65.8	0	0	0	0	109.7
179	V	28.1	Very low	28.2	Very low	114 Å²	114	132 Å²	132	69%	0.691	72%	0.724	S	S	*	*			trans	79.6	127	144.9	163.3	0	0	0	0	113.4
180	N	27.4	Very low	28.3	Very low	129 Å²	129	132.6 Å²	132.6	69%	0.69	73%	0.726	S	S	*	*			cis	179.4	137.8	3.8	-113.1	-6.1	0	0	0	105.5
181	S	28.3	Very low	28.3	Very low	94 Å²	94	128.3 Å²	128.3	66%	0.657	72%	0.722	S	S	*	*				84.5	123.6	102.1	84.8	0	0	0	0	115.5
182	S	30.7	Very low	27.9	Very low	105 Å²	105	128.5 Å²	128.5	73%	0.734	73%	0.726	S	S	*	*				159.9	140.2	112.1	52.1	0	0	0	0	108.4
183	K	31.5	Very low	28.1	Very low	186 Å²	186	126.7 Å²	126.7	81%	0.809	72%	0.723	S	S	*	*			cis	-171	115.8	0.1	-103.1	166.9	-177.1	178.2	0	103.3
184	T	27.8	Very low	28.1	Very low	124 Å²	124	125.3 Å²	125.3	76%	0.761	72%	0.724	S	S	*	*				54.6	152.4	109.7	56.2	0	0	0	0	117.5
185	P	33.9	Very low	27.9	Very low	106 Å²	106	123.9 Å²	123.9	69%	0.688	73%	0.729	S	S	*	*			cis	-148.1	176.7	-33.4	38.8	-19.6	0	0	0	115.3
186	L	29	Very low	27.9	Very low	156 Å²	156	123.4 Å²	123.4	82%	0.817	73%	0.734	S	S	*	*				136.4	125	124.3	-124.4	99	0	0	0	117.7
187	S	33.7	Very low	27.9	Very low	100 Å²	100	128.4 Å²	128.4	70%	0.699	75%	0.748	S	S	*	*			trans	68.9	133.5	162.8	68.4	0	0	0	0	119.7
188	D	30	Very low	27.9	Very low	145 Å²	145	128.5 Å²	128.5	78%	0.775	75%	0.754	S	S	*	*			cis	-167.4	145.9	-13.3	-104.8	-29.2	0	0	0	109
189	L	29.2	Very low	28	Very low	134 Å²	134	133.5 Å²	133.5	70%	0.702	77%	0.767	S	S	*	*			trans	71.8	101.1	157.2	-87	82.8	0	0	0	124
190	Q	27.7	Very low	27.9	Very low	167 Å²	167	133.3 Å²	133.3	78%	0.78	77%	0.771	S	S	*	*				79.5	119.4	116.5	-75.6	174.3	-24.6	0	0	124.1
191	S	28.8	Very low	27.7	Very low	111 Å²	111	133.7 Å²	133.7	78%	0.776	77%	0.773	S	S	*	*			trans	86.3	103.2	144.1	60.1	0	0	0	0	123
192	S	24.7	Very low	27.7	Very low	109 Å²	109	135.9 Å²	135.9	76%	0.762	78%	0.783	S	S	*	*			trans	16.3	161.8	130.6	61.7	0	0	0	0	122.6
193	P	29.2	Very low	27.4	Very low	113 Å²	113	136.3 Å²	136.3	73%	0.734	78%	0.781	S	S	*	*				-118.9	-175.8	-57.3	36.3	-19.4	0	0	0	111
194	S	22.9	Very low	27.1	Very low	103 Å²	103	137.9 Å²	137.9	72%	0.72	78%	0.783	S	S	*	*			trans	73.8	121.9	156.3	65.5	0	0	0	0	121.4
195	C	22.4	Very low	27.2	Very low	114 Å²	114	139.1 Å²	139.1	77%	0.77	78%	0.784	S	S	*	*			trans	70.6	134.7	144.3	-59.8	0	0	0	0	120.7
196	L	24.5	Very low	26.9	Very low	162 Å²	162	141.2 Å²	141.2	85%	0.848	79%	0.789	S	S	*	*			trans	68.4	123.1	168.1	-78.9	84.4	0	0	0	117.7
197	E	24.4	Very low	26.8	Very low	191 Å²	191	141.5 Å²	141.5	89%	0.893	79%	0.791	S	S	*	*			trans	167	105.4	132.8	-94.6	170.9	177.3	0	0	111.7
198	T	25.1	Very low	26.5	Very low	145 Å²	145	143.6 Å²	143.6	89%	0.89	79%	0.788	S	S	*	*			trans	-155.7	68.8	152.2	37.9	0	0	0	0	109.8
199	Q	28.1	Very low	26.3	Very low	196 Å²	196	142.2 Å²	142.2	92%	0.916	78%	0.776	S	S	*	*			trans	-142.7	101.6	157.7	-82	-167.9	-6.5	0	0	109.6
200	S	27.1	Very low	26.1	Very low	110 Å²	110	140 Å²	140	77%	0.769	77%	0.768	S	S	*	*			trans	-79.8	128.2	-175.1	34.2	0	0	0	0	113.1
201	D	23.2	Very low	26	Very low	137 Å²	137	139.2 Å²	139.2	73%	0.733	77%	0.774	S	S	*	*			trans	69.1	78.8	138	-55.9	-22.4	0	0	0	121.3
202	T	27	Very low	25.8	Very low	140 Å²	140	142 Å²	142	86%	0.859	77%	0.772	S	S	*	*			trans	-150.1	63.3	130.1	57.7	0	0	0	0	111.2
203	T	24.8	Very low	25.8	Very low	114 Å²	114	142.5 Å²	142.5	70%	0.699	77%	0.773	S	S	*	*			trans	-111.5	50	178.7	39	0	0	0	0	112.5
204	Y	26.5	Very low	25.7	Very low	218 Å²	218	143.2 Å²	143.2	86%	0.855	78%	0.775	S	S	*	*	S	Bend	trans	-147.8	119.1	161.3	-72.7	-81	0	0	0	107.8
205	I	29.4	Very low	25.8	Very low	151 Å²	151	145.4 Å²	145.4	77%	0.774	78%	0.779	S	S	*	*	S	Bend	trans	141.8	-11	164.5	-71.3	157.5	0	0	0	113.8
206	N	27.9	Very low	26	Very low	149 Å²	149	147 Å²	147	80%	0.797	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	1.8	-175	-81.9	-26.2	0	0	0	117.9
207	D	26.1	Very low	26.1	Very low	162 Å²	162	148.3 Å²	148.3	87%	0.866	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	6	179.5	-87.2	-17.8	0	0	0	115.5
208	F	27.2	Very low	26.2	Very low	144 Å²	144	147.1 Å²	147.1	63%	0.632	78%	0.779	S	S	*	*	S	Bend	trans	-92.5	-15.7	-172.7	-97.4	-86.4	0	0	0	116.1	F346	F208-F346 HydrophobicContact CD1-CD2 4.46Å; F208-F346 HydrophobicContact CD1-CE2 4.33Å; F208-F346 HydrophobicContact CE1-CE2 4.1Å
209	F	26.1	Very low	26.2	Very low	117 Å²	117	147.9 Å²	147.9	51%	0.513	78%	0.777	S	S	.	*	S	Bend	trans	-152.9	64.6	-173.4	-68.3	-78.1	0	0	0	114.9	F346	F209-F346 HydrophobicContact CZ-CB 4.31Å
210	T	25.8	Very low	26	Very low	88 Å²	88	146.7 Å²	146.7	54%	0.54	78%	0.776	S	S	.	*			trans	-147.1	108.1	161.4	52.9	0	0	0	0	111.7	K212	T210-K212 PolarHBondContact O-N 3.27Å
211	V	25.4	Very low	26	Very low	149 Å²	149	147 Å²	147	90%	0.903	78%	0.778	S	S	*	*			trans	-74.4	99.8	159.9	177.4	0	0	0	0	106.7
212	K	23.2	Very low	26.1	Very low	169 Å²	169	148.7 Å²	148.7	74%	0.735	78%	0.782	S	S	*	*			trans	-61.2	130.2	169.7	-76.8	178.3	176	173.8	0	108.9	T210 T214	T210-K212 PolarHBondContact O-N 3.27Å; K212-T214 PolarHBondContact O-N 3.29Å
213	P	25.3	Very low	25.9	Very low	121 Å²	121	149.1 Å²	149.1	79%	0.786	78%	0.779	S	S	*	*			trans	-77.1	103.8	168.7	31.1	-27.2	0	0	0	107.2	N215	P213-N215 PolarHBondContact O-N 2.93Å; P213-N215 VanDerWaalsContact O-N 3.11Å
214	T	27.9	Very low	26	Very low	127 Å²	127	149.2 Å²	149.2	78%	0.779	78%	0.784	S	S	*	*			trans	-73	101.7	168.6	42.1	0	0	0	0	108.5	K212 N216	K212-T214 PolarHBondContact O-N 3.29Å; T214-N216 PolarHBondContact O-N 3.36Å
215	N	23.5	Very low	26	Very low	149 Å²	149	145.5 Å²	145.5	80%	0.797	78%	0.784	S	S	*	*			trans	-54	116.9	154.8	-77.6	-23.7	0	0	0	107.2	P213	P213-N215 PolarHBondContact O-N 2.93Å; P213-N215 VanDerWaalsContact O-N 3.11Å
216	N	27.5	Very low	25.9	Very low	148 Å²	148	143.4 Å²	143.4	79%	0.791	78%	0.78	S	S	*	*			trans	-161.2	130.5	152.8	-90.8	-23.2	0	0	0	110.4	T214 I218	T214-N216 PolarHBondContact O-N 3.36Å; N216-I218 PolarHBondContact O-N 3.29Å
217	H	26.9	Very low	25.8	Very low	189 Å²	189	141 Å²	141	88%	0.875	78%	0.776	S	S	*	*			trans	-54.8	126.7	-178.2	-77	-109.1	0	0	0	112.1	L219	H217-L219 PolarHBondContact O-N 3.09Å
218	I	25.9	Very low	25.8	Very low	166 Å²	166	144.4 Å²	144.4	85%	0.851	78%	0.778	S	S	*	*			trans	-88.2	96.3	168.1	-61.6	171.7	0	0	0	107.3	N216	N216-I218 PolarHBondContact O-N 3.29Å
219	L	26.1	Very low	25.7	Very low	161 Å²	161	149 Å²	149	84%	0.843	79%	0.791	S	S	*	*			trans	-91.4	131.3	155.1	-93.4	162.2	0	0	0	108.2	H217 S221	H217-L219 PolarHBondContact O-N 3.09Å; L219-S221 PolarHBondContact O-N 3.13Å
220	L	24.1	Very low	25.8	Very low	172 Å²	172	151.9 Å²	151.9	90%	0.901	81%	0.806	S	S	*	*			trans	-59.6	122.8	172.2	-71	137.7	0	0	0	109.8
221	S	25.9	Very low	26	Very low	117 Å²	117	156.5 Å²	156.5	82%	0.818	82%	0.821	S	S	*	*			trans	-145.2	130	143.2	85.4	0	0	0	0	110.4	L219	L219-S221 PolarHBondContact O-N 3.13Å
222	E	25.3	Very low	26.3	Very low	172 Å²	172	154.6 Å²	154.6	80%	0.804	82%	0.815	S	S	*	*			trans	-61.6	157.4	170.8	-66	165.9	145.5	0	0	110.6
223	N	24	Very low	26.6	Very low	149 Å²	149	154 Å²	154	80%	0.797	82%	0.82	S	S	*	*			trans	72.6	92.6	159.3	-53.9	-26.5	0	0	0	117.8
224	S	26.2	Very low	27.1	Very low	116 Å²	116	159.2 Å²	159.2	81%	0.811	82%	0.824	S	S	*	*			trans	-173.4	114.7	136.2	34.4	0	0	0	0	111
225	T	26.7	Very low	27.6	Very low	140 Å²	140	157.5 Å²	157.5	86%	0.859	82%	0.816	S	S	*	*			trans	-68.6	141.2	160.6	46.1	0	0	0	0	109.9
226	P	27.5	Very low	28.4	Very low	106 Å²	106	155.8 Å²	155.8	69%	0.688	81%	0.807	S	S	*	*				-142.6	124.5	127	24.2	-4.3	0	0	0	111.1
227	S	24.9	Very low	29.5	Very low	100 Å²	100	158 Å²	158	70%	0.699	80%	0.804	S	S	*	*				47.9	93.8	86.6	69.7	0	0	0	0	113.7
228	Y	27.4	Very low	30.1	Very low	233 Å²	233	154.2 Å²	154.2	91%	0.914	79%	0.785	S	S	*	*			trans	-162	94.6	144.6	-113.2	-81.5	0	0	0	108.2
229	W	25.2	Very low	31.2	Very low	240 Å²	240	150.1 Å²	150.1	91%	0.909	77%	0.768	S	S	*	*			trans	-90.3	129.4	157.3	-79.9	85.9	0	0	0	106
230	E	27.8	Very low	32	Very low	177 Å²	177	145.3 Å²	145.3	83%	0.827	74%	0.743	S	S	*	*				177.4	150.3	121	-99.9	168.1	167	0	0	112.1
231	E	28.5	Very low	33.1	Very low	185 Å²	185	143.6 Å²	143.6	86%	0.864	73%	0.725	S	S	*	*			trans	80.3	96.3	161.3	-70.7	172.5	165.5	0	0	120.3
232	S	31.7	Very low	34.1	Very low	109 Å²	109	143.1 Å²	143.1	76%	0.762	71%	0.708	S	S	*	*				178.7	92	117.1	164.6	0	0	0	0	110.5	R234	S232-R234 PolarHBondContact O-N 3.45Å; S232-R234 VanDerWaalsContact O-N 3.11Å
233	N	30.7	Very low	34.9	Very low	156 Å²	156	140.9 Å²	140.9	83%	0.834	70%	0.696	S	S	*	*			trans	-68.2	92.5	169.9	-82.8	-34.9	0	0	0	110.9
234	R	35.4	Very low	36	Very low	231 Å²	231	143.9 Å²	143.9	87%	0.872	70%	0.697	S	S	*	*			trans	-164.3	71.8	165.2	-115.2	-176.4	-87.7	-147.4	1.5	112.3	S232	S232-R234 PolarHBondContact O-N 3.45Å; S232-R234 VanDerWaalsContact O-N 3.11Å
235	C	39.6	Very low	37.1	Very low	92 Å²	92	141.8 Å²	141.8	62%	0.622	68%	0.68	S	S	*	*			trans	161.5	54	156.1	-88	0	0	0	0	111.6	W237 V239	C235-W237 VanDerWaalsContact C-N 3.33Å; C235-W237 PolarHBondContact O-N 3.12Å; C235-V239 WeakPolarHBondContact O-CG2 3.43Å; C235-V239 PolarHBondContact O-N 3.38Å
236	N	38.8	Very low	37.9	Very low	112 Å²	112	143 Å²	143	60%	0.599	67%	0.669	S	S	*	*	H	α-helix	trans	-68	-29.2	-170.9	-133.3	-1.8	0	0	0	113.2	N240	N236-N240 WeakPolarHBondContact O-CB 3.49Å; N236-N240 PolarHBondContact O-N 3.46Å; N236-N240 PolarHBondContact O-ND2 3.44Å
237	W	51.1	Low	38.9	Very low	195 Å²	195	145 Å²	145	74%	0.739	67%	0.673	S	S	*	*	H	α-helix	trans	-73.7	-44.6	-179.9	173.2	73.9	0	0	0	113.5	C235 N240 W241	C235-W237 VanDerWaalsContact C-N 3.33Å; C235-W237 PolarHBondContact O-N 3.12Å; W237-N240 PolarHBondContact O-N 3.48Å; W237-W241 WeakPolarHBondContact O-CB 3.42Å; W237-W241 PolarHBondContact O-N 3.48Å
238	F	38.8	Very low	40	Very low	109 Å²	109	144.4 Å²	144.4	48%	0.478	68%	0.683	S	S	.	*	H	α-helix	trans	-70.8	-38.7	-178.2	-161.9	-97.3	0	0	0	112	W241 F242	F238-W241 PolarHBondContact O-N 3.31Å; F238-F242 HydrophobicContact CE1-CD2 4.07Å; F238-F242 HydrophobicContact CE1-CE2 4.28Å; F238-F242 HydrophobicContact CZ-CD2 4.47Å; F238-F242 HydrophobicContact CZ-CE2 4.41Å; F238-F242 PolarHBondContact O-N 3.09Å
239	V	50.4	Low	41.5	Very low	81 Å²	81	136.7 Å²	136.7	49%	0.491	66%	0.656	S	S	.	*	H	α-helix	trans	-67.8	-38.1	173.4	177.3	0	0	0	0	110.9	C235 F242 K243	C235-V239 WeakPolarHBondContact O-CG2 3.43Å; C235-V239 PolarHBondContact O-N 3.38Å; V239-F242 PolarHBondContact O-N 2.86Å; V239-K243 WeakPolarHBondContact O-CB 3.42Å; V239-K243 PolarHBondContact O-N 3.31Å
240	N	43	Very low	43.6	Very low	60 Å²	60	128.2 Å²	128.2	32%	0.321	63%	0.633	S	S	.	*	H	α-helix	trans	-68.8	-37.9	173.6	-75.8	-23.6	0	0	0	112.3	N236 W237 F242 K243 Y244	N236-N240 WeakPolarHBondContact O-CB 3.49Å; N236-N240 PolarHBondContact O-N 3.46Å; N236-N240 PolarHBondContact O-ND2 3.44Å; W237-N240 PolarHBondContact O-N 3.48Å; N240-F242 VanDerWaalsContact C-N 3.34Å; N240-F242 PolarHBondContact O-N 3.07Å; N240-K243 PolarHBondContact O-N 3.03Å; N240-Y244 WeakPolarHBondContact O-CB 3.35Å; N240-Y244 WeakPolarHBondContact O-CD2 3.25Å; N240-Y244 PolarHBondContact O-N 2.95Å
241	W	46.8	Very low	45.6	Very low	135 Å²	135	123.6 Å²	123.6	51%	0.511	63%	0.625	S	S	.	*	H	α-helix	trans	-62.9	-39.9	175.1	-173.2	77.5	0	0	0	111.9	W237 F238 Y244 T245	W237-W241 WeakPolarHBondContact O-CB 3.42Å; W237-W241 PolarHBondContact O-N 3.48Å; F238-W241 PolarHBondContact O-N 3.31Å; W241-Y244 PolarHBondContact O-N 2.92Å; W241-T245 PolarHBondContact O-N 3.03Å; W241-T245 VanDerWaalsContact O-N 3.15Å; W241-T245 PolarHBondContact O-OG1 3.11Å
242	F	45.6	Very low	47.7	Very low	107 Å²	107	124.1 Å²	124.1	47%	0.469	62%	0.619	S	S	.	*	H	α-helix	trans	-73.9	-28.1	172.6	-112.3	-78.2	0	0	0	113.9	F238 V239 N240 T245	F238-F242 HydrophobicContact CE1-CD2 4.07Å; F238-F242 HydrophobicContact CE1-CE2 4.28Å; F238-F242 HydrophobicContact CZ-CD2 4.47Å; F238-F242 HydrophobicContact CZ-CE2 4.41Å; F238-F242 PolarHBondContact O-N 3.09Å; V239-F242 PolarHBondContact O-N 2.86Å; N240-F242 VanDerWaalsContact C-N 3.34Å; N240-F242 PolarHBondContact O-N 3.07Å; F242-T245 WeakPolarHBondContact CA-OG1 3.32Å; F242-T245 PolarHBondContact O-OG1 3.23Å
243	K	43.4	Very low	49.8	Very low	126 Å²	126	123.5 Å²	123.5	55%	0.548	61%	0.605	S	S	.	*	H	α-helix	trans	-69.3	-38.2	171.2	-107.3	178.1	174.5	176.8	0	111.5	V239 N240 R246	V239-K243 WeakPolarHBondContact O-CB 3.42Å; V239-K243 PolarHBondContact O-N 3.31Å; N240-K243 PolarHBondContact O-N 3.03Å; K243-R246 WeakPolarHBondContact O-CB 3.41Å
244	Y	47.7	Very low	51.6	Low	211 Å²	211	119.2 Å²	119.2	83%	0.827	58%	0.579	S	S	*	*	H	α-helix	trans	-78.9	-21.3	-178.9	-94.5	-83.4	0	0	0	114	N240 W241 R246	N240-Y244 WeakPolarHBondContact O-CB 3.35Å; N240-Y244 WeakPolarHBondContact O-CD2 3.25Å; N240-Y244 PolarHBondContact O-N 2.95Å; W241-Y244 PolarHBondContact O-N 2.92Å; Y244-R246 PolarHBondContact O-N 3.37Å
245	T	47.7	Very low	53.5	Low	73 Å²	73	113 Å²	113	45%	0.448	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	10	173.5	42.7	0	0	0	0	113.7	W241 F242 L247	W241-T245 PolarHBondContact O-N 3.03Å; W241-T245 VanDerWaalsContact O-N 3.15Å; W241-T245 PolarHBondContact O-OG1 3.11Å; F242-T245 WeakPolarHBondContact CA-OG1 3.32Å; F242-T245 PolarHBondContact O-OG1 3.23Å; T245-L247 PolarHBondContact O-N 2.92Å
246	R	44.3	Very low	55.4	Low	164 Å²	164	112.9 Å²	112.9	62%	0.619	56%	0.556	S	S	*	*			trans	-68.6	94.9	173.1	-81.7	-175.5	178.1	-168.4	0.2	111.1	K243 Y244 G248	K243-R246 WeakPolarHBondContact O-CB 3.41Å; Y244-R246 PolarHBondContact O-N 3.37Å; R246-G248 PolarHBondContact O-N 3Å
247	L	48.4	Very low	57.3	Low	150 Å²	150	111.3 Å²	111.3	79%	0.785	55%	0.546	S	S	*	.			trans	-44.4	125.1	151.4	-81.4	127.9	0	0	0	108.6	T245 M249	T245-L247 PolarHBondContact O-N 2.92Å; L247-M249 PolarHBondContact O-N 2.78Å
248	G	48.9	Very low	58.9	Low	87 Å²	87	104.9 Å²	104.9	90%	0.897	52%	0.523	S	S	*	.			trans	-61.8	60.9	-169.1	0	0	0	0	0	116.1	R246	R246-G248 PolarHBondContact O-N 3Å
249	M	58.4	Low	61	Low	70 Å²	70	103.2 Å²	103.2	35%	0.345	52%	0.519	S	S	.	.			trans	-87.6	128.8	175.7	-67.2	-179.1	71.3	0	0	109.9	L247 Q253 Q254 M257	L247-M249 PolarHBondContact O-N 2.78Å; M249-Q253 VanDerWaalsContact CA-OE1 3.27Å; M249-Q253 HydrophobicContact CB-CB 4.09Å; M249-Q253 HydrophobicContact CE-CB 3.7Å; M249-Q254 HydrophobicContact CB-CG 4.04Å; M249-M257 HydrophobicContact CE-CB 4.44Å; M249-M257 HydrophobicContact CE-SD 4.12Å; M249-M257 HydrophobicContact SD-SD 4.47Å
250	S	67.8	Low	62.6	Low	63 Å²	63	101.8 Å²	101.8	44%	0.441	51%	0.505	S	S	.	.			trans	-60.4	152.2	172.7	63.7	0	0	0	0	110.7	R252 Q253 Q254	S250-R252 PolarHBondContact O-N 3.34Å; S250-Q253 WeakPolarHBondContact O-CA 3.47Å; S250-Q253 WeakPolarHBondContact O-CB 3.46Å; S250-Q253 PolarHBondContact O-N 3.06Å; S250-Q253 WeakPolarHBondContact OG-CG 3.44Å; S250-Q254 PolarHBondContact O-N 2.87Å
251	A	70.5	Confident	64.7	Low	80 Å²	80	99.3 Å²	99.3	66%	0.661	49%	0.492	S	S	*	.	H	α-helix	trans	-51.6	-34.4	178.9	0	0	0	0	0	112.3	Q254 L255	A251-Q254 PolarHBondContact O-N 3.28Å; A251-L255 WeakPolarHBondContact O-CB 3.39Å; A251-L255 PolarHBondContact O-N 3.11Å
252	R	73.1	Confident	66.5	Low	196 Å²	196	95.5 Å²	95.5	74%	0.74	48%	0.481	S	S	*	.	H	α-helix	trans	-64.2	-40.6	173.9	-169.4	175.4	-174.3	175.3	2.8	113.2	S250 N256	S250-R252 PolarHBondContact O-N 3.34Å; R252-N256 WeakPolarHBondContact O-CB 3.45Å; R252-N256 VanDerWaalsContact O-CG 3.23Å; R252-N256 PolarHBondContact O-N 2.91Å; R252-N256 PolarHBondContact O-ND2 3.34Å
253	Q	74.6	Confident	68.5	Low	96 Å²	96	95.5 Å²	95.5	45%	0.449	48%	0.477	S	S	.	.	H	α-helix	trans	-69	-37.9	176.4	-72.2	173.3	-14.3	0	0	111.5	M249 S250 N256 M257	M249-Q253 VanDerWaalsContact CA-OE1 3.27Å; M249-Q253 HydrophobicContact CB-CB 4.09Å; M249-Q253 HydrophobicContact CE-CB 3.7Å; S250-Q253 WeakPolarHBondContact O-CA 3.47Å; S250-Q253 WeakPolarHBondContact O-CB 3.46Å; S250-Q253 PolarHBondContact O-N 3.06Å; S250-Q253 WeakPolarHBondContact OG-CG 3.44Å; Q253-N256 PolarHBondContact O-N 3.41Å; Q253-M257 WeakPolarHBondContact O-CB 3.36Å; Q253-M257 PolarHBondContact O-N 3.35Å
254	Q	68.5	Low	70.6	Confident	65 Å²	65	92.2 Å²	92.2	30%	0.304	46%	0.463	S	S	.	.	H	α-helix	trans	-63.4	-44.8	174.4	-66.2	-176.7	-5.4	0	0	111.6	M249 S250 A251 M257 K258	M249-Q254 HydrophobicContact CB-CG 4.04Å; S250-Q254 PolarHBondContact O-N 2.87Å; A251-Q254 PolarHBondContact O-N 3.28Å; Q254-M257 PolarHBondContact O-N 3.42Å; Q254-K258 WeakPolarHBondContact O-CB 3.34Å; Q254-K258 PolarHBondContact O-N 2.87Å
255	L	76.1	Confident	72.4	Confident	100 Å²	100	83.2 Å²	83.2	52%	0.524	43%	0.43	S	S	.	.	H	α-helix	trans	-62.6	-45.2	175.8	-174.5	68.4	0	0	0	111.7	A251 M257 K258 L259	A251-L255 WeakPolarHBondContact O-CB 3.39Å; A251-L255 PolarHBondContact O-N 3.11Å; L255-M257 VanDerWaalsContact C-N 3.34Å; L255-M257 PolarHBondContact O-N 3.4Å; L255-K258 PolarHBondContact O-N 3.17Å; L255-L259 HydrophobicContact CG-CD1 4Å; L255-L259 HydrophobicContact CG-CG 4.46Å; L255-L259 WeakPolarHBondContact O-CB 3.44Å; L255-L259 VanDerWaalsContact O-CG 3.29Å; L255-L259 WeakPolarHBondContact O-CG 3.41Å; L255-L259 PolarHBondContact O-N 3.01Å
256	N	79.9	Confident	74.2	Confident	91 Å²	91	82 Å²	82	49%	0.487	42%	0.423	S	S	.	.	H	α-helix	trans	-62.3	-40.5	177.7	-77.4	-20.6	0	0	0	112.4	R252 Q253 Y260	R252-N256 WeakPolarHBondContact O-CB 3.45Å; R252-N256 VanDerWaalsContact O-CG 3.23Å; R252-N256 PolarHBondContact O-N 2.91Å; R252-N256 PolarHBondContact O-ND2 3.34Å; Q253-N256 PolarHBondContact O-N 3.41Å; N256-Y260 WeakPolarHBondContact O-CB 3.3Å; N256-Y260 PolarHBondContact O-N 3.41Å
257	M	79.3	Confident	76.1	Confident	78 Å²	78	75.5 Å²	75.5	38%	0.384	40%	0.401	S	S	.	.	H	α-helix	trans	-64.8	-45.7	176	-176.6	173.4	74	0	0	111	M249 Q253 Q254 L255 Y260 C261	M249-M257 HydrophobicContact CE-CB 4.44Å; M249-M257 HydrophobicContact CE-SD 4.12Å; M249-M257 HydrophobicContact SD-SD 4.47Å; Q253-M257 WeakPolarHBondContact O-CB 3.36Å; Q253-M257 PolarHBondContact O-N 3.35Å; Q254-M257 PolarHBondContact O-N 3.42Å; L255-M257 VanDerWaalsContact C-N 3.34Å; L255-M257 PolarHBondContact O-N 3.4Å; M257-Y260 WeakPolarHBondContact O-CB 3.38Å; M257-Y260 PolarHBondContact O-N 2.86Å; M257-C261 PolarHBondContact O-N 3.46Å; M257-C261 PolarHBondContact O-SG 3.14Å
258	K	83.3	Confident	77.8	Confident	60 Å²	60	73.5 Å²	73.5	26%	0.261	40%	0.4	S	S	.	.	H	α-helix	trans	-59	-50.7	176	-175	179.3	176.2	-172.1	0	111.5	Q254 L255 Y260 C261 E262 A335 T337	Q254-K258 WeakPolarHBondContact O-CB 3.34Å; Q254-K258 PolarHBondContact O-N 2.87Å; L255-K258 PolarHBondContact O-N 3.17Å; K258-Y260 PolarHBondContact O-N 2.87Å; K258-C261 PolarHBondContact O-N 2.98Å; K258-C261 VanDerWaalsContact O-N 3.11Å; K258-E262 WeakPolarHBondContact CE-OE1 3.36Å; K258-E262 HydrophobicContact CG-CG 4.48Å; K258-E262 WeakPolarHBondContact O-CB 3.46Å; K258-E262 WeakPolarHBondContact O-CG 3.49Å; K258-E262 PolarHBondContact O-N 2.9Å; K258-A335 WeakPolarHBondContact CE-O 3.36Å; K258-T337 VanDerWaalsContact NZ-CG2 3.35Å
259	L	83.1	Confident	79.6	Confident	75 Å²	75	74.3 Å²	74.3	39%	0.393	38%	0.376	S	S	.	.	H	α-helix	trans	-58.5	-35.3	176.6	-74	168	0	0	0	112.7	L255 R263	L255-L259 HydrophobicContact CG-CD1 4Å; L255-L259 HydrophobicContact CG-CG 4.46Å; L255-L259 WeakPolarHBondContact O-CB 3.44Å; L255-L259 VanDerWaalsContact O-CG 3.29Å; L255-L259 WeakPolarHBondContact O-CG 3.41Å; L255-L259 PolarHBondContact O-N 3.01Å; L259-R263 WeakPolarHBondContact O-CG 3.46Å; L259-R263 PolarHBondContact O-N 3.13Å; L259-R263 VanDerWaalsContact O-N 3.17Å
260	Y	84.6	Confident	80.9	Confident	50 Å²	50	75.4 Å²	75.4	20%	0.196	39%	0.389	C	S	.	.	H	α-helix	trans	-69	-46.2	175.7	-170	-82.3	0	0	0	111.3	F30 Y34 N256 M257 K258 E262 R263 F264	F30-Y260 HydrophobicContact CD1-CE1 4.49Å; F30-Y260 HydrophobicContact CE1-CD1 4.08Å; F30-Y260 AromaticContact CE1-CE1 3.25Å; F30-Y260 HydrophobicContact CE1-CE1 3.25Å; F30-Y260 AromaticContact CE1-CZ 3.78Å; F30-Y260 HydrophobicContact CZ-CD1 4.24Å; F30-Y260 AromaticContact CZ-CE1 3.4Å; F30-Y260 HydrophobicContact CZ-CE1 3.4Å; Y34-Y260 HydrophobicContact CD2-CE2 4.15Å; Y34-Y260 HydrophobicContact CE2-CE2 4.38Å; N256-Y260 WeakPolarHBondContact O-CB 3.3Å; N256-Y260 PolarHBondContact O-N 3.41Å; M257-Y260 WeakPolarHBondContact O-CB 3.38Å; M257-Y260 PolarHBondContact O-N 2.86Å; K258-Y260 PolarHBondContact O-N 2.87Å; Y260-E262 VanDerWaalsContact C-N 3.32Å; Y260-E262 PolarHBondContact O-N 3.2Å; Y260-R263 WeakPolarHBondContact O-CB 3.39Å; Y260-R263 PolarHBondContact O-N 3.01Å; Y260-F264 AromaticContact CD1-CD2 3.98Å; Y260-F264 HydrophobicContact CD1-CD2 3.98Å; Y260-F264 HydrophobicContact CD1-CE2 4.05Å; Y260-F264 AromaticContact CE1-CD2 3.55Å; Y260-F264 HydrophobicContact CE1-CD2 3.55Å; Y260-F264 AromaticContact CE1-CE2 3.26Å; Y260-F264 HydrophobicContact CE1-CE2 3.26Å; Y260-F264 HydrophobicContact CE1-CZ 4.25Å; Y260-F264 HydrophobicContact CE2-CE2 4.07Å; Y260-F264 AromaticContact CZ-CE2 3.32Å; Y260-F264 WeakPolarHBondContact O-CD2 3.47Å; Y260-F264 PolarHBondContact O-N 3.27Å; Y260-F264 WeakPolarHBondContact OH-CE2 3.42Å
261	C	86.6	Confident	81.8	Confident	8 Å²	8	74.2 Å²	74.2	5%	0.054	38%	0.383	C	S	.	.	H	α-helix	trans	-63.9	-39.5	177.2	-61.9	0	0	0	0	111.3	M257 K258 R263 F264 T265 C334 A335	M257-C261 PolarHBondContact O-N 3.46Å; M257-C261 PolarHBondContact O-SG 3.14Å; K258-C261 PolarHBondContact O-N 2.98Å; K258-C261 VanDerWaalsContact O-N 3.11Å; C261-R263 VanDerWaalsContact C-N 3.31Å; C261-R263 PolarHBondContact O-N 3.08Å; C261-F264 PolarHBondContact O-N 3.1Å; C261-F264 VanDerWaalsContact O-N 3.15Å; C261-T265 WeakPolarHBondContact O-CB 3.47Å; C261-T265 WeakPolarHBondContact O-CG2 3.25Å; C261-T265 PolarHBondContact O-N 3.09Å; C261-T265 PolarHBondContact O-OG1 3.4Å; C261-C334 HydrophobicContact CB-CB 4Å; C261-C334 WeakPolarHBondContact SG-CB 3.19Å; C261-A335 HydrophobicContact CB-CB 3.98Å
262	E	85.3	Confident	82.6	Confident	56 Å²	56	70.4 Å²	70.4	26%	0.262	35%	0.351	S	S	.	.	H	α-helix	trans	-57.7	-40.9	172.9	-77.8	176.3	177.1	0	0	111.5	K258 Y260 F264 T265 T266 A335	K258-E262 WeakPolarHBondContact CE-OE1 3.36Å; K258-E262 HydrophobicContact CG-CG 4.48Å; K258-E262 WeakPolarHBondContact O-CB 3.46Å; K258-E262 WeakPolarHBondContact O-CG 3.49Å; K258-E262 PolarHBondContact O-N 2.9Å; Y260-E262 VanDerWaalsContact C-N 3.32Å; Y260-E262 PolarHBondContact O-N 3.2Å; E262-F264 VanDerWaalsContact C-N 3.25Å; E262-F264 PolarHBondContact O-N 3.24Å; E262-T265 WeakPolarHBondContact CA-OG1 3.23Å; E262-T265 PolarHBondContact O-N 2.98Å; E262-T265 PolarHBondContact O-OG1 3.05Å; E262-T266 HydrophobicContact CB-CG2 4.27Å; E262-T266 VanDerWaalsContact O-CB 3.23Å; E262-T266 WeakPolarHBondContact O-CB 3.43Å; E262-T266 VanDerWaalsContact O-CG2 3.26Å; E262-T266 WeakPolarHBondContact O-CG2 3.25Å; E262-T266 PolarHBondContact O-N 3.28Å; E262-T266 PolarHBondContact O-OG1 3.31Å; E262-A335 HydrophobicContact CG-CB 4.11Å
263	R	87	Confident	83.3	Confident	107 Å²	107	64.8 Å²	64.8	40%	0.404	33%	0.332	S	S	.	.	H	α-helix	trans	-62.5	-27.4	177.4	-76.8	175.4	176	165.3	6.1	114.8	L259 Y260 C261 Y269	L259-R263 WeakPolarHBondContact O-CG 3.46Å; L259-R263 PolarHBondContact O-N 3.13Å; L259-R263 VanDerWaalsContact O-N 3.17Å; Y260-R263 WeakPolarHBondContact O-CB 3.39Å; Y260-R263 PolarHBondContact O-N 3.01Å; C261-R263 VanDerWaalsContact C-N 3.31Å; C261-R263 PolarHBondContact O-N 3.08Å; R263-Y269 HydrophobicContact CB-CD2 4.2Å; R263-Y269 HydrophobicContact CB-CE2 4.39Å; R263-Y269 HydrophobicContact CB-CG 4.36Å; R263-Y269 HydrophobicContact CG-CD1 4.21Å; R263-Y269 HydrophobicContact CG-CD2 3.98Å; R263-Y269 HydrophobicContact CG-CE1 3.94Å; R263-Y269 HydrophobicContact CG-CE2 3.71Å; R263-Y269 HydrophobicContact CG-CG 4.21Å; R263-Y269 WeakPolarHBondContact O-CB 3.31Å
264	F	87.8	Confident	84	Confident	57 Å²	57	65.1 Å²	65.1	25%	0.25	34%	0.336	C	S	.	.	H	α-helix	trans	-95.1	-15.1	179	-79.6	-87.3	0	0	0	113.5	Y260 C261 E262 A271 G272 L331	Y260-F264 AromaticContact CD1-CD2 3.98Å; Y260-F264 HydrophobicContact CD1-CD2 3.98Å; Y260-F264 HydrophobicContact CD1-CE2 4.05Å; Y260-F264 AromaticContact CE1-CD2 3.55Å; Y260-F264 HydrophobicContact CE1-CD2 3.55Å; Y260-F264 AromaticContact CE1-CE2 3.26Å; Y260-F264 HydrophobicContact CE1-CE2 3.26Å; Y260-F264 HydrophobicContact CE1-CZ 4.25Å; Y260-F264 HydrophobicContact CE2-CE2 4.07Å; Y260-F264 AromaticContact CZ-CE2 3.32Å; Y260-F264 WeakPolarHBondContact O-CD2 3.47Å; Y260-F264 PolarHBondContact O-N 3.27Å; Y260-F264 WeakPolarHBondContact OH-CE2 3.42Å; C261-F264 PolarHBondContact O-N 3.1Å; C261-F264 VanDerWaalsContact O-N 3.15Å; E262-F264 VanDerWaalsContact C-N 3.25Å; E262-F264 PolarHBondContact O-N 3.24Å; F264-A271 HydrophobicContact CD1-CB 4.21Å; F264-A271 HydrophobicContact CE1-CB 4.16Å; F264-G272 WeakPolarHBondContact O-CA 3.47Å; F264-L331 HydrophobicContact CB-CD1 4.46Å
265	T	85.3	Confident	85	Confident	22 Å²	22	63.5 Å²	63.5	14%	0.135	33%	0.329	C	S	.	.	H	α-helix	trans	-106.7	-30.9	-177.7	52.3	0	0	0	0	112.2	C261 E262 L331 K332 A335	C261-T265 WeakPolarHBondContact O-CB 3.47Å; C261-T265 WeakPolarHBondContact O-CG2 3.25Å; C261-T265 PolarHBondContact O-N 3.09Å; C261-T265 PolarHBondContact O-OG1 3.4Å; E262-T265 WeakPolarHBondContact CA-OG1 3.23Å; E262-T265 PolarHBondContact O-N 2.98Å; E262-T265 PolarHBondContact O-OG1 3.05Å; T265-L331 HydrophobicContact CG2-CB 3.88Å; T265-K332 HydrophobicContact CG2-CG 3.97Å; T265-A335 HydrophobicContact CG2-CB 4.3Å; T265-A335 WeakPolarHBondContact OG1-CB 3.5Å
266	T	85.2	Confident	85.6	Confident	48 Å²	48	59.6 Å²	59.6	29%	0.294	31%	0.308	S	S	.	.	S	Bend	trans	-81.9	133.8	178.2	63.1	0	0	0	0	111.3	E262 S268 Y269 G272	E262-T266 HydrophobicContact CB-CG2 4.27Å; E262-T266 VanDerWaalsContact O-CB 3.23Å; E262-T266 WeakPolarHBondContact O-CB 3.43Å; E262-T266 VanDerWaalsContact O-CG2 3.26Å; E262-T266 WeakPolarHBondContact O-CG2 3.25Å; E262-T266 PolarHBondContact O-N 3.28Å; E262-T266 PolarHBondContact O-OG1 3.31Å; T266-S268 PolarHBondContact O-N 3.23Å; T266-Y269 PolarHBondContact O-N 2.85Å; T266-Y269 VanDerWaalsContact OG1-CD2 3.31Å; T266-Y269 WeakPolarHBondContact OG1-CD2 3.26Å; T266-G272 WeakPolarHBondContact O-CA 3.47Å
267	V	83.5	Confident	86	Confident	26 Å²	26	56.8 Å²	56.8	16%	0.158	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-15.5	-178.7	-175.9	0	0	0	0	112.4	Y269 K273 L276 Y388	V267-Y269 PolarHBondContact O-N 3.46Å; V267-Y269 VanDerWaalsContact O-N 3.16Å; V267-K273 HydrophobicContact CG1-CG 3.8Å; V267-K273 VanDerWaalsContact O-CE 3.26Å; V267-K273 WeakPolarHBondContact O-CE 3.33Å; V267-K273 VanDerWaalsContact O-CG 3.23Å; V267-K273 WeakPolarHBondContact O-CG 3.47Å; V267-L276 HydrophobicContact CG2-CD2 3.9Å; V267-Y388 HydrophobicContact CB-CD2 4.25Å; V267-Y388 HydrophobicContact CB-CE1 4.48Å; V267-Y388 HydrophobicContact CB-CE2 4.07Å; V267-Y388 HydrophobicContact CG1-CD1 3.5Å; V267-Y388 HydrophobicContact CG1-CD2 3.25Å; V267-Y388 HydrophobicContact CG1-CE1 3.75Å; V267-Y388 HydrophobicContact CG1-CE2 3.52Å; V267-Y388 HydrophobicContact CG1-CG 3.24Å; V267-Y388 HydrophobicContact CG2-CD2 4.03Å; V267-Y388 HydrophobicContact CG2-CE2 3.62Å
268	S	84.2	Confident	86.6	Confident	109 Å²	109	56.3 Å²	56.3	76%	0.762	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-26.2	176.8	-50.8	0	0	0	0	113	T266	T266-S268 PolarHBondContact O-N 3.23Å
269	Y	86.6	Confident	86.9	Confident	103 Å²	103	53.9 Å²	53.9	40%	0.404	28%	0.282	S	S	.	.	S	Bend	trans	-102	144.3	177.1	-62.2	-87.4	0	0	0	111.1	R263 T266 V267 A271 G272 K273	R263-Y269 HydrophobicContact CB-CD2 4.2Å; R263-Y269 HydrophobicContact CB-CE2 4.39Å; R263-Y269 HydrophobicContact CB-CG 4.36Å; R263-Y269 HydrophobicContact CG-CD1 4.21Å; R263-Y269 HydrophobicContact CG-CD2 3.98Å; R263-Y269 HydrophobicContact CG-CE1 3.94Å; R263-Y269 HydrophobicContact CG-CE2 3.71Å; R263-Y269 HydrophobicContact CG-CG 4.21Å; R263-Y269 WeakPolarHBondContact O-CB 3.31Å; T266-Y269 PolarHBondContact O-N 2.85Å; T266-Y269 VanDerWaalsContact OG1-CD2 3.31Å; T266-Y269 WeakPolarHBondContact OG1-CD2 3.26Å; V267-Y269 PolarHBondContact O-N 3.46Å; V267-Y269 VanDerWaalsContact O-N 3.16Å; Y269-A271 PolarHBondContact O-N 2.95Å; Y269-G272 PolarHBondContact O-N 2.95Å; Y269-K273 PolarHBondContact O-N 3.23Å
270	P	85.6	Confident	87.3	Confident	94 Å²	94	50.5 Å²	50.5	61%	0.61	26%	0.264	S	S	*	.	H	α-helix	trans	-58.8	-32.7	176.3	23.6	-33.6	0	0	0	112.3	K273 I274	P270-K273 PolarHBondContact O-N 3.27Å; P270-I274 WeakPolarHBondContact O-CD1 3.47Å; P270-I274 VanDerWaalsContact O-CG1 3.27Å; P270-I274 WeakPolarHBondContact O-CG1 3.38Å; P270-I274 PolarHBondContact O-N 3.25Å
271	A	87.7	Confident	87.6	Confident	37 Å²	37	51.8 Å²	51.8	31%	0.306	28%	0.277	S	S	.	.	H	α-helix	trans	-61.9	-44.1	174.4	0	0	0	0	0	112	F264 Y269 I274 M275	F264-A271 HydrophobicContact CD1-CB 4.21Å; F264-A271 HydrophobicContact CE1-CB 4.16Å; Y269-A271 PolarHBondContact O-N 2.95Å; A271-I274 PolarHBondContact O-N 2.93Å; A271-M275 WeakPolarHBondContact O-CB 3.1Å; A271-M275 PolarHBondContact O-N 3.45Å
272	G	87.3	Confident	87.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-67.3	-38.2	176.3	0	0	0	0	0	113.3	F264 T266 Y269 M275 L276	F264-G272 WeakPolarHBondContact O-CA 3.47Å; T266-G272 WeakPolarHBondContact O-CA 3.47Å; Y269-G272 PolarHBondContact O-N 2.95Å; G272-M275 PolarHBondContact O-N 3.21Å; G272-L276 WeakPolarHBondContact O-CB 3.42Å; G272-L276 PolarHBondContact O-N 2.92Å
273	K	87.1	Confident	88.1	Confident	79 Å²	79	51 Å²	51	34%	0.343	27%	0.274	S	S	.	.	H	α-helix	trans	-57.4	-51	171.9	-66.1	-170	175.9	-167.1	0	111.6	V267 Y269 P270 M275 L276 T277 Y388	V267-K273 HydrophobicContact CG1-CG 3.8Å; V267-K273 VanDerWaalsContact O-CE 3.26Å; V267-K273 WeakPolarHBondContact O-CE 3.33Å; V267-K273 VanDerWaalsContact O-CG 3.23Å; V267-K273 WeakPolarHBondContact O-CG 3.47Å; Y269-K273 PolarHBondContact O-N 3.23Å; P270-K273 PolarHBondContact O-N 3.27Å; K273-M275 PolarHBondContact O-N 3.27Å; K273-L276 PolarHBondContact O-N 3.04Å; K273-T277 WeakPolarHBondContact O-CG2 3.31Å; K273-T277 PolarHBondContact O-N 3.45Å; K273-T277 PolarHBondContact O-OG1 2.79Å; K273-Y388 PolarHBondContact NZ-O 3.5Å
274	I	89.5	Confident	88.3	Confident	102 Å²	102	46.6 Å²	46.6	52%	0.523	26%	0.259	S	S	.	.	H	α-helix	trans	-61.1	-47.2	179.2	-67.1	164.6	0	0	0	110	P270 A271 L276 T277 I278	P270-I274 WeakPolarHBondContact O-CD1 3.47Å; P270-I274 VanDerWaalsContact O-CG1 3.27Å; P270-I274 WeakPolarHBondContact O-CG1 3.38Å; P270-I274 PolarHBondContact O-N 3.25Å; A271-I274 PolarHBondContact O-N 2.93Å; I274-L276 PolarHBondContact O-N 3.08Å; I274-T277 WeakPolarHBondContact CA-OG1 3.42Å; I274-T277 PolarHBondContact O-N 2.85Å; I274-T277 PolarHBondContact O-OG1 2.97Å; I274-I278 HydrophobicContact CG2-CD1 3.64Å; I274-I278 HydrophobicContact CG2-CG1 4.36Å; I274-I278 VanDerWaalsContact O-CG1 3.3Å; I274-I278 WeakPolarHBondContact O-CG1 3.43Å; I274-I278 PolarHBondContact O-N 3.11Å
275	M	89.6	Confident	88.5	Confident	32 Å²	32	46 Å²	46	16%	0.158	26%	0.26	C	S	.	.	H	α-helix	trans	-61	-44.2	-178.8	-164.2	67	-175.9	0	0	112.3	A271 G272 K273 I278 Y279 F324 Y328 L331	A271-M275 WeakPolarHBondContact O-CB 3.1Å; A271-M275 PolarHBondContact O-N 3.45Å; G272-M275 PolarHBondContact O-N 3.21Å; K273-M275 PolarHBondContact O-N 3.27Å; M275-I278 PolarHBondContact O-N 3.13Å; M275-Y279 WeakPolarHBondContact O-CB 3.25Å; M275-Y279 PolarHBondContact O-N 2.99Å; M275-F324 HydrophobicContact CE-CD2 4.29Å; M275-F324 HydrophobicContact CE-CE1 3.92Å; M275-F324 HydrophobicContact CE-CE2 3.41Å; M275-F324 VanDerWaalsContact CE-CE2 3.41Å; M275-F324 HydrophobicContact CE-CZ 3.19Å; M275-F324 HydrophobicContact SD-CE2 3.89Å; M275-F324 HydrophobicContact SD-CZ 3.53Å; M275-F324 VanDerWaalsContact SD-CZ 3.53Å; M275-Y328 HydrophobicContact CB-CE2 4.31Å; M275-Y328 HydrophobicContact CE-CD2 3.85Å; M275-Y328 HydrophobicContact CE-CG 4.4Å; M275-Y328 HydrophobicContact CG-CD2 3.52Å; M275-Y328 HydrophobicContact CG-CE2 3.6Å; M275-L331 HydrophobicContact CE-CD1 4.34Å
276	L	88.6	Confident	88.8	Confident	18 Å²	18	45 Å²	45	9%	0.094	25%	0.254	C	S	.	.	H	α-helix	trans	-63.7	-45.3	176.4	-179.9	64.1	0	0	0	111.7	V267 G272 K273 I274 I278 Y279 I280 Y388	V267-L276 HydrophobicContact CG2-CD2 3.9Å; G272-L276 WeakPolarHBondContact O-CB 3.42Å; G272-L276 PolarHBondContact O-N 2.92Å; K273-L276 PolarHBondContact O-N 3.04Å; I274-L276 PolarHBondContact O-N 3.08Å; L276-I278 VanDerWaalsContact C-N 3.33Å; L276-I278 PolarHBondContact O-N 2.9Å; L276-Y279 HydrophobicContact CD1-CD1 4.46Å; L276-Y279 PolarHBondContact O-N 3.1Å; L276-I280 HydrophobicContact CD1-CD1 3.94Å; L276-I280 HydrophobicContact CD1-CG1 4.33Å; L276-I280 HydrophobicContact CG-CD1 3.9Å; L276-I280 WeakPolarHBondContact O-CG1 3.41Å; L276-I280 PolarHBondContact O-N 3.16Å; L276-Y388 HydrophobicContact CD2-CD2 4.37Å; L276-Y388 HydrophobicContact CD2-CE2 4.36Å
277	T	89.2	Confident	89	Confident	32 Å²	32	44 Å²	44	20%	0.196	25%	0.245	C	C	.	.	H	α-helix	trans	-59.8	-43.7	178	57.8	0	0	0	0	111.8	K273 I274 I280 V281 T385 L389	K273-T277 WeakPolarHBondContact O-CG2 3.31Å; K273-T277 PolarHBondContact O-N 3.45Å; K273-T277 PolarHBondContact O-OG1 2.79Å; I274-T277 WeakPolarHBondContact CA-OG1 3.42Å; I274-T277 PolarHBondContact O-N 2.85Å; I274-T277 PolarHBondContact O-OG1 2.97Å; T277-I280 PolarHBondContact O-N 2.8Å; T277-V281 VanDerWaalsContact O-CG2 3.31Å; T277-V281 WeakPolarHBondContact O-CG2 3.36Å; T277-V281 PolarHBondContact O-N 2.89Å; T277-T385 HydrophobicContact CG2-CG2 3.4Å; T277-L389 HydrophobicContact CG2-CD1 4.11Å; T277-L389 HydrophobicContact CG2-CD2 4.18Å; T277-L389 HydrophobicContact CG2-CG 4.32Å
278	I	91.1	Very high	89.4	Confident	67 Å²	67	46.9 Å²	46.9	34%	0.344	26%	0.259	S	S	.	.	H	α-helix	trans	-64.7	-45.6	177.7	-66.4	169.5	0	0	0	110.1	I274 M275 L276 I280 V281 L282 F324	I274-I278 HydrophobicContact CG2-CD1 3.64Å; I274-I278 HydrophobicContact CG2-CG1 4.36Å; I274-I278 VanDerWaalsContact O-CG1 3.3Å; I274-I278 WeakPolarHBondContact O-CG1 3.43Å; I274-I278 PolarHBondContact O-N 3.11Å; M275-I278 PolarHBondContact O-N 3.13Å; L276-I278 VanDerWaalsContact C-N 3.33Å; L276-I278 PolarHBondContact O-N 2.9Å; I278-I280 VanDerWaalsContact C-N 3.32Å; I278-I280 PolarHBondContact O-N 3.28Å; I278-V281 PolarHBondContact O-N 3.24Å; I278-L282 HydrophobicContact CG2-CD1 3.62Å; I278-L282 HydrophobicContact CG2-CG 4.04Å; I278-L282 WeakPolarHBondContact O-CB 3.45Å; I278-L282 VanDerWaalsContact O-CG 3.24Å; I278-L282 WeakPolarHBondContact O-CG 3.22Å; I278-L282 PolarHBondContact O-N 3.49Å; I278-F324 HydrophobicContact CB-CE1 4.42Å; I278-F324 HydrophobicContact CB-CZ 4.04Å; I278-F324 HydrophobicContact CG2-CE1 3.73Å; I278-F324 HydrophobicContact CG2-CE2 4.06Å; I278-F324 HydrophobicContact CG2-CZ 3.42Å; I278-F324 VanDerWaalsContact CG2-CZ 3.42Å
279	Y	91	Very high	89.6	Confident	10 Å²	10	43.4 Å²	43.4	4%	0.039	23%	0.23	C	C	.	.	H	α-helix	trans	-56	-45.2	177.5	167.9	-101.7	0	0	0	112.4	M275 L276 S283 C325 Y328 D351	M275-Y279 WeakPolarHBondContact O-CB 3.25Å; M275-Y279 PolarHBondContact O-N 2.99Å; L276-Y279 HydrophobicContact CD1-CD1 4.46Å; L276-Y279 PolarHBondContact O-N 3.1Å; Y279-S283 VanDerWaalsContact O-CB 3.29Å; Y279-S283 WeakPolarHBondContact O-CB 3.39Å; Y279-S283 PolarHBondContact O-N 3.25Å; Y279-S283 PolarHBondContact O-OG 3.39Å; Y279-C325 HydrophobicContact CE2-CB 4.3Å; Y279-Y328 HydrophobicContact CD1-CD1 4.07Å; Y279-Y328 AromaticContact CD1-CE1 3.74Å; Y279-Y328 HydrophobicContact CD1-CE1 3.74Å; Y279-Y328 AromaticContact CD2-CD1 3.38Å; Y279-Y328 HydrophobicContact CD2-CD1 3.38Å; Y279-Y328 AromaticContact CD2-CE1 3.94Å; Y279-Y328 HydrophobicContact CD2-CE1 3.94Å; Y279-Y328 HydrophobicContact CD2-CG 4.16Å; Y279-Y328 HydrophobicContact CE1-CD1 4.44Å; Y279-Y328 HydrophobicContact CE1-CE1 4.19Å; Y279-Y328 AromaticContact CE2-CD1 3.8Å; Y279-Y328 HydrophobicContact CE2-CD1 3.8Å; Y279-Y328 HydrophobicContact CE2-CE1 4.35Å; Y279-Y328 AromaticContact CG-CD1 3.51Å; Y279-Y328 HydrophobicContact CG-CD1 3.51Å; Y279-Y328 AromaticContact CG-CE1 3.6Å; Y279-Y328 HydrophobicContact CG-CE1 3.6Å; Y279-Y328 HydrophobicContact CG-CG 4.36Å; Y279-D351 PolarHBondContact OH-OD1 2.9Å; Y279-D351 VanDerWaalsContact OH-OD1 3.08Å; Y279-D351 PolarHBondContact OH-OD2 2.87Å; Y279-D351 VanDerWaalsContact OH-OD2 3.11Å
280	I	90.4	Very high	89.7	Confident	3 Å²	3	38.6 Å²	38.6	2%	0.015	21%	0.211	C	C	.	.	H	α-helix	trans	-67.7	-46.1	-179.3	-68.5	166.1	0	0	0	111.1	L276 T277 I278 L282 S283 T284 Y382 T385	L276-I280 HydrophobicContact CD1-CD1 3.94Å; L276-I280 HydrophobicContact CD1-CG1 4.33Å; L276-I280 HydrophobicContact CG-CD1 3.9Å; L276-I280 WeakPolarHBondContact O-CG1 3.41Å; L276-I280 PolarHBondContact O-N 3.16Å; T277-I280 PolarHBondContact O-N 2.8Å; I278-I280 VanDerWaalsContact C-N 3.32Å; I278-I280 PolarHBondContact O-N 3.28Å; I280-L282 PolarHBondContact O-N 3.06Å; I280-S283 PolarHBondContact O-N 2.96Å; I280-T284 PolarHBondContact O-N 2.92Å; I280-T284 PolarHBondContact O-OG1 2.84Å; I280-Y382 HydrophobicContact CG2-CD2 3.4Å; I280-Y382 HydrophobicContact CG2-CE1 4.39Å; I280-Y382 HydrophobicContact CG2-CE2 3.08Å; I280-Y382 HydrophobicContact CG2-CG 4.22Å; I280-T385 HydrophobicContact CD1-CG2 4.35Å; I280-T385 WeakPolarHBondContact CD1-OG1 3.32Å
281	V	91.7	Very high	89.9	Confident	78 Å²	78	34.8 Å²	34.8	47%	0.473	19%	0.186	S	C	.	.	H	α-helix	trans	-60.7	-47.7	178.2	171.4	0	0	0	0	110.7	T277 I278 S283 T284 V285	T277-V281 VanDerWaalsContact O-CG2 3.31Å; T277-V281 WeakPolarHBondContact O-CG2 3.36Å; T277-V281 PolarHBondContact O-N 2.89Å; I278-V281 PolarHBondContact O-N 3.24Å; V281-S283 VanDerWaalsContact C-N 3.33Å; V281-S283 PolarHBondContact O-N 2.97Å; V281-T284 WeakPolarHBondContact CA-OG1 3.31Å; V281-T284 PolarHBondContact O-N 3.45Å; V281-T284 PolarHBondContact O-OG1 3.18Å; V281-V285 WeakPolarHBondContact O-CG2 3.38Å; V281-V285 PolarHBondContact O-N 3.26Å
282	L	92.1	Very high	89.8	Confident	45 Å²	45	36.1 Å²	36.1	24%	0.236	19%	0.19	C	C	.	.	H	α-helix	trans	-64.3	-37.6	178.1	-65.8	-180	0	0	0	112.1	I278 I280 T284 V285 S286 I321 F324	I278-L282 HydrophobicContact CG2-CD1 3.62Å; I278-L282 HydrophobicContact CG2-CG 4.04Å; I278-L282 WeakPolarHBondContact O-CB 3.45Å; I278-L282 VanDerWaalsContact O-CG 3.24Å; I278-L282 WeakPolarHBondContact O-CG 3.22Å; I278-L282 PolarHBondContact O-N 3.49Å; I280-L282 PolarHBondContact O-N 3.06Å; L282-T284 PolarHBondContact O-N 3.49Å; L282-V285 PolarHBondContact O-N 3.2Å; L282-S286 PolarHBondContact O-N 2.9Å; L282-I321 HydrophobicContact CB-CG2 3.93Å; L282-I321 HydrophobicContact CD2-CG1 4.27Å; L282-F324 HydrophobicContact CD1-CB 4.26Å; L282-F324 HydrophobicContact CD1-CD1 3.53Å; L282-F324 HydrophobicContact CD1-CE1 3.92Å; L282-F324 HydrophobicContact CD1-CG 3.85Å
283	S	90.5	Very high	89.6	Confident	1 Å²	1	37 Å²	37	1%	0.007	19%	0.194	C	C	.	.	H	α-helix	trans	-63.6	-39.8	174.6	-61.7	0	0	0	0	112.1	Y279 I280 V281 S286 W287	Y279-S283 VanDerWaalsContact O-CB 3.29Å; Y279-S283 WeakPolarHBondContact O-CB 3.39Å; Y279-S283 PolarHBondContact O-N 3.25Å; Y279-S283 PolarHBondContact O-OG 3.39Å; I280-S283 PolarHBondContact O-N 2.96Å; V281-S283 VanDerWaalsContact C-N 3.33Å; V281-S283 PolarHBondContact O-N 2.97Å; S283-S286 PolarHBondContact O-N 2.96Å; S283-W287 PolarHBondContact O-N 3.37Å
284	T	91.2	Very high	89.3	Confident	15 Å²	15	33.2 Å²	33.2	9%	0.092	18%	0.178	C	C	.	.	H	α-helix	trans	-66.1	-36.5	173.8	50.9	0	0	0	0	113.2	I280 V281 L282 S286 W287 L288 C378 F379 Y382	I280-T284 PolarHBondContact O-N 2.92Å; I280-T284 PolarHBondContact O-OG1 2.84Å; V281-T284 WeakPolarHBondContact CA-OG1 3.31Å; V281-T284 PolarHBondContact O-N 3.45Å; V281-T284 PolarHBondContact O-OG1 3.18Å; L282-T284 PolarHBondContact O-N 3.49Å; T284-S286 VanDerWaalsContact C-N 3.34Å; T284-W287 PolarHBondContact O-N 2.97Å; T284-L288 WeakPolarHBondContact O-CG 3.48Å; T284-L288 PolarHBondContact O-N 3.37Å; T284-C378 WeakPolarHBondContact CG2-SG 3.35Å; T284-F379 HydrophobicContact CG2-CE1 3.88Å; T284-F379 HydrophobicContact CG2-CZ 3.96Å; T284-Y382 HydrophobicContact CG2-CE2 3.49Å; T284-Y382 VanDerWaalsContact CG2-CE2 3.49Å; T284-Y382 VanDerWaalsContact CG2-OH 3.31Å; T284-Y382 WeakPolarHBondContact CG2-OH 3.19Å; T284-Y382 PolarHBondContact OG1-OH 3.3Å
285	V	91.4	Very high	88.8	Confident	46 Å²	46	36.1 Å²	36.1	28%	0.279	18%	0.183	S	C	.	.	H	α-helix	trans	-65.1	-40.4	174.3	173.8	0	0	0	0	110.6	V281 L282 L288 F289 I321	V281-V285 WeakPolarHBondContact O-CG2 3.38Å; V281-V285 PolarHBondContact O-N 3.26Å; L282-V285 PolarHBondContact O-N 3.2Å; V285-L288 WeakPolarHBondContact O-CB 3.48Å; V285-L288 PolarHBondContact O-N 3.42Å; V285-F289 HydrophobicContact CG1-CD2 4.33Å; V285-F289 HydrophobicContact CG1-CE1 4.04Å; V285-F289 HydrophobicContact CG1-CE2 3.72Å; V285-F289 HydrophobicContact CG1-CZ 3.56Å; V285-F289 WeakPolarHBondContact O-CG 3.36Å; V285-F289 PolarHBondContact O-N 3.32Å; V285-I321 HydrophobicContact CB-CD1 4.25Å; V285-I321 HydrophobicContact CG1-CD1 3.79Å
286	S	90.3	Very high	88.1	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.9	-41.2	174.9	-169.9	0	0	0	0	112.3	L282 S283 T284 F289 Y290 N318	L282-S286 PolarHBondContact O-N 2.9Å; S283-S286 PolarHBondContact O-N 2.96Å; T284-S286 VanDerWaalsContact C-N 3.34Å; S286-F289 WeakPolarHBondContact O-CB 3.35Å; S286-F289 PolarHBondContact O-N 2.98Å; S286-Y290 PolarHBondContact O-N 3.1Å; S286-Y290 VanDerWaalsContact O-N 3.15Å; S286-N318 PolarHBondContact OG-OD1 3.24Å
287	W	91.3	Very high	87.4	Confident	28 Å²	28	43.8 Å²	43.8	11%	0.106	22%	0.224	C	C	.	.	H	α-helix	trans	-62.9	-41.9	171.3	169.3	74	0	0	0	112.5	S283 T284 F289 Y290 V291 R375 F379 M412	S283-W287 PolarHBondContact O-N 3.37Å; T284-W287 PolarHBondContact O-N 2.97Å; W287-F289 PolarHBondContact O-N 2.95Å; W287-Y290 VanDerWaalsContact O-CB 3.29Å; W287-Y290 WeakPolarHBondContact O-CB 3.25Å; W287-Y290 PolarHBondContact O-N 2.97Å; W287-Y290 VanDerWaalsContact O-N 3.11Å; W287-V291 HydrophobicContact CD2-CG2 4.41Å; W287-V291 HydrophobicContact CZ2-CG2 3.92Å; W287-V291 PolarHBondContact O-N 2.76Å; W287-V291 VanDerWaalsContact O-N 3.15Å; W287-R375 HydrophobicContact CB-CB 4.09Å; W287-F379 HydrophobicContact CE3-CE2 4.29Å; W287-F379 HydrophobicContact CE3-CZ 4.28Å; W287-F379 HydrophobicContact CZ3-CE2 4.38Å; W287-F379 HydrophobicContact CZ3-CZ 4.21Å; W287-M412 HydrophobicContact CH2-SD 4.49Å; W287-M412 HydrophobicContact CZ2-CG 4.29Å; W287-M412 HydrophobicContact CZ2-SD 3.77Å
288	L	90.9	Very high	86.8	Confident	86 Å²	86	44.3 Å²	44.3	45%	0.45	23%	0.228	S	C	.	.	H	α-helix	trans	-61.4	-35.5	175.3	-74.8	170.3	0	0	0	111.9	T284 V285 V291 V292	T284-L288 WeakPolarHBondContact O-CG 3.48Å; T284-L288 PolarHBondContact O-N 3.37Å; V285-L288 WeakPolarHBondContact O-CB 3.48Å; V285-L288 PolarHBondContact O-N 3.42Å; L288-V291 PolarHBondContact O-N 2.82Å; L288-V292 VanDerWaalsContact O-CG2 3.31Å; L288-V292 WeakPolarHBondContact O-CG2 3.33Å; L288-V292 PolarHBondContact O-N 3.41Å
289	F	88.5	Confident	86.1	Confident	36 Å²	36	41.2 Å²	41.2	16%	0.158	21%	0.213	C	C	.	.	H	α-helix	trans	-64	-40.2	173.3	-66	-23	0	0	0	112.4	V285 S286 W287 V291 V292 E293 L314 I317 N318 I321	V285-F289 HydrophobicContact CG1-CD2 4.33Å; V285-F289 HydrophobicContact CG1-CE1 4.04Å; V285-F289 HydrophobicContact CG1-CE2 3.72Å; V285-F289 HydrophobicContact CG1-CZ 3.56Å; V285-F289 WeakPolarHBondContact O-CG 3.36Å; V285-F289 PolarHBondContact O-N 3.32Å; S286-F289 WeakPolarHBondContact O-CB 3.35Å; S286-F289 PolarHBondContact O-N 2.98Å; W287-F289 PolarHBondContact O-N 2.95Å; F289-V291 VanDerWaalsContact C-N 3.32Å; F289-V291 PolarHBondContact O-N 3.09Å; F289-V292 PolarHBondContact O-N 3Å; F289-E293 WeakPolarHBondContact O-CB 3.34Å; F289-E293 WeakPolarHBondContact O-CG 3.27Å; F289-E293 PolarHBondContact O-N 2.72Å; F289-L314 HydrophobicContact CD1-CD2 3.98Å; F289-L314 HydrophobicContact CD1-CG 4.27Å; F289-L314 HydrophobicContact CE1-CG 4.42Å; F289-L314 HydrophobicContact CG-CD2 4.37Å; F289-I317 HydrophobicContact CE2-CB 4.19Å; F289-I317 HydrophobicContact CE2-CG2 3.72Å; F289-I317 HydrophobicContact CZ-CB 4.47Å; F289-I317 HydrophobicContact CZ-CG2 3.9Å; F289-N318 HydrophobicContact CD2-CB 4.22Å; F289-I321 HydrophobicContact CD2-CD1 4.42Å; F289-I321 HydrophobicContact CE2-CD1 3.83Å
290	Y	88.7	Confident	85.5	Confident	1 Å²	1	42.3 Å²	42.3	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-55.2	-46.8	171.8	171.3	-88.9	0	0	0	112	S286 W287 V292 N294 P299 D370 N372 F373 H419 Y439	S286-Y290 PolarHBondContact O-N 3.1Å; S286-Y290 VanDerWaalsContact O-N 3.15Å; W287-Y290 VanDerWaalsContact O-CB 3.29Å; W287-Y290 WeakPolarHBondContact O-CB 3.25Å; W287-Y290 PolarHBondContact O-N 2.97Å; W287-Y290 VanDerWaalsContact O-N 3.11Å; Y290-V292 VanDerWaalsContact C-N 3.32Å; Y290-V292 PolarHBondContact O-N 3Å; Y290-N294 WeakPolarHBondContact CD2-ND2 3.21Å; Y290-N294 WeakPolarHBondContact CE2-ND2 3.48Å; Y290-N294 WeakPolarHBondContact O-CB 3.44Å; Y290-N294 PolarHBondContact O-N 2.76Å; Y290-N294 PolarHBondContact O-ND2 3.5Å; Y290-P299 HydrophobicContact CE2-CB 4.39Å; Y290-D370 WeakPolarHBondContact CD2-OD2 2.96Å; Y290-D370 WeakPolarHBondContact CE2-O 3.47Å; Y290-N372 HydrophobicContact CD2-CB 4.3Å; Y290-N372 HydrophobicContact CG-CB 4.48Å; Y290-F373 HydrophobicContact CD1-CB 3.86Å; Y290-F373 HydrophobicContact CD2-CB 4.23Å; Y290-F373 HydrophobicContact CE1-CB 3.56Å; Y290-F373 HydrophobicContact CE2-CB 3.95Å; Y290-F373 HydrophobicContact CE2-CD1 4.06Å; Y290-F373 HydrophobicContact CG-CB 4.21Å; Y290-H419 AromaticContact CZ-ND1 3.85Å; Y290-H419 PolarHBondContact OH-ND1 3.03Å; Y290-Y439 AromaticContact CE1-CD2 3.69Å; Y290-Y439 HydrophobicContact CE1-CD2 3.69Å; Y290-Y439 AromaticContact CE1-CE2 3.82Å; Y290-Y439 HydrophobicContact CE1-CE2 3.82Å; Y290-Y439 HydrophobicContact CE1-CG 4.16Å
291	V	89.2	Confident	84.6	Confident	15 Å²	15	43.4 Å²	43.4	9%	0.091	23%	0.228	C	C	.	.	H	α-helix	trans	-63.6	-39.3	179.5	178.6	0	0	0	0	111.4	W287 L288 F289 R295 Y439 F440	W287-V291 HydrophobicContact CD2-CG2 4.41Å; W287-V291 HydrophobicContact CZ2-CG2 3.92Å; W287-V291 PolarHBondContact O-N 2.76Å; W287-V291 VanDerWaalsContact O-N 3.15Å; L288-V291 PolarHBondContact O-N 2.82Å; F289-V291 VanDerWaalsContact C-N 3.32Å; F289-V291 PolarHBondContact O-N 3.09Å; V291-R295 PolarHBondContact O-N 3.26Å; V291-Y439 HydrophobicContact CG1-CD1 4.17Å; V291-Y439 HydrophobicContact CG2-CD1 3.92Å; V291-Y439 HydrophobicContact CG2-CE1 3.67Å; V291-F440 HydrophobicContact CG1-CE1 4.26Å; V291-F440 HydrophobicContact CG1-CE2 3.88Å; V291-F440 HydrophobicContact CG1-CZ 3.49Å; V291-F440 VanDerWaalsContact CG1-CZ 3.49Å
292	V	86.5	Confident	83.5	Confident	64 Å²	64	47.6 Å²	47.6	39%	0.388	25%	0.246	S	C	.	.	H	α-helix	trans	-73.5	-42.8	-179.2	171.4	0	0	0	0	112.1	L288 F289 Y290 L314	L288-V292 VanDerWaalsContact O-CG2 3.31Å; L288-V292 WeakPolarHBondContact O-CG2 3.33Å; L288-V292 PolarHBondContact O-N 3.41Å; F289-V292 PolarHBondContact O-N 3Å; Y290-V292 VanDerWaalsContact C-N 3.32Å; Y290-V292 PolarHBondContact O-N 3Å; V292-L314 HydrophobicContact CG1-CD2 4.08Å
293	E	82.3	Confident	82.1	Confident	18 Å²	18	56 Å²	56	8%	0.084	28%	0.275	C	S	.	.	H	α-helix	trans	-71.9	-37.8	-177.5	-72.1	-170.6	170.1	0	0	112.5	F289 N297 L314 R367	F289-E293 WeakPolarHBondContact O-CB 3.34Å; F289-E293 WeakPolarHBondContact O-CG 3.27Å; F289-E293 PolarHBondContact O-N 2.72Å; E293-N297 PolarHBondContact O-ND2 3.04Å; E293-L314 HydrophobicContact CG-CD2 3.96Å; E293-L314 WeakPolarHBondContact OE1-CB 3.43Å; E293-R367 IonicContact OE2-CZ 2.7Å; E293-R367 IonicContact OE2-NH1 3.13Å; E293-R367 PolarHBondContact OE2-NH1 2.93Å
294	N	81.8	Confident	81.1	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	18.8	-176.3	-53.5	-49.7	0	0	0	113.3	Y290 N296 N297 R367 D370	Y290-N294 WeakPolarHBondContact CD2-ND2 3.21Å; Y290-N294 WeakPolarHBondContact CE2-ND2 3.48Å; Y290-N294 WeakPolarHBondContact O-CB 3.44Å; Y290-N294 PolarHBondContact O-N 2.76Å; Y290-N294 PolarHBondContact O-ND2 3.5Å; N294-N296 VanDerWaalsContact C-N 3.34Å; N294-N297 WeakPolarHBondContact CA-O 3.46Å; N294-R367 VanDerWaalsContact OD1-CZ 3.28Å; N294-R367 PolarHBondContact OD1-NH1 3.23Å; N294-R367 PolarHBondContact OD1-NH2 3.35Å; N294-D370 PolarHBondContact ND2-OD2 3.04Å
295	R	79.3	Confident	80.2	Confident	163 Å²	163	57.5 Å²	57.5	62%	0.615	29%	0.285	S	S	*	.	S	Bend	trans	-62.4	-42.5	175	-172.8	-175.3	173.5	177	-1.1	112.1	V291	V291-R295 PolarHBondContact O-N 3.26Å
296	N	74	Confident	79.3	Confident	140 Å²	140	57.8 Å²	57.8	75%	0.749	29%	0.288	S	S	*	.	S	Bend	trans	-123.9	-0	-175.6	-62.4	-4.5	0	0	0	112.7	N294	N294-N296 VanDerWaalsContact C-N 3.34Å
297	N	74.3	Confident	78.3	Confident	70 Å²	70	60 Å²	60	37%	0.374	30%	0.298	S	S	.	.	S	Bend	trans	-122.6	141.7	-171.7	-69.6	-37.5	0	0	0	109.4	E293 N294 I305	E293-N297 PolarHBondContact O-ND2 3.04Å; N294-N297 WeakPolarHBondContact CA-O 3.46Å; N297-I305 HydrophobicContact CB-CD1 3.85Å
298	P	76.3	Confident	77.7	Confident	44 Å²	44	62.9 Å²	62.9	29%	0.286	32%	0.319	S	S	.	.			trans	-65.6	140.1	177.1	26.9	-33.2	0	0	0	110.4	V300 I305 H423	P298-V300 VanDerWaalsContact C-N 3.28Å; P298-V300 PolarHBondContact O-N 3.19Å; P298-I305 HydrophobicContact CG-CD1 3.97Å; P298-I305 WeakPolarHBondContact O-CD1 3.49Å; P298-H423 VanDerWaalsContact CB-CD2 3.44Å; P298-H423 WeakPolarHBondContact CB-CD2 3.13Å
299	P	77.2	Confident	77.1	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.013	33%	0.333	C	S	.	.	S	Bend	trans	-70.6	-26	179.8	29.1	-34.5	0	0	0	112.5	Y290 D370 V420 H423	Y290-P299 HydrophobicContact CE2-CB 4.39Å; P299-D370 PolarHBondContact O-N 3.32Å; P299-V420 HydrophobicContact CB-CG2 4.22Å; P299-V420 HydrophobicContact CG-CG2 4.05Å; P299-H423 WeakPolarHBondContact CD-ND1 3.21Å; P299-H423 HydrophobicContact CG-CB 4.23Å
300	V	77.6	Confident	76.9	Confident	32 Å²	32	72 Å²	72	19%	0.194	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	126.3	176.1	-179.6	0	0	0	0	108	P298 H368 I369 V420 L424	P298-V300 VanDerWaalsContact C-N 3.28Å; P298-V300 PolarHBondContact O-N 3.19Å; V300-H368 WeakPolarHBondContact CA-O 3.34Å; V300-I369 HydrophobicContact CG1-CG1 4.48Å; V300-V420 HydrophobicContact CG2-CG1 4.11Å; V300-L424 HydrophobicContact CG1-CD1 4.43Å
301	S	71.9	Confident	76.4	Confident	26 Å²	26	73 Å²	73	18%	0.182	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	117.5	175.3	180	0	0	0	0	110.6	R303 G304 H368	S301-R303 PolarHBondContact O-N 3.48Å; S301-R303 PolarHBondContact OG-N 3.04Å; S301-G304 PolarHBondContact O-N 2.94Å; S301-G304 VanDerWaalsContact O-N 3.09Å; S301-G304 PolarHBondContact OG-N 2.83Å; S301-H368 PolarHBondContact N-O 3.13Å; S301-H368 PolarHBondContact O-ND1 3.06Å
302	I	67.9	Low	76	Confident	167 Å²	167	77.9 Å²	77.9	86%	0.856	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61	-37.8	175.1	-58.3	167.4	0	0	0	110.1	G304	I302-G304 VanDerWaalsContact C-N 3.25Å; I302-G304 PolarHBondContact O-N 3.39Å
303	R	62.7	Low	76	Confident	222 Å²	222	79.2 Å²	79.2	84%	0.838	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	-13.5	178.8	-68.6	-175.7	-177.9	179.5	1	113.3	S301	S301-R303 PolarHBondContact O-N 3.48Å; S301-R303 PolarHBondContact OG-N 3.04Å
304	G	69.3	Low	76.1	Confident	12 Å²	12	79.5 Å²	79.5	12%	0.124	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	69.6	137.4	-177.6	0	0	0	0	0	112.8	S301 I302	S301-G304 PolarHBondContact O-N 2.94Å; S301-G304 VanDerWaalsContact O-N 3.09Å; S301-G304 PolarHBondContact OG-N 2.83Å; I302-G304 VanDerWaalsContact C-N 3.25Å; I302-G304 PolarHBondContact O-N 3.39Å
305	I	72	Confident	76.2	Confident	35 Å²	35	79.6 Å²	79.6	18%	0.179	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	120.5	-179.6	-54	179.6	0	0	0	108.6	N297 P298 H307 H366 R367	N297-I305 HydrophobicContact CB-CD1 3.85Å; P298-I305 HydrophobicContact CG-CD1 3.97Å; P298-I305 WeakPolarHBondContact O-CD1 3.49Å; I305-H307 PolarHBondContact O-N 3.06Å; I305-H366 WeakPolarHBondContact O-CA 3.24Å; I305-R367 PolarHBondContact N-O 3.04Å; I305-R367 PolarHBondContact O-N 3.4Å
306	C	72.6	Confident	76.6	Confident	51 Å²	51	78.6 Å²	78.6	35%	0.345	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	136.1	175.8	-71.1	0	0	0	0	109.3	C3 T308 H366	C3-C306 WeakPolarHBondContact CB-SG 3.47Å; C3-C306 WeakPolarHBondContact SG-CB 3.35Å; C3-C306 CovalentContact SG-SG 2.11Å; C3-C306 PolarHBondContact SG-SG 3.14Å; C306-T308 PolarHBondContact O-N 3.4Å; C306-H366 PolarHBondContact SG-CE1 3.43Å
307	H	71.2	Confident	77.3	Confident	46 Å²	46	76 Å²	76	21%	0.213	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-67.1	124.3	179.6	-77.1	-75.4	0	0	0	112.3	I305 S311 K312 S315 S361	I305-H307 PolarHBondContact O-N 3.06Å; H307-S311 VanDerWaalsContact CA-OG 3.25Å; H307-S311 WeakPolarHBondContact CA-OG 3.42Å; H307-S311 PolarHBondContact ND1-OG 3.17Å; H307-K312 HydrophobicContact CB-CB 4.31Å; H307-S315 PolarHBondContact CE1-OG 2.92Å; H307-S315 VanDerWaalsContact CE1-OG 3.25Å; H307-S361 PolarHBondContact NE2-O 2.95Å; H307-S361 VanDerWaalsContact NE2-O 3.15Å
308	T	76.9	Confident	78	Confident	89 Å²	89	72.9 Å²	72.9	55%	0.546	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-75.9	161.7	164.7	61.3	0	0	0	0	109.9	C306 R310 S311 K312	C306-T308 PolarHBondContact O-N 3.4Å; T308-R310 PolarHBondContact O-N 2.97Å; T308-R310 VanDerWaalsContact O-N 3.17Å; T308-S311 PolarHBondContact N-OG 2.79Å; T308-S311 PolarHBondContact O-N 3.26Å; T308-S311 VanDerWaalsContact O-N 3.1Å; T308-S311 PolarHBondContact O-OG 3.4Å; T308-S311 VanDerWaalsContact O-OG 3.12Å; T308-S311 PolarHBondContact OG1-N 2.89Å; T308-S311 VanDerWaalsContact OG1-N 3.15Å; T308-S311 PolarHBondContact OG1-OG 3.27Å; T308-K312 WeakPolarHBondContact O-CB 3.28Å; T308-K312 PolarHBondContact O-N 2.88Å
309	L	79.8	Confident	78.6	Confident	143 Å²	143	72.3 Å²	72.3	75%	0.749	35%	0.348	S	S	*	.	H	α-helix	trans	-53.1	-40.6	176.4	-175.6	69.1	0	0	0	111.6	I313	L309-I313 HydrophobicContact CG-CD1 4.36Å; L309-I313 VanDerWaalsContact O-CG1 3.32Å; L309-I313 WeakPolarHBondContact O-CG1 3.39Å; L309-I313 PolarHBondContact O-N 2.89Å; L309-I313 VanDerWaalsContact O-N 3.13Å
310	R	82.6	Confident	79.2	Confident	170 Å²	170	74.2 Å²	74.2	64%	0.642	37%	0.368	S	S	*	.	H	α-helix	trans	-64.1	-50.4	175.8	-178.2	178.4	176.3	179.5	-0.1	112	T308 K312 I313 L314	T308-R310 PolarHBondContact O-N 2.97Å; T308-R310 VanDerWaalsContact O-N 3.17Å; R310-K312 VanDerWaalsContact C-N 3.28Å; R310-K312 PolarHBondContact O-N 3.24Å; R310-I313 PolarHBondContact O-N 2.91Å; R310-L314 HydrophobicContact CG-CD1 4.02Å; R310-L314 WeakPolarHBondContact O-CD1 3.26Å; R310-L314 PolarHBondContact O-N 3.08Å
311	S	79.5	Confident	79.9	Confident	22 Å²	22	73.1 Å²	73.1	15%	0.154	36%	0.361	C	S	.	.	H	α-helix	trans	-65.9	-33.8	-179.6	71.8	0	0	0	0	111.8	H307 T308 L314 S315	H307-S311 VanDerWaalsContact CA-OG 3.25Å; H307-S311 WeakPolarHBondContact CA-OG 3.42Å; H307-S311 PolarHBondContact ND1-OG 3.17Å; T308-S311 PolarHBondContact N-OG 2.79Å; T308-S311 PolarHBondContact O-N 3.26Å; T308-S311 VanDerWaalsContact O-N 3.1Å; T308-S311 PolarHBondContact O-OG 3.4Å; T308-S311 VanDerWaalsContact O-OG 3.12Å; T308-S311 PolarHBondContact OG1-N 2.89Å; T308-S311 VanDerWaalsContact OG1-N 3.15Å; T308-S311 PolarHBondContact OG1-OG 3.27Å; S311-L314 PolarHBondContact O-N 3.4Å; S311-S315 VanDerWaalsContact O-CB 3.31Å; S311-S315 WeakPolarHBondContact O-CB 3.46Å; S311-S315 PolarHBondContact O-N 2.66Å; S311-S315 PolarHBondContact O-OG 3.33Å
312	K	81.3	Confident	80.8	Confident	118 Å²	118	71.9 Å²	71.9	51%	0.513	35%	0.352	S	S	.	.	H	α-helix	trans	-62.1	-44.9	175.1	-164.9	170.9	-175.7	174.3	0	111.3	H307 T308 R310 S315 W316	H307-K312 HydrophobicContact CB-CB 4.31Å; T308-K312 WeakPolarHBondContact O-CB 3.28Å; T308-K312 PolarHBondContact O-N 2.88Å; R310-K312 VanDerWaalsContact C-N 3.28Å; R310-K312 PolarHBondContact O-N 3.24Å; K312-S315 PolarHBondContact O-N 2.75Å; K312-W316 PolarHBondContact O-N 3.47Å
313	I	85.2	Confident	81.9	Confident	93 Å²	93	66 Å²	66	48%	0.477	32%	0.322	S	S	.	.	H	α-helix	trans	-62.3	-47.4	175.5	-67.1	164.6	0	0	0	110.6	L309 R310 S315 W316 I317	L309-I313 HydrophobicContact CG-CD1 4.36Å; L309-I313 VanDerWaalsContact O-CG1 3.32Å; L309-I313 WeakPolarHBondContact O-CG1 3.39Å; L309-I313 PolarHBondContact O-N 2.89Å; L309-I313 VanDerWaalsContact O-N 3.13Å; R310-I313 PolarHBondContact O-N 2.91Å; I313-S315 VanDerWaalsContact C-N 3.33Å; I313-S315 PolarHBondContact O-N 2.95Å; I313-W316 PolarHBondContact O-N 2.91Å; I313-I317 HydrophobicContact CG2-CD1 3.99Å; I313-I317 WeakPolarHBondContact O-CG1 3.44Å; I313-I317 PolarHBondContact O-N 2.95Å; I313-I317 VanDerWaalsContact O-N 3.1Å
314	L	85.6	Confident	83.3	Confident	23 Å²	23	57.9 Å²	57.9	12%	0.12	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-42.1	178.5	-91.4	73.6	0	0	0	111.8	F289 V292 E293 R310 S311 W316 I317 N318	F289-L314 HydrophobicContact CD1-CD2 3.98Å; F289-L314 HydrophobicContact CD1-CG 4.27Å; F289-L314 HydrophobicContact CE1-CG 4.42Å; F289-L314 HydrophobicContact CG-CD2 4.37Å; V292-L314 HydrophobicContact CG1-CD2 4.08Å; E293-L314 HydrophobicContact CG-CD2 3.96Å; E293-L314 WeakPolarHBondContact OE1-CB 3.43Å; R310-L314 HydrophobicContact CG-CD1 4.02Å; R310-L314 WeakPolarHBondContact O-CD1 3.26Å; R310-L314 PolarHBondContact O-N 3.08Å; S311-L314 PolarHBondContact O-N 3.4Å; L314-W316 PolarHBondContact O-N 3.06Å; L314-I317 PolarHBondContact O-N 3.22Å; L314-N318 WeakPolarHBondContact O-CB 3.49Å; L314-N318 PolarHBondContact O-N 3.11Å
315	S	82.4	Confident	84.3	Confident	4 Å²	4	57.3 Å²	57.3	3%	0.028	29%	0.287	C	S	.	.	H	α-helix	trans	-63.1	-40.2	178.2	-65.1	0	0	0	0	112.2	H307 S311 K312 I313 N318 F319 V362	H307-S315 PolarHBondContact CE1-OG 2.92Å; H307-S315 VanDerWaalsContact CE1-OG 3.25Å; S311-S315 VanDerWaalsContact O-CB 3.31Å; S311-S315 WeakPolarHBondContact O-CB 3.46Å; S311-S315 PolarHBondContact O-N 2.66Å; S311-S315 PolarHBondContact O-OG 3.33Å; K312-S315 PolarHBondContact O-N 2.75Å; I313-S315 VanDerWaalsContact C-N 3.33Å; I313-S315 PolarHBondContact O-N 2.95Å; S315-N318 PolarHBondContact O-N 2.86Å; S315-F319 WeakPolarHBondContact O-CB 3.39Å; S315-F319 PolarHBondContact O-N 3.25Å; S315-V362 WeakPolarHBondContact O-CG2 3.47Å
316	W	88.6	Confident	85.2	Confident	141 Å²	141	58.2 Å²	58.2	53%	0.534	29%	0.292	S	S	.	.	H	α-helix	trans	-64.4	-39.3	173.6	-85.8	108.4	0	0	0	113.1	K312 I313 L314 F319 G320 V362	K312-W316 PolarHBondContact O-N 3.47Å; I313-W316 PolarHBondContact O-N 2.91Å; L314-W316 PolarHBondContact O-N 3.06Å; W316-F319 WeakPolarHBondContact O-CB 3.42Å; W316-F319 PolarHBondContact O-N 3.3Å; W316-G320 PolarHBondContact O-N 3.01Å; W316-V362 HydrophobicContact CD2-CG1 3.86Å; W316-V362 HydrophobicContact CE3-CG1 4.03Å; W316-V362 HydrophobicContact CH2-CG1 3.86Å; W316-V362 HydrophobicContact CZ2-CG1 3.68Å; W316-V362 HydrophobicContact CZ3-CG1 4.03Å
317	I	89.1	Confident	86	Confident	85 Å²	85	56.8 Å²	56.8	44%	0.436	29%	0.286	S	S	.	.	H	α-helix	trans	-67.5	-43.1	174.9	-61.4	168	0	0	0	109.9	F289 I313 L314 F319 G320 I321	F289-I317 HydrophobicContact CE2-CB 4.19Å; F289-I317 HydrophobicContact CE2-CG2 3.72Å; F289-I317 HydrophobicContact CZ-CB 4.47Å; F289-I317 HydrophobicContact CZ-CG2 3.9Å; I313-I317 HydrophobicContact CG2-CD1 3.99Å; I313-I317 WeakPolarHBondContact O-CG1 3.44Å; I313-I317 PolarHBondContact O-N 2.95Å; I313-I317 VanDerWaalsContact O-N 3.1Å; L314-I317 PolarHBondContact O-N 3.22Å; I317-F319 VanDerWaalsContact C-N 3.28Å; I317-F319 PolarHBondContact O-N 3.33Å; I317-G320 PolarHBondContact O-N 2.63Å; I317-G320 VanDerWaalsContact O-N 3.12Å; I317-I321 HydrophobicContact CG2-CD1 4.28Å; I317-I321 PolarHBondContact O-N 2.96Å
318	N	87.7	Confident	86.9	Confident	6 Å²	6	54.7 Å²	54.7	3%	0.032	28%	0.276	C	S	.	.	H	α-helix	trans	-63.8	-33.7	178.3	-159.7	33.7	0	0	0	111.8	S286 F289 L314 S315 I321 N322 N372	S286-N318 PolarHBondContact OG-OD1 3.24Å; F289-N318 HydrophobicContact CD2-CB 4.22Å; L314-N318 WeakPolarHBondContact O-CB 3.49Å; L314-N318 PolarHBondContact O-N 3.11Å; S315-N318 PolarHBondContact O-N 2.86Å; N318-I321 PolarHBondContact O-N 3.2Å; N318-N322 WeakPolarHBondContact O-CB 3.38Å; N318-N322 PolarHBondContact O-N 3.09Å; N318-N322 PolarHBondContact O-ND2 3.04Å; N318-N322 PolarHBondContact OD1-ND2 3.24Å; N318-N322 VanDerWaalsContact OD1-ND2 3.11Å; N318-N372 PolarHBondContact ND2-ND2 3.02Å
319	F	90.1	Very high	87.5	Confident	32 Å²	32	51.9 Å²	51.9	14%	0.14	26%	0.256	C	S	.	.	H	α-helix	trans	-60.4	-46	171	174.7	-89	0	0	0	111.9	S315 W316 I317 I321 N322 L323 L359 V362 F363	S315-F319 WeakPolarHBondContact O-CB 3.39Å; S315-F319 PolarHBondContact O-N 3.25Å; W316-F319 WeakPolarHBondContact O-CB 3.42Å; W316-F319 PolarHBondContact O-N 3.3Å; I317-F319 VanDerWaalsContact C-N 3.28Å; I317-F319 PolarHBondContact O-N 3.33Å; F319-I321 VanDerWaalsContact C-N 3.31Å; F319-I321 PolarHBondContact O-N 2.9Å; F319-N322 PolarHBondContact O-N 3.49Å; F319-L323 HydrophobicContact CE1-CD2 4.48Å; F319-L323 VanDerWaalsContact O-CB 3.31Å; F319-L323 WeakPolarHBondContact O-CB 3.36Å; F319-L323 PolarHBondContact O-N 3.36Å; F319-L359 HydrophobicContact CD2-CD2 3.68Å; F319-L359 HydrophobicContact CE2-CD2 3.75Å; F319-L359 HydrophobicContact CG-CD2 4.42Å; F319-V362 HydrophobicContact CB-CG2 3.76Å; F319-V362 HydrophobicContact CD2-CB 4.46Å; F319-V362 HydrophobicContact CD2-CG2 4.29Å; F319-V362 HydrophobicContact CG-CG2 4.34Å; F319-F363 HydrophobicContact CE2-CE2 4.02Å; F319-F363 HydrophobicContact CE2-CZ 4.25Å
320	G	90.3	Very high	88.1	Confident	41 Å²	41	49 Å²	49	42%	0.423	24%	0.24	S	C	.	.	H	α-helix	trans	-60	-40.7	175.3	0	0	0	0	0	112.9	W316 I317 F324	W316-G320 PolarHBondContact O-N 3.01Å; I317-G320 PolarHBondContact O-N 2.63Å; I317-G320 VanDerWaalsContact O-N 3.12Å; G320-F324 PolarHBondContact O-N 2.95Å
321	I	91.4	Very high	88.4	Confident	10 Å²	10	42 Å²	42	5%	0.051	22%	0.215	C	C	.	.	H	α-helix	trans	-64.3	-50.5	175.7	-67.8	171.4	0	0	0	111.2	L282 V285 F289 I317 N318 F319 L323 F324 C325	L282-I321 HydrophobicContact CB-CG2 3.93Å; L282-I321 HydrophobicContact CD2-CG1 4.27Å; V285-I321 HydrophobicContact CB-CD1 4.25Å; V285-I321 HydrophobicContact CG1-CD1 3.79Å; F289-I321 HydrophobicContact CD2-CD1 4.42Å; F289-I321 HydrophobicContact CE2-CD1 3.83Å; I317-I321 HydrophobicContact CG2-CD1 4.28Å; I317-I321 PolarHBondContact O-N 2.96Å; N318-I321 PolarHBondContact O-N 3.2Å; F319-I321 VanDerWaalsContact C-N 3.31Å; F319-I321 PolarHBondContact O-N 2.9Å; I321-L323 VanDerWaalsContact C-N 3.29Å; I321-L323 PolarHBondContact O-N 3.28Å; I321-F324 WeakPolarHBondContact O-CB 3.03Å; I321-F324 PolarHBondContact O-N 2.95Å; I321-F324 VanDerWaalsContact O-N 3.11Å; I321-C325 PolarHBondContact O-N 2.93Å; I321-C325 PolarHBondContact O-SG 3.25Å; I321-C325 VanDerWaalsContact O-SG 3.4Å
322	N	90.1	Very high	88.8	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-68.7	-28.5	-177.5	-76.8	-77.7	0	0	0	112.5	N318 F319 C325 L326 A358 L359 R375	N318-N322 WeakPolarHBondContact O-CB 3.38Å; N318-N322 PolarHBondContact O-N 3.09Å; N318-N322 PolarHBondContact O-ND2 3.04Å; N318-N322 PolarHBondContact OD1-ND2 3.24Å; N318-N322 VanDerWaalsContact OD1-ND2 3.11Å; F319-N322 PolarHBondContact O-N 3.49Å; N322-C325 PolarHBondContact O-N 2.84Å; N322-L326 WeakPolarHBondContact O-CB 3.25Å; N322-L326 PolarHBondContact O-N 3.23Å; N322-A358 HydrophobicContact CB-CB 4.21Å; N322-A358 WeakPolarHBondContact ND2-CB 3.29Å; N322-L359 HydrophobicContact CB-CD2 4.13Å; N322-L359 HydrophobicContact CB-CG 4.44Å; N322-R375 PolarHBondContact OD1-NH2 2.92Å
323	L	91.5	Very high	89.1	Confident	43 Å²	43	39.4 Å²	39.4	23%	0.225	20%	0.203	C	C	.	.	H	α-helix	trans	-63.6	-41.3	170.6	-176	64.3	0	0	0	111.6	F26 F319 I321 G327	F26-L323 HydrophobicContact CE2-CD1 4.37Å; F26-L323 HydrophobicContact CE2-CD2 3.98Å; F26-L323 HydrophobicContact CE2-CG 3.97Å; F319-L323 HydrophobicContact CE1-CD2 4.48Å; F319-L323 VanDerWaalsContact O-CB 3.31Å; F319-L323 WeakPolarHBondContact O-CB 3.36Å; F319-L323 PolarHBondContact O-N 3.36Å; I321-L323 VanDerWaalsContact C-N 3.29Å; I321-L323 PolarHBondContact O-N 3.28Å; L323-G327 PolarHBondContact O-N 3.5Å; L323-G327 VanDerWaalsContact O-N 3.08Å
324	F	91.8	Very high	89.2	Confident	51 Å²	51	36.9 Å²	36.9	22%	0.224	19%	0.193	C	C	.	.	H	α-helix	trans	-65.5	-45	173	178.1	-87.9	0	0	0	111.7	M275 I278 L282 G320 I321 L326 G327 Y328	M275-F324 HydrophobicContact CE-CD2 4.29Å; M275-F324 HydrophobicContact CE-CE1 3.92Å; M275-F324 HydrophobicContact CE-CE2 3.41Å; M275-F324 VanDerWaalsContact CE-CE2 3.41Å; M275-F324 HydrophobicContact CE-CZ 3.19Å; M275-F324 HydrophobicContact SD-CE2 3.89Å; M275-F324 HydrophobicContact SD-CZ 3.53Å; M275-F324 VanDerWaalsContact SD-CZ 3.53Å; I278-F324 HydrophobicContact CB-CE1 4.42Å; I278-F324 HydrophobicContact CB-CZ 4.04Å; I278-F324 HydrophobicContact CG2-CE1 3.73Å; I278-F324 HydrophobicContact CG2-CE2 4.06Å; I278-F324 HydrophobicContact CG2-CZ 3.42Å; I278-F324 VanDerWaalsContact CG2-CZ 3.42Å; L282-F324 HydrophobicContact CD1-CB 4.26Å; L282-F324 HydrophobicContact CD1-CD1 3.53Å; L282-F324 HydrophobicContact CD1-CE1 3.92Å; L282-F324 HydrophobicContact CD1-CG 3.85Å; G320-F324 PolarHBondContact O-N 2.95Å; I321-F324 WeakPolarHBondContact O-CB 3.03Å; I321-F324 PolarHBondContact O-N 2.95Å; I321-F324 VanDerWaalsContact O-N 3.11Å; F324-L326 VanDerWaalsContact C-N 3.31Å; F324-L326 PolarHBondContact O-N 3.14Å; F324-G327 PolarHBondContact O-N 3.48Å; F324-G327 VanDerWaalsContact O-N 3.16Å; F324-Y328 PolarHBondContact O-N 3.1Å
325	C	89.9	Confident	89.2	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.5	-39.7	176.9	-67	0	0	0	0	112	Y279 I321 N322 Y328 Y329 I355	Y279-C325 HydrophobicContact CE2-CB 4.3Å; I321-C325 PolarHBondContact O-N 2.93Å; I321-C325 PolarHBondContact O-SG 3.25Å; I321-C325 VanDerWaalsContact O-SG 3.4Å; N322-C325 PolarHBondContact O-N 2.84Å; C325-Y328 PolarHBondContact O-N 3.06Å; C325-Y329 WeakPolarHBondContact O-CB 3.36Å; C325-Y329 PolarHBondContact O-N 3.42Å; C325-I355 HydrophobicContact CB-CD1 4.31Å
326	L	91.2	Very high	89.2	Confident	55 Å²	55	37 Å²	37	29%	0.288	20%	0.198	S	C	.	.	H	α-helix	trans	-61.1	-45.7	173.3	-178.2	64.8	0	0	0	111.5	N322 F324 Y328 Y329 I330 I355 L359	N322-L326 WeakPolarHBondContact O-CB 3.25Å; N322-L326 PolarHBondContact O-N 3.23Å; F324-L326 VanDerWaalsContact C-N 3.31Å; F324-L326 PolarHBondContact O-N 3.14Å; L326-Y328 VanDerWaalsContact C-N 3.31Å; L326-Y328 PolarHBondContact O-N 2.72Å; L326-Y329 WeakPolarHBondContact O-CB 3.49Å; L326-Y329 PolarHBondContact O-N 3.37Å; L326-I330 HydrophobicContact CD1-CD1 4.38Å; L326-I330 HydrophobicContact CG-CD1 4.1Å; L326-I330 VanDerWaalsContact O-CG1 3.3Å; L326-I330 WeakPolarHBondContact O-CG1 3.44Å; L326-I330 PolarHBondContact O-N 2.8Å; L326-I355 HydrophobicContact CB-CD1 4.47Å; L326-I355 HydrophobicContact CB-CG2 4.08Å; L326-I355 HydrophobicContact CD1-CG2 4.21Å; L326-L359 HydrophobicContact CD2-CD1 4.09Å
327	G	90.6	Very high	89	Confident	20 Å²	20	36.2 Å²	36.2	21%	0.206	21%	0.209	C	C	.	.	H	α-helix	trans	-59.5	-41.8	175.4	0	0	0	0	0	112.4	L323 F324 I330 L331	L323-G327 PolarHBondContact O-N 3.5Å; L323-G327 VanDerWaalsContact O-N 3.08Å; F324-G327 PolarHBondContact O-N 3.48Å; F324-G327 VanDerWaalsContact O-N 3.16Å; G327-I330 PolarHBondContact O-N 2.9Å; G327-L331 WeakPolarHBondContact O-CG 3.28Å; G327-L331 PolarHBondContact O-N 3.46Å
328	Y	90.1	Very high	88.8	Confident	3 Å²	3	36 Å²	36	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-67.7	-39.4	176.4	-173.3	-116.1	0	0	0	112.9	M275 Y279 F324 C325 L326 L331 K332	M275-Y328 HydrophobicContact CB-CE2 4.31Å; M275-Y328 HydrophobicContact CE-CD2 3.85Å; M275-Y328 HydrophobicContact CE-CG 4.4Å; M275-Y328 HydrophobicContact CG-CD2 3.52Å; M275-Y328 HydrophobicContact CG-CE2 3.6Å; Y279-Y328 HydrophobicContact CD1-CD1 4.07Å; Y279-Y328 AromaticContact CD1-CE1 3.74Å; Y279-Y328 HydrophobicContact CD1-CE1 3.74Å; Y279-Y328 AromaticContact CD2-CD1 3.38Å; Y279-Y328 HydrophobicContact CD2-CD1 3.38Å; Y279-Y328 AromaticContact CD2-CE1 3.94Å; Y279-Y328 HydrophobicContact CD2-CE1 3.94Å; Y279-Y328 HydrophobicContact CD2-CG 4.16Å; Y279-Y328 HydrophobicContact CE1-CD1 4.44Å; Y279-Y328 HydrophobicContact CE1-CE1 4.19Å; Y279-Y328 AromaticContact CE2-CD1 3.8Å; Y279-Y328 HydrophobicContact CE2-CD1 3.8Å; Y279-Y328 HydrophobicContact CE2-CE1 4.35Å; Y279-Y328 AromaticContact CG-CD1 3.51Å; Y279-Y328 HydrophobicContact CG-CD1 3.51Å; Y279-Y328 AromaticContact CG-CE1 3.6Å; Y279-Y328 HydrophobicContact CG-CE1 3.6Å; Y279-Y328 HydrophobicContact CG-CG 4.36Å; F324-Y328 PolarHBondContact O-N 3.1Å; C325-Y328 PolarHBondContact O-N 3.06Å; L326-Y328 VanDerWaalsContact C-N 3.31Å; L326-Y328 PolarHBondContact O-N 2.72Å; Y328-L331 PolarHBondContact O-N 3.46Å; Y328-K332 HydrophobicContact CD1-CD 4.38Å; Y328-K332 HydrophobicContact CE1-CD 3.96Å; Y328-K332 HydrophobicContact CE1-CG 4.44Å; Y328-K332 PolarHBondContact O-N 3.05Å; Y328-K332 WeakPolarHBondContact OH-CE 3.05Å
329	Y	89.8	Confident	88.6	Confident	29 Å²	29	42 Å²	42	11%	0.114	23%	0.231	C	C	.	.	H	α-helix	trans	-59.9	-45.9	173.5	172.5	-97.9	0	0	0	111.8	C325 L326 L331 K332 L333 F342 D351 I352	C325-Y329 WeakPolarHBondContact O-CB 3.36Å; C325-Y329 PolarHBondContact O-N 3.42Å; L326-Y329 WeakPolarHBondContact O-CB 3.49Å; L326-Y329 PolarHBondContact O-N 3.37Å; Y329-L331 VanDerWaalsContact C-N 3.33Å; Y329-L331 PolarHBondContact O-N 3.3Å; Y329-K332 PolarHBondContact O-N 3.29Å; Y329-L333 HydrophobicContact CE1-CD2 4.45Å; Y329-L333 WeakPolarHBondContact O-CB 3.02Å; Y329-L333 PolarHBondContact O-N 3.01Å; Y329-F342 HydrophobicContact CD2-CE1 4.33Å; Y329-F342 HydrophobicContact CD2-CZ 4.47Å; Y329-F342 AromaticContact CE2-CE1 3.86Å; Y329-F342 HydrophobicContact CE2-CE1 3.86Å; Y329-F342 HydrophobicContact CE2-CZ 4.35Å; Y329-D351 HydrophobicContact CD2-CB 4.09Å; Y329-I352 HydrophobicContact CE2-CD1 4.48Å; Y329-I352 HydrophobicContact CE2-CG1 4.21Å; Y329-I352 WeakPolarHBondContact OH-CD1 3.46Å
330	I	90.4	Very high	88.4	Confident	84 Å²	84	45 Å²	45	43%	0.431	25%	0.252	S	S	.	.	H	α-helix	trans	-61.6	-42.5	176.7	-66.9	165.4	0	0	0	110.7	L326 G327 K332 L333 C334	L326-I330 HydrophobicContact CD1-CD1 4.38Å; L326-I330 HydrophobicContact CG-CD1 4.1Å; L326-I330 VanDerWaalsContact O-CG1 3.3Å; L326-I330 WeakPolarHBondContact O-CG1 3.44Å; L326-I330 PolarHBondContact O-N 2.8Å; G327-I330 PolarHBondContact O-N 2.9Å; I330-K332 VanDerWaalsContact C-N 3.34Å; I330-K332 PolarHBondContact O-N 2.87Å; I330-L333 PolarHBondContact O-N 2.73Å; I330-C334 WeakPolarHBondContact O-CB 2.95Å; I330-C334 PolarHBondContact O-N 3.37Å; I330-C334 PolarHBondContact O-SG 3.44Å; I330-C334 VanDerWaalsContact O-SG 3.32Å
331	L	89.2	Confident	88.2	Confident	22 Å²	22	52.3 Å²	52.3	12%	0.115	27%	0.267	C	S	.	.	H	α-helix	trans	-60.1	-43.1	175.9	-73.4	170.7	0	0	0	111.9	F30 F264 T265 M275 G327 Y328 Y329 C334 A335	F30-L331 HydrophobicContact CZ-CD2 4.38Å; F264-L331 HydrophobicContact CB-CD1 4.46Å; T265-L331 HydrophobicContact CG2-CB 3.88Å; M275-L331 HydrophobicContact CE-CD1 4.34Å; G327-L331 WeakPolarHBondContact O-CG 3.28Å; G327-L331 PolarHBondContact O-N 3.46Å; Y328-L331 PolarHBondContact O-N 3.46Å; Y329-L331 VanDerWaalsContact C-N 3.33Å; Y329-L331 PolarHBondContact O-N 3.3Å; L331-C334 PolarHBondContact O-N 3.1Å; L331-A335 WeakPolarHBondContact O-CB 2.9Å; L331-A335 PolarHBondContact O-N 3.32Å
332	K	88.5	Confident	88	Confident	36 Å²	36	54 Å²	54	16%	0.157	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-43.1	174.8	-76.2	-178	165.5	174.7	0	112	T265 Y328 Y329 I330 C334 A335 A336 F342	T265-K332 HydrophobicContact CG2-CG 3.97Å; Y328-K332 HydrophobicContact CD1-CD 4.38Å; Y328-K332 HydrophobicContact CE1-CD 3.96Å; Y328-K332 HydrophobicContact CE1-CG 4.44Å; Y328-K332 PolarHBondContact O-N 3.05Å; Y328-K332 WeakPolarHBondContact OH-CE 3.05Å; Y329-K332 PolarHBondContact O-N 3.29Å; I330-K332 VanDerWaalsContact C-N 3.34Å; I330-K332 PolarHBondContact O-N 2.87Å; K332-C334 VanDerWaalsContact C-N 3.31Å; K332-C334 PolarHBondContact O-N 2.96Å; K332-A335 PolarHBondContact O-N 2.84Å; K332-A335 VanDerWaalsContact O-N 3.14Å; K332-A336 PolarHBondContact O-N 2.83Å; K332-F342 HydrophobicContact CB-CE1 4.14Å; K332-F342 HydrophobicContact CB-CE2 3.82Å; K332-F342 HydrophobicContact CB-CZ 3.37Å; K332-F342 HydrophobicContact CD-CE2 4.23Å; K332-F342 HydrophobicContact CD-CZ 4.09Å; K332-F342 HydrophobicContact CG-CZ 4.36Å
333	L	88.2	Confident	87.8	Confident	49 Å²	49	56.4 Å²	56.4	26%	0.257	29%	0.289	S	S	.	.	H	α-helix	trans	-61.3	-38.7	176.6	-176.1	66.8	0	0	0	112	Y329 I330 R339 F342 V343	Y329-L333 HydrophobicContact CE1-CD2 4.45Å; Y329-L333 WeakPolarHBondContact O-CB 3.02Å; Y329-L333 PolarHBondContact O-N 3.01Å; I330-L333 PolarHBondContact O-N 2.73Å; L333-R339 HydrophobicContact CD1-CB 4.41Å; L333-F342 HydrophobicContact CB-CD1 4.3Å; L333-F342 HydrophobicContact CB-CE1 4.03Å; L333-F342 HydrophobicContact CD1-CD1 3.75Å; L333-F342 HydrophobicContact CD1-CE1 4.21Å; L333-V343 HydrophobicContact CD1-CG2 3.65Å
334	C	86.7	Confident	87.6	Confident	40 Å²	40	60 Å²	60	27%	0.27	31%	0.307	S	S	.	.	H	α-helix	trans	-71.6	-28.7	175.4	-69.8	0	0	0	0	113.4	C261 I330 L331 K332	C261-C334 HydrophobicContact CB-CB 4Å; C261-C334 WeakPolarHBondContact SG-CB 3.19Å; I330-C334 WeakPolarHBondContact O-CB 2.95Å; I330-C334 PolarHBondContact O-N 3.37Å; I330-C334 PolarHBondContact O-SG 3.44Å; I330-C334 VanDerWaalsContact O-SG 3.32Å; L331-C334 PolarHBondContact O-N 3.1Å; K332-C334 VanDerWaalsContact C-N 3.31Å; K332-C334 PolarHBondContact O-N 2.96Å
335	A	84.7	Confident	87.2	Confident	11 Å²	11	59.4 Å²	59.4	9%	0.091	31%	0.309	C	S	.	.	H	α-helix	trans	-81.6	-25.8	177.7	0	0	0	0	0	113.2	K258 C261 E262 T265 L331 K332 T337	K258-A335 WeakPolarHBondContact CE-O 3.36Å; C261-A335 HydrophobicContact CB-CB 3.98Å; E262-A335 HydrophobicContact CG-CB 4.11Å; T265-A335 HydrophobicContact CG2-CB 4.3Å; T265-A335 WeakPolarHBondContact OG1-CB 3.5Å; L331-A335 WeakPolarHBondContact O-CB 2.9Å; L331-A335 PolarHBondContact O-N 3.32Å; K332-A335 PolarHBondContact O-N 2.84Å; K332-A335 VanDerWaalsContact O-N 3.14Å; A335-T337 PolarHBondContact O-N 3.27Å
336	A	83.8	Confident	86.9	Confident	19 Å²	19	65.5 Å²	65.5	16%	0.157	34%	0.336	C	S	.	.			trans	-57.5	130.9	-176.7	0	0	0	0	0	112.7	K332 F342	K332-A336 PolarHBondContact O-N 2.83Å; A336-F342 HydrophobicContact CB-CB 3.69Å; A336-F342 HydrophobicContact CB-CD1 4.45Å; A336-F342 HydrophobicContact CB-CD2 4.43Å; A336-F342 HydrophobicContact CB-CG 3.93Å
337	T	82.9	Confident	86.5	Confident	125 Å²	125	63.8 Å²	63.8	77%	0.767	33%	0.329	S	S	*	.	S	Bend	trans	-64.9	-47.8	169.8	43.2	0	0	0	0	110.5	K258 A335	K258-T337 VanDerWaalsContact NZ-CG2 3.35Å; A335-T337 PolarHBondContact O-N 3.27Å
338	D	85.4	Confident	86.3	Confident	81 Å²	81	62.9 Å²	62.9	43%	0.433	32%	0.319	S	S	.	.	S	Bend	trans	-114.8	104.4	177.1	-170.7	-7.6	0	0	0	109.9	V340 R341 F342	D338-V340 PolarHBondContact OD1-N 3.35Å; D338-R341 HydrophobicContact CB-CB 4.05Å; D338-R341 WeakPolarHBondContact OD2-CB 3.29Å; D338-F342 WeakPolarHBondContact O-CB 3.42Å; D338-F342 PolarHBondContact O-N 3.35Å
339	R	84.3	Confident	86.2	Confident	132 Å²	132	65.8 Å²	65.8	50%	0.498	34%	0.335	S	S	.	.	H	α-helix	trans	-71.1	-34.3	-173.6	-61.6	178.9	-173.3	172.9	1.1	111.9	L333 F342 V343	L333-R339 HydrophobicContact CD1-CB 4.41Å; R339-F342 PolarHBondContact O-N 2.82Å; R339-V343 VanDerWaalsContact O-CG2 3.27Å; R339-V343 WeakPolarHBondContact O-CG2 3.45Å; R339-V343 PolarHBondContact O-N 2.92Å
340	V	85.6	Confident	86	Confident	95 Å²	95	65.9 Å²	65.9	58%	0.576	34%	0.337	S	S	*	.	H	α-helix	trans	-70.9	-47.9	-178.2	179.2	0	0	0	0	109.3	D338 F342 V343 L344	D338-V340 PolarHBondContact OD1-N 3.35Å; V340-F342 VanDerWaalsContact C-N 3.25Å; V340-F342 PolarHBondContact O-N 2.92Å; V340-V343 PolarHBondContact O-N 2.69Å; V340-L344 HydrophobicContact CG1-CD1 3.98Å; V340-L344 WeakPolarHBondContact O-CG 3.35Å; V340-L344 PolarHBondContact O-N 3.42Å
341	R	85.8	Confident	85.8	Confident	193 Å²	193	62 Å²	62	73%	0.728	32%	0.317	S	S	*	.	H	α-helix	trans	-60.7	-36.5	175	-170.1	173.8	-176.9	167.8	1.9	112.2	D338 S345	D338-R341 HydrophobicContact CB-CB 4.05Å; D338-R341 WeakPolarHBondContact OD2-CB 3.29Å; R341-S345 PolarHBondContact O-N 3.15Å
342	F	87	Confident	85.7	Confident	46 Å²	46	64.1 Å²	64.1	20%	0.202	33%	0.328	C	S	.	.	H	α-helix	trans	-65.1	-46.5	174.1	176.4	-99.1	0	0	0	112.3	Y329 K332 L333 A336 D338 R339 V340 L344 S345 S348	Y329-F342 HydrophobicContact CD2-CE1 4.33Å; Y329-F342 HydrophobicContact CD2-CZ 4.47Å; Y329-F342 AromaticContact CE2-CE1 3.86Å; Y329-F342 HydrophobicContact CE2-CE1 3.86Å; Y329-F342 HydrophobicContact CE2-CZ 4.35Å; K332-F342 HydrophobicContact CB-CE1 4.14Å; K332-F342 HydrophobicContact CB-CE2 3.82Å; K332-F342 HydrophobicContact CB-CZ 3.37Å; K332-F342 HydrophobicContact CD-CE2 4.23Å; K332-F342 HydrophobicContact CD-CZ 4.09Å; K332-F342 HydrophobicContact CG-CZ 4.36Å; L333-F342 HydrophobicContact CB-CD1 4.3Å; L333-F342 HydrophobicContact CB-CE1 4.03Å; L333-F342 HydrophobicContact CD1-CD1 3.75Å; L333-F342 HydrophobicContact CD1-CE1 4.21Å; A336-F342 HydrophobicContact CB-CB 3.69Å; A336-F342 HydrophobicContact CB-CD1 4.45Å; A336-F342 HydrophobicContact CB-CD2 4.43Å; A336-F342 HydrophobicContact CB-CG 3.93Å; D338-F342 WeakPolarHBondContact O-CB 3.42Å; D338-F342 PolarHBondContact O-N 3.35Å; R339-F342 PolarHBondContact O-N 2.82Å; V340-F342 VanDerWaalsContact C-N 3.25Å; V340-F342 PolarHBondContact O-N 2.92Å; F342-L344 VanDerWaalsContact C-N 3.28Å; F342-L344 PolarHBondContact O-N 3.5Å; F342-S345 VanDerWaalsContact O-CB 3.24Å; F342-S345 WeakPolarHBondContact O-CB 3.28Å; F342-S345 PolarHBondContact O-N 3.12Å; F342-S345 VanDerWaalsContact O-N 3.15Å; F342-S348 VanDerWaalsContact O-CB 3.27Å; F342-S348 WeakPolarHBondContact O-CB 3.29Å; F342-S348 PolarHBondContact O-OG 3.49Å
343	V	87.2	Confident	85.7	Confident	51 Å²	51	66.3 Å²	66.3	31%	0.309	34%	0.34	S	S	.	.	H	α-helix	trans	-65.6	-30	179.9	171.4	0	0	0	0	112.4	L333 R339 V340 S345 S348 I352	L333-V343 HydrophobicContact CD1-CG2 3.65Å; R339-V343 VanDerWaalsContact O-CG2 3.27Å; R339-V343 WeakPolarHBondContact O-CG2 3.45Å; R339-V343 PolarHBondContact O-N 2.92Å; V340-V343 PolarHBondContact O-N 2.69Å; V343-S345 VanDerWaalsContact C-N 3.34Å; V343-S348 VanDerWaalsContact C-OG 3.32Å; V343-S348 PolarHBondContact O-OG 3.26Å; V343-I352 HydrophobicContact CG1-CD1 4.02Å
344	L	85.7	Confident	85.5	Confident	119 Å²	119	64 Å²	64	62%	0.623	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	0.3	176	-67.2	172.6	0	0	0	114	V340 F342	V340-L344 HydrophobicContact CG1-CD1 3.98Å; V340-L344 WeakPolarHBondContact O-CG 3.35Å; V340-L344 PolarHBondContact O-N 3.42Å; F342-L344 VanDerWaalsContact C-N 3.28Å; F342-L344 PolarHBondContact O-N 3.5Å
345	S	84.5	Confident	85.6	Confident	38 Å²	38	62.4 Å²	62.4	27%	0.266	32%	0.317	S	S	.	.	S	Bend	trans	-68.1	140.9	174.8	-175.5	0	0	0	0	110.9	R341 F342 V343 S347 S348 L349	R341-S345 PolarHBondContact O-N 3.15Å; F342-S345 VanDerWaalsContact O-CB 3.24Å; F342-S345 WeakPolarHBondContact O-CB 3.28Å; F342-S345 PolarHBondContact O-N 3.12Å; F342-S345 VanDerWaalsContact O-N 3.15Å; V343-S345 VanDerWaalsContact C-N 3.34Å; S345-S347 PolarHBondContact O-N 3.49Å; S345-S347 VanDerWaalsContact O-N 3.11Å; S345-S348 PolarHBondContact N-OG 3.45Å; S345-S348 PolarHBondContact O-N 3.01Å; S345-S348 PolarHBondContact O-OG 2.69Å; S345-L349 WeakPolarHBondContact O-CG 3.37Å; S345-L349 PolarHBondContact O-N 2.72Å
346	F	83.4	Confident	85.7	Confident	127 Å²	127	64.9 Å²	64.9	56%	0.557	33%	0.332	S	S	*	.	H	α-helix	trans	-54	-36.4	178.4	-74	-77.1	0	0	0	113.3	F208 F209 L349 I350	F208-F346 HydrophobicContact CD1-CD2 4.46Å; F208-F346 HydrophobicContact CD1-CE2 4.33Å; F208-F346 HydrophobicContact CE1-CE2 4.1Å; F209-F346 HydrophobicContact CZ-CB 4.31Å; F346-L349 PolarHBondContact O-N 3.21Å; F346-I350 WeakPolarHBondContact O-CD1 3.4Å; F346-I350 VanDerWaalsContact O-CG1 3.31Å; F346-I350 WeakPolarHBondContact O-CG1 3.38Å; F346-I350 PolarHBondContact O-N 2.91Å; F346-I350 VanDerWaalsContact O-N 3.14Å
347	S	83.8	Confident	85.6	Confident	19 Å²	19	66.1 Å²	66.1	13%	0.133	34%	0.338	C	S	.	.	H	α-helix	trans	-66.5	-39.2	177.8	173.9	0	0	0	0	113	S345 D351 Y381	S345-S347 PolarHBondContact O-N 3.49Å; S345-S347 VanDerWaalsContact O-N 3.11Å; S347-D351 PolarHBondContact O-N 2.94Å; S347-Y381 WeakPolarHBondContact CB-OH 3.26Å; S347-Y381 PolarHBondContact OG-OH 3.5Å
348	S	85.9	Confident	85.6	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.007	30%	0.303	C	S	.	.	H	α-helix	trans	-74.6	-36.9	178.4	52.4	0	0	0	0	111.1	F342 V343 S345 I350 D351 I352	F342-S348 VanDerWaalsContact O-CB 3.27Å; F342-S348 WeakPolarHBondContact O-CB 3.29Å; F342-S348 PolarHBondContact O-OG 3.49Å; V343-S348 VanDerWaalsContact C-OG 3.32Å; V343-S348 PolarHBondContact O-OG 3.26Å; S345-S348 PolarHBondContact N-OG 3.45Å; S345-S348 PolarHBondContact O-N 3.01Å; S345-S348 PolarHBondContact O-OG 2.69Å; S348-I350 VanDerWaalsContact C-N 3.3Å; S348-I350 PolarHBondContact O-N 3.45Å; S348-D351 PolarHBondContact O-N 3.49Å; S348-D351 VanDerWaalsContact O-N 3.15Å; S348-I352 WeakPolarHBondContact O-CB 3.45Å; S348-I352 WeakPolarHBondContact O-CD1 3.31Å; S348-I352 WeakPolarHBondContact O-CG1 3.2Å; S348-I352 PolarHBondContact O-N 2.88Å
349	L	86.6	Confident	85.6	Confident	64 Å²	64	58 Å²	58	34%	0.335	29%	0.291	S	S	.	.	H	α-helix	trans	-57.5	-42.9	174	-70.9	173.6	0	0	0	111.8	S345 F346 D351 I352 I353	S345-L349 WeakPolarHBondContact O-CG 3.37Å; S345-L349 PolarHBondContact O-N 2.72Å; F346-L349 PolarHBondContact O-N 3.21Å; L349-D351 PolarHBondContact O-N 3.11Å; L349-I352 PolarHBondContact O-N 3.4Å; L349-I353 WeakPolarHBondContact O-CB 3.35Å; L349-I353 VanDerWaalsContact O-CG1 3.26Å; L349-I353 WeakPolarHBondContact O-CG1 3.19Å; L349-I353 PolarHBondContact O-N 3.3Å
350	I	86.1	Confident	85.6	Confident	32 Å²	32	54.6 Å²	54.6	16%	0.164	29%	0.287	C	S	.	.	H	α-helix	trans	-61.9	-44.4	175.7	-68.9	159.4	0	0	0	111.4	F346 S348 I353 S354 L374 M377	F346-I350 WeakPolarHBondContact O-CD1 3.4Å; F346-I350 VanDerWaalsContact O-CG1 3.31Å; F346-I350 WeakPolarHBondContact O-CG1 3.38Å; F346-I350 PolarHBondContact O-N 2.91Å; F346-I350 VanDerWaalsContact O-N 3.14Å; S348-I350 VanDerWaalsContact C-N 3.3Å; S348-I350 PolarHBondContact O-N 3.45Å; I350-I353 PolarHBondContact O-N 3.5Å; I350-S354 VanDerWaalsContact O-CB 3.3Å; I350-S354 WeakPolarHBondContact O-CB 3.43Å; I350-S354 PolarHBondContact O-N 3.3Å; I350-S354 PolarHBondContact O-OG 2.99Å; I350-L374 HydrophobicContact CG2-CB 3.93Å; I350-M377 HydrophobicContact CD1-CB 3.88Å; I350-M377 HydrophobicContact CD1-CG 3.69Å
351	D	86.8	Confident	85.3	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.011	26%	0.264	C	S	.	.	H	α-helix	trans	-63.4	-41.4	176.3	-79.8	-28.8	0	0	0	111.2	Y279 Y329 S347 S348 L349 I353 S354 I355 R375	Y279-D351 PolarHBondContact OH-OD1 2.9Å; Y279-D351 VanDerWaalsContact OH-OD1 3.08Å; Y279-D351 PolarHBondContact OH-OD2 2.87Å; Y279-D351 VanDerWaalsContact OH-OD2 3.11Å; Y329-D351 HydrophobicContact CD2-CB 4.09Å; S347-D351 PolarHBondContact O-N 2.94Å; S348-D351 PolarHBondContact O-N 3.49Å; S348-D351 VanDerWaalsContact O-N 3.15Å; L349-D351 PolarHBondContact O-N 3.11Å; D351-I353 VanDerWaalsContact C-N 3.34Å; D351-I353 PolarHBondContact O-N 3.47Å; D351-S354 PolarHBondContact O-N 3.27Å; D351-I355 HydrophobicContact CB-CD1 3.91Å; D351-I355 VanDerWaalsContact O-CB 3.28Å; D351-I355 WeakPolarHBondContact O-CB 3.39Å; D351-I355 WeakPolarHBondContact O-CD1 3.42Å; D351-I355 WeakPolarHBondContact O-CG1 3.46Å; D351-I355 PolarHBondContact O-N 2.89Å; D351-R375 IonicContact OD1-CZ 3.46Å; D351-R375 IonicContact OD1-NH1 2.75Å; D351-R375 PolarHBondContact OD1-NH1 2.9Å
352	I	87.8	Confident	85	Confident	67 Å²	67	42.8 Å²	42.8	34%	0.344	24%	0.236	S	C	.	.	H	α-helix	trans	-64.1	-36.9	177.5	-67.6	162.3	0	0	0	111.7	Y329 V343 S348 L349 P356	Y329-I352 HydrophobicContact CE2-CD1 4.48Å; Y329-I352 HydrophobicContact CE2-CG1 4.21Å; Y329-I352 WeakPolarHBondContact OH-CD1 3.46Å; V343-I352 HydrophobicContact CG1-CD1 4.02Å; S348-I352 WeakPolarHBondContact O-CB 3.45Å; S348-I352 WeakPolarHBondContact O-CD1 3.31Å; S348-I352 WeakPolarHBondContact O-CG1 3.2Å; S348-I352 PolarHBondContact O-N 2.88Å; L349-I352 PolarHBondContact O-N 3.4Å; I352-P356 WeakPolarHBondContact O-CD 3.41Å; I352-P356 WeakPolarHBondContact O-CG 3.41Å
353	I	87.3	Confident	84.7	Confident	81 Å²	81	45.9 Å²	45.9	42%	0.415	25%	0.25	S	S	.	.	H	α-helix	trans	-78.9	-37.4	-179.8	-67.3	165.5	0	0	0	111.6	L349 I350 D351 P357 L371 L374	L349-I353 WeakPolarHBondContact O-CB 3.35Å; L349-I353 VanDerWaalsContact O-CG1 3.26Å; L349-I353 WeakPolarHBondContact O-CG1 3.19Å; L349-I353 PolarHBondContact O-N 3.3Å; I350-I353 PolarHBondContact O-N 3.5Å; D351-I353 VanDerWaalsContact C-N 3.34Å; D351-I353 PolarHBondContact O-N 3.47Å; I353-P357 WeakPolarHBondContact O-CD 3.41Å; I353-P357 WeakPolarHBondContact O-CG 3.5Å; I353-L371 HydrophobicContact CG2-CD1 3.73Å; I353-L374 HydrophobicContact CG2-CD1 3.92Å
354	S	85.3	Confident	84.3	Confident	1 Å²	1	47 Å²	47	1%	0.007	25%	0.252	C	S	.	.	H	α-helix	trans	-85.3	-36.3	-173.2	57.2	0	0	0	0	114.3	I350 D351 R375	I350-S354 VanDerWaalsContact O-CB 3.3Å; I350-S354 WeakPolarHBondContact O-CB 3.43Å; I350-S354 PolarHBondContact O-N 3.3Å; I350-S354 PolarHBondContact O-OG 2.99Å; D351-S354 PolarHBondContact O-N 3.27Å; S354-R375 PolarHBondContact OG-NE 3.03Å; S354-R375 PolarHBondContact OG-NH2 3.08Å; S354-R375 VanDerWaalsContact OG-NH2 3.11Å
355	I	87.2	Confident	83.7	Confident	6 Å²	6	46.2 Å²	46.2	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-67.7	-50.6	-173.7	-64.5	167.7	0	0	0	112.5	C325 L326 D351 A358 L359	C325-I355 HydrophobicContact CB-CD1 4.31Å; L326-I355 HydrophobicContact CB-CD1 4.47Å; L326-I355 HydrophobicContact CB-CG2 4.08Å; L326-I355 HydrophobicContact CD1-CG2 4.21Å; D351-I355 HydrophobicContact CB-CD1 3.91Å; D351-I355 VanDerWaalsContact O-CB 3.28Å; D351-I355 WeakPolarHBondContact O-CB 3.39Å; D351-I355 WeakPolarHBondContact O-CD1 3.42Å; D351-I355 WeakPolarHBondContact O-CG1 3.46Å; D351-I355 PolarHBondContact O-N 2.89Å; I355-A358 PolarHBondContact O-N 2.93Å; I355-L359 HydrophobicContact CG2-CD1 3.61Å; I355-L359 HydrophobicContact CG2-CG 4.1Å; I355-L359 WeakPolarHBondContact O-CG 3.4Å; I355-L359 PolarHBondContact O-N 3.27Å
356	P	86.6	Confident	83.2	Confident	63 Å²	63	46.6 Å²	46.6	41%	0.409	25%	0.25	S	C	.	.	H	α-helix	trans	-63.1	-46.8	-172.8	-19.8	31.7	0	0	0	114	I352 A358 L359 C360	I352-P356 WeakPolarHBondContact O-CD 3.41Å; I352-P356 WeakPolarHBondContact O-CG 3.41Å; P356-A358 VanDerWaalsContact C-N 3.28Å; P356-A358 PolarHBondContact O-N 3.49Å; P356-L359 PolarHBondContact O-N 3.15Å; P356-C360 PolarHBondContact O-N 3.28Å; P356-C360 PolarHBondContact O-SG 3.11Å; P356-C360 VanDerWaalsContact O-SG 3.4Å
357	P	83	Confident	82.9	Confident	45 Å²	45	41.3 Å²	41.3	29%	0.292	23%	0.226	S	C	.	.	H	α-helix	trans	-58.8	-39.6	176.3	-25	35.2	0	0	0	112.5	I353 L359 C360 S361	I353-P357 WeakPolarHBondContact O-CD 3.41Å; I353-P357 WeakPolarHBondContact O-CG 3.5Å; P357-L359 PolarHBondContact O-N 3.16Å; P357-C360 PolarHBondContact O-N 3.27Å; P357-S361 VanDerWaalsContact O-CB 3.32Å; P357-S361 WeakPolarHBondContact O-CB 3.2Å; P357-S361 PolarHBondContact O-N 3.41Å
358	A	82.4	Confident	82.6	Confident	4 Å²	4	43.9 Å²	43.9	3%	0.033	24%	0.236	C	C	.	.	H	α-helix	trans	-65.9	-38.9	178.7	0	0	0	0	0	112.3	N322 I355 P356 S361	N322-A358 HydrophobicContact CB-CB 4.21Å; N322-A358 WeakPolarHBondContact ND2-CB 3.29Å; I355-A358 PolarHBondContact O-N 2.93Å; P356-A358 VanDerWaalsContact C-N 3.28Å; P356-A358 PolarHBondContact O-N 3.49Å; A358-S361 PolarHBondContact O-OG 3.42Å
359	L	86.1	Confident	82.5	Confident	33 Å²	33	48 Å²	48	17%	0.173	26%	0.257	C	S	.	.	H	α-helix	trans	-69.8	-38.8	176.2	-67.3	176.4	0	0	0	112.3	F319 N322 L326 I355 P356 P357 F363	F319-L359 HydrophobicContact CD2-CD2 3.68Å; F319-L359 HydrophobicContact CE2-CD2 3.75Å; F319-L359 HydrophobicContact CG-CD2 4.42Å; N322-L359 HydrophobicContact CB-CD2 4.13Å; N322-L359 HydrophobicContact CB-CG 4.44Å; L326-L359 HydrophobicContact CD2-CD1 4.09Å; I355-L359 HydrophobicContact CG2-CD1 3.61Å; I355-L359 HydrophobicContact CG2-CG 4.1Å; I355-L359 WeakPolarHBondContact O-CG 3.4Å; I355-L359 PolarHBondContact O-N 3.27Å; P356-L359 PolarHBondContact O-N 3.15Å; P357-L359 PolarHBondContact O-N 3.16Å; L359-F363 WeakPolarHBondContact O-CD2 3.32Å; L359-F363 WeakPolarHBondContact O-CE2 3.39Å
360	C	83.7	Confident	82.2	Confident	60 Å²	60	45.2 Å²	45.2	41%	0.405	24%	0.242	S	C	.	.	H	α-helix	trans	-70.7	-33.8	177.8	-66.9	0	0	0	0	112.8	P356 P357 V362 F363 E364	P356-C360 PolarHBondContact O-N 3.28Å; P356-C360 PolarHBondContact O-SG 3.11Å; P356-C360 VanDerWaalsContact O-SG 3.4Å; P357-C360 PolarHBondContact O-N 3.27Å; C360-V362 PolarHBondContact O-N 3.38Å; C360-F363 PolarHBondContact O-N 2.84Å; C360-E364 PolarHBondContact O-N 3.25Å
361	S	79.6	Confident	82.2	Confident	15 Å²	15	45.6 Å²	45.6	11%	0.105	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.1	-173.8	71.4	0	0	0	0	115.8	H307 P357 A358	H307-S361 PolarHBondContact NE2-O 2.95Å; H307-S361 VanDerWaalsContact NE2-O 3.15Å; P357-S361 VanDerWaalsContact O-CB 3.32Å; P357-S361 WeakPolarHBondContact O-CB 3.2Å; P357-S361 PolarHBondContact O-N 3.41Å; A358-S361 PolarHBondContact O-OG 3.42Å
362	V	80	Confident	82.2	Confident	24 Å²	24	45.9 Å²	45.9	15%	0.145	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-29.4	176.9	174.7	0	0	0	0	112.2	S315 W316 F319 C360	S315-V362 WeakPolarHBondContact O-CG2 3.47Å; W316-V362 HydrophobicContact CD2-CG1 3.86Å; W316-V362 HydrophobicContact CE3-CG1 4.03Å; W316-V362 HydrophobicContact CH2-CG1 3.86Å; W316-V362 HydrophobicContact CZ2-CG1 3.68Å; W316-V362 HydrophobicContact CZ3-CG1 4.03Å; F319-V362 HydrophobicContact CB-CG2 3.76Å; F319-V362 HydrophobicContact CD2-CB 4.46Å; F319-V362 HydrophobicContact CD2-CG2 4.29Å; F319-V362 HydrophobicContact CG-CG2 4.34Å; C360-V362 PolarHBondContact O-N 3.38Å
363	F	80.6	Confident	82.2	Confident	111 Å²	111	43.1 Å²	43.1	49%	0.487	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-26.5	-179.6	-62.1	-69.8	0	0	0	112.1	W11 F319 L359 C360	W11-F363 HydrophobicContact CH2-CB 4.09Å; W11-F363 HydrophobicContact CZ3-CB 4.19Å; F319-F363 HydrophobicContact CE2-CE2 4.02Å; F319-F363 HydrophobicContact CE2-CZ 4.25Å; L359-F363 WeakPolarHBondContact O-CD2 3.32Å; L359-F363 WeakPolarHBondContact O-CE2 3.39Å; C360-F363 PolarHBondContact O-N 2.84Å
364	E	77.7	Confident	82.3	Confident	74 Å²	74	40.7 Å²	40.7	35%	0.346	22%	0.219	S	C	.	.	S	Bend	trans	-80.9	136.4	174.6	-67.2	176.3	-178.3	0	0	111	C360 H366 H368	C360-E364 PolarHBondContact O-N 3.25Å; E364-H366 WeakPolarHBondContact CB-O 3.47Å; E364-H366 PolarHBondContact O-N 3.22Å; E364-H368 IonicContact OE2-CD2 3.2Å; E364-H368 PolarHBondContact OE2-CD2 3.18Å
365	T	72.7	Confident	82.5	Confident	103 Å²	103	40.9 Å²	40.9	63%	0.632	22%	0.22	S	C	*	.	S	Bend	trans	-65.5	-20.8	173.6	46.6	0	0	0	0	112.3
366	H	75.5	Confident	82.6	Confident	47 Å²	47	40.6 Å²	40.6	22%	0.218	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	137.9	-178.2	-60.5	-82.8	0	0	0	110.9	I305 C306 E364	I305-H366 WeakPolarHBondContact O-CA 3.24Å; C306-H366 PolarHBondContact SG-CE1 3.43Å; E364-H366 WeakPolarHBondContact CB-O 3.47Å; E364-H366 PolarHBondContact O-N 3.22Å
367	R	75.7	Confident	82.7	Confident	16 Å²	16	40.6 Å²	40.6	6%	0.06	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	115.6	169.9	-170	-179.4	66.1	129.2	16.1	109.2	E293 N294 I305 D370	E293-R367 IonicContact OE2-CZ 2.7Å; E293-R367 IonicContact OE2-NH1 3.13Å; E293-R367 PolarHBondContact OE2-NH1 2.93Å; N294-R367 VanDerWaalsContact OD1-CZ 3.28Å; N294-R367 PolarHBondContact OD1-NH1 3.23Å; N294-R367 PolarHBondContact OD1-NH2 3.35Å; I305-R367 PolarHBondContact N-O 3.04Å; I305-R367 PolarHBondContact O-N 3.4Å; R367-D370 IonicContact NH1-OD2 3.49Å; R367-D370 PolarHBondContact NH1-OD2 3.15Å; R367-D370 VanDerWaalsContact NH1-OD2 3.13Å
368	H	78.3	Confident	83	Confident	72 Å²	72	38.8 Å²	38.8	33%	0.333	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-48.6	-178.7	-75.1	-73.2	0	0	0	113.8	V300 S301 E364	V300-H368 WeakPolarHBondContact CA-O 3.34Å; S301-H368 PolarHBondContact N-O 3.13Å; S301-H368 PolarHBondContact O-ND1 3.06Å; E364-H368 IonicContact OE2-CD2 3.2Å; E364-H368 PolarHBondContact OE2-CD2 3.18Å
369	I	82.8	Confident	83.4	Confident	87 Å²	87	39.7 Å²	39.7	45%	0.446	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	126.6	-171.2	-63.3	168.8	0	0	0	109.2	V300 L371	V300-I369 HydrophobicContact CG1-CG1 4.48Å; I369-L371 HydrophobicContact CG2-CD1 4.1Å; I369-L371 HydrophobicContact CG2-CD2 4.27Å; I369-L371 HydrophobicContact CG2-CG 3.74Å
370	D	81.9	Confident	83.5	Confident	6 Å²	6	41.2 Å²	41.2	3%	0.032	21%	0.213	C	C	.	.			trans	-124	102.7	172.7	-175.3	13.3	0	0	0	111.1	Y290 N294 P299 R367 N372	Y290-D370 WeakPolarHBondContact CD2-OD2 2.96Å; Y290-D370 WeakPolarHBondContact CE2-O 3.47Å; N294-D370 PolarHBondContact ND2-OD2 3.04Å; P299-D370 PolarHBondContact O-N 3.32Å; R367-D370 IonicContact NH1-OD2 3.49Å; R367-D370 PolarHBondContact NH1-OD2 3.15Å; R367-D370 VanDerWaalsContact NH1-OD2 3.13Å; D370-N372 VanDerWaalsContact OD1-CB 3.28Å; D370-N372 WeakPolarHBondContact OD1-CB 3.33Å; D370-N372 VanDerWaalsContact OD1-CG 3.3Å; D370-N372 PolarHBondContact OD1-N 3.14Å; D370-N372 PolarHBondContact OD1-ND2 3.36Å
371	L	85.1	Confident	83.7	Confident	41 Å²	41	41 Å²	41	22%	0.215	20%	0.204	C	C	.	.			trans	-102	18.2	179.1	-61.5	175.5	0	0	0	112.7	I353 I369 F373 L374	I353-L371 HydrophobicContact CG2-CD1 3.73Å; I369-L371 HydrophobicContact CG2-CD1 4.1Å; I369-L371 HydrophobicContact CG2-CD2 4.27Å; I369-L371 HydrophobicContact CG2-CG 3.74Å; L371-F373 HydrophobicContact CB-CE1 4.47Å; L371-F373 HydrophobicContact CD2-CE1 3.8Å; L371-F373 PolarHBondContact O-N 2.83Å; L371-F373 VanDerWaalsContact O-N 3.08Å; L371-L374 HydrophobicContact CB-CD1 4.37Å; L371-L374 PolarHBondContact O-N 2.93Å; L371-L374 VanDerWaalsContact O-N 3.15Å
372	N	86.3	Confident	84.2	Confident	7 Å²	7	42.9 Å²	42.9	4%	0.037	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-67.4	-8.3	-177.5	-72.7	-44.8	0	0	0	113.7	Y290 N318 D370 L374 R375	Y290-N372 HydrophobicContact CD2-CB 4.3Å; Y290-N372 HydrophobicContact CG-CB 4.48Å; N318-N372 PolarHBondContact ND2-ND2 3.02Å; D370-N372 VanDerWaalsContact OD1-CB 3.28Å; D370-N372 WeakPolarHBondContact OD1-CB 3.33Å; D370-N372 VanDerWaalsContact OD1-CG 3.3Å; D370-N372 PolarHBondContact OD1-N 3.14Å; D370-N372 PolarHBondContact OD1-ND2 3.36Å; N372-L374 PolarHBondContact O-N 2.84Å; N372-R375 HydrophobicContact CB-CG 4.48Å; N372-R375 WeakPolarHBondContact O-CB 3.37Å; N372-R375 WeakPolarHBondContact O-CG 3.44Å; N372-R375 PolarHBondContact O-N 3.12Å
373	F	88.7	Confident	84.6	Confident	10 Å²	10	41.8 Å²	41.8	4%	0.044	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-57.4	-30.9	169	74.5	-92.8	0	0	0	112.5	Y290 L371 R375 S376 I417 V420	Y290-F373 HydrophobicContact CD1-CB 3.86Å; Y290-F373 HydrophobicContact CD2-CB 4.23Å; Y290-F373 HydrophobicContact CE1-CB 3.56Å; Y290-F373 HydrophobicContact CE2-CB 3.95Å; Y290-F373 HydrophobicContact CE2-CD1 4.06Å; Y290-F373 HydrophobicContact CG-CB 4.21Å; L371-F373 HydrophobicContact CB-CE1 4.47Å; L371-F373 HydrophobicContact CD2-CE1 3.8Å; L371-F373 PolarHBondContact O-N 2.83Å; L371-F373 VanDerWaalsContact O-N 3.08Å; F373-R375 PolarHBondContact O-N 3.23Å; F373-R375 VanDerWaalsContact O-N 3.16Å; F373-S376 WeakPolarHBondContact O-CB 3.41Å; F373-S376 PolarHBondContact O-N 3.16Å; F373-S376 PolarHBondContact O-OG 3.11Å; F373-I417 HydrophobicContact CE2-CG1 3.7Å; F373-I417 HydrophobicContact CZ-CG1 4.04Å; F373-V420 HydrophobicContact CD1-CG2 4.24Å; F373-V420 HydrophobicContact CE1-CG2 3.78Å
374	L	89.8	Confident	84.9	Confident	29 Å²	29	38.6 Å²	38.6	15%	0.152	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-61.9	-21.9	176.7	-68	171.7	0	0	0	112.4	I350 I353 L371 N372 S376 M377	I350-L374 HydrophobicContact CG2-CB 3.93Å; I353-L374 HydrophobicContact CG2-CD1 3.92Å; L371-L374 HydrophobicContact CB-CD1 4.37Å; L371-L374 PolarHBondContact O-N 2.93Å; L371-L374 VanDerWaalsContact O-N 3.15Å; N372-L374 PolarHBondContact O-N 2.84Å; L374-S376 PolarHBondContact O-N 2.84Å; L374-M377 WeakPolarHBondContact O-CB 2.96Å; L374-M377 PolarHBondContact O-N 2.56Å; L374-M377 VanDerWaalsContact O-N 3.14Å
375	R	89.4	Confident	85.4	Confident	5 Å²	5	35.6 Å²	35.6	2%	0.019	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-62.7	-20.7	173.8	-65.2	-69.9	-169.2	-169.2	-11.3	112.9	W287 N322 D351 S354 N372 F373 M377 C378	W287-R375 HydrophobicContact CB-CB 4.09Å; N322-R375 PolarHBondContact OD1-NH2 2.92Å; D351-R375 IonicContact OD1-CZ 3.46Å; D351-R375 IonicContact OD1-NH1 2.75Å; D351-R375 PolarHBondContact OD1-NH1 2.9Å; S354-R375 PolarHBondContact OG-NE 3.03Å; S354-R375 PolarHBondContact OG-NH2 3.08Å; S354-R375 VanDerWaalsContact OG-NH2 3.11Å; N372-R375 HydrophobicContact CB-CG 4.48Å; N372-R375 WeakPolarHBondContact O-CB 3.37Å; N372-R375 WeakPolarHBondContact O-CG 3.44Å; N372-R375 PolarHBondContact O-N 3.12Å; F373-R375 PolarHBondContact O-N 3.23Å; F373-R375 VanDerWaalsContact O-N 3.16Å; R375-M377 PolarHBondContact O-N 2.94Å; R375-M377 VanDerWaalsContact O-N 3.14Å; R375-C378 WeakPolarHBondContact O-CB 3.5Å; R375-C378 PolarHBondContact O-N 2.95Å; R375-C378 PolarHBondContact O-SG 3.05Å
376	S	89.6	Confident	86.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-59.4	-21.2	173.6	60.5	0	0	0	0	113.1	F373 L374 C378 F379 V413	F373-S376 WeakPolarHBondContact O-CB 3.41Å; F373-S376 PolarHBondContact O-N 3.16Å; F373-S376 PolarHBondContact O-OG 3.11Å; L374-S376 PolarHBondContact O-N 2.84Å; S376-C378 PolarHBondContact O-N 2.95Å; S376-F379 WeakPolarHBondContact O-CD2 3.37Å; S376-F379 PolarHBondContact O-N 2.86Å; S376-F379 VanDerWaalsContact O-N 3.08Å; S376-V413 WeakPolarHBondContact OG-CG2 3.11Å
377	M	88.6	Confident	86.8	Confident	64 Å²	64	32.2 Å²	32.2	32%	0.315	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-57.4	-17.9	171.3	-76.1	-70.4	-151.1	0	0	114.3	I350 L374 R375 F379 L380 T409 V413	I350-M377 HydrophobicContact CD1-CB 3.88Å; I350-M377 HydrophobicContact CD1-CG 3.69Å; L374-M377 WeakPolarHBondContact O-CB 2.96Å; L374-M377 PolarHBondContact O-N 2.56Å; L374-M377 VanDerWaalsContact O-N 3.14Å; R375-M377 PolarHBondContact O-N 2.94Å; R375-M377 VanDerWaalsContact O-N 3.14Å; M377-F379 PolarHBondContact O-N 3.48Å; M377-F379 VanDerWaalsContact O-N 3.16Å; M377-L380 PolarHBondContact O-N 3.47Å; M377-L380 HydrophobicContact SD-CD1 4.05Å; M377-T409 HydrophobicContact CG-CG2 4.26Å; M377-T409 HydrophobicContact SD-CG2 3.33Å; M377-T409 WeakPolarHBondContact SD-CG2 3.27Å; M377-V413 HydrophobicContact CE-CG1 4.37Å; M377-V413 HydrophobicContact CE-CG2 4.17Å; M377-V413 HydrophobicContact CG-CG2 3.68Å; M377-V413 HydrophobicContact SD-CG2 3.85Å
378	C	89.4	Confident	87.3	Confident	7 Å²	7	35.8 Å²	35.8	5%	0.047	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-62.1	-19	174.8	71.5	0	0	0	0	113.8	T284 R375 S376 L380 Y381	T284-C378 WeakPolarHBondContact CG2-SG 3.35Å; R375-C378 WeakPolarHBondContact O-CB 3.5Å; R375-C378 PolarHBondContact O-N 2.95Å; R375-C378 PolarHBondContact O-SG 3.05Å; S376-C378 PolarHBondContact O-N 2.95Å; C378-L380 PolarHBondContact O-N 3.01Å; C378-Y381 PolarHBondContact O-N 3.42Å
379	F	90.2	Very high	87.6	Confident	22 Å²	22	37.4 Å²	37.4	10%	0.096	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-60.2	-26.8	175.3	-73.9	-58.5	0	0	0	113.1	T284 W287 S376 M377 Y381 Y382 F405 F408 T409	T284-F379 HydrophobicContact CG2-CE1 3.88Å; T284-F379 HydrophobicContact CG2-CZ 3.96Å; W287-F379 HydrophobicContact CE3-CE2 4.29Å; W287-F379 HydrophobicContact CE3-CZ 4.28Å; W287-F379 HydrophobicContact CZ3-CE2 4.38Å; W287-F379 HydrophobicContact CZ3-CZ 4.21Å; S376-F379 WeakPolarHBondContact O-CD2 3.37Å; S376-F379 PolarHBondContact O-N 2.86Å; S376-F379 VanDerWaalsContact O-N 3.08Å; M377-F379 PolarHBondContact O-N 3.48Å; M377-F379 VanDerWaalsContact O-N 3.16Å; F379-Y381 PolarHBondContact O-N 3.4Å; F379-Y382 AromaticContact CD1-CD2 3.76Å; F379-Y382 HydrophobicContact CD1-CD2 3.76Å; F379-Y382 AromaticContact CD1-CE2 3.8Å; F379-Y382 HydrophobicContact CD1-CE2 3.8Å; F379-Y382 HydrophobicContact CD1-CG 4.45Å; F379-Y382 HydrophobicContact CE1-CD2 4.38Å; F379-Y382 AromaticContact CE1-CE2 3.97Å; F379-Y382 HydrophobicContact CE1-CE2 3.97Å; F379-Y382 WeakPolarHBondContact O-CB 3.45Å; F379-Y382 PolarHBondContact O-N 3.33Å; F379-F405 HydrophobicContact CB-CD1 4.15Å; F379-F405 HydrophobicContact CD1-CD1 4.17Å; F379-F405 HydrophobicContact CD1-CE1 4.16Å; F379-F408 HydrophobicContact CD1-CE1 4.48Å; F379-F408 AromaticContact CD2-CD1 3.77Å; F379-F408 HydrophobicContact CD2-CD1 3.77Å; F379-F408 AromaticContact CD2-CE1 3.68Å; F379-F408 HydrophobicContact CD2-CE1 3.68Å; F379-F408 HydrophobicContact CE1-CE1 4.29Å; F379-F408 HydrophobicContact CE2-CD1 4.08Å; F379-F408 AromaticContact CE2-CE1 3.49Å; F379-F408 HydrophobicContact CE2-CE1 3.49Å; F379-F408 VanDerWaalsContact CE2-CE1 3.49Å; F379-F408 HydrophobicContact CG-CD1 4.05Å; F379-F408 HydrophobicContact CG-CE1 4.23Å; F379-F408 AromaticContact CZ-CE1 3.81Å; F379-F408 HydrophobicContact CZ-CE1 3.81Å; F379-T409 WeakPolarHBondContact CB-OG1 3.18Å
380	L	87.8	Confident	87.7	Confident	66 Å²	66	35.4 Å²	35.4	35%	0.346	18%	0.184	S	C	.	.	H	α-helix	trans	-62.2	-32.6	173.4	-62.3	176	0	0	0	112.4	M377 C378 T406 T409	M377-L380 PolarHBondContact O-N 3.47Å; M377-L380 HydrophobicContact SD-CD1 4.05Å; C378-L380 PolarHBondContact O-N 3.01Å; L380-T406 HydrophobicContact CD2-CG2 4.38Å; L380-T409 HydrophobicContact CD1-CG2 4.37Å; L380-T409 HydrophobicContact CD2-CG2 4.37Å; L380-T409 HydrophobicContact CG-CG2 4.07Å
381	Y	88.6	Confident	87.9	Confident	55 Å²	55	39.9 Å²	39.9	22%	0.216	21%	0.211	C	C	.	.	H	α-helix	trans	-85	-7.4	179.5	-61.3	-59	0	0	0	114.1	S347 C378 F379 V383 T385	S347-Y381 WeakPolarHBondContact CB-OH 3.26Å; S347-Y381 PolarHBondContact OG-OH 3.5Å; C378-Y381 PolarHBondContact O-N 3.42Å; F379-Y381 PolarHBondContact O-N 3.4Å; Y381-V383 VanDerWaalsContact C-N 3.34Å; Y381-T385 WeakPolarHBondContact O-CB 3.43Å; Y381-T385 PolarHBondContact O-N 3.49Å; Y381-T385 PolarHBondContact O-OG1 3.08Å
382	Y	89.5	Confident	87.8	Confident	54 Å²	54	39.6 Å²	39.6	21%	0.212	21%	0.21	C	C	.	.	H	α-helix	trans	-63.5	-41.6	177	-98.8	-98.3	0	0	0	111.6	I280 T284 F379 D384 T385 L386 F405	I280-Y382 HydrophobicContact CG2-CD2 3.4Å; I280-Y382 HydrophobicContact CG2-CE1 4.39Å; I280-Y382 HydrophobicContact CG2-CE2 3.08Å; I280-Y382 HydrophobicContact CG2-CG 4.22Å; T284-Y382 HydrophobicContact CG2-CE2 3.49Å; T284-Y382 VanDerWaalsContact CG2-CE2 3.49Å; T284-Y382 VanDerWaalsContact CG2-OH 3.31Å; T284-Y382 WeakPolarHBondContact CG2-OH 3.19Å; T284-Y382 PolarHBondContact OG1-OH 3.3Å; F379-Y382 AromaticContact CD1-CD2 3.76Å; F379-Y382 HydrophobicContact CD1-CD2 3.76Å; F379-Y382 AromaticContact CD1-CE2 3.8Å; F379-Y382 HydrophobicContact CD1-CE2 3.8Å; F379-Y382 HydrophobicContact CD1-CG 4.45Å; F379-Y382 HydrophobicContact CE1-CD2 4.38Å; F379-Y382 AromaticContact CE1-CE2 3.97Å; F379-Y382 HydrophobicContact CE1-CE2 3.97Å; F379-Y382 WeakPolarHBondContact O-CB 3.45Å; F379-Y382 PolarHBondContact O-N 3.33Å; Y382-D384 PolarHBondContact O-N 3.49Å; Y382-T385 PolarHBondContact O-N 2.92Å; Y382-L386 WeakPolarHBondContact O-CB 3.41Å; Y382-L386 VanDerWaalsContact O-CG 3.27Å; Y382-L386 WeakPolarHBondContact O-CG 3.42Å; Y382-L386 PolarHBondContact O-N 3.35Å; Y382-F405 HydrophobicContact CG-CE1 4.29Å; Y382-F405 HydrophobicContact CG-CZ 4.49Å
383	V	88.7	Confident	87.7	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.012	24%	0.238	C	C	.	.	H	α-helix	trans	-60.5	-50.9	-179	179	0	0	0	0	110.2	Y381 T385 L386 T387 I398 A401 R402 F405	Y381-V383 VanDerWaalsContact C-N 3.34Å; V383-T385 VanDerWaalsContact C-N 3.28Å; V383-T385 PolarHBondContact O-N 2.9Å; V383-L386 PolarHBondContact O-N 3.43Å; V383-T387 WeakPolarHBondContact O-CG2 3.4Å; V383-T387 PolarHBondContact O-N 3.41Å; V383-I398 HydrophobicContact CG1-CG2 4Å; V383-A401 HydrophobicContact CG1-CB 4.47Å; V383-A401 HydrophobicContact CG2-CB 4.09Å; V383-R402 HydrophobicContact CG1-CB 4.4Å; V383-R402 HydrophobicContact CG2-CB 4.47Å; V383-F405 HydrophobicContact CG2-CB 4.13Å; V383-F405 HydrophobicContact CG2-CD2 3.44Å; V383-F405 VanDerWaalsContact CG2-CD2 3.44Å; V383-F405 HydrophobicContact CG2-CE2 4.21Å; V383-F405 HydrophobicContact CG2-CG 4.11Å
384	D	87.7	Confident	87.2	Confident	44 Å²	44	46.6 Å²	46.6	24%	0.235	26%	0.256	C	S	.	.	H	α-helix	trans	-57.6	-45.6	177.6	-62.8	-18.5	0	0	0	110.2	Y382 L386 T387 Y388 R402	Y382-D384 PolarHBondContact O-N 3.49Å; D384-L386 PolarHBondContact O-N 3.4Å; D384-T387 PolarHBondContact O-N 3.39Å; D384-T387 PolarHBondContact O-OG1 3.19Å; D384-Y388 VanDerWaalsContact C-CD2 3.41Å; D384-Y388 HydrophobicContact CB-CD2 4.32Å; D384-Y388 HydrophobicContact CB-CE2 3.68Å; D384-Y388 WeakPolarHBondContact O-CD2 3.11Å; D384-Y388 WeakPolarHBondContact O-CE2 3.34Å; D384-Y388 PolarHBondContact O-N 3.09Å; D384-R402 IonicContact OD1-NH2 3.73Å
385	T	87.1	Confident	86.9	Confident	11 Å²	11	51.2 Å²	51.2	7%	0.067	28%	0.281	C	S	.	.	H	α-helix	trans	-62.4	-43.2	179.2	-58.7	0	0	0	0	113.3	T277 I280 Y381 Y382 V383 T387 Y388 L389	T277-T385 HydrophobicContact CG2-CG2 3.4Å; I280-T385 HydrophobicContact CD1-CG2 4.35Å; I280-T385 WeakPolarHBondContact CD1-OG1 3.32Å; Y381-T385 WeakPolarHBondContact O-CB 3.43Å; Y381-T385 PolarHBondContact O-N 3.49Å; Y381-T385 PolarHBondContact O-OG1 3.08Å; Y382-T385 PolarHBondContact O-N 2.92Å; V383-T385 VanDerWaalsContact C-N 3.28Å; V383-T385 PolarHBondContact O-N 2.9Å; T385-T387 VanDerWaalsContact C-N 3.3Å; T385-T387 PolarHBondContact O-N 3.01Å; T385-Y388 PolarHBondContact O-N 3.19Å; T385-L389 HydrophobicContact CG2-CD1 4.09Å; T385-L389 HydrophobicContact CG2-CG 4.49Å; T385-L389 WeakPolarHBondContact O-CB 3.24Å; T385-L389 VanDerWaalsContact O-CG 3.31Å; T385-L389 WeakPolarHBondContact O-CG 3.28Å; T385-L389 PolarHBondContact O-N 3.04Å
386	L	88.4	Confident	86.4	Confident	41 Å²	41	54.6 Å²	54.6	22%	0.215	30%	0.297	C	S	.	.	H	α-helix	trans	-64.7	-35.3	176.7	-71.9	172.1	0	0	0	111.8	Y382 V383 D384 G390 V391 I392 F405	Y382-L386 WeakPolarHBondContact O-CB 3.41Å; Y382-L386 VanDerWaalsContact O-CG 3.27Å; Y382-L386 WeakPolarHBondContact O-CG 3.42Å; Y382-L386 PolarHBondContact O-N 3.35Å; V383-L386 PolarHBondContact O-N 3.43Å; D384-L386 PolarHBondContact O-N 3.4Å; L386-G390 PolarHBondContact O-N 2.77Å; L386-V391 HydrophobicContact CB-CB 4.45Å; L386-V391 HydrophobicContact CD2-CB 4.12Å; L386-V391 HydrophobicContact CD2-CG1 4.27Å; L386-V391 HydrophobicContact CD2-CG2 4.12Å; L386-V391 PolarHBondContact O-N 3.14Å; L386-I392 HydrophobicContact CB-CD1 4.03Å; L386-I392 HydrophobicContact CB-CG1 4.26Å; L386-I392 HydrophobicContact CD1-CD1 3.99Å; L386-F405 HydrophobicContact CD1-CE2 4.3Å
387	T	89.1	Confident	86.2	Confident	37 Å²	37	55.6 Å²	55.6	23%	0.227	31%	0.308	C	S	.	.	H	α-helix	trans	-67.8	-40.1	172.7	65.9	0	0	0	0	111.8	V383 D384 T385 L389 G390 I398	V383-T387 WeakPolarHBondContact O-CG2 3.4Å; V383-T387 PolarHBondContact O-N 3.41Å; D384-T387 PolarHBondContact O-N 3.39Å; D384-T387 PolarHBondContact O-OG1 3.19Å; T385-T387 VanDerWaalsContact C-N 3.3Å; T385-T387 PolarHBondContact O-N 3.01Å; T387-L389 VanDerWaalsContact C-N 3.33Å; T387-L389 PolarHBondContact O-N 2.85Å; T387-G390 PolarHBondContact O-N 3.03Å; T387-I398 HydrophobicContact CG2-CD1 3.61Å; T387-I398 HydrophobicContact CG2-CG1 3.6Å; T387-I398 HydrophobicContact CG2-CG2 4.32Å
388	Y	85.8	Confident	86.1	Confident	92 Å²	92	54.5 Å²	54.5	36%	0.361	30%	0.303	S	S	.	.	H	α-helix	trans	-70.8	-27.6	179.7	-59.3	-41.2	0	0	0	114.3	V267 K273 L276 D384 T385 G390	V267-Y388 HydrophobicContact CB-CD2 4.25Å; V267-Y388 HydrophobicContact CB-CE1 4.48Å; V267-Y388 HydrophobicContact CB-CE2 4.07Å; V267-Y388 HydrophobicContact CG1-CD1 3.5Å; V267-Y388 HydrophobicContact CG1-CD2 3.25Å; V267-Y388 HydrophobicContact CG1-CE1 3.75Å; V267-Y388 HydrophobicContact CG1-CE2 3.52Å; V267-Y388 HydrophobicContact CG1-CG 3.24Å; V267-Y388 HydrophobicContact CG2-CD2 4.03Å; V267-Y388 HydrophobicContact CG2-CE2 3.62Å; K273-Y388 PolarHBondContact NZ-O 3.5Å; L276-Y388 HydrophobicContact CD2-CD2 4.37Å; L276-Y388 HydrophobicContact CD2-CE2 4.36Å; D384-Y388 VanDerWaalsContact C-CD2 3.41Å; D384-Y388 HydrophobicContact CB-CD2 4.32Å; D384-Y388 HydrophobicContact CB-CE2 3.68Å; D384-Y388 WeakPolarHBondContact O-CD2 3.11Å; D384-Y388 WeakPolarHBondContact O-CE2 3.34Å; D384-Y388 PolarHBondContact O-N 3.09Å; T385-Y388 PolarHBondContact O-N 3.19Å; Y388-G390 VanDerWaalsContact C-N 3.31Å
389	L	85.6	Confident	86	Confident	105 Å²	105	59 Å²	59	55%	0.55	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-10.2	171	-68.4	174.6	0	0	0	112.8	T277 T385 T387 V391	T277-L389 HydrophobicContact CG2-CD1 4.11Å; T277-L389 HydrophobicContact CG2-CD2 4.18Å; T277-L389 HydrophobicContact CG2-CG 4.32Å; T385-L389 HydrophobicContact CG2-CD1 4.09Å; T385-L389 HydrophobicContact CG2-CG 4.49Å; T385-L389 WeakPolarHBondContact O-CB 3.24Å; T385-L389 VanDerWaalsContact O-CG 3.31Å; T385-L389 WeakPolarHBondContact O-CG 3.28Å; T385-L389 PolarHBondContact O-N 3.04Å; T387-L389 VanDerWaalsContact C-N 3.33Å; T387-L389 PolarHBondContact O-N 2.85Å; L389-V391 HydrophobicContact CB-CG2 4.17Å
390	G	83.6	Confident	85.8	Confident	45 Å²	45	59.4 Å²	59.4	46%	0.464	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	16.2	179.5	0	0	0	0	0	114.7	L386 T387 Y388	L386-G390 PolarHBondContact O-N 2.77Å; T387-G390 PolarHBondContact O-N 3.03Å; Y388-G390 VanDerWaalsContact C-N 3.31Å
391	V	86	Confident	85.9	Confident	100 Å²	100	56.9 Å²	56.9	61%	0.606	32%	0.318	S	S	*	.	S	Bend	trans	-72.7	-41.9	179	179.9	0	0	0	0	110.8	L386 L389	L386-V391 HydrophobicContact CB-CB 4.45Å; L386-V391 HydrophobicContact CD2-CB 4.12Å; L386-V391 HydrophobicContact CD2-CG1 4.27Å; L386-V391 HydrophobicContact CD2-CG2 4.12Å; L386-V391 PolarHBondContact O-N 3.14Å; L389-V391 HydrophobicContact CB-CG2 4.17Å
392	I	84.2	Confident	86	Confident	35 Å²	35	59.9 Å²	59.9	18%	0.179	33%	0.328	C	S	.	.			trans	-112	115.4	178.5	-54	175.2	0	0	0	108.3	L386 I398 A401	L386-I392 HydrophobicContact CB-CD1 4.03Å; L386-I392 HydrophobicContact CB-CG1 4.26Å; L386-I392 HydrophobicContact CD1-CD1 3.99Å; I392-I398 HydrophobicContact CB-CG1 4.5Å; I392-I398 HydrophobicContact CG2-CG1 3.7Å; I392-A401 HydrophobicContact CD1-CB 3.94Å
393	T	83.1	Confident	86	Confident	104 Å²	104	58.2 Å²	58.2	64%	0.638	32%	0.323	S	S	*	.			trans	-114	-10.5	-179	59.9	0	0	0	0	113.8
394	S	79.7	Confident	86	Confident	61 Å²	61	61.7 Å²	61.7	43%	0.427	34%	0.344	S	S	.	.			trans	-91.8	133.5	-178.6	177.1	0	0	0	0	110.5	Q396 G397 I398	S394-Q396 VanDerWaalsContact C-N 3.3Å; S394-Q396 PolarHBondContact O-N 2.8Å; S394-G397 CarbonylContact O-C 3.55Å; S394-G397 WeakPolarHBondContact O-CA 3.4Å; S394-G397 PolarHBondContact O-N 3.02Å; S394-I398 WeakPolarHBondContact O-CG1 3.47Å; S394-I398 PolarHBondContact O-N 3.08Å
395	N	83.4	Confident	86.1	Confident	125 Å²	125	61.9 Å²	61.9	67%	0.668	34%	0.343	S	S	*	.	H	α-helix	trans	-58	-42.7	176.5	-72.2	-10.8	0	0	0	111.8	G397 I398 Q399	N395-G397 VanDerWaalsContact C-N 3.28Å; N395-G397 PolarHBondContact O-N 3.25Å; N395-I398 PolarHBondContact O-N 2.82Å; N395-Q399 WeakPolarHBondContact O-CG 3.42Å; N395-Q399 PolarHBondContact O-N 3Å
396	Q	79.3	Confident	86.2	Confident	76 Å²	76	62.9 Å²	62.9	36%	0.355	35%	0.349	S	S	.	.	H	α-helix	trans	-63.4	-36.7	174.8	-69.8	174.2	-17.1	0	0	111.6	S394 S400	S394-Q396 VanDerWaalsContact C-N 3.3Å; S394-Q396 PolarHBondContact O-N 2.8Å; Q396-S400 WeakPolarHBondContact O-CB 3.1Å; Q396-S400 PolarHBondContact O-N 3.24Å; Q396-S400 PolarHBondContact O-OG 3.35Å
397	G	83.8	Confident	86.2	Confident	22 Å²	22	62.6 Å²	62.6	23%	0.227	35%	0.347	C	S	.	.	H	α-helix	trans	-64.9	-39.8	173.9	0	0	0	0	0	112.6	S394 N395 S400 A401	S394-G397 CarbonylContact O-C 3.55Å; S394-G397 WeakPolarHBondContact O-CA 3.4Å; S394-G397 PolarHBondContact O-N 3.02Å; N395-G397 VanDerWaalsContact C-N 3.28Å; N395-G397 PolarHBondContact O-N 3.25Å; G397-S400 WeakPolarHBondContact CA-OG 3.39Å; G397-S400 PolarHBondContact O-OG 3.24Å; G397-S400 VanDerWaalsContact O-OG 3.12Å; G397-A401 WeakPolarHBondContact O-CB 3.11Å; G397-A401 PolarHBondContact O-N 2.92Å
398	I	87.2	Confident	86.3	Confident	40 Å²	40	63.8 Å²	63.8	21%	0.205	35%	0.35	C	S	.	.	H	α-helix	trans	-68	-45.6	177.2	-63.9	171.3	0	0	0	110.4	V383 T387 I392 S394 N395 R402	V383-I398 HydrophobicContact CG1-CG2 4Å; T387-I398 HydrophobicContact CG2-CD1 3.61Å; T387-I398 HydrophobicContact CG2-CG1 3.6Å; T387-I398 HydrophobicContact CG2-CG2 4.32Å; I392-I398 HydrophobicContact CB-CG1 4.5Å; I392-I398 HydrophobicContact CG2-CG1 3.7Å; S394-I398 WeakPolarHBondContact O-CG1 3.47Å; S394-I398 PolarHBondContact O-N 3.08Å; N395-I398 PolarHBondContact O-N 2.82Å; I398-R402 VanDerWaalsContact O-CB 3.3Å; I398-R402 WeakPolarHBondContact O-CB 3.49Å; I398-R402 PolarHBondContact O-N 3.08Å
399	Q	87	Confident	86.5	Confident	101 Å²	101	59.5 Å²	59.5	47%	0.472	33%	0.333	S	S	.	.	H	α-helix	trans	-62.6	-50.8	178.5	-74.8	175.4	-21.4	0	0	111.7	N395 A401 R402 I403	N395-Q399 WeakPolarHBondContact O-CG 3.42Å; N395-Q399 PolarHBondContact O-N 3Å; Q399-A401 PolarHBondContact O-N 3.1Å; Q399-R402 PolarHBondContact O-N 3.01Å; Q399-I403 WeakPolarHBondContact O-CG1 3.41Å; Q399-I403 PolarHBondContact O-N 3.23Å
400	S	86.6	Confident	86.6	Confident	31 Å²	31	56.9 Å²	56.9	22%	0.217	32%	0.319	C	S	.	.	H	α-helix	trans	-61.3	-43.9	177.4	53.5	0	0	0	0	112.3	Q396 G397 R402 I403 V404	Q396-S400 WeakPolarHBondContact O-CB 3.1Å; Q396-S400 PolarHBondContact O-N 3.24Å; Q396-S400 PolarHBondContact O-OG 3.35Å; G397-S400 WeakPolarHBondContact CA-OG 3.39Å; G397-S400 PolarHBondContact O-OG 3.24Å; G397-S400 VanDerWaalsContact O-OG 3.12Å; S400-R402 VanDerWaalsContact C-N 3.34Å; S400-R402 PolarHBondContact O-N 3.27Å; S400-I403 PolarHBondContact O-N 3.29Å; S400-V404 VanDerWaalsContact O-CG2 3.31Å; S400-V404 WeakPolarHBondContact O-CG2 3.47Å; S400-V404 PolarHBondContact O-N 3.11Å
401	A	88.7	Confident	87	Confident	14 Å²	14	57.5 Å²	57.5	12%	0.116	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-43.2	175	0	0	0	0	0	111.6	V383 I392 G397 Q399 I403 V404 F405	V383-A401 HydrophobicContact CG1-CB 4.47Å; V383-A401 HydrophobicContact CG2-CB 4.09Å; I392-A401 HydrophobicContact CD1-CB 3.94Å; G397-A401 WeakPolarHBondContact O-CB 3.11Å; G397-A401 PolarHBondContact O-N 2.92Å; Q399-A401 PolarHBondContact O-N 3.1Å; A401-I403 PolarHBondContact O-N 3.26Å; A401-V404 PolarHBondContact O-N 3.12Å; A401-F405 HydrophobicContact CB-CD2 4.36Å; A401-F405 WeakPolarHBondContact O-CB 3.41Å; A401-F405 WeakPolarHBondContact O-CD2 3.35Å; A401-F405 PolarHBondContact O-N 3.28Å
402	R	90.9	Very high	87.3	Confident	117 Å²	117	53.5 Å²	53.5	44%	0.442	28%	0.282	S	S	.	.	H	α-helix	trans	-59	-46.8	176.2	-174.1	174.2	-79.1	178.7	-5.8	111.7	V383 D384 I398 Q399 S400 V404 T406	V383-R402 HydrophobicContact CG1-CB 4.4Å; V383-R402 HydrophobicContact CG2-CB 4.47Å; D384-R402 IonicContact OD1-NH2 3.73Å; I398-R402 VanDerWaalsContact O-CB 3.3Å; I398-R402 WeakPolarHBondContact O-CB 3.49Å; I398-R402 PolarHBondContact O-N 3.08Å; Q399-R402 PolarHBondContact O-N 3.01Å; S400-R402 VanDerWaalsContact C-N 3.34Å; S400-R402 PolarHBondContact O-N 3.27Å; R402-V404 PolarHBondContact O-N 3.49Å; R402-T406 VanDerWaalsContact O-CB 3.28Å; R402-T406 WeakPolarHBondContact O-CB 3.42Å; R402-T406 PolarHBondContact O-N 2.97Å; R402-T406 PolarHBondContact O-OG1 2.9Å
403	I	89.8	Confident	87.7	Confident	19 Å²	19	52.4 Å²	52.4	10%	0.097	28%	0.278	C	S	.	.	H	α-helix	trans	-60.5	-48.2	177.6	-64.4	165.7	0	0	0	110.7	Q399 S400 A401 T406 L407 F483 E486 L487	Q399-I403 WeakPolarHBondContact O-CG1 3.41Å; Q399-I403 PolarHBondContact O-N 3.23Å; S400-I403 PolarHBondContact O-N 3.29Å; A401-I403 PolarHBondContact O-N 3.26Å; I403-T406 PolarHBondContact O-N 3.25Å; I403-L407 HydrophobicContact CG2-CD1 4.12Å; I403-L407 WeakPolarHBondContact O-CG 3.34Å; I403-L407 PolarHBondContact O-N 3.17Å; I403-F483 HydrophobicContact CG2-CB 3.54Å; I403-F483 HydrophobicContact CG2-CD1 4.44Å; I403-F483 HydrophobicContact CG2-CD2 3.89Å; I403-F483 HydrophobicContact CG2-CG 3.71Å; I403-E486 HydrophobicContact CD1-CB 4.28Å; I403-E486 HydrophobicContact CD1-CG 3.97Å; I403-L487 HydrophobicContact CB-CD2 4.18Å; I403-L487 HydrophobicContact CB-CG 4.3Å; I403-L487 HydrophobicContact CD1-CD2 4.49Å; I403-L487 HydrophobicContact CD1-CG 4.43Å; I403-L487 HydrophobicContact CG2-CD1 3.68Å; I403-L487 HydrophobicContact CG2-CD2 4.12Å; I403-L487 HydrophobicContact CG2-CG 3.73Å
404	V	89	Confident	88.1	Confident	76 Å²	76	47.7 Å²	47.7	46%	0.461	25%	0.249	S	C	.	.	H	α-helix	trans	-62.5	-47.9	-178.9	172.3	0	0	0	0	112	S400 A401 R402 L407 F408 L487	S400-V404 VanDerWaalsContact O-CG2 3.31Å; S400-V404 WeakPolarHBondContact O-CG2 3.47Å; S400-V404 PolarHBondContact O-N 3.11Å; A401-V404 PolarHBondContact O-N 3.12Å; R402-V404 PolarHBondContact O-N 3.49Å; V404-L407 PolarHBondContact O-N 2.93Å; V404-F408 WeakPolarHBondContact O-CB 3.48Å; V404-F408 PolarHBondContact O-N 3.22Å; V404-L487 HydrophobicContact CG2-CD1 4.49Å; V404-L487 HydrophobicContact CG2-CD2 4.02Å
405	F	90.8	Very high	88.7	Confident	47 Å²	47	44.8 Å²	44.8	21%	0.206	23%	0.229	C	C	.	.	H	α-helix	trans	-68.4	-33.4	179.5	-80.7	-69.9	0	0	0	112.4	F379 Y382 V383 L386 A401 T409	F379-F405 HydrophobicContact CB-CD1 4.15Å; F379-F405 HydrophobicContact CD1-CD1 4.17Å; F379-F405 HydrophobicContact CD1-CE1 4.16Å; Y382-F405 HydrophobicContact CG-CE1 4.29Å; Y382-F405 HydrophobicContact CG-CZ 4.49Å; V383-F405 HydrophobicContact CG2-CB 4.13Å; V383-F405 HydrophobicContact CG2-CD2 3.44Å; V383-F405 VanDerWaalsContact CG2-CD2 3.44Å; V383-F405 HydrophobicContact CG2-CE2 4.21Å; V383-F405 HydrophobicContact CG2-CG 4.11Å; L386-F405 HydrophobicContact CD1-CE2 4.3Å; A401-F405 HydrophobicContact CB-CD2 4.36Å; A401-F405 WeakPolarHBondContact O-CB 3.41Å; A401-F405 WeakPolarHBondContact O-CD2 3.35Å; A401-F405 PolarHBondContact O-N 3.28Å; F405-T409 WeakPolarHBondContact O-CB 3.41Å; F405-T409 PolarHBondContact O-N 3.1Å; F405-T409 PolarHBondContact O-OG1 2.57Å
406	T	88.3	Confident	89	Confident	32 Å²	32	38.8 Å²	38.8	20%	0.196	20%	0.197	C	C	.	.	H	α-helix	trans	-66.8	-47.9	174.3	-61.7	0	0	0	0	111.6	L380 R402 I403 F408 T409 I410 F483	L380-T406 HydrophobicContact CD2-CG2 4.38Å; R402-T406 VanDerWaalsContact O-CB 3.28Å; R402-T406 WeakPolarHBondContact O-CB 3.42Å; R402-T406 PolarHBondContact O-N 2.97Å; R402-T406 PolarHBondContact O-OG1 2.9Å; I403-T406 PolarHBondContact O-N 3.25Å; T406-F408 VanDerWaalsContact C-N 3.31Å; T406-F408 PolarHBondContact O-N 2.96Å; T406-T409 PolarHBondContact O-N 3.32Å; T406-T409 VanDerWaalsContact O-N 3.15Å; T406-I410 HydrophobicContact CG2-CD1 3.96Å; T406-I410 WeakPolarHBondContact O-CG1 3.28Å; T406-I410 PolarHBondContact O-N 3.32Å; T406-F483 HydrophobicContact CG2-CE2 3.92Å; T406-F483 HydrophobicContact CG2-CZ 4.5Å
407	L	88.4	Confident	89.6	Confident	35 Å²	35	37.9 Å²	37.9	18%	0.183	19%	0.194	C	C	.	.	H	α-helix	trans	-57.7	-45.5	175.1	-75.3	173.6	0	0	0	111.6	I403 V404 T409 I410 W411 V479 F483 L487	I403-L407 HydrophobicContact CG2-CD1 4.12Å; I403-L407 WeakPolarHBondContact O-CG 3.34Å; I403-L407 PolarHBondContact O-N 3.17Å; V404-L407 PolarHBondContact O-N 2.93Å; L407-T409 VanDerWaalsContact C-N 3.31Å; L407-T409 PolarHBondContact O-N 3.18Å; L407-I410 PolarHBondContact O-N 3.19Å; L407-W411 WeakPolarHBondContact O-CB 3.4Å; L407-W411 PolarHBondContact O-N 3.43Å; L407-V479 HydrophobicContact CD2-CG1 3.68Å; L407-F483 HydrophobicContact CD1-CB 4.2Å; L407-F483 HydrophobicContact CD1-CD2 4.38Å; L407-F483 HydrophobicContact CD2-CB 4.43Å; L407-F483 HydrophobicContact CD2-CD2 3.73Å; L407-F483 HydrophobicContact CG-CB 4.48Å; L407-F483 HydrophobicContact CG-CD2 3.8Å; L407-L487 HydrophobicContact CD1-CD1 4.31Å
408	F	90.6	Very high	89.9	Confident	62 Å²	62	36.9 Å²	36.9	27%	0.272	18%	0.183	S	C	.	.	H	α-helix	trans	-61.8	-39.7	177.3	-172.4	-101.9	0	0	0	112.2	F379 V404 T406 W411 M412	F379-F408 HydrophobicContact CD1-CE1 4.48Å; F379-F408 AromaticContact CD2-CD1 3.77Å; F379-F408 HydrophobicContact CD2-CD1 3.77Å; F379-F408 AromaticContact CD2-CE1 3.68Å; F379-F408 HydrophobicContact CD2-CE1 3.68Å; F379-F408 HydrophobicContact CE1-CE1 4.29Å; F379-F408 HydrophobicContact CE2-CD1 4.08Å; F379-F408 AromaticContact CE2-CE1 3.49Å; F379-F408 HydrophobicContact CE2-CE1 3.49Å; F379-F408 VanDerWaalsContact CE2-CE1 3.49Å; F379-F408 HydrophobicContact CG-CD1 4.05Å; F379-F408 HydrophobicContact CG-CE1 4.23Å; F379-F408 AromaticContact CZ-CE1 3.81Å; F379-F408 HydrophobicContact CZ-CE1 3.81Å; V404-F408 WeakPolarHBondContact O-CB 3.48Å; V404-F408 PolarHBondContact O-N 3.22Å; T406-F408 VanDerWaalsContact C-N 3.31Å; T406-F408 PolarHBondContact O-N 2.96Å; F408-W411 AromaticContact CD2-CE3 3.93Å; F408-W411 HydrophobicContact CD2-CE3 3.93Å; F408-W411 HydrophobicContact CD2-CZ3 4.11Å; F408-W411 HydrophobicContact CE2-CE3 4.19Å; F408-W411 HydrophobicContact CE2-CZ3 4.04Å; F408-W411 PolarHBondContact O-N 3.43Å; F408-M412 HydrophobicContact CD1-CG 4.13Å; F408-M412 HydrophobicContact CD2-CE 4.1Å; F408-M412 HydrophobicContact CE1-CE 4.32Å; F408-M412 HydrophobicContact CE1-CG 3.79Å; F408-M412 HydrophobicContact CE2-CE 3.3Å; F408-M412 HydrophobicContact CE2-CG 4.26Å; F408-M412 HydrophobicContact CZ-CE 3.44Å; F408-M412 VanDerWaalsContact CZ-CE 3.44Å; F408-M412 HydrophobicContact CZ-CG 3.87Å; F408-M412 HydrophobicContact CZ-SD 4.29Å; F408-M412 WeakPolarHBondContact O-CB 3.42Å; F408-M412 VanDerWaalsContact O-CG 3.27Å; F408-M412 WeakPolarHBondContact O-CG 3.31Å; F408-M412 PolarHBondContact O-N 3.26Å
409	T	90.2	Very high	90	Very high	2 Å²	2	35 Å²	35	1%	0.012	17%	0.174	C	C	.	.	H	α-helix	trans	-65.7	-48.1	177.6	-57.4	0	0	0	0	111.6	M377 F379 L380 F405 T406 L407 W411 M412 V413	M377-T409 HydrophobicContact CG-CG2 4.26Å; M377-T409 HydrophobicContact SD-CG2 3.33Å; M377-T409 WeakPolarHBondContact SD-CG2 3.27Å; F379-T409 WeakPolarHBondContact CB-OG1 3.18Å; L380-T409 HydrophobicContact CD1-CG2 4.37Å; L380-T409 HydrophobicContact CD2-CG2 4.37Å; L380-T409 HydrophobicContact CG-CG2 4.07Å; F405-T409 WeakPolarHBondContact O-CB 3.41Å; F405-T409 PolarHBondContact O-N 3.1Å; F405-T409 PolarHBondContact O-OG1 2.57Å; T406-T409 PolarHBondContact O-N 3.32Å; T406-T409 VanDerWaalsContact O-N 3.15Å; L407-T409 VanDerWaalsContact C-N 3.31Å; L407-T409 PolarHBondContact O-N 3.18Å; T409-W411 VanDerWaalsContact C-N 3.27Å; T409-W411 PolarHBondContact O-N 3.46Å; T409-M412 PolarHBondContact O-N 3.06Å; T409-V413 HydrophobicContact CG2-CG2 4.04Å; T409-V413 WeakPolarHBondContact O-CB 3.39Å; T409-V413 VanDerWaalsContact O-CG2 3.28Å; T409-V413 WeakPolarHBondContact O-CG2 3.3Å; T409-V413 PolarHBondContact O-N 2.67Å
410	I	88.8	Confident	90.1	Very high	50 Å²	50	31.2 Å²	31.2	26%	0.256	16%	0.157	S	C	.	.	H	α-helix	trans	-58.3	-43.3	178.2	-68	167.7	0	0	0	110.1	T406 L407 G414 F472 V479	T406-I410 HydrophobicContact CG2-CD1 3.96Å; T406-I410 WeakPolarHBondContact O-CG1 3.28Å; T406-I410 PolarHBondContact O-N 3.32Å; L407-I410 PolarHBondContact O-N 3.19Å; I410-G414 PolarHBondContact O-N 3.13Å; I410-F472 HydrophobicContact CG2-CE2 4.26Å; I410-V479 HydrophobicContact CD1-CG1 4.02Å; I410-V479 HydrophobicContact CD1-CG2 4.4Å
411	W	91	Very high	90.2	Very high	58 Å²	58	31 Å²	31	22%	0.22	15%	0.154	C	C	.	.	H	α-helix	trans	-62.6	-49.9	176.6	176.7	34	0	0	0	112.5	L407 F408 T409 S415 C443 L447	L407-W411 WeakPolarHBondContact O-CB 3.4Å; L407-W411 PolarHBondContact O-N 3.43Å; F408-W411 AromaticContact CD2-CE3 3.93Å; F408-W411 HydrophobicContact CD2-CE3 3.93Å; F408-W411 HydrophobicContact CD2-CZ3 4.11Å; F408-W411 HydrophobicContact CE2-CE3 4.19Å; F408-W411 HydrophobicContact CE2-CZ3 4.04Å; F408-W411 PolarHBondContact O-N 3.43Å; T409-W411 VanDerWaalsContact C-N 3.27Å; T409-W411 PolarHBondContact O-N 3.46Å; W411-S415 WeakPolarHBondContact O-CB 3.42Å; W411-S415 PolarHBondContact O-N 3.31Å; W411-S415 PolarHBondContact O-OG 2.57Å; W411-C443 HydrophobicContact CZ2-CB 4.22Å; W411-C443 PolarHBondContact NE1-O 3.44Å; W411-L447 HydrophobicContact CZ2-CB 4.21Å; W411-L447 HydrophobicContact CZ2-CD1 4.35Å; W411-L447 HydrophobicContact CZ2-CD2 4.17Å; W411-L447 HydrophobicContact CZ2-CG 4.49Å
412	M	92.7	Very high	90.1	Very high	16 Å²	16	31 Å²	31	8%	0.079	15%	0.151	C	C	.	.	H	α-helix	trans	-68.6	-40	-176.8	-69.5	-60.6	159.7	0	0	113.2	W287 F408 T409 G416 Y439	W287-M412 HydrophobicContact CH2-SD 4.49Å; W287-M412 HydrophobicContact CZ2-CG 4.29Å; W287-M412 HydrophobicContact CZ2-SD 3.77Å; F408-M412 HydrophobicContact CD1-CG 4.13Å; F408-M412 HydrophobicContact CD2-CE 4.1Å; F408-M412 HydrophobicContact CE1-CE 4.32Å; F408-M412 HydrophobicContact CE1-CG 3.79Å; F408-M412 HydrophobicContact CE2-CE 3.3Å; F408-M412 HydrophobicContact CE2-CG 4.26Å; F408-M412 HydrophobicContact CZ-CE 3.44Å; F408-M412 VanDerWaalsContact CZ-CE 3.44Å; F408-M412 HydrophobicContact CZ-CG 3.87Å; F408-M412 HydrophobicContact CZ-SD 4.29Å; F408-M412 WeakPolarHBondContact O-CB 3.42Å; F408-M412 VanDerWaalsContact O-CG 3.27Å; F408-M412 WeakPolarHBondContact O-CG 3.31Å; F408-M412 PolarHBondContact O-N 3.26Å; T409-M412 PolarHBondContact O-N 3.06Å; M412-G416 PolarHBondContact O-N 2.99Å; M412-G416 VanDerWaalsContact O-N 3.14Å; M412-Y439 PolarHBondContact O-OH 3.05Å; M412-Y439 VanDerWaalsContact O-OH 3.07Å
413	V	91.3	Very high	89.7	Confident	13 Å²	13	27.1 Å²	27.1	8%	0.079	14%	0.138	C	C	.	.	H	α-helix	trans	-68.7	-47.4	175.8	175.3	0	0	0	0	110.3	S376 M377 T409 S415 G416 I417	S376-V413 WeakPolarHBondContact OG-CG2 3.11Å; M377-V413 HydrophobicContact CE-CG1 4.37Å; M377-V413 HydrophobicContact CE-CG2 4.17Å; M377-V413 HydrophobicContact CG-CG2 3.68Å; M377-V413 HydrophobicContact SD-CG2 3.85Å; T409-V413 HydrophobicContact CG2-CG2 4.04Å; T409-V413 WeakPolarHBondContact O-CB 3.39Å; T409-V413 VanDerWaalsContact O-CG2 3.28Å; T409-V413 WeakPolarHBondContact O-CG2 3.3Å; T409-V413 PolarHBondContact O-N 2.67Å; V413-S415 VanDerWaalsContact C-N 3.26Å; V413-S415 PolarHBondContact O-N 3.38Å; V413-G416 PolarHBondContact O-N 3.23Å; V413-G416 VanDerWaalsContact O-N 3.08Å; V413-I417 HydrophobicContact CG1-CD1 4.06Å; V413-I417 HydrophobicContact CG1-CG1 4.49Å; V413-I417 WeakPolarHBondContact O-CG1 3.23Å; V413-I417 PolarHBondContact O-N 2.97Å
414	G	91.9	Very high	89.3	Confident	4 Å²	4	30.2 Å²	30.2	4%	0.041	15%	0.154	C	C	.	.	H	α-helix	trans	-56.3	-42.8	176.6	0	0	0	0	0	111.7	I410 G416 I417 M418 L446	I410-G414 PolarHBondContact O-N 3.13Å; G414-G416 VanDerWaalsContact C-N 3.3Å; G414-G416 PolarHBondContact O-N 3.48Å; G414-I417 PolarHBondContact O-N 3.16Å; G414-M418 WeakPolarHBondContact O-CB 3.47Å; G414-M418 PolarHBondContact O-N 2.85Å; G414-L446 VanDerWaalsContact O-CD1 3.3Å; G414-L446 WeakPolarHBondContact O-CD1 3.47Å
415	S	92.5	Very high	88.9	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-64.5	-36	178	-54.5	0	0	0	0	112.3	W411 V413 H419 C443 L446	W411-S415 WeakPolarHBondContact O-CB 3.42Å; W411-S415 PolarHBondContact O-N 3.31Å; W411-S415 PolarHBondContact O-OG 2.57Å; V413-S415 VanDerWaalsContact C-N 3.26Å; V413-S415 PolarHBondContact O-N 3.38Å; S415-H419 WeakPolarHBondContact O-CB 3.16Å; S415-H419 PolarHBondContact O-N 2.83Å; S415-C443 WeakPolarHBondContact CB-SG 3.49Å; S415-C443 WeakPolarHBondContact OG-CA 3.35Å; S415-C443 PolarHBondContact OG-SG 3.38Å; S415-C443 VanDerWaalsContact OG-SG 3.41Å; S415-L446 VanDerWaalsContact CA-CD1 3.45Å
416	G	90.3	Very high	88.5	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-69.5	-40.9	176.2	0	0	0	0	0	112.8	M412 V413 G414 H419 V420	M412-G416 PolarHBondContact O-N 2.99Å; M412-G416 VanDerWaalsContact O-N 3.14Å; V413-G416 PolarHBondContact O-N 3.23Å; V413-G416 VanDerWaalsContact O-N 3.08Å; G414-G416 VanDerWaalsContact C-N 3.3Å; G414-G416 PolarHBondContact O-N 3.48Å; G416-H419 PolarHBondContact O-N 3.3Å; G416-V420 WeakPolarHBondContact O-CG2 3.16Å; G416-V420 PolarHBondContact O-N 3.12Å; G416-V420 VanDerWaalsContact O-N 3.08Å
417	I	91.5	Very high	87.9	Confident	57 Å²	57	30.3 Å²	30.3	29%	0.292	15%	0.147	S	C	.	.	H	α-helix	trans	-61.5	-48.2	173.8	-64.5	170.9	0	0	0	109.7	F373 V413 G414 H419 V420 I421 F468	F373-I417 HydrophobicContact CE2-CG1 3.7Å; F373-I417 HydrophobicContact CZ-CG1 4.04Å; V413-I417 HydrophobicContact CG1-CD1 4.06Å; V413-I417 HydrophobicContact CG1-CG1 4.49Å; V413-I417 WeakPolarHBondContact O-CG1 3.23Å; V413-I417 PolarHBondContact O-N 2.97Å; G414-I417 PolarHBondContact O-N 3.16Å; I417-H419 PolarHBondContact O-N 2.85Å; I417-V420 PolarHBondContact O-N 3.45Å; I417-V420 VanDerWaalsContact O-N 3.17Å; I417-I421 HydrophobicContact CG2-CD1 3.6Å; I417-I421 HydrophobicContact CG2-CG1 4.27Å; I417-I421 WeakPolarHBondContact O-CG1 3.44Å; I417-I421 PolarHBondContact O-N 3.31Å; I417-F468 HydrophobicContact CB-CE2 4.07Å; I417-F468 HydrophobicContact CB-CZ 4.14Å; I417-F468 HydrophobicContact CD1-CE2 4.19Å; I417-F468 HydrophobicContact CG2-CD2 3.79Å; I417-F468 HydrophobicContact CG2-CE2 3.57Å; I417-F468 HydrophobicContact CG2-CG 4.42Å; I417-F468 HydrophobicContact CG2-CZ 4.04Å
418	M	90.5	Very high	87.5	Confident	0 Å²	0	35 Å²	35	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.7	-46	-180	-170.8	59.2	-155.1	0	0	112.3	G414 V420 I421 E422 W437 F445 L446 T460 F468 I469	G414-M418 WeakPolarHBondContact O-CB 3.47Å; G414-M418 PolarHBondContact O-N 2.85Å; M418-V420 VanDerWaalsContact C-N 3.3Å; M418-V420 PolarHBondContact O-N 3.36Å; M418-I421 PolarHBondContact O-N 3.37Å; M418-E422 HydrophobicContact CE-CG 3.36Å; M418-E422 WeakPolarHBondContact CE-OE1 3.26Å; M418-E422 PolarHBondContact O-N 2.82Å; M418-W437 HydrophobicContact CE-CE3 4.12Å; M418-W437 HydrophobicContact CE-CH2 3.93Å; M418-W437 HydrophobicContact CE-CZ3 3.36Å; M418-W437 HydrophobicContact CG-CZ3 4.27Å; M418-F445 HydrophobicContact CE-CE1 4.42Å; M418-L446 HydrophobicContact CB-CD1 4.12Å; M418-T460 HydrophobicContact CE-CG2 3.04Å; M418-T460 HydrophobicContact SD-CG2 4.35Å; M418-F468 HydrophobicContact CB-CE1 4.17Å; M418-F468 HydrophobicContact SD-CD1 3.82Å; M418-F468 HydrophobicContact SD-CE1 4.26Å; M418-I469 HydrophobicContact CE-CD1 4.49Å
419	H	89.6	Confident	86.8	Confident	1 Å²	1	36 Å²	36	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-61	-36.3	176.8	-179.6	-143.4	0	0	0	112.8	Y290 S415 G416 I417 H423 W437 Y439	Y290-H419 AromaticContact CZ-ND1 3.85Å; Y290-H419 PolarHBondContact OH-ND1 3.03Å; S415-H419 WeakPolarHBondContact O-CB 3.16Å; S415-H419 PolarHBondContact O-N 2.83Å; G416-H419 PolarHBondContact O-N 3.3Å; I417-H419 PolarHBondContact O-N 2.85Å; H419-H423 AromaticContact CD2-CE1 3.33Å; H419-H423 PolarHBondContact CD2-CE1 3.34Å; H419-H423 AromaticContact CD2-ND1 3.35Å; H419-H423 PolarHBondContact CD2-ND1 3.47Å; H419-H423 VanDerWaalsContact CD2-ND1 3.35Å; H419-H423 AromaticContact NE2-CE1 3.17Å; H419-H423 PolarHBondContact NE2-CE1 3.46Å; H419-H423 AromaticContact NE2-ND1 3.56Å; H419-H423 PolarHBondContact O-ND1 3.44Å; H419-W437 PolarHBondContact CD2-O 3.11Å; H419-W437 PolarHBondContact NE2-O 3.33Å; H419-Y439 HydrophobicContact CB-CD2 4.2Å; H419-Y439 AromaticContact ND1-CD2 3.87Å
420	V	87.8	Confident	85.7	Confident	22 Å²	22	44.3 Å²	44.3	13%	0.133	21%	0.214	C	C	.	.	H	α-helix	trans	-72.5	-43	175.5	170.5	0	0	0	0	111.3	P299 V300 F373 G416 I417 M418 H423 L424	P299-V420 HydrophobicContact CB-CG2 4.22Å; P299-V420 HydrophobicContact CG-CG2 4.05Å; V300-V420 HydrophobicContact CG2-CG1 4.11Å; F373-V420 HydrophobicContact CD1-CG2 4.24Å; F373-V420 HydrophobicContact CE1-CG2 3.78Å; G416-V420 WeakPolarHBondContact O-CG2 3.16Å; G416-V420 PolarHBondContact O-N 3.12Å; G416-V420 VanDerWaalsContact O-N 3.08Å; I417-V420 PolarHBondContact O-N 3.45Å; I417-V420 VanDerWaalsContact O-N 3.17Å; M418-V420 VanDerWaalsContact C-N 3.3Å; M418-V420 PolarHBondContact O-N 3.36Å; V420-H423 PolarHBondContact O-N 3.1Å; V420-L424 WeakPolarHBondContact O-CB 3.46Å; V420-L424 PolarHBondContact O-N 2.96Å
421	I	89.1	Confident	84.5	Confident	27 Å²	27	48.6 Å²	48.6	14%	0.138	23%	0.233	C	C	.	.	H	α-helix	trans	-62.9	-46.5	-178.6	-70.5	171.9	0	0	0	111.4	I417 M418 H423 L424 G425 L464 G465 F468	I417-I421 HydrophobicContact CG2-CD1 3.6Å; I417-I421 HydrophobicContact CG2-CG1 4.27Å; I417-I421 WeakPolarHBondContact O-CG1 3.44Å; I417-I421 PolarHBondContact O-N 3.31Å; M418-I421 PolarHBondContact O-N 3.37Å; I421-H423 PolarHBondContact O-N 3.03Å; I421-L424 PolarHBondContact O-N 2.77Å; I421-G425 PolarHBondContact O-N 3.2Å; I421-L464 HydrophobicContact CG2-CB 3.6Å; I421-G465 VanDerWaalsContact CG2-N 3.32Å; I421-F468 HydrophobicContact CD1-CB 3.84Å; I421-F468 HydrophobicContact CD1-CD2 4.33Å; I421-F468 HydrophobicContact CD1-CG 4.04Å
422	E	86.8	Confident	82.9	Confident	13 Å²	13	53 Å²	53	6%	0.061	26%	0.261	C	S	.	.	H	α-helix	trans	-67.3	-25.3	-179.5	-72.8	-63.6	139.6	0	0	113.2	M418 G435 W437 T460 S462	M418-E422 HydrophobicContact CE-CG 3.36Å; M418-E422 WeakPolarHBondContact CE-OE1 3.26Å; M418-E422 PolarHBondContact O-N 2.82Å; E422-G435 WeakPolarHBondContact O-CA 3.46Å; E422-W437 HydrophobicContact CG-CD2 4.14Å; E422-W437 HydrophobicContact CG-CE3 3.83Å; E422-W437 HydrophobicContact CG-CZ3 4.06Å; E422-T460 WeakPolarHBondContact OE1-CB 3.37Å; E422-T460 WeakPolarHBondContact OE1-CG2 3.2Å; E422-S462 PolarHBondContact OE1-OG 3.48Å
423	H	83.3	Confident	81.3	Confident	35 Å²	35	55.6 Å²	55.6	16%	0.162	27%	0.273	C	S	.	.	H	α-helix	trans	-84.2	-32.3	172.7	-78.7	103.3	0	0	0	113.8	P298 P299 H419 V420 I421 G425 W437	P298-H423 VanDerWaalsContact CB-CD2 3.44Å; P298-H423 WeakPolarHBondContact CB-CD2 3.13Å; P299-H423 WeakPolarHBondContact CD-ND1 3.21Å; P299-H423 HydrophobicContact CG-CB 4.23Å; H419-H423 AromaticContact CD2-CE1 3.33Å; H419-H423 PolarHBondContact CD2-CE1 3.34Å; H419-H423 AromaticContact CD2-ND1 3.35Å; H419-H423 PolarHBondContact CD2-ND1 3.47Å; H419-H423 VanDerWaalsContact CD2-ND1 3.35Å; H419-H423 AromaticContact NE2-CE1 3.17Å; H419-H423 PolarHBondContact NE2-CE1 3.46Å; H419-H423 AromaticContact NE2-ND1 3.56Å; H419-H423 PolarHBondContact O-ND1 3.44Å; V420-H423 PolarHBondContact O-N 3.1Å; I421-H423 PolarHBondContact O-N 3.03Å; H423-G425 VanDerWaalsContact C-N 3.33Å; H423-W437 PolarHBondContact CE1-O 3.22Å
424	L	81.9	Confident	79.9	Confident	84 Å²	84	66 Å²	66	44%	0.44	31%	0.311	S	S	.	.	H	α-helix	trans	-69.1	-37	174.8	-171	73.3	0	0	0	110.7	V300 V420 I421 L464	V300-L424 HydrophobicContact CG1-CD1 4.43Å; V420-L424 WeakPolarHBondContact O-CB 3.46Å; V420-L424 PolarHBondContact O-N 2.96Å; I421-L424 PolarHBondContact O-N 2.77Å; L424-L464 HydrophobicContact CD2-CD1 4.46Å
425	G	79.8	Confident	78.6	Confident	1 Å²	1	67 Å²	67	1%	0.01	32%	0.321	C	S	.	.			trans	63.3	-163.4	-172.2	0	0	0	0	0	112.1	I421 H423 F427	I421-G425 PolarHBondContact O-N 3.2Å; H423-G425 VanDerWaalsContact C-N 3.33Å; G425-F427 PolarHBondContact O-N 2.65Å
426	D	81.9	Confident	77.8	Confident	10 Å²	10	72.3 Å²	72.3	5%	0.053	35%	0.353	C	S	.	.			trans	-81.9	96.8	176.2	-65.2	-28.9	0	0	0	109.1	W428 L429 T463 L464	D426-W428 HydrophobicContact CB-CD2 4.29Å; D426-W428 HydrophobicContact CB-CZ2 4.25Å; D426-W428 PolarHBondContact O-N 2.77Å; D426-L429 HydrophobicContact CB-CB 4.27Å; D426-L429 HydrophobicContact CB-CD1 3.86Å; D426-L429 HydrophobicContact CB-CG 4.27Å; D426-L429 PolarHBondContact O-N 3.47Å; D426-T463 PolarHBondContact OD1-N 2.95Å; D426-T463 PolarHBondContact OD1-OG1 3.15Å; D426-T463 WeakPolarHBondContact OD2-CG2 3.08Å; D426-T463 PolarHBondContact OD2-N 3.23Å; D426-T463 PolarHBondContact OD2-OG1 3.02Å; D426-L464 PolarHBondContact OD1-N 3.32Å
427	F	75.8	Confident	77.5	Confident	147 Å²	147	73.2 Å²	73.2	65%	0.645	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-15.3	-173	66.6	-100.1	0	0	0	114.6	G425 L464	G425-F427 PolarHBondContact O-N 2.65Å; F427-L464 HydrophobicContact CD1-CD1 3.92Å; F427-L464 HydrophobicContact CE1-CD1 4.15Å
428	W	81.4	Confident	77.3	Confident	133 Å²	133	71.7 Å²	71.7	50%	0.504	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-10.7	177.4	57.8	89.3	0	0	0	113.9	D426 T463 L464	D426-W428 HydrophobicContact CB-CD2 4.29Å; D426-W428 HydrophobicContact CB-CZ2 4.25Å; D426-W428 PolarHBondContact O-N 2.77Å; W428-T463 VanDerWaalsContact CH2-OG1 3.26Å; W428-T463 WeakPolarHBondContact CH2-OG1 3.44Å; W428-T463 WeakPolarHBondContact CZ2-OG1 3.37Å; W428-L464 HydrophobicContact CH2-CD1 4.37Å; W428-L464 HydrophobicContact CH2-CD2 3.72Å; W428-L464 HydrophobicContact CH2-CG 3.64Å; W428-L464 HydrophobicContact CZ3-CD1 3.94Å; W428-L464 HydrophobicContact CZ3-CD2 3.79Å; W428-L464 HydrophobicContact CZ3-CG 3.7Å
429	L	76	Confident	77.2	Confident	82 Å²	82	71.9 Å²	71.9	43%	0.429	35%	0.352	S	S	.	.	S	Bend	trans	-99.6	124.6	173.9	-69.6	168	0	0	0	108.6	D426 E431	D426-L429 HydrophobicContact CB-CB 4.27Å; D426-L429 HydrophobicContact CB-CD1 3.86Å; D426-L429 HydrophobicContact CB-CG 4.27Å; D426-L429 PolarHBondContact O-N 3.47Å; L429-E431 PolarHBondContact O-N 2.93Å
430	N	65.3	Low	77.2	Confident	177 Å²	177	77.3 Å²	77.3	95%	0.947	38%	0.376	S	S	*	.			trans	-70.4	15.5	179	-87.6	-19.9	0	0	0	114
431	E	64	Low	77.4	Confident	140 Å²	140	78.9 Å²	78.9	65%	0.654	38%	0.382	S	S	*	.	S	Bend	trans	-88.4	122.7	177.8	-65.7	-170	173.8	0	0	110.3	L429 H433	L429-E431 PolarHBondContact O-N 2.93Å; E431-H433 PolarHBondContact O-N 3.38Å; E431-H433 PolarHBondContact O-ND1 2.85Å; E431-H433 VanDerWaalsContact O-ND1 3.11Å
432	N	57.4	Low	77.4	Confident	151 Å²	151	77.6 Å²	77.6	81%	0.807	38%	0.375	S	S	*	.			trans	-65.4	85.6	173	-71.4	-43.4	0	0	0	109.7	R434	N432-R434 PolarHBondContact O-N 2.9Å; N432-R434 VanDerWaalsContact O-N 3.07Å
433	H	60.4	Low	77.7	Confident	70 Å²	70	77.4 Å²	77.4	32%	0.324	38%	0.375	S	S	.	.			trans	-62.6	110.9	170	-80.1	66.4	0	0	0	108.1	E431 G435	E431-H433 PolarHBondContact O-N 3.38Å; E431-H433 PolarHBondContact O-ND1 2.85Å; E431-H433 VanDerWaalsContact O-ND1 3.11Å; H433-G435 PolarHBondContact O-N 3.39Å
434	R	60.7	Low	78.2	Confident	233 Å²	233	79.8 Å²	79.8	88%	0.879	38%	0.383	S	S	*	.			trans	-76.9	77.8	170.3	-71.3	-175.1	179.1	179.9	1.3	107.9	N432 T436	N432-R434 PolarHBondContact O-N 2.9Å; N432-R434 VanDerWaalsContact O-N 3.07Å; R434-T436 PolarHBondContact O-N 3Å
435	G	65.9	Low	78.7	Confident	24 Å²	24	76.8 Å²	76.8	25%	0.247	37%	0.367	C	S	.	.			trans	-56.9	121.3	165.8	0	0	0	0	0	108.9	E422 H433	E422-G435 WeakPolarHBondContact O-CA 3.46Å; H433-G435 PolarHBondContact O-N 3.39Å
436	T	75.5	Confident	79.3	Confident	111 Å²	111	76.8 Å²	76.8	68%	0.681	37%	0.366	S	S	*	.			trans	-113.7	-6.7	-175.2	45.4	0	0	0	0	113.1	R434 S438	R434-T436 PolarHBondContact O-N 3Å; T436-S438 PolarHBondContact O-N 3.02Å
437	W	83.4	Confident	79.7	Confident	19 Å²	19	80 Å²	80	7%	0.072	38%	0.383	C	S	.	.			trans	-73.2	123	-172	-67.3	11.9	0	0	0	110.7	M418 H419 E422 H423 F445 Y458 V459 T460	M418-W437 HydrophobicContact CE-CE3 4.12Å; M418-W437 HydrophobicContact CE-CH2 3.93Å; M418-W437 HydrophobicContact CE-CZ3 3.36Å; M418-W437 HydrophobicContact CG-CZ3 4.27Å; H419-W437 PolarHBondContact CD2-O 3.11Å; H419-W437 PolarHBondContact NE2-O 3.33Å; E422-W437 HydrophobicContact CG-CD2 4.14Å; E422-W437 HydrophobicContact CG-CE3 3.83Å; E422-W437 HydrophobicContact CG-CZ3 4.06Å; H423-W437 PolarHBondContact CE1-O 3.22Å; W437-F445 HydrophobicContact CH2-CD1 4.3Å; W437-F445 HydrophobicContact CH2-CD2 4.3Å; W437-F445 HydrophobicContact CH2-CG 4.15Å; W437-F445 HydrophobicContact CZ3-CB 4.33Å; W437-F445 AromaticContact CZ3-CD1 3.99Å; W437-F445 HydrophobicContact CZ3-CD1 3.99Å; W437-F445 HydrophobicContact CZ3-CG 4.04Å; W437-Y458 HydrophobicContact CZ2-CD1 4.23Å; W437-V459 VanDerWaalsContact CZ2-O 3.29Å; W437-V459 WeakPolarHBondContact CZ2-O 3.39Å; W437-T460 HydrophobicContact CH2-CG2 3.82Å; W437-T460 HydrophobicContact CZ3-CG2 4.34Å
438	S	86.9	Confident	80.4	Confident	26 Å²	26	73.6 Å²	73.6	18%	0.182	36%	0.356	C	S	.	.			trans	-67.4	160.7	164.6	64.8	0	0	0	0	111.2	T436 F440 E441 S442	T436-S438 PolarHBondContact O-N 3.02Å; S438-F440 PolarHBondContact O-N 3.02Å; S438-E441 WeakPolarHBondContact CB-OE2 3.45Å; S438-E441 PolarHBondContact N-OE2 3.09Å; S438-E441 PolarHBondContact O-N 2.94Å; S438-E441 VanDerWaalsContact OG-CG 3.27Å; S438-E441 WeakPolarHBondContact OG-CG 3.36Å; S438-E441 PolarHBondContact OG-N 2.76Å; S438-E441 PolarHBondContact OG-OE2 3.08Å; S438-S442 PolarHBondContact O-N 3.15Å; S438-S442 PolarHBondContact O-OG 2.74Å
439	Y	88.9	Confident	80.8	Confident	3 Å²	3	68.3 Å²	68.3	1%	0.012	34%	0.338	C	S	.	.	H	α-helix	trans	-54.8	-37.2	172.4	-179	-110.1	0	0	0	112.2	Y290 V291 M412 H419 S442 C443	Y290-Y439 AromaticContact CE1-CD2 3.69Å; Y290-Y439 HydrophobicContact CE1-CD2 3.69Å; Y290-Y439 AromaticContact CE1-CE2 3.82Å; Y290-Y439 HydrophobicContact CE1-CE2 3.82Å; Y290-Y439 HydrophobicContact CE1-CG 4.16Å; V291-Y439 HydrophobicContact CG1-CD1 4.17Å; V291-Y439 HydrophobicContact CG2-CD1 3.92Å; V291-Y439 HydrophobicContact CG2-CE1 3.67Å; M412-Y439 PolarHBondContact O-OH 3.05Å; M412-Y439 VanDerWaalsContact O-OH 3.07Å; H419-Y439 HydrophobicContact CB-CD2 4.2Å; H419-Y439 AromaticContact ND1-CD2 3.87Å; Y439-S442 WeakPolarHBondContact O-CB 3.38Å; Y439-S442 PolarHBondContact O-N 3.32Å; Y439-C443 PolarHBondContact O-N 3.37Å; Y439-C443 PolarHBondContact O-SG 2.67Å
440	F	89.9	Confident	81.4	Confident	115 Å²	115	65.8 Å²	65.8	50%	0.504	33%	0.325	S	S	.	.	H	α-helix	trans	-70.1	-36.1	179.8	-70.4	-70.9	0	0	0	113.1	V291 S438 S442 C443 Y444	V291-F440 HydrophobicContact CG1-CE1 4.26Å; V291-F440 HydrophobicContact CG1-CE2 3.88Å; V291-F440 HydrophobicContact CG1-CZ 3.49Å; V291-F440 VanDerWaalsContact CG1-CZ 3.49Å; S438-F440 PolarHBondContact O-N 3.02Å; F440-S442 VanDerWaalsContact C-N 3.33Å; F440-C443 WeakPolarHBondContact O-CB 3.3Å; F440-C443 PolarHBondContact O-N 3.39Å; F440-Y444 PolarHBondContact O-N 2.91Å
441	E	90.4	Very high	82.4	Confident	56 Å²	56	60.1 Å²	60.1	26%	0.262	30%	0.3	S	S	.	.	H	α-helix	trans	-67.2	-38.4	173.2	-70.7	166.6	132.7	0	0	110.8	S438 C443 Y444 F445 Y458	S438-E441 WeakPolarHBondContact CB-OE2 3.45Å; S438-E441 PolarHBondContact N-OE2 3.09Å; S438-E441 PolarHBondContact O-N 2.94Å; S438-E441 VanDerWaalsContact OG-CG 3.27Å; S438-E441 WeakPolarHBondContact OG-CG 3.36Å; S438-E441 PolarHBondContact OG-N 2.76Å; S438-E441 PolarHBondContact OG-OE2 3.08Å; E441-C443 VanDerWaalsContact C-N 3.33Å; E441-C443 PolarHBondContact O-N 2.9Å; E441-Y444 PolarHBondContact O-N 3.41Å; E441-F445 WeakPolarHBondContact O-CB 3.37Å; E441-F445 PolarHBondContact O-N 2.96Å; E441-Y458 HydrophobicContact CB-CE1 3.93Å; E441-Y458 HydrophobicContact CG-CE1 3.93Å; E441-Y458 WeakPolarHBondContact CG-OH 3.38Å; E441-Y458 PolarHBondContact OE1-OH 3.46Å
442	S	90.5	Very high	83.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.3	-40.1	172.1	-54.9	0	0	0	0	111.8	S438 Y439 F440 L446	S438-S442 PolarHBondContact O-N 3.15Å; S438-S442 PolarHBondContact O-OG 2.74Å; Y439-S442 WeakPolarHBondContact O-CB 3.38Å; Y439-S442 PolarHBondContact O-N 3.32Å; F440-S442 VanDerWaalsContact C-N 3.33Å; S442-L446 PolarHBondContact O-N 3.07Å
443	C	92.5	Very high	85	Confident	9 Å²	9	54.8 Å²	54.8	6%	0.061	28%	0.282	C	S	.	.	H	α-helix	trans	-63.6	-43	173.3	-71.8	0	0	0	0	112.8	W411 S415 Y439 F440 E441 L447	W411-C443 HydrophobicContact CZ2-CB 4.22Å; W411-C443 PolarHBondContact NE1-O 3.44Å; S415-C443 WeakPolarHBondContact CB-SG 3.49Å; S415-C443 WeakPolarHBondContact OG-CA 3.35Å; S415-C443 PolarHBondContact OG-SG 3.38Å; S415-C443 VanDerWaalsContact OG-SG 3.41Å; Y439-C443 PolarHBondContact O-N 3.37Å; Y439-C443 PolarHBondContact O-SG 2.67Å; F440-C443 WeakPolarHBondContact O-CB 3.3Å; F440-C443 PolarHBondContact O-N 3.39Å; E441-C443 VanDerWaalsContact C-N 3.33Å; E441-C443 PolarHBondContact O-N 2.9Å; C443-L447 VanDerWaalsContact O-CB 3.32Å; C443-L447 WeakPolarHBondContact O-CB 3.43Å; C443-L447 PolarHBondContact O-N 3Å
444	Y	93.5	Very high	86.2	Confident	85 Å²	85	54 Å²	54	33%	0.333	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-49.4	177.4	167.9	-102.2	0	0	0	110.9	F440 E441 L446 L447 V448 D457 Y458	F440-Y444 PolarHBondContact O-N 2.91Å; E441-Y444 PolarHBondContact O-N 3.41Å; Y444-L446 PolarHBondContact O-N 2.73Å; Y444-L447 WeakPolarHBondContact O-CB 3.49Å; Y444-L447 PolarHBondContact O-N 2.79Å; Y444-L447 VanDerWaalsContact O-N 3.15Å; Y444-V448 HydrophobicContact CD2-CG2 4.2Å; Y444-V448 HydrophobicContact CE1-CG2 4.25Å; Y444-V448 HydrophobicContact CE2-CG2 3.75Å; Y444-V448 WeakPolarHBondContact O-CG2 3.4Å; Y444-V448 PolarHBondContact O-N 3.1Å; Y444-D457 WeakPolarHBondContact CE1-OD2 3.49Å; Y444-D457 VanDerWaalsContact CZ-OD2 3.32Å; Y444-D457 PolarHBondContact OH-OD2 2.95Å; Y444-Y458 AromaticContact CD1-CD2 3.86Å; Y444-Y458 HydrophobicContact CD1-CD2 3.86Å; Y444-Y458 AromaticContact CD1-CE2 3.91Å; Y444-Y458 HydrophobicContact CD1-CE2 3.91Å; Y444-Y458 AromaticContact CE1-CD2 3.77Å; Y444-Y458 HydrophobicContact CE1-CD2 3.77Å; Y444-Y458 AromaticContact CE1-CE2 3.92Å; Y444-Y458 HydrophobicContact CE1-CE2 3.92Å
445	F	92.3	Very high	87.6	Confident	21 Å²	21	50.5 Å²	50.5	9%	0.092	28%	0.281	C	S	.	.	H	α-helix	trans	-55.1	-52.2	177.9	174.7	-101.8	0	0	0	111.5	M418 W437 E441 L447 V448 T449 Y458 T460 I469	M418-F445 HydrophobicContact CE-CE1 4.42Å; W437-F445 HydrophobicContact CH2-CD1 4.3Å; W437-F445 HydrophobicContact CH2-CD2 4.3Å; W437-F445 HydrophobicContact CH2-CG 4.15Å; W437-F445 HydrophobicContact CZ3-CB 4.33Å; W437-F445 AromaticContact CZ3-CD1 3.99Å; W437-F445 HydrophobicContact CZ3-CD1 3.99Å; W437-F445 HydrophobicContact CZ3-CG 4.04Å; E441-F445 WeakPolarHBondContact O-CB 3.37Å; E441-F445 PolarHBondContact O-N 2.96Å; F445-L447 VanDerWaalsContact C-N 3.32Å; F445-L447 PolarHBondContact O-N 3.35Å; F445-V448 PolarHBondContact O-N 3.22Å; F445-T449 PolarHBondContact O-N 3.38Å; F445-T449 PolarHBondContact O-OG1 3.48Å; F445-Y458 WeakPolarHBondContact CD2-O 3.39Å; F445-Y458 WeakPolarHBondContact CE2-O 3.46Å; F445-T460 HydrophobicContact CE1-CG2 4.3Å; F445-T460 HydrophobicContact CZ-CG2 4.25Å; F445-I469 HydrophobicContact CE1-CD1 3.45Å; F445-I469 VanDerWaalsContact CE1-CD1 3.45Å; F445-I469 HydrophobicContact CE1-CG1 3.94Å; F445-I469 HydrophobicContact CZ-CD1 3.44Å; F445-I469 VanDerWaalsContact CZ-CD1 3.44Å; F445-I469 HydrophobicContact CZ-CG1 4.25Å
446	L	92.5	Very high	88.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-68.8	-27.8	179.2	-75.5	177	0	0	0	114.1	G414 S415 M418 S442 Y444 T449 L450 F468 F472	G414-L446 VanDerWaalsContact O-CD1 3.3Å; G414-L446 WeakPolarHBondContact O-CD1 3.47Å; S415-L446 VanDerWaalsContact CA-CD1 3.45Å; M418-L446 HydrophobicContact CB-CD1 4.12Å; S442-L446 PolarHBondContact O-N 3.07Å; Y444-L446 PolarHBondContact O-N 2.73Å; L446-T449 PolarHBondContact O-N 2.88Å; L446-L450 WeakPolarHBondContact O-CB 3.26Å; L446-L450 PolarHBondContact O-N 2.92Å; L446-F468 HydrophobicContact CD1-CE1 4.41Å; L446-F468 HydrophobicContact CD2-CE1 4.21Å; L446-F472 HydrophobicContact CB-CE1 4.43Å; L446-F472 HydrophobicContact CB-CZ 4.47Å; L446-F472 HydrophobicContact CD1-CZ 4.4Å; L446-F472 HydrophobicContact CD2-CD1 3.61Å; L446-F472 HydrophobicContact CD2-CD2 4.49Å; L446-F472 HydrophobicContact CD2-CE1 3.49Å; L446-F472 VanDerWaalsContact CD2-CE1 3.49Å; L446-F472 HydrophobicContact CD2-CE2 4.4Å; L446-F472 HydrophobicContact CD2-CG 4.12Å; L446-F472 HydrophobicContact CD2-CZ 3.92Å; L446-F472 HydrophobicContact CG-CE1 4.42Å
447	L	91.6	Very high	89.3	Confident	79 Å²	79	50.5 Å²	50.5	41%	0.414	28%	0.283	S	S	.	.	H	α-helix	trans	-65.8	-44.2	173.4	-177.5	66.2	0	0	0	110.6	W411 C443 Y444 F445 T449 L450 S451	W411-L447 HydrophobicContact CZ2-CB 4.21Å; W411-L447 HydrophobicContact CZ2-CD1 4.35Å; W411-L447 HydrophobicContact CZ2-CD2 4.17Å; W411-L447 HydrophobicContact CZ2-CG 4.49Å; C443-L447 VanDerWaalsContact O-CB 3.32Å; C443-L447 WeakPolarHBondContact O-CB 3.43Å; C443-L447 PolarHBondContact O-N 3Å; Y444-L447 WeakPolarHBondContact O-CB 3.49Å; Y444-L447 PolarHBondContact O-N 2.79Å; Y444-L447 VanDerWaalsContact O-N 3.15Å; F445-L447 VanDerWaalsContact C-N 3.32Å; F445-L447 PolarHBondContact O-N 3.35Å; L447-T449 VanDerWaalsContact C-N 3.34Å; L447-L450 PolarHBondContact O-N 3.04Å; L447-S451 WeakPolarHBondContact O-CB 3.19Å; L447-S451 PolarHBondContact O-N 3.25Å; L447-S451 PolarHBondContact O-OG 3.45Å; L447-S451 VanDerWaalsContact O-OG 3.09Å
448	V	90.6	Very high	89.5	Confident	11 Å²	11	52.8 Å²	52.8	7%	0.067	29%	0.292	C	S	.	.	H	α-helix	trans	-62.6	-41.9	175.9	171.7	0	0	0	0	110.6	Y444 F445 S451 T452 V453 G454 Y455	Y444-V448 HydrophobicContact CD2-CG2 4.2Å; Y444-V448 HydrophobicContact CE1-CG2 4.25Å; Y444-V448 HydrophobicContact CE2-CG2 3.75Å; Y444-V448 WeakPolarHBondContact O-CG2 3.4Å; Y444-V448 PolarHBondContact O-N 3.1Å; F445-V448 PolarHBondContact O-N 3.22Å; V448-S451 WeakPolarHBondContact CA-OG 3.35Å; V448-S451 PolarHBondContact O-N 3.39Å; V448-S451 PolarHBondContact O-OG 2.94Å; V448-T452 PolarHBondContact O-N 3.43Å; V448-V453 HydrophobicContact CG1-CB 4.2Å; V448-V453 HydrophobicContact CG1-CG1 4.47Å; V448-V453 PolarHBondContact O-N 3.12Å; V448-V453 VanDerWaalsContact O-N 3.12Å; V448-G454 VanDerWaalsContact CG1-N 3.34Å; V448-Y455 HydrophobicContact CB-CD2 4.49Å; V448-Y455 HydrophobicContact CG1-CD2 3.71Å; V448-Y455 HydrophobicContact CG1-CE2 4.36Å; V448-Y455 HydrophobicContact CG1-CG 4.36Å; V448-Y455 HydrophobicContact CG2-CD2 3.87Å; V448-Y455 HydrophobicContact CG2-CE2 4.1Å
449	T	89.8	Confident	89.5	Confident	22 Å²	22	55.1 Å²	55.1	14%	0.135	31%	0.305	C	S	.	.	H	α-helix	trans	-66.7	-44.6	175.2	-49.9	0	0	0	0	112.7	F445 L446 L447 S451 T452 F472 I473	F445-T449 PolarHBondContact O-N 3.38Å; F445-T449 PolarHBondContact O-OG1 3.48Å; L446-T449 PolarHBondContact O-N 2.88Å; L447-T449 VanDerWaalsContact C-N 3.34Å; T449-S451 VanDerWaalsContact C-N 3.26Å; T449-S451 PolarHBondContact O-N 2.94Å; T449-T452 PolarHBondContact O-N 2.65Å; T449-F472 HydrophobicContact CG2-CD1 4.46Å; T449-I473 HydrophobicContact CG2-CD1 4.13Å; T449-I473 HydrophobicContact CG2-CG1 3.58Å
450	L	87.5	Confident	89.4	Confident	29 Å²	29	55.4 Å²	55.4	15%	0.152	31%	0.307	C	S	.	.	H	α-helix	trans	-60.2	-38	177.5	-178.6	72.7	0	0	0	111.3	L446 L447 T452 A476 S480	L446-L450 WeakPolarHBondContact O-CB 3.26Å; L446-L450 PolarHBondContact O-N 2.92Å; L447-L450 PolarHBondContact O-N 3.04Å; L450-T452 PolarHBondContact O-N 2.92Å; L450-A476 HydrophobicContact CD1-CB 3.6Å; L450-S480 WeakPolarHBondContact CD1-OG 3.48Å
451	S	86.3	Confident	89	Confident	59 Å²	59	55.8 Å²	55.8	41%	0.413	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	1.8	175.5	67.6	0	0	0	0	114.6	L447 V448 T449 V453	L447-S451 WeakPolarHBondContact O-CB 3.19Å; L447-S451 PolarHBondContact O-N 3.25Å; L447-S451 PolarHBondContact O-OG 3.45Å; L447-S451 VanDerWaalsContact O-OG 3.09Å; V448-S451 WeakPolarHBondContact CA-OG 3.35Å; V448-S451 PolarHBondContact O-N 3.39Å; V448-S451 PolarHBondContact O-OG 2.94Å; T449-S451 VanDerWaalsContact C-N 3.26Å; T449-S451 PolarHBondContact O-N 2.94Å; S451-V453 PolarHBondContact O-N 2.74Å; S451-V453 VanDerWaalsContact O-N 3.08Å; S451-V453 WeakPolarHBondContact OG-CG2 3.33Å
452	T	87	Confident	88.7	Confident	104 Å²	104	53.2 Å²	53.2	64%	0.638	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	21.1	-175.9	65.9	0	0	0	0	114.7	V448 T449 L450 M477	V448-T452 PolarHBondContact O-N 3.43Å; T449-T452 PolarHBondContact O-N 2.65Å; L450-T452 PolarHBondContact O-N 2.92Å; T452-M477 HydrophobicContact CG2-CG 3.95Å; T452-M477 HydrophobicContact CG2-SD 4.48Å
453	V	89.1	Confident	88.6	Confident	75 Å²	75	56 Å²	56	46%	0.455	32%	0.315	S	S	.	.			trans	-78.5	-47.4	-179.7	173.2	0	0	0	0	111	V448 S451 Y455	V448-V453 HydrophobicContact CG1-CB 4.2Å; V448-V453 HydrophobicContact CG1-CG1 4.47Å; V448-V453 PolarHBondContact O-N 3.12Å; V448-V453 VanDerWaalsContact O-N 3.12Å; S451-V453 PolarHBondContact O-N 2.74Å; S451-V453 VanDerWaalsContact O-N 3.08Å; S451-V453 WeakPolarHBondContact OG-CG2 3.33Å; V453-Y455 HydrophobicContact CG1-CD1 3.98Å; V453-Y455 HydrophobicContact CG1-CD2 4.09Å; V453-Y455 HydrophobicContact CG1-CE1 3.65Å; V453-Y455 HydrophobicContact CG1-CE2 3.76Å; V453-Y455 HydrophobicContact CG1-CG 4.18Å
454	G	85.8	Confident	88.4	Confident	53 Å²	53	57.6 Å²	57.6	55%	0.546	32%	0.323	S	S	.	.			trans	57.9	57.8	172.2	0	0	0	0	0	115.7	V448 G456	V448-G454 VanDerWaalsContact CG1-N 3.34Å; G454-G456 PolarHBondContact O-N 3.03Å; G454-G456 VanDerWaalsContact O-N 3.15Å
455	Y	90.9	Very high	88.2	Confident	160 Å²	160	53.5 Å²	53.5	63%	0.627	31%	0.307	S	S	*	.			trans	-56.4	-30.7	-178.9	-69.5	-61.2	0	0	0	114.9	V448 V453 D457	V448-Y455 HydrophobicContact CB-CD2 4.49Å; V448-Y455 HydrophobicContact CG1-CD2 3.71Å; V448-Y455 HydrophobicContact CG1-CE2 4.36Å; V448-Y455 HydrophobicContact CG1-CG 4.36Å; V448-Y455 HydrophobicContact CG2-CD2 3.87Å; V448-Y455 HydrophobicContact CG2-CE2 4.1Å; V453-Y455 HydrophobicContact CG1-CD1 3.98Å; V453-Y455 HydrophobicContact CG1-CD2 4.09Å; V453-Y455 HydrophobicContact CG1-CE1 3.65Å; V453-Y455 HydrophobicContact CG1-CE2 3.76Å; V453-Y455 HydrophobicContact CG1-CG 4.18Å; Y455-D457 VanDerWaalsContact C-N 3.28Å; Y455-D457 PolarHBondContact O-N 2.71Å
456	G	85.8	Confident	88.2	Confident	51 Å²	51	58.8 Å²	58.8	53%	0.526	33%	0.326	S	S	.	.			trans	76	13.6	-176.9	0	0	0	0	0	114.4	G454	G454-G456 PolarHBondContact O-N 3.03Å; G454-G456 VanDerWaalsContact O-N 3.15Å
457	D	90.2	Very high	88.1	Confident	84 Å²	84	63.9 Å²	63.9	45%	0.449	35%	0.353	S	S	.	.	S	Bend	trans	-71.6	-36.4	173.7	53.3	-7.7	0	0	0	112.5	Y444 Y455	Y444-D457 WeakPolarHBondContact CE1-OD2 3.49Å; Y444-D457 VanDerWaalsContact CZ-OD2 3.32Å; Y444-D457 PolarHBondContact OH-OD2 2.95Å; Y455-D457 VanDerWaalsContact C-N 3.28Å; Y455-D457 PolarHBondContact O-N 2.71Å
458	Y	87.7	Confident	88.2	Confident	67 Å²	67	61.6 Å²	61.6	26%	0.263	34%	0.339	S	S	.	.	S	Bend	trans	-111.3	131.8	167	-70.3	-94.9	0	0	0	109.6	W437 E441 Y444 F445	W437-Y458 HydrophobicContact CZ2-CD1 4.23Å; E441-Y458 HydrophobicContact CB-CE1 3.93Å; E441-Y458 HydrophobicContact CG-CE1 3.93Å; E441-Y458 WeakPolarHBondContact CG-OH 3.38Å; E441-Y458 PolarHBondContact OE1-OH 3.46Å; Y444-Y458 AromaticContact CD1-CD2 3.86Å; Y444-Y458 HydrophobicContact CD1-CD2 3.86Å; Y444-Y458 AromaticContact CD1-CE2 3.91Å; Y444-Y458 HydrophobicContact CD1-CE2 3.91Å; Y444-Y458 AromaticContact CE1-CD2 3.77Å; Y444-Y458 HydrophobicContact CE1-CD2 3.77Å; Y444-Y458 AromaticContact CE1-CE2 3.92Å; Y444-Y458 HydrophobicContact CE1-CE2 3.92Å; F445-Y458 WeakPolarHBondContact CD2-O 3.39Å; F445-Y458 WeakPolarHBondContact CE2-O 3.46Å
459	V	86.5	Confident	88.3	Confident	74 Å²	74	62 Å²	62	45%	0.448	34%	0.341	S	S	.	.			trans	-134.4	139.5	-178.9	-178.3	0	0	0	0	109.8	W437 H461	W437-V459 VanDerWaalsContact CZ2-O 3.29Å; W437-V459 WeakPolarHBondContact CZ2-O 3.39Å; V459-H461 PolarHBondContact O-CD2 3.12Å; V459-H461 PolarHBondContact O-N 3.28Å
460	T	86.5	Confident	88.4	Confident	10 Å²	10	65.3 Å²	65.3	6%	0.061	36%	0.364	C	S	.	.			trans	-78	122.9	178.1	53.2	0	0	0	0	112.2	M418 E422 W437 F445 R466 I469	M418-T460 HydrophobicContact CE-CG2 3.04Å; M418-T460 HydrophobicContact SD-CG2 4.35Å; E422-T460 WeakPolarHBondContact OE1-CB 3.37Å; E422-T460 WeakPolarHBondContact OE1-CG2 3.2Å; W437-T460 HydrophobicContact CH2-CG2 3.82Å; W437-T460 HydrophobicContact CZ3-CG2 4.34Å; F445-T460 HydrophobicContact CE1-CG2 4.3Å; F445-T460 HydrophobicContact CZ-CG2 4.25Å; T460-R466 PolarHBondContact O-NE 2.91Å; T460-R466 PolarHBondContact O-NH2 3.41Å; T460-R466 VanDerWaalsContact OG1-CG 3.3Å; T460-R466 WeakPolarHBondContact OG1-CG 3.21Å; T460-I469 HydrophobicContact CG2-CD1 3.19Å; T460-I469 HydrophobicContact CG2-CG1 4.49Å; T460-I469 WeakPolarHBondContact OG1-CD1 3.23Å
461	H	81.5	Confident	88.6	Confident	123 Å²	123	69 Å²	69	57%	0.569	38%	0.383	S	S	*	.			trans	-88.7	-33.5	176.2	-66	-72.3	0	0	0	111.3	V459	V459-H461 PolarHBondContact O-CD2 3.12Å; V459-H461 PolarHBondContact O-N 3.28Å
462	S	85.2	Confident	88.8	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.007	37%	0.366	C	S	.	.	S	Bend	trans	-68	137.4	179.5	67.4	0	0	0	0	112.2	E422 L464 G465 R466	E422-S462 PolarHBondContact OE1-OG 3.48Å; S462-L464 PolarHBondContact O-N 3.07Å; S462-G465 PolarHBondContact O-N 3Å; S462-G465 VanDerWaalsContact OG-CA 3.23Å; S462-G465 WeakPolarHBondContact OG-CA 3.05Å; S462-G465 PolarHBondContact OG-N 3.46Å; S462-R466 WeakPolarHBondContact O-CG 3.19Å; S462-R466 PolarHBondContact O-N 3.07Å
463	T	87.6	Confident	89	Confident	58 Å²	58	65 Å²	65	36%	0.356	35%	0.352	S	S	.	.	H	α-helix	trans	-63.9	-35.2	172.9	62.3	0	0	0	0	111.2	D426 W428 R466 L467	D426-T463 PolarHBondContact OD1-N 2.95Å; D426-T463 PolarHBondContact OD1-OG1 3.15Å; D426-T463 WeakPolarHBondContact OD2-CG2 3.08Å; D426-T463 PolarHBondContact OD2-N 3.23Å; D426-T463 PolarHBondContact OD2-OG1 3.02Å; W428-T463 VanDerWaalsContact CH2-OG1 3.26Å; W428-T463 WeakPolarHBondContact CH2-OG1 3.44Å; W428-T463 WeakPolarHBondContact CZ2-OG1 3.37Å; T463-R466 PolarHBondContact O-N 3.33Å; T463-L467 WeakPolarHBondContact O-CB 3.46Å; T463-L467 PolarHBondContact O-N 2.61Å
464	L	88.3	Confident	89.1	Confident	43 Å²	43	65.5 Å²	65.5	23%	0.225	36%	0.356	C	S	.	.	H	α-helix	trans	-62.3	-41	172	-73.6	-180	0	0	0	112.4	I421 L424 D426 F427 W428 S462 L467 F468	I421-L464 HydrophobicContact CG2-CB 3.6Å; L424-L464 HydrophobicContact CD2-CD1 4.46Å; D426-L464 PolarHBondContact OD1-N 3.32Å; F427-L464 HydrophobicContact CD1-CD1 3.92Å; F427-L464 HydrophobicContact CE1-CD1 4.15Å; W428-L464 HydrophobicContact CH2-CD1 4.37Å; W428-L464 HydrophobicContact CH2-CD2 3.72Å; W428-L464 HydrophobicContact CH2-CG 3.64Å; W428-L464 HydrophobicContact CZ3-CD1 3.94Å; W428-L464 HydrophobicContact CZ3-CD2 3.79Å; W428-L464 HydrophobicContact CZ3-CG 3.7Å; S462-L464 PolarHBondContact O-N 3.07Å; L464-L467 PolarHBondContact O-N 3.27Å; L464-F468 PolarHBondContact O-N 3.15Å
465	G	89.8	Confident	89.3	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-67.1	-40.6	178.5	0	0	0	0	0	111.9	I421 S462 F468 I469	I421-G465 VanDerWaalsContact CG2-N 3.32Å; S462-G465 PolarHBondContact O-N 3Å; S462-G465 VanDerWaalsContact OG-CA 3.23Å; S462-G465 WeakPolarHBondContact OG-CA 3.05Å; S462-G465 PolarHBondContact OG-N 3.46Å; G465-F468 PolarHBondContact O-N 2.95Å; G465-I469 WeakPolarHBondContact O-CD1 3.43Å; G465-I469 WeakPolarHBondContact O-CG1 3.19Å; G465-I469 PolarHBondContact O-N 3.41Å
466	R	91.3	Very high	89	Confident	132 Å²	132	59.3 Å²	59.3	50%	0.498	32%	0.324	S	S	.	.	H	α-helix	trans	-60.9	-45.5	172.5	-68.9	176	-173.8	174.1	2.3	111.8	T460 S462 T463 F468 I469 C470	T460-R466 PolarHBondContact O-NE 2.91Å; T460-R466 PolarHBondContact O-NH2 3.41Å; T460-R466 VanDerWaalsContact OG1-CG 3.3Å; T460-R466 WeakPolarHBondContact OG1-CG 3.21Å; S462-R466 WeakPolarHBondContact O-CG 3.19Å; S462-R466 PolarHBondContact O-N 3.07Å; T463-R466 PolarHBondContact O-N 3.33Å; R466-F468 PolarHBondContact O-N 3.38Å; R466-I469 PolarHBondContact O-N 3.28Å; R466-C470 PolarHBondContact O-N 3.38Å; R466-C470 PolarHBondContact O-SG 2.84Å
467	L	92.3	Very high	89.1	Confident	106 Å²	106	61.7 Å²	61.7	56%	0.555	32%	0.323	S	S	*	.	H	α-helix	trans	-62	-42.9	176.7	-176.2	146.8	0	0	0	111.8	T463 L464 I469 C470 I471	T463-L467 WeakPolarHBondContact O-CB 3.46Å; T463-L467 PolarHBondContact O-N 2.61Å; L464-L467 PolarHBondContact O-N 3.27Å; L467-I469 VanDerWaalsContact C-N 3.35Å; L467-I469 PolarHBondContact O-N 3.47Å; L467-C470 PolarHBondContact O-N 3.36Å; L467-I471 HydrophobicContact CD2-CD1 3.76Å; L467-I471 PolarHBondContact O-N 3.36Å
468	F	92.9	Very high	89	Confident	31 Å²	31	59.8 Å²	59.8	14%	0.136	32%	0.323	C	S	.	.	H	α-helix	trans	-59.3	-44.8	175.9	174.1	-104	0	0	0	111.7	I417 M418 I421 L446 L464 G465 R466 I471 F472	I417-F468 HydrophobicContact CB-CE2 4.07Å; I417-F468 HydrophobicContact CB-CZ 4.14Å; I417-F468 HydrophobicContact CD1-CE2 4.19Å; I417-F468 HydrophobicContact CG2-CD2 3.79Å; I417-F468 HydrophobicContact CG2-CE2 3.57Å; I417-F468 HydrophobicContact CG2-CG 4.42Å; I417-F468 HydrophobicContact CG2-CZ 4.04Å; M418-F468 HydrophobicContact CB-CE1 4.17Å; M418-F468 HydrophobicContact SD-CD1 3.82Å; M418-F468 HydrophobicContact SD-CE1 4.26Å; I421-F468 HydrophobicContact CD1-CB 3.84Å; I421-F468 HydrophobicContact CD1-CD2 4.33Å; I421-F468 HydrophobicContact CD1-CG 4.04Å; L446-F468 HydrophobicContact CD1-CE1 4.41Å; L446-F468 HydrophobicContact CD2-CE1 4.21Å; L464-F468 PolarHBondContact O-N 3.15Å; G465-F468 PolarHBondContact O-N 2.95Å; R466-F468 PolarHBondContact O-N 3.38Å; F468-I471 PolarHBondContact O-N 3.29Å; F468-F472 HydrophobicContact CE1-CB 4.29Å; F468-F472 HydrophobicContact CE1-CD2 4.32Å; F468-F472 HydrophobicContact CE1-CG 4.38Å; F468-F472 HydrophobicContact CZ-CB 4.38Å; F468-F472 AromaticContact CZ-CD2 3.94Å; F468-F472 HydrophobicContact CZ-CD2 3.94Å; F468-F472 HydrophobicContact CZ-CG 4.4Å; F468-F472 VanDerWaalsContact O-CB 3.29Å; F468-F472 WeakPolarHBondContact O-CB 3.39Å; F468-F472 PolarHBondContact O-N 2.96Å
469	I	91.5	Very high	88.9	Confident	20 Å²	20	57.7 Å²	57.7	10%	0.103	32%	0.318	C	S	.	.	H	α-helix	trans	-65.3	-40.3	178.3	-69.8	159.7	0	0	0	112	M418 F445 T460 G465 R466 L467 I471 F472 I473	M418-I469 HydrophobicContact CE-CD1 4.49Å; F445-I469 HydrophobicContact CE1-CD1 3.45Å; F445-I469 VanDerWaalsContact CE1-CD1 3.45Å; F445-I469 HydrophobicContact CE1-CG1 3.94Å; F445-I469 HydrophobicContact CZ-CD1 3.44Å; F445-I469 VanDerWaalsContact CZ-CD1 3.44Å; F445-I469 HydrophobicContact CZ-CG1 4.25Å; T460-I469 HydrophobicContact CG2-CD1 3.19Å; T460-I469 HydrophobicContact CG2-CG1 4.49Å; T460-I469 WeakPolarHBondContact OG1-CD1 3.23Å; G465-I469 WeakPolarHBondContact O-CD1 3.43Å; G465-I469 WeakPolarHBondContact O-CG1 3.19Å; G465-I469 PolarHBondContact O-N 3.41Å; R466-I469 PolarHBondContact O-N 3.28Å; L467-I469 VanDerWaalsContact C-N 3.35Å; L467-I469 PolarHBondContact O-N 3.47Å; I469-I471 PolarHBondContact O-N 2.97Å; I469-F472 PolarHBondContact O-N 3.3Å; I469-F472 VanDerWaalsContact O-N 3.13Å; I469-I473 HydrophobicContact CG2-CD1 3.42Å; I469-I473 VanDerWaalsContact CG2-CD1 3.42Å; I469-I473 HydrophobicContact CG2-CG1 3.86Å; I469-I473 WeakPolarHBondContact O-CG1 3.34Å; I469-I473 PolarHBondContact O-N 3.4Å
470	C	92	Very high	88.7	Confident	91 Å²	91	55.3 Å²	55.3	62%	0.615	30%	0.304	S	S	*	.	H	α-helix	trans	-58.7	-30.4	175.8	-71	0	0	0	0	112.7	R466 L467 P474	R466-C470 PolarHBondContact O-N 3.38Å; R466-C470 PolarHBondContact O-SG 2.84Å; L467-C470 PolarHBondContact O-N 3.36Å; C470-P474 WeakPolarHBondContact O-CD 3.34Å; C470-P474 WeakPolarHBondContact O-CG 3.28Å
471	I	92.1	Very high	88.6	Confident	106 Å²	106	58.2 Å²	58.2	54%	0.544	33%	0.329	S	S	.	.	H	α-helix	trans	-85.1	-39.3	174.4	-62	170.8	0	0	0	110.9	L467 F468 I469 P474 V475	L467-I471 HydrophobicContact CD2-CD1 3.76Å; L467-I471 PolarHBondContact O-N 3.36Å; F468-I471 PolarHBondContact O-N 3.29Å; I469-I471 PolarHBondContact O-N 2.97Å; I471-P474 WeakPolarHBondContact O-CD 3.3Å; I471-V475 WeakPolarHBondContact O-CG2 3.39Å
472	F	91.5	Very high	88.9	Confident	16 Å²	16	55.1 Å²	55.1	7%	0.07	32%	0.321	C	S	.	.	H	α-helix	trans	-66.7	-40.4	-177	-175.2	-95.8	0	0	0	112.1	I410 L446 T449 F468 I469 V475 A476	I410-F472 HydrophobicContact CG2-CE2 4.26Å; L446-F472 HydrophobicContact CB-CE1 4.43Å; L446-F472 HydrophobicContact CB-CZ 4.47Å; L446-F472 HydrophobicContact CD1-CZ 4.4Å; L446-F472 HydrophobicContact CD2-CD1 3.61Å; L446-F472 HydrophobicContact CD2-CD2 4.49Å; L446-F472 HydrophobicContact CD2-CE1 3.49Å; L446-F472 VanDerWaalsContact CD2-CE1 3.49Å; L446-F472 HydrophobicContact CD2-CE2 4.4Å; L446-F472 HydrophobicContact CD2-CG 4.12Å; L446-F472 HydrophobicContact CD2-CZ 3.92Å; L446-F472 HydrophobicContact CG-CE1 4.42Å; T449-F472 HydrophobicContact CG2-CD1 4.46Å; F468-F472 HydrophobicContact CE1-CB 4.29Å; F468-F472 HydrophobicContact CE1-CD2 4.32Å; F468-F472 HydrophobicContact CE1-CG 4.38Å; F468-F472 HydrophobicContact CZ-CB 4.38Å; F468-F472 AromaticContact CZ-CD2 3.94Å; F468-F472 HydrophobicContact CZ-CD2 3.94Å; F468-F472 HydrophobicContact CZ-CG 4.4Å; F468-F472 VanDerWaalsContact O-CB 3.29Å; F468-F472 WeakPolarHBondContact O-CB 3.39Å; F468-F472 PolarHBondContact O-N 2.96Å; I469-F472 PolarHBondContact O-N 3.3Å; I469-F472 VanDerWaalsContact O-N 3.13Å; F472-V475 PolarHBondContact O-N 3.28Å; F472-A476 HydrophobicContact CD1-CB 4.02Å; F472-A476 HydrophobicContact CE1-CB 3.81Å; F472-A476 HydrophobicContact CZ-CB 4.28Å; F472-A476 WeakPolarHBondContact O-CB 3.22Å; F472-A476 PolarHBondContact O-N 2.87Å
473	I	90.8	Very high	88.9	Confident	65 Å²	65	57.8 Å²	57.8	33%	0.333	33%	0.333	S	S	.	.	H	α-helix	trans	-59.2	-54.2	-177.2	-71.3	169	0	0	0	112.3	T449 I469 V475 A476 M477	T449-I473 HydrophobicContact CG2-CD1 4.13Å; T449-I473 HydrophobicContact CG2-CG1 3.58Å; I469-I473 HydrophobicContact CG2-CD1 3.42Å; I469-I473 VanDerWaalsContact CG2-CD1 3.42Å; I469-I473 HydrophobicContact CG2-CG1 3.86Å; I469-I473 WeakPolarHBondContact O-CG1 3.34Å; I469-I473 PolarHBondContact O-N 3.4Å; I473-V475 VanDerWaalsContact C-N 3.31Å; I473-V475 PolarHBondContact O-N 3.23Å; I473-A476 PolarHBondContact O-N 3.43Å; I473-M477 HydrophobicContact CG2-CG 4.25Å; I473-M477 HydrophobicContact CG2-SD 3.69Å; I473-M477 WeakPolarHBondContact O-CB 3.3Å; I473-M477 WeakPolarHBondContact O-CG 3.4Å; I473-M477 PolarHBondContact O-N 3.39Å
474	P	91.2	Very high	88.8	Confident	84 Å²	84	59.1 Å²	59.1	55%	0.545	34%	0.341	S	S	.	.	H	α-helix	trans	-58.5	-40.9	178.4	-26	34.4	0	0	0	113.2	C470 I471 G478	C470-P474 WeakPolarHBondContact O-CD 3.34Å; C470-P474 WeakPolarHBondContact O-CG 3.28Å; I471-P474 WeakPolarHBondContact O-CD 3.3Å; P474-G478 PolarHBondContact O-N 3.17Å
475	V	89.4	Confident	88.6	Confident	80 Å²	80	60.6 Å²	60.6	49%	0.485	35%	0.353	S	S	.	.	H	α-helix	trans	-66.2	-46.8	177.9	176.4	0	0	0	0	110.7	I471 F472 I473 M477 G478 V479	I471-V475 WeakPolarHBondContact O-CG2 3.39Å; F472-V475 PolarHBondContact O-N 3.28Å; I473-V475 VanDerWaalsContact C-N 3.31Å; I473-V475 PolarHBondContact O-N 3.23Å; V475-M477 PolarHBondContact O-N 2.8Å; V475-G478 PolarHBondContact O-N 3.02Å; V475-V479 HydrophobicContact CG1-CG2 4.32Å; V475-V479 WeakPolarHBondContact O-CB 3.07Å; V475-V479 WeakPolarHBondContact O-CG2 3.01Å; V475-V479 PolarHBondContact O-N 2.63Å
476	A	85.7	Confident	88.4	Confident	3 Å²	3	63.3 Å²	63.3	3%	0.025	37%	0.365	C	S	.	.	H	α-helix	trans	-60.9	-43.4	178.2	0	0	0	0	0	111.9	L450 F472 I473 S480	L450-A476 HydrophobicContact CD1-CB 3.6Å; F472-A476 HydrophobicContact CD1-CB 4.02Å; F472-A476 HydrophobicContact CE1-CB 3.81Å; F472-A476 HydrophobicContact CZ-CB 4.28Å; F472-A476 WeakPolarHBondContact O-CB 3.22Å; F472-A476 PolarHBondContact O-N 2.87Å; I473-A476 PolarHBondContact O-N 3.43Å; A476-S480 WeakPolarHBondContact O-CB 3.46Å; A476-S480 PolarHBondContact O-N 3.22Å; A476-S480 PolarHBondContact O-OG 3.14Å
477	M	87.9	Confident	88.1	Confident	101 Å²	101	58.2 Å²	58.2	50%	0.498	35%	0.348	S	S	.	.	H	α-helix	trans	-64.9	-48.1	176.5	-73.9	178.9	68.2	0	0	111.6	T452 I473 V475 V479 S480 A481	T452-M477 HydrophobicContact CG2-CG 3.95Å; T452-M477 HydrophobicContact CG2-SD 4.48Å; I473-M477 HydrophobicContact CG2-CG 4.25Å; I473-M477 HydrophobicContact CG2-SD 3.69Å; I473-M477 WeakPolarHBondContact O-CB 3.3Å; I473-M477 WeakPolarHBondContact O-CG 3.4Å; I473-M477 PolarHBondContact O-N 3.39Å; V475-M477 PolarHBondContact O-N 2.8Å; M477-V479 PolarHBondContact O-N 2.96Å; M477-S480 PolarHBondContact O-N 3.29Å; M477-A481 WeakPolarHBondContact O-CB 3.44Å; M477-A481 PolarHBondContact O-N 3.39Å
478	G	87.8	Confident	87.6	Confident	44 Å²	44	60 Å²	60	45%	0.454	35%	0.352	S	S	.	.	H	α-helix	trans	-64.1	-40.8	178.8	0	0	0	0	0	113.3	P474 V475 S482	P474-G478 PolarHBondContact O-N 3.17Å; V475-G478 PolarHBondContact O-N 3.02Å; G478-S482 PolarHBondContact O-N 3.1Å; G478-S482 PolarHBondContact O-OG 2.92Å
479	V	86.1	Confident	86.9	Confident	24 Å²	24	65.4 Å²	65.4	15%	0.145	37%	0.371	C	S	.	.	H	α-helix	trans	-67	-44.7	175.8	172.7	0	0	0	0	110.9	L407 I410 V475 M477 S482 F483	L407-V479 HydrophobicContact CD2-CG1 3.68Å; I410-V479 HydrophobicContact CD1-CG1 4.02Å; I410-V479 HydrophobicContact CD1-CG2 4.4Å; V475-V479 HydrophobicContact CG1-CG2 4.32Å; V475-V479 WeakPolarHBondContact O-CB 3.07Å; V475-V479 WeakPolarHBondContact O-CG2 3.01Å; V475-V479 PolarHBondContact O-N 2.63Å; M477-V479 PolarHBondContact O-N 2.96Å; V479-S482 PolarHBondContact O-N 3.19Å; V479-S482 PolarHBondContact O-OG 3.34Å; V479-F483 HydrophobicContact CG1-CD2 3.45Å; V479-F483 VanDerWaalsContact CG1-CD2 3.45Å; V479-F483 HydrophobicContact CG1-CE2 3.53Å; V479-F483 HydrophobicContact CG1-CG 4.21Å; V479-F483 HydrophobicContact CG1-CZ 4.31Å; V479-F483 VanDerWaalsContact O-CB 3.23Å; V479-F483 WeakPolarHBondContact O-CB 3.36Å; V479-F483 WeakPolarHBondContact O-CG 3.29Å; V479-F483 PolarHBondContact O-N 3.48Å
480	S	82	Confident	86.2	Confident	24 Å²	24	65 Å²	65	17%	0.168	37%	0.369	C	S	.	.	H	α-helix	trans	-69.2	-39	-179.1	-57.8	0	0	0	0	112.2	L450 A476 M477 S482 V484	L450-S480 WeakPolarHBondContact CD1-OG 3.48Å; A476-S480 WeakPolarHBondContact O-CB 3.46Å; A476-S480 PolarHBondContact O-N 3.22Å; A476-S480 PolarHBondContact O-OG 3.14Å; M477-S480 PolarHBondContact O-N 3.29Å; S480-S482 VanDerWaalsContact C-N 3.28Å; S480-S482 PolarHBondContact O-N 3.32Å; S480-V484 WeakPolarHBondContact O-CB 3.34Å; S480-V484 WeakPolarHBondContact O-CG2 3.2Å; S480-V484 PolarHBondContact O-N 3.1Å; S480-V484 VanDerWaalsContact O-N 3.11Å
481	A	84.7	Confident	85.4	Confident	70 Å²	70	66.5 Å²	66.5	58%	0.579	37%	0.365	S	S	*	.	H	α-helix	trans	-63.8	-31.3	178.1	0	0	0	0	0	113	M477 P485	M477-A481 WeakPolarHBondContact O-CB 3.44Å; M477-A481 PolarHBondContact O-N 3.39Å; A481-P485 WeakPolarHBondContact O-CD 3.26Å; A481-P485 VanDerWaalsContact O-CG 3.23Å; A481-P485 WeakPolarHBondContact O-CG 3.42Å
482	S	86.5	Confident	84.3	Confident	58 Å²	58	65.2 Å²	65.2	41%	0.406	36%	0.36	S	S	.	.	H	α-helix	trans	-86.8	-42	177	54.2	0	0	0	0	112.8	G478 V479 S480	G478-S482 PolarHBondContact O-N 3.1Å; G478-S482 PolarHBondContact O-OG 2.92Å; V479-S482 PolarHBondContact O-N 3.19Å; V479-S482 PolarHBondContact O-OG 3.34Å; S480-S482 VanDerWaalsContact C-N 3.28Å; S480-S482 PolarHBondContact O-N 3.32Å
483	F	86.2	Confident	82.9	Confident	58 Å²	58	67.1 Å²	67.1	25%	0.254	37%	0.371	S	S	.	.	H	α-helix	trans	-81	-34.5	-170.3	-73.6	0.9	0	0	0	114	I403 T406 L407 V479 L487	I403-F483 HydrophobicContact CG2-CB 3.54Å; I403-F483 HydrophobicContact CG2-CD1 4.44Å; I403-F483 HydrophobicContact CG2-CD2 3.89Å; I403-F483 HydrophobicContact CG2-CG 3.71Å; T406-F483 HydrophobicContact CG2-CE2 3.92Å; T406-F483 HydrophobicContact CG2-CZ 4.5Å; L407-F483 HydrophobicContact CD1-CB 4.2Å; L407-F483 HydrophobicContact CD1-CD2 4.38Å; L407-F483 HydrophobicContact CD2-CB 4.43Å; L407-F483 HydrophobicContact CD2-CD2 3.73Å; L407-F483 HydrophobicContact CG-CB 4.48Å; L407-F483 HydrophobicContact CG-CD2 3.8Å; V479-F483 HydrophobicContact CG1-CD2 3.45Å; V479-F483 VanDerWaalsContact CG1-CD2 3.45Å; V479-F483 HydrophobicContact CG1-CE2 3.53Å; V479-F483 HydrophobicContact CG1-CG 4.21Å; V479-F483 HydrophobicContact CG1-CZ 4.31Å; V479-F483 VanDerWaalsContact O-CB 3.23Å; V479-F483 WeakPolarHBondContact O-CB 3.36Å; V479-F483 WeakPolarHBondContact O-CG 3.29Å; V479-F483 PolarHBondContact O-N 3.48Å; F483-L487 WeakPolarHBondContact O-CG 3.34Å; F483-L487 PolarHBondContact O-N 2.98Å
484	V	84	Confident	81.3	Confident	85 Å²	85	67.7 Å²	67.7	52%	0.515	37%	0.374	S	S	.	.	H	α-helix	trans	-68.7	-46.2	-178.2	176.8	0	0	0	0	112.3	S480 E486 L487 F488	S480-V484 WeakPolarHBondContact O-CB 3.34Å; S480-V484 WeakPolarHBondContact O-CG2 3.2Å; S480-V484 PolarHBondContact O-N 3.1Å; S480-V484 VanDerWaalsContact O-N 3.11Å; V484-E486 VanDerWaalsContact C-N 3.34Å; V484-E486 PolarHBondContact O-N 3.1Å; V484-L487 PolarHBondContact O-N 3.39Å; V484-F488 PolarHBondContact O-N 3.46Å
485	P	85.6	Confident	79.4	Confident	75 Å²	75	73.3 Å²	73.3	49%	0.487	39%	0.386	S	S	.	.	H	α-helix	trans	-62.5	-38.9	175.7	-24.7	36.5	0	0	0	113	A481 F488 R489	A481-P485 WeakPolarHBondContact O-CD 3.26Å; A481-P485 VanDerWaalsContact O-CG 3.23Å; A481-P485 WeakPolarHBondContact O-CG 3.42Å; P485-F488 PolarHBondContact O-N 3.36Å; P485-R489 WeakPolarHBondContact O-CB 3.39Å; P485-R489 PolarHBondContact O-N 2.88Å
486	E	84.3	Confident	77.5	Confident	56 Å²	56	73.5 Å²	73.5	26%	0.262	39%	0.387	S	S	.	.	H	α-helix	trans	-68.5	-36.2	179.4	-171.4	58.9	-160.2	0	0	111.9	I403 V484 R489 N490	I403-E486 HydrophobicContact CD1-CB 4.28Å; I403-E486 HydrophobicContact CD1-CG 3.97Å; V484-E486 VanDerWaalsContact C-N 3.34Å; V484-E486 PolarHBondContact O-N 3.1Å; E486-R489 IonicContact OE1-CZ 3.45Å; E486-R489 IonicContact OE1-NE 2.7Å; E486-R489 IonicContact OE1-NH2 3.48Å; E486-R489 PolarHBondContact OE1-NH2 2.91Å; E486-R489 IonicContact OE2-CZ 2.76Å; E486-R489 IonicContact OE2-NE 2.7Å; E486-R489 PolarHBondContact OE2-NE 3.33Å; E486-R489 VanDerWaalsContact OE2-NE 3.16Å; E486-R489 IonicContact OE2-NH2 2.68Å; E486-R489 PolarHBondContact OE2-NH2 3.27Å; E486-N490 WeakPolarHBondContact O-CB 3.22Å; E486-N490 PolarHBondContact O-N 3.2Å; E486-N490 VanDerWaalsContact O-N 3.15Å; E486-N490 PolarHBondContact O-ND2 3.14Å; E486-N490 PolarHBondContact OE1-ND2 2.98Å
487	L	85.1	Confident	75.8	Confident	26 Å²	26	76.7 Å²	76.7	14%	0.136	40%	0.404	C	S	.	.	H	α-helix	trans	-60.8	-48.7	169	-78.1	168.4	0	0	0	110.9	I403 V404 L407 F483 V484 R489 N490 F491	I403-L487 HydrophobicContact CB-CD2 4.18Å; I403-L487 HydrophobicContact CB-CG 4.3Å; I403-L487 HydrophobicContact CD1-CD2 4.49Å; I403-L487 HydrophobicContact CD1-CG 4.43Å; I403-L487 HydrophobicContact CG2-CD1 3.68Å; I403-L487 HydrophobicContact CG2-CD2 4.12Å; I403-L487 HydrophobicContact CG2-CG 3.73Å; V404-L487 HydrophobicContact CG2-CD1 4.49Å; V404-L487 HydrophobicContact CG2-CD2 4.02Å; L407-L487 HydrophobicContact CD1-CD1 4.31Å; F483-L487 WeakPolarHBondContact O-CG 3.34Å; F483-L487 PolarHBondContact O-N 2.98Å; V484-L487 PolarHBondContact O-N 3.39Å; L487-R489 PolarHBondContact O-N 2.84Å; L487-N490 PolarHBondContact O-N 3.13Å; L487-F491 HydrophobicContact CD2-CE2 4.43Å; L487-F491 WeakPolarHBondContact O-CD2 3.45Å; L487-F491 PolarHBondContact O-N 3.3Å
488	F	82.4	Confident	74	Confident	144 Å²	144	75.2 Å²	75.2	63%	0.632	40%	0.404	S	S	*	.	H	α-helix	trans	-60.6	-44.1	-179.5	-174.8	-98.3	0	0	0	112.4	V484 P485 N490 F491 N492	V484-F488 PolarHBondContact O-N 3.46Å; P485-F488 PolarHBondContact O-N 3.36Å; F488-N490 PolarHBondContact O-N 2.88Å; F488-F491 PolarHBondContact O-N 3.43Å; F488-N492 WeakPolarHBondContact O-CB 3.49Å; F488-N492 PolarHBondContact O-N 3.46Å
489	R	79.2	Confident	72.4	Confident	144 Å²	144	77.5 Å²	77.5	54%	0.543	41%	0.413	S	S	.	.	H	α-helix	trans	-58.9	-45.6	176.7	-169.6	175	75.9	150.5	2.6	111.8	P485 E486 L487 N492 N493	P485-R489 WeakPolarHBondContact O-CB 3.39Å; P485-R489 PolarHBondContact O-N 2.88Å; E486-R489 IonicContact OE1-CZ 3.45Å; E486-R489 IonicContact OE1-NE 2.7Å; E486-R489 IonicContact OE1-NH2 3.48Å; E486-R489 PolarHBondContact OE1-NH2 2.91Å; E486-R489 IonicContact OE2-CZ 2.76Å; E486-R489 IonicContact OE2-NE 2.7Å; E486-R489 PolarHBondContact OE2-NE 3.33Å; E486-R489 VanDerWaalsContact OE2-NE 3.16Å; E486-R489 IonicContact OE2-NH2 2.68Å; E486-R489 PolarHBondContact OE2-NH2 3.27Å; L487-R489 PolarHBondContact O-N 2.84Å; R489-N492 PolarHBondContact O-N 2.96Å; R489-N493 PolarHBondContact O-N 3.5Å; R489-N493 VanDerWaalsContact O-N 3.13Å
490	N	76.5	Confident	71.3	Confident	11 Å²	11	81.9 Å²	81.9	6%	0.059	44%	0.435	C	S	.	.	H	α-helix	trans	-67.5	-34.6	178.4	-74.5	-45.2	0	0	0	112.7	E486 L487 F488 N494	E486-N490 WeakPolarHBondContact O-CB 3.22Å; E486-N490 PolarHBondContact O-N 3.2Å; E486-N490 VanDerWaalsContact O-N 3.15Å; E486-N490 PolarHBondContact O-ND2 3.14Å; E486-N490 PolarHBondContact OE1-ND2 2.98Å; L487-N490 PolarHBondContact O-N 3.13Å; F488-N490 PolarHBondContact O-N 2.88Å; N490-N494 PolarHBondContact O-ND2 2.77Å; N490-N494 VanDerWaalsContact O-ND2 3.15Å
491	F	73.7	Confident	70.9	Confident	122 Å²	122	90 Å²	90	54%	0.535	46%	0.462	S	S	.	.	H	α-helix	trans	-69.4	-43.3	173.1	-84	-67.5	0	0	0	112.6	L487 F488 N493 N494	L487-F491 HydrophobicContact CD2-CE2 4.43Å; L487-F491 WeakPolarHBondContact O-CD2 3.45Å; L487-F491 PolarHBondContact O-N 3.3Å; F488-F491 PolarHBondContact O-N 3.43Å; F491-N493 PolarHBondContact O-N 3.03Å; F491-N494 WeakPolarHBondContact O-CB 3.43Å; F491-N494 PolarHBondContact O-N 2.92Å
492	N	69.5	Low	70.8	Confident	80 Å²	80	86.9 Å²	86.9	43%	0.428	44%	0.436	S	S	.	.	H	α-helix	trans	-66	-40.5	-177.5	-164.4	30.5	0	0	0	111.9	F488 R489 N494 Y495 T496	F488-N492 WeakPolarHBondContact O-CB 3.49Å; F488-N492 PolarHBondContact O-N 3.46Å; R489-N492 PolarHBondContact O-N 2.96Å; N492-N494 PolarHBondContact O-N 2.86Å; N492-N494 VanDerWaalsContact O-N 3.15Å; N492-Y495 PolarHBondContact O-N 2.8Å; N492-T496 PolarHBondContact O-N 2.88Å; N492-T496 PolarHBondContact O-OG1 3.47Å; N492-T496 VanDerWaalsContact O-OG1 3.13Å
493	N	63.3	Low	70.6	Confident	56 Å²	56	91.2 Å²	91.2	30%	0.299	45%	0.449	S	S	.	.	H	α-helix	trans	-58.4	-28.3	176.1	-75.7	-14.7	0	0	0	113.4	R489 F491 N497	R489-N493 PolarHBondContact O-N 3.5Å; R489-N493 VanDerWaalsContact O-N 3.13Å; F491-N493 PolarHBondContact O-N 3.03Å; N493-N497 WeakPolarHBondContact O-CB 3.42Å; N493-N497 PolarHBondContact O-N 3.3Å
494	N	56.7	Low	70	Confident	76 Å²	76	90.1 Å²	90.1	41%	0.406	45%	0.448	S	S	.	.	H	α-helix	trans	-74.2	-31.3	176	-69.9	-32.8	0	0	0	112.8	N490 F491 N492	N490-N494 PolarHBondContact O-ND2 2.77Å; N490-N494 VanDerWaalsContact O-ND2 3.15Å; F491-N494 WeakPolarHBondContact O-CB 3.43Å; F491-N494 PolarHBondContact O-N 2.92Å; N492-N494 PolarHBondContact O-N 2.86Å; N492-N494 VanDerWaalsContact O-N 3.15Å
495	Y	50.2	Low	69.6	Low	203 Å²	203	90.6 Å²	90.6	80%	0.796	45%	0.447	S	S	*	.	H	α-helix	trans	-80.1	-34.3	177.3	-82.8	-78.7	0	0	0	112.4	N492	N492-Y495 PolarHBondContact O-N 2.8Å
496	T	49.8	Very low	68.9	Low	83 Å²	83	93 Å²	93	51%	0.509	47%	0.466	S	S	.	.	H	α-helix	trans	-86.7	-30.1	-173.8	54.6	0	0	0	0	113.8	N492	N492-T496 PolarHBondContact O-N 2.88Å; N492-T496 PolarHBondContact O-OG1 3.47Å; N492-T496 VanDerWaalsContact O-OG1 3.13Å
497	N	51.3	Low	68.2	Low	70 Å²	70	93.9 Å²	93.9	37%	0.374	49%	0.489	S	S	.	.	H	α-helix	trans	-115.5	-19.1	-161.6	-70.6	-23.4	0	0	0	118.4	N493 L570	N493-N497 WeakPolarHBondContact O-CB 3.42Å; N493-N497 PolarHBondContact O-N 3.3Å; N497-L570 HydrophobicContact CB-CD2 4.48Å
498	S	50.4	Low	67.6	Low	70 Å²	70	95 Å²	95	49%	0.49	49%	0.494	S	S	.	.	S	Bend	trans	-150.4	39.8	-146.2	67.6	0	0	0	0	121.6
499	S	53.3	Low	67.7	Low	92 Å²	92	94 Å²	94	64%	0.643	49%	0.486	S	S	*	.			trans	-162.7	-14.7	156.5	59.6	0	0	0	0	120.3	R501	S499-R501 PolarHBondContact O-N 2.71Å; S499-R501 VanDerWaalsContact O-N 3.13Å
500	D	63.3	Low	68.2	Low	116 Å²	116	87.3 Å²	87.3	62%	0.62	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-65	124.7	-172.3	-80.5	0.2	0	0	0	111.3	F569 R581	D500-F569 HydrophobicContact CB-CE1 4.38Å; D500-F569 WeakPolarHBondContact O-CE1 3.35Å; D500-R581 WeakPolarHBondContact O-CD 3.32Å; D500-R581 VanDerWaalsContact O-CG 3.23Å; D500-R581 WeakPolarHBondContact O-CG 3.21Å
501	R	73.4	Confident	69	Low	195 Å²	195	86.8 Å²	86.8	74%	0.736	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-89.2	143.1	167.7	-65.9	179.2	-175.8	178.3	1.8	107.6	S499 E503 R581	S499-R501 PolarHBondContact O-N 2.71Å; S499-R501 VanDerWaalsContact O-N 3.13Å; R501-E503 PolarHBondContact O-N 3.27Å; R501-E503 VanDerWaalsContact O-N 3.11Å; R501-R581 HydrophobicContact CG-CG 4.31Å
502	Y	83.3	Confident	70	Confident	5 Å²	5	81 Å²	81	2%	0.02	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-65.2	117.2	171.9	-179.3	-104.4	0	0	0	109.1	P504 H510 N542 V544 F569 R581 K583	Y502-P504 HydrophobicContact CD1-CB 4.45Å; Y502-P504 HydrophobicContact CE1-CB 3.96Å; Y502-P504 WeakPolarHBondContact O-CD 3.4Å; Y502-H510 HydrophobicContact CE1-CB 3.84Å; Y502-H510 AromaticContact CE1-CE1 3.99Å; Y502-H510 AromaticContact CE1-CG 3.53Å; Y502-H510 AromaticContact CE1-ND1 3.47Å; Y502-H510 WeakPolarHBondContact CE1-ND1 3.1Å; Y502-N542 WeakPolarHBondContact OH-CB 3.46Å; Y502-N542 PolarHBondContact OH-ND2 3.05Å; Y502-V544 HydrophobicContact CD1-CG2 4.35Å; Y502-V544 HydrophobicContact CD2-CG2 3.71Å; Y502-V544 HydrophobicContact CE1-CG2 4.37Å; Y502-V544 HydrophobicContact CE2-CG2 3.73Å; Y502-V544 HydrophobicContact CG-CG2 4.03Å; Y502-F569 HydrophobicContact CD2-CE2 4.18Å; Y502-F569 HydrophobicContact CD2-CZ 4.29Å; Y502-R581 PolarHBondContact N-O 3.35Å; Y502-K583 WeakPolarHBondContact O-CD 3.44Å; Y502-K583 WeakPolarHBondContact O-CE 3.34Å
503	E	80.8	Confident	71.2	Confident	148 Å²	148	77.1 Å²	77.1	69%	0.692	41%	0.412	S	S	*	.			trans	-93	110.8	172.5	-67.9	-168	162.9	0	0	109.1	R501 I505	R501-E503 PolarHBondContact O-N 3.27Å; R501-E503 VanDerWaalsContact O-N 3.11Å; E503-I505 PolarHBondContact O-N 2.95Å
504	P	73.1	Confident	72.7	Confident	35 Å²	35	74.5 Å²	74.5	23%	0.227	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-74.8	127	-179.4	30.8	-27.4	0	0	0	107.3	Y502 S506 K583 E586	Y502-P504 HydrophobicContact CD1-CB 4.45Å; Y502-P504 HydrophobicContact CE1-CB 3.96Å; Y502-P504 WeakPolarHBondContact O-CD 3.4Å; P504-S506 PolarHBondContact O-N 2.8Å; P504-K583 HydrophobicContact CG-CD 3.76Å; P504-E586 WeakPolarHBondContact CG-OE2 3.26Å
505	I	77.1	Confident	74.2	Confident	95 Å²	95	71.2 Å²	71.2	49%	0.487	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-69.4	126.1	171.5	-62.4	163.9	0	0	0	106.8	E503 G507 E508	E503-I505 PolarHBondContact O-N 2.95Å; I505-G507 PolarHBondContact O-N 2.88Å; I505-E508 HydrophobicContact CB-CB 4.19Å; I505-E508 HydrophobicContact CB-CG 4.26Å; I505-E508 VanDerWaalsContact CD1-OE2 3.29Å; I505-E508 WeakPolarHBondContact CD1-OE2 3.4Å; I505-E508 HydrophobicContact CG2-CG 4.12Å; I505-E508 PolarHBondContact O-N 3.3Å
506	S	69.7	Low	76	Confident	126 Å²	126	64.7 Å²	64.7	88%	0.881	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	123.5	-178.3	-171.9	0	0	0	0	110.7	P504	P504-S506 PolarHBondContact O-N 2.8Å
507	G	70.3	Confident	77.8	Confident	74 Å²	74	60.8 Å²	60.8	76%	0.763	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	-22.6	-177.4	0	0	0	0	0	115.1	I505	I505-G507 PolarHBondContact O-N 2.88Å
508	E	72.5	Confident	79.5	Confident	49 Å²	49	60.8 Å²	60.8	23%	0.229	34%	0.337	C	S	.	.			trans	-88.1	131.4	174.4	-62.2	-169.7	158.7	0	0	110.2	I505 N542	I505-E508 HydrophobicContact CB-CB 4.19Å; I505-E508 HydrophobicContact CB-CG 4.26Å; I505-E508 VanDerWaalsContact CD1-OE2 3.29Å; I505-E508 WeakPolarHBondContact CD1-OE2 3.4Å; I505-E508 HydrophobicContact CG2-CG 4.12Å; I505-E508 PolarHBondContact O-N 3.3Å; E508-N542 PolarHBondContact OE2-ND2 2.86Å
509	R	83.5	Confident	81.2	Confident	125 Å²	125	59.6 Å²	59.6	47%	0.472	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	150.7	173.7	-62.4	-173.6	-173.4	179.9	2.3	108.6	I541 N542 R588	R509-I541 WeakPolarHBondContact O-CA 3.36Å; R509-N542 PolarHBondContact O-N 3.24Å; R509-R588 HydrophobicContact CB-CB 4.18Å
510	H	91.1	Very high	82.7	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.009	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	159.6	174	67.1	-80.8	0	0	0	111.4	Y502 N542 V544 T582 K583 A587 R588	Y502-H510 HydrophobicContact CE1-CB 3.84Å; Y502-H510 AromaticContact CE1-CE1 3.99Å; Y502-H510 AromaticContact CE1-CG 3.53Å; Y502-H510 AromaticContact CE1-ND1 3.47Å; Y502-H510 WeakPolarHBondContact CE1-ND1 3.1Å; H510-N542 CarbonylContact C-O 3.59Å; H510-N542 WeakPolarHBondContact CA-O 3.46Å; H510-N542 HydrophobicContact CB-CB 4.3Å; H510-V544 HydrophobicContact CB-CG2 4.24Å; H510-T582 PolarHBondContact NE2-O 3.42Å; H510-T582 VanDerWaalsContact NE2-O 3.15Å; H510-K583 PolarHBondContact CE1-O 3.02Å; H510-K583 PolarHBondContact NE2-O 3.37Å; H510-A587 PolarHBondContact CE1-N 3.36Å; H510-A587 WeakPolarHBondContact NE2-CB 3.32Å; H510-R588 PolarHBondContact O-N 3.32Å
511	V	93.1	Very high	83.7	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	139.6	173.7	166.1	0	0	0	0	107.8	V513 F529 I541 N542 V544 A589 F591 F1115	V511-V513 HydrophobicContact CG1-CG2 4.41Å; V511-F529 HydrophobicContact CG2-CZ 4.3Å; V511-I541 HydrophobicContact CB-CG2 4.17Å; V511-I541 HydrophobicContact CG2-CG2 3.54Å; V511-N542 PolarHBondContact N-O 3.49Å; V511-V544 PolarHBondContact O-N 3.2Å; V511-A589 WeakPolarHBondContact CA-O 3.4Å; V511-A589 HydrophobicContact CG2-CB 4.33Å; V511-F591 HydrophobicContact CG1-CD2 3.34Å; V511-F591 HydrophobicContact CG1-CE2 3.52Å; V511-F1115 HydrophobicContact CG2-CE2 4.43Å; V511-F1115 HydrophobicContact CG2-CZ 4.12Å
512	I	94.6	Very high	84.5	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	133.3	176.6	-63.9	167	0	0	0	108.3	C514 V544 L584 A587 A589 A590 F591	I512-C514 WeakPolarHBondContact CG2-SG 3.13Å; I512-V544 CarbonylContact C-O 3.41Å; I512-V544 WeakPolarHBondContact CA-O 3.19Å; I512-V544 HydrophobicContact CG1-CB 4.33Å; I512-L584 HydrophobicContact CD1-CB 4.09Å; I512-L584 HydrophobicContact CD1-CD1 3.55Å; I512-L584 HydrophobicContact CD1-CG 4.46Å; I512-A587 HydrophobicContact CD1-CB 3.88Å; I512-A587 HydrophobicContact CG1-CB 4.25Å; I512-A589 PolarHBondContact N-O 3.17Å; I512-A589 VanDerWaalsContact N-O 3.14Å; I512-A590 HydrophobicContact CB-CB 4.43Å; I512-A590 CarbonylContact O-C 3.57Å; I512-A590 WeakPolarHBondContact O-CA 3.47Å; I512-F591 PolarHBondContact O-N 2.82Å
513	V	94.8	Very high	84.7	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	117.2	175.4	-176	0	0	0	0	107.5	V511 F517 I522 F525 M543 V544 L545 L546 F591 L593	V511-V513 HydrophobicContact CG1-CG2 4.41Å; V513-F517 HydrophobicContact CG1-CE1 4.34Å; V513-I522 HydrophobicContact CG1-CD1 4.5Å; V513-F525 HydrophobicContact CG1-CE1 4.34Å; V513-F525 HydrophobicContact CG2-CE1 3.91Å; V513-F525 HydrophobicContact CG2-CZ 4.49Å; V513-M543 HydrophobicContact CG2-CE 4.35Å; V513-M543 HydrophobicContact CG2-CG 3.63Å; V513-M543 HydrophobicContact CG2-SD 3.86Å; V513-V544 PolarHBondContact N-O 3.07Å; V513-L545 HydrophobicContact CB-CD2 3.66Å; V513-L545 HydrophobicContact CG1-CD2 4.08Å; V513-L545 HydrophobicContact CG2-CD2 4.09Å; V513-L545 WeakPolarHBondContact O-CA 3.36Å; V513-L546 PolarHBondContact O-N 3.15Å; V513-F591 WeakPolarHBondContact CA-O 3.33Å; V513-F591 HydrophobicContact CG1-CB 4.28Å; V513-F591 HydrophobicContact CG2-CB 4.28Å; V513-F591 HydrophobicContact CG2-CD2 4.28Å; V513-L593 HydrophobicContact CG1-CD1 3.6Å; V513-L593 HydrophobicContact CG1-CG 3.96Å
514	C	94	Very high	84.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	-174	178.9	-58.4	0	0	0	0	109.4	I512 P573 F591 I592 L593	I512-C514 WeakPolarHBondContact CG2-SG 3.13Å; C514-P573 HydrophobicContact CB-CG 4.23Å; C514-F591 PolarHBondContact N-O 3.44Å; C514-I592 WeakPolarHBondContact O-CA 3.29Å; C514-L593 PolarHBondContact O-N 3.09Å
515	G	89.2	Confident	85.7	Confident	7 Å²	7	42.1 Å²	42.1	7%	0.072	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	94.5	-176.3	-179.3	0	0	0	0	0	112.1	L593	G515-L593 VanDerWaalsContact CA-O 3.27Å; G515-L593 WeakPolarHBondContact CA-O 3.43Å
516	N	88.1	Confident	86.3	Confident	67 Å²	67	37.6 Å²	37.6	36%	0.358	21%	0.213	S	C	.	.			trans	-95.1	140.7	173.5	-160.8	20.7	0	0	0	109.4	R547 L593 A594 T595 E604	N516-R547 PolarHBondContact OD1-NH2 3.38Å; N516-L593 PolarHBondContact N-O 2.82Å; N516-L593 CarbonylContact O-C 3.41Å; N516-A594 CarbonylContact O-C 3.49Å; N516-A594 WeakPolarHBondContact O-CA 3.44Å; N516-T595 VanDerWaalsContact C-OG1 3.28Å; N516-T595 PolarHBondContact ND2-OG1 3.31Å; N516-T595 PolarHBondContact O-N 2.64Å; N516-T595 VanDerWaalsContact O-N 3.14Å; N516-E604 WeakPolarHBondContact CB-OE1 3.5Å
517	F	87.9	Confident	87	Confident	1 Å²	1	35.5 Å²	35.5	0%	0.004	19%	0.188	C	C	.	.			trans	-159.1	150.6	177.6	52.1	-101.4	0	0	0	110.6	V513 I522 R547 L593 T595	V513-F517 HydrophobicContact CG1-CE1 4.34Å; F517-I522 HydrophobicContact CD2-CB 3.51Å; F517-I522 HydrophobicContact CD2-CD1 4.04Å; F517-I522 HydrophobicContact CD2-CG1 3.86Å; F517-I522 HydrophobicContact CD2-CG2 4.02Å; F517-I522 HydrophobicContact CE1-CD1 4.37Å; F517-I522 HydrophobicContact CE2-CB 3.77Å; F517-I522 HydrophobicContact CE2-CD1 3.82Å; F517-I522 HydrophobicContact CE2-CG1 3.59Å; F517-I522 HydrophobicContact CE2-CG2 4.15Å; F517-I522 HydrophobicContact CG-CB 4.29Å; F517-I522 HydrophobicContact CG-CD1 4.37Å; F517-I522 HydrophobicContact CZ-CD1 3.97Å; F517-I522 HydrophobicContact CZ-CG1 4.19Å; F517-R547 HydrophobicContact CE1-CG 3.97Å; F517-R547 VanDerWaalsContact CZ-CD 3.45Å; F517-R547 HydrophobicContact CZ-CG 3.77Å; F517-R547 PolarHBondContact O-NH2 2.8Å; F517-L593 HydrophobicContact CB-CB 4.43Å; F517-L593 HydrophobicContact CB-CD1 4.4Å; F517-L593 HydrophobicContact CD1-CB 4.29Å; F517-L593 HydrophobicContact CD1-CD1 4.03Å; F517-L593 HydrophobicContact CG-CD1 4.4Å; F517-T595 VanDerWaalsContact CA-OG1 3.25Å; F517-T595 WeakPolarHBondContact CA-OG1 3.46Å; F517-T595 PolarHBondContact N-OG1 3.47Å; F517-T595 VanDerWaalsContact N-OG1 3.17Å
518	D	85.7	Confident	87.5	Confident	70 Å²	70	32.1 Å²	32.1	37%	0.374	15%	0.153	S	C	.	.			trans	-88.9	166.6	176.7	-56.2	-21.7	0	0	0	111.1	E520 S521 I522 T595	D518-E520 VanDerWaalsContact C-N 3.32Å; D518-E520 PolarHBondContact O-N 3.36Å; D518-S521 PolarHBondContact N-OG 3.1Å; D518-S521 VanDerWaalsContact N-OG 3.12Å; D518-S521 PolarHBondContact O-N 3.4Å; D518-S521 PolarHBondContact O-OG 2.7Å; D518-I522 VanDerWaalsContact O-CG2 3.26Å; D518-I522 WeakPolarHBondContact O-CG2 3.46Å; D518-I522 PolarHBondContact O-N 3.01Å; D518-T595 VanDerWaalsContact CG-CG2 3.5Å; D518-T595 WeakPolarHBondContact OD1-CG2 3.31Å; D518-T595 PolarHBondContact OD1-OG1 2.71Å; D518-T595 WeakPolarHBondContact OD2-CG2 3.21Å
519	N	87.1	Confident	88.1	Confident	44 Å²	44	29.8 Å²	29.8	24%	0.235	14%	0.142	C	C	.	.	H	α-helix	trans	-61.9	-36.7	-179.9	-69.5	-21	0	0	0	112.6	I522 R523 D552 I558	N519-I522 VanDerWaalsContact O-CG2 3.28Å; N519-I522 WeakPolarHBondContact O-CG2 3.5Å; N519-R523 VanDerWaalsContact O-CB 3.31Å; N519-R523 WeakPolarHBondContact O-CB 3.39Å; N519-R523 PolarHBondContact O-N 2.76Å; N519-D552 PolarHBondContact ND2-OD2 2.87Å; N519-I558 HydrophobicContact CB-CD1 3.86Å; N519-I558 WeakPolarHBondContact O-CD1 3.37Å
520	E	83.1	Confident	88.1	Confident	89 Å²	89	24.7 Å²	24.7	42%	0.416	12%	0.124	S	C	.	.	H	α-helix	trans	-77.9	-39.7	178.1	-69.6	-60.6	166.9	0	0	112.8	D518 I522 R523 A524	D518-E520 VanDerWaalsContact C-N 3.32Å; D518-E520 PolarHBondContact O-N 3.36Å; E520-I522 PolarHBondContact O-N 3.4Å; E520-R523 WeakPolarHBondContact O-CB 3.46Å; E520-R523 PolarHBondContact O-N 3.45Å; E520-R523 IonicContact OE2-NH1 3.85Å; E520-A524 PolarHBondContact O-N 2.96Å
521	S	85.8	Confident	87.4	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.007	14%	0.14	C	C	.	.	H	α-helix	trans	-66.8	-38.8	179.5	67.3	0	0	0	0	112	D518 A524 F525	D518-S521 PolarHBondContact N-OG 3.1Å; D518-S521 VanDerWaalsContact N-OG 3.12Å; D518-S521 PolarHBondContact O-N 3.4Å; D518-S521 PolarHBondContact O-OG 2.7Å; S521-A524 PolarHBondContact O-N 2.94Å; S521-F525 WeakPolarHBondContact O-CB 3.25Å; S521-F525 PolarHBondContact O-N 3.45Å
522	I	89.6	Confident	86.2	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-68.7	-34.7	173.4	-166.1	62.3	0	0	0	112.2	V513 F517 D518 N519 E520 F525 I526 L545 L555 L593	V513-I522 HydrophobicContact CG1-CD1 4.5Å; F517-I522 HydrophobicContact CD2-CB 3.51Å; F517-I522 HydrophobicContact CD2-CD1 4.04Å; F517-I522 HydrophobicContact CD2-CG1 3.86Å; F517-I522 HydrophobicContact CD2-CG2 4.02Å; F517-I522 HydrophobicContact CE1-CD1 4.37Å; F517-I522 HydrophobicContact CE2-CB 3.77Å; F517-I522 HydrophobicContact CE2-CD1 3.82Å; F517-I522 HydrophobicContact CE2-CG1 3.59Å; F517-I522 HydrophobicContact CE2-CG2 4.15Å; F517-I522 HydrophobicContact CG-CB 4.29Å; F517-I522 HydrophobicContact CG-CD1 4.37Å; F517-I522 HydrophobicContact CZ-CD1 3.97Å; F517-I522 HydrophobicContact CZ-CG1 4.19Å; D518-I522 VanDerWaalsContact O-CG2 3.26Å; D518-I522 WeakPolarHBondContact O-CG2 3.46Å; D518-I522 PolarHBondContact O-N 3.01Å; N519-I522 VanDerWaalsContact O-CG2 3.28Å; N519-I522 WeakPolarHBondContact O-CG2 3.5Å; E520-I522 PolarHBondContact O-N 3.4Å; I522-F525 HydrophobicContact CD1-CD1 4.09Å; I522-F525 PolarHBondContact O-N 2.7Å; I522-I526 HydrophobicContact CD1-CD1 4.37Å; I522-I526 HydrophobicContact CD1-CG1 4.31Å; I522-I526 HydrophobicContact CG1-CD1 3.81Å; I522-I526 HydrophobicContact CG1-CG1 4.19Å; I522-I526 WeakPolarHBondContact O-CB 3.46Å; I522-I526 VanDerWaalsContact O-CG1 3.26Å; I522-I526 WeakPolarHBondContact O-CG1 3.28Å; I522-I526 PolarHBondContact O-N 3.14Å; I522-L545 HydrophobicContact CD1-CD2 4.1Å; I522-L555 HydrophobicContact CG2-CD1 3.68Å; I522-L593 HydrophobicContact CD1-CD1 4.19Å
523	R	88.3	Confident	84.6	Confident	102 Å²	102	29.9 Å²	29.9	39%	0.385	15%	0.149	S	C	.	.	H	α-helix	trans	-63.2	-46.1	175	-176.1	-179.6	-169.7	-178.4	3.4	111.2	N519 E520 K527 I558	N519-R523 VanDerWaalsContact O-CB 3.31Å; N519-R523 WeakPolarHBondContact O-CB 3.39Å; N519-R523 PolarHBondContact O-N 2.76Å; E520-R523 WeakPolarHBondContact O-CB 3.46Å; E520-R523 PolarHBondContact O-N 3.45Å; E520-R523 IonicContact OE2-NH1 3.85Å; R523-K527 WeakPolarHBondContact O-CB 3.43Å; R523-K527 WeakPolarHBondContact O-CG 3.32Å; R523-K527 PolarHBondContact O-N 2.68Å; R523-K527 VanDerWaalsContact O-N 3.08Å; R523-I558 HydrophobicContact CB-CG2 4.06Å; R523-I558 HydrophobicContact CG-CG2 4.17Å
524	A	84.4	Confident	83.3	Confident	32 Å²	32	36 Å²	36	26%	0.264	18%	0.178	S	C	.	.	H	α-helix	trans	-61	-44.5	175.2	0	0	0	0	0	111.4	E520 S521 G528	E520-A524 PolarHBondContact O-N 2.96Å; S521-A524 PolarHBondContact O-N 2.94Å; A524-G528 PolarHBondContact O-N 2.94Å
525	F	89.5	Confident	81.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.4	-48.4	177.9	179.1	-103.2	0	0	0	112.9	V513 S521 I522 K527 G528 F529 M543 F591 L593 L1111	V513-F525 HydrophobicContact CG1-CE1 4.34Å; V513-F525 HydrophobicContact CG2-CE1 3.91Å; V513-F525 HydrophobicContact CG2-CZ 4.49Å; S521-F525 WeakPolarHBondContact O-CB 3.25Å; S521-F525 PolarHBondContact O-N 3.45Å; I522-F525 HydrophobicContact CD1-CD1 4.09Å; I522-F525 PolarHBondContact O-N 2.7Å; F525-K527 PolarHBondContact O-N 2.92Å; F525-G528 PolarHBondContact O-N 2.97Å; F525-F529 HydrophobicContact CZ-CD2 4.23Å; F525-F529 WeakPolarHBondContact O-CB 3.38Å; F525-F529 PolarHBondContact O-N 2.94Å; F525-M543 HydrophobicContact CD1-CE 4.02Å; F525-M543 HydrophobicContact CD1-SD 4.45Å; F525-M543 HydrophobicContact CE1-CE 3.46Å; F525-M543 VanDerWaalsContact CE1-CE 3.46Å; F525-M543 HydrophobicContact CE1-SD 4.11Å; F525-M543 HydrophobicContact CZ-CE 4.35Å; F525-F591 HydrophobicContact CE2-CD1 4.02Å; F525-F591 AromaticContact CE2-CE1 3.89Å; F525-F591 HydrophobicContact CE2-CE1 3.89Å; F525-F591 HydrophobicContact CE2-CG 4.43Å; F525-F591 HydrophobicContact CE2-CZ 4.21Å; F525-F591 HydrophobicContact CZ-CB 4.5Å; F525-F591 AromaticContact CZ-CD1 3.9Å; F525-F591 HydrophobicContact CZ-CD1 3.9Å; F525-F591 AromaticContact CZ-CD2 3.89Å; F525-F591 HydrophobicContact CZ-CD2 3.89Å; F525-F591 AromaticContact CZ-CE1 3.92Å; F525-F591 HydrophobicContact CZ-CE1 3.92Å; F525-F591 AromaticContact CZ-CE2 3.93Å; F525-F591 HydrophobicContact CZ-CE2 3.93Å; F525-F591 AromaticContact CZ-CG 3.85Å; F525-F591 HydrophobicContact CZ-CG 3.85Å; F525-F591 AromaticContact CZ-CZ 3.91Å; F525-F591 HydrophobicContact CZ-CZ 3.91Å; F525-L593 HydrophobicContact CD1-CD1 4.36Å; F525-L593 HydrophobicContact CG-CD1 4.42Å; F525-L1111 HydrophobicContact CD2-CB 4.19Å; F525-L1111 HydrophobicContact CD2-CD1 4.46Å; F525-L1111 HydrophobicContact CE2-CB 4.01Å
526	I	89.4	Confident	80.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.7	-46.1	179.8	-71.3	170.5	0	0	0	110.5	I522 F529 L530 M543 L559 Y562 V566	I522-I526 HydrophobicContact CD1-CD1 4.37Å; I522-I526 HydrophobicContact CD1-CG1 4.31Å; I522-I526 HydrophobicContact CG1-CD1 3.81Å; I522-I526 HydrophobicContact CG1-CG1 4.19Å; I522-I526 WeakPolarHBondContact O-CB 3.46Å; I522-I526 VanDerWaalsContact O-CG1 3.26Å; I522-I526 WeakPolarHBondContact O-CG1 3.28Å; I522-I526 PolarHBondContact O-N 3.14Å; I526-F529 PolarHBondContact O-N 3.09Å; I526-L530 HydrophobicContact CG2-CD1 3.62Å; I526-L530 HydrophobicContact CG2-CG 4.2Å; I526-L530 WeakPolarHBondContact O-CB 3.15Å; I526-L530 WeakPolarHBondContact O-CG 3.27Å; I526-L530 PolarHBondContact O-N 3.36Å; I526-M543 HydrophobicContact CG1-CE 4.44Å; I526-M543 HydrophobicContact CG1-SD 3.94Å; I526-L559 HydrophobicContact CD1-CD2 3.55Å; I526-Y562 HydrophobicContact CG2-CD1 4.32Å; I526-Y562 HydrophobicContact CG2-CD2 3.92Å; I526-Y562 HydrophobicContact CG2-CE1 4.46Å; I526-Y562 HydrophobicContact CG2-CE2 4.08Å; I526-Y562 HydrophobicContact CG2-CG 4.04Å; I526-V566 HydrophobicContact CD1-CG1 4.49Å; I526-V566 HydrophobicContact CG2-CG2 4.38Å
527	K	84.2	Confident	78.9	Confident	83 Å²	83	39.8 Å²	39.8	36%	0.361	22%	0.217	S	C	.	.	H	α-helix	trans	-57.2	-54.7	176.8	-76.8	-179	177	-178.4	0	110.4	R523 F525 F529 L530 Y531	R523-K527 WeakPolarHBondContact O-CB 3.43Å; R523-K527 WeakPolarHBondContact O-CG 3.32Å; R523-K527 PolarHBondContact O-N 2.68Å; R523-K527 VanDerWaalsContact O-N 3.08Å; F525-K527 PolarHBondContact O-N 2.92Å; K527-F529 VanDerWaalsContact C-N 3.34Å; K527-F529 PolarHBondContact O-N 3.04Å; K527-L530 PolarHBondContact O-N 3.22Å; K527-Y531 HydrophobicContact CB-CD2 4.43Å; K527-Y531 HydrophobicContact CB-CE2 4.47Å; K527-Y531 WeakPolarHBondContact O-CB 3.13Å; K527-Y531 WeakPolarHBondContact O-CD2 2.89Å; K527-Y531 PolarHBondContact O-N 2.66Å
528	G	80.9	Confident	77.5	Confident	3 Å²	3	46.4 Å²	46.4	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-59	-42.7	179.3	0	0	0	0	0	113.1	A524 F525 G532 S1112	A524-G528 PolarHBondContact O-N 2.94Å; F525-G528 PolarHBondContact O-N 2.97Å; G528-G532 PolarHBondContact O-N 3.27Å; G528-S1112 PolarHBondContact O-OG 3.42Å
529	F	86.3	Confident	76.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66.5	-44.3	-178.4	-172.1	-92.3	0	0	0	113.5	V511 F525 I526 K527 C533 I541 M543 F591 F1115 Y1116	V511-F529 HydrophobicContact CG2-CZ 4.3Å; F525-F529 HydrophobicContact CZ-CD2 4.23Å; F525-F529 WeakPolarHBondContact O-CB 3.38Å; F525-F529 PolarHBondContact O-N 2.94Å; I526-F529 PolarHBondContact O-N 3.09Å; K527-F529 VanDerWaalsContact C-N 3.34Å; K527-F529 PolarHBondContact O-N 3.04Å; F529-C533 PolarHBondContact O-N 2.85Å; F529-C533 VanDerWaalsContact O-N 3.11Å; F529-I541 HydrophobicContact CE1-CB 4.34Å; F529-I541 HydrophobicContact CE1-CG2 4.18Å; F529-I541 HydrophobicContact CZ-CB 4.37Å; F529-I541 HydrophobicContact CZ-CG2 3.96Å; F529-M543 HydrophobicContact CB-CE 4Å; F529-M543 HydrophobicContact CD1-CE 3.45Å; F529-M543 VanDerWaalsContact CD1-CE 3.45Å; F529-M543 HydrophobicContact CD2-CE 4.42Å; F529-M543 HydrophobicContact CE1-CE 4Å; F529-M543 HydrophobicContact CG-CE 3.69Å; F529-F591 HydrophobicContact CD2-CE2 4.33Å; F529-F591 HydrophobicContact CD2-CZ 4.28Å; F529-F591 AromaticContact CE2-CE2 3.82Å; F529-F591 HydrophobicContact CE2-CE2 3.82Å; F529-F591 HydrophobicContact CE2-CZ 4.01Å; F529-F1115 AromaticContact CE2-CD1 3.69Å; F529-F1115 HydrophobicContact CE2-CD1 3.69Å; F529-F1115 AromaticContact CE2-CE1 3.85Å; F529-F1115 HydrophobicContact CE2-CE1 3.85Å; F529-F1115 HydrophobicContact CE2-CG 4.31Å; F529-F1115 HydrophobicContact CZ-CD1 4.39Å; F529-F1115 HydrophobicContact CZ-CE1 4.1Å; F529-Y1116 HydrophobicContact CD2-CE2 4.47Å; F529-Y1116 PolarHBondContact O-OH 3.27Å
530	L	83.2	Confident	75.6	Confident	17 Å²	17	53.6 Å²	53.6	9%	0.089	27%	0.265	C	S	.	.	H	α-helix	trans	-73.3	-38	179.9	-66.6	178.3	0	0	0	111.8	I526 K527 C533 Q534 Y562 W565	I526-L530 HydrophobicContact CG2-CD1 3.62Å; I526-L530 HydrophobicContact CG2-CG 4.2Å; I526-L530 WeakPolarHBondContact O-CB 3.15Å; I526-L530 WeakPolarHBondContact O-CG 3.27Å; I526-L530 PolarHBondContact O-N 3.36Å; K527-L530 PolarHBondContact O-N 3.22Å; L530-C533 VanDerWaalsContact O-CB 3.28Å; L530-C533 WeakPolarHBondContact O-CB 3.5Å; L530-C533 PolarHBondContact O-N 3.49Å; L530-Q534 WeakPolarHBondContact O-CG 3.37Å; L530-Q534 PolarHBondContact O-N 3.37Å; L530-Q534 VanDerWaalsContact O-N 3.12Å; L530-Y562 HydrophobicContact CD1-CD1 3.29Å; L530-Y562 HydrophobicContact CD1-CE1 3.69Å; L530-Y562 HydrophobicContact CD1-CG 4.01Å; L530-W565 HydrophobicContact CD1-CE3 4.26Å; L530-W565 HydrophobicContact CD2-CB 4.14Å; L530-W565 HydrophobicContact CD2-CG 4.44Å
531	Y	76.8	Confident	75.7	Confident	85 Å²	85	49.6 Å²	49.6	33%	0.333	25%	0.247	S	C	.	.	H	α-helix	trans	-65	-44.6	172.9	-79.1	-59.9	0	0	0	112	K527 C533 Q534 A535 G683	K527-Y531 HydrophobicContact CB-CD2 4.43Å; K527-Y531 HydrophobicContact CB-CE2 4.47Å; K527-Y531 WeakPolarHBondContact O-CB 3.13Å; K527-Y531 WeakPolarHBondContact O-CD2 2.89Å; K527-Y531 PolarHBondContact O-N 2.66Å; Y531-C533 PolarHBondContact O-N 3.29Å; Y531-Q534 PolarHBondContact O-N 3.13Å; Y531-Q534 VanDerWaalsContact O-N 3.08Å; Y531-A535 PolarHBondContact O-N 3.16Å; Y531-G683 VanDerWaalsContact CE1-CA 3.49Å
532	G	66.4	Low	75.8	Confident	7 Å²	7	50 Å²	50	7%	0.072	25%	0.248	C	C	.	.	H	α-helix	trans	-58.8	-32.6	174.8	0	0	0	0	0	113.1	G528 K536	G528-G532 PolarHBondContact O-N 3.27Å; G532-K536 PolarHBondContact O-N 3.48Å
533	C	61.2	Low	75.9	Confident	19 Å²	19	50 Å²	50	13%	0.128	25%	0.249	C	C	.	.	H	α-helix	trans	-64.8	-47.8	173.3	-175.5	0	0	0	0	111.8	F529 L530 Y531 G537 M539 Y1116	F529-C533 PolarHBondContact O-N 2.85Å; F529-C533 VanDerWaalsContact O-N 3.11Å; L530-C533 VanDerWaalsContact O-CB 3.28Å; L530-C533 WeakPolarHBondContact O-CB 3.5Å; L530-C533 PolarHBondContact O-N 3.49Å; Y531-C533 PolarHBondContact O-N 3.29Å; C533-G537 PolarHBondContact O-N 3.14Å; C533-M539 PolarHBondContact SG-O 3.41Å; C533-Y1116 WeakPolarHBondContact CA-OH 2.9Å; C533-Y1116 VanDerWaalsContact CB-OH 3.27Å; C533-Y1116 WeakPolarHBondContact CB-OH 3.37Å; C533-Y1116 PolarHBondContact N-OH 3.48Å
534	Q	68	Low	76.1	Confident	128 Å²	128	45.1 Å²	45.1	60%	0.598	23%	0.23	S	C	*	.	H	α-helix	trans	-65.1	-46.1	179.6	-69.6	178.2	-0.1	0	0	111.7	L530 Y531 K536 G537	L530-Q534 WeakPolarHBondContact O-CG 3.37Å; L530-Q534 PolarHBondContact O-N 3.37Å; L530-Q534 VanDerWaalsContact O-N 3.12Å; Y531-Q534 PolarHBondContact O-N 3.13Å; Y531-Q534 VanDerWaalsContact O-N 3.08Å; Q534-K536 PolarHBondContact O-N 3.28Å; Q534-G537 PolarHBondContact O-N 2.77Å
535	A	58	Low	76.5	Confident	49 Å²	49	43.6 Å²	43.6	41%	0.405	22%	0.218	S	C	.	.	H	α-helix	trans	-59.9	-33.3	-179.1	0	0	0	0	0	113	Y531	Y531-A535 PolarHBondContact O-N 3.16Å
536	K	63.7	Low	76.6	Confident	39 Å²	39	43.7 Å²	43.7	17%	0.17	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-7.3	177.6	-68.8	-167.5	174.2	-153	0	114.3	G532 Q534 R538 Y773 Y1116 N1117	G532-K536 PolarHBondContact O-N 3.48Å; Q534-K536 PolarHBondContact O-N 3.28Å; K536-R538 WeakPolarHBondContact O-CG 3.44Å; K536-R538 PolarHBondContact O-N 2.8Å; K536-Y773 HydrophobicContact CB-CD1 4.48Å; K536-Y773 HydrophobicContact CG-CD1 4.2Å; K536-Y773 HydrophobicContact CG-CE1 4.41Å; K536-Y773 HydrophobicContact CG-CG 4.36Å; K536-Y1116 HydrophobicContact CD-CD1 4.01Å; K536-Y1116 HydrophobicContact CD-CG 4.1Å; K536-Y1116 PolarHBondContact NZ-O 3.19Å; K536-N1117 VanDerWaalsContact NZ-CG 3.28Å; K536-N1117 PolarHBondContact NZ-ND2 3.13Å; K536-N1117 PolarHBondContact NZ-OD1 3.36Å
537	G	57	Low	76.7	Confident	66 Å²	66	44.8 Å²	44.8	68%	0.68	22%	0.222	S	C	*	.			trans	59.5	-0.5	166	0	0	0	0	0	118.5	C533 Q534	C533-G537 PolarHBondContact O-N 3.14Å; Q534-G537 PolarHBondContact O-N 2.77Å
538	R	59	Low	76.8	Confident	140 Å²	140	44.9 Å²	44.9	53%	0.528	23%	0.231	S	C	.	.	S	Bend	trans	-116	-19.1	-163	-75.9	-178.7	177.3	158.1	3.7	116.6	K536 Y781	K536-R538 WeakPolarHBondContact O-CG 3.44Å; K536-R538 PolarHBondContact O-N 2.8Å; R538-Y781 PolarHBondContact NH1-OH 2.74Å; R538-Y781 VanDerWaalsContact NH1-OH 3.08Å; R538-Y781 PolarHBondContact NH2-OH 3.43Å
539	M	61.5	Low	77.1	Confident	85 Å²	85	48.7 Å²	48.7	42%	0.419	25%	0.25	S	S	.	.			trans	-149.2	117.2	-175.7	-63.9	-69	-86.2	0	0	110.3	C533 I541	C533-M539 PolarHBondContact SG-O 3.41Å; M539-I541 HydrophobicContact CB-CG1 4.39Å
540	R	72	Confident	77	Confident	180 Å²	180	52.8 Å²	52.8	68%	0.679	28%	0.277	S	S	*	.			trans	-74.4	123.7	165.7	-65.4	-178.6	-179	179.4	-0.7	108.3
541	I	83.5	Confident	77	Confident	6 Å²	6	55.1 Å²	55.1	3%	0.031	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	119.6	178.8	-60.1	175.3	0	0	0	107.8	R509 V511 F529 M539 F1115 Y1116	R509-I541 WeakPolarHBondContact O-CA 3.36Å; V511-I541 HydrophobicContact CB-CG2 4.17Å; V511-I541 HydrophobicContact CG2-CG2 3.54Å; F529-I541 HydrophobicContact CE1-CB 4.34Å; F529-I541 HydrophobicContact CE1-CG2 4.18Å; F529-I541 HydrophobicContact CZ-CB 4.37Å; F529-I541 HydrophobicContact CZ-CG2 3.96Å; M539-I541 HydrophobicContact CB-CG1 4.39Å; I541-F1115 HydrophobicContact CD1-CE1 3.84Å; I541-F1115 HydrophobicContact CD1-CZ 4.07Å; I541-Y1116 HydrophobicContact CD1-CE1 4.26Å
542	N	88.8	Confident	77.4	Confident	8 Å²	8	54.8 Å²	54.8	4%	0.043	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	152.4	175.4	-62.3	-22.5	0	0	0	110.1	Y502 E508 R509 H510 V511 W565	Y502-N542 WeakPolarHBondContact OH-CB 3.46Å; Y502-N542 PolarHBondContact OH-ND2 3.05Å; E508-N542 PolarHBondContact OE2-ND2 2.86Å; R509-N542 PolarHBondContact O-N 3.24Å; H510-N542 CarbonylContact C-O 3.59Å; H510-N542 WeakPolarHBondContact CA-O 3.46Å; H510-N542 HydrophobicContact CB-CB 4.3Å; V511-N542 PolarHBondContact N-O 3.49Å; N542-W565 CarbonylContact C-O 3.51Å; N542-W565 WeakPolarHBondContact CA-O 3.45Å
543	M	91.4	Very high	78.4	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132.2	-178.5	-172.5	-179.7	-70	0	0	110	V513 F525 I526 F529 L545 W565 V566 R567	V513-M543 HydrophobicContact CG2-CE 4.35Å; V513-M543 HydrophobicContact CG2-CG 3.63Å; V513-M543 HydrophobicContact CG2-SD 3.86Å; F525-M543 HydrophobicContact CD1-CE 4.02Å; F525-M543 HydrophobicContact CD1-SD 4.45Å; F525-M543 HydrophobicContact CE1-CE 3.46Å; F525-M543 VanDerWaalsContact CE1-CE 3.46Å; F525-M543 HydrophobicContact CE1-SD 4.11Å; F525-M543 HydrophobicContact CZ-CE 4.35Å; I526-M543 HydrophobicContact CG1-CE 4.44Å; I526-M543 HydrophobicContact CG1-SD 3.94Å; F529-M543 HydrophobicContact CB-CE 4Å; F529-M543 HydrophobicContact CD1-CE 3.45Å; F529-M543 VanDerWaalsContact CD1-CE 3.45Å; F529-M543 HydrophobicContact CD2-CE 4.42Å; F529-M543 HydrophobicContact CE1-CE 4Å; F529-M543 HydrophobicContact CG-CE 3.69Å; M543-L545 HydrophobicContact CG-CD2 3.9Å; M543-L545 HydrophobicContact SD-CD2 3.69Å; M543-W565 PolarHBondContact N-O 3.32Å; M543-V566 HydrophobicContact CB-CG1 4.35Å; M543-V566 HydrophobicContact CB-CG2 4.15Å; M543-V566 HydrophobicContact CG-CG1 4.44Å; M543-V566 CarbonylContact O-C 3.52Å; M543-V566 WeakPolarHBondContact O-CA 3.48Å; M543-V566 HydrophobicContact SD-CG1 4.38Å; M543-V566 HydrophobicContact SD-CG2 4.44Å; M543-R567 PolarHBondContact O-N 3.13Å
544	V	92.5	Very high	79.8	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	106.9	177.7	178.8	0	0	0	0	107.6	Y502 H510 V511 I512 V513 R567 F569 T582	Y502-V544 HydrophobicContact CD1-CG2 4.35Å; Y502-V544 HydrophobicContact CD2-CG2 3.71Å; Y502-V544 HydrophobicContact CE1-CG2 4.37Å; Y502-V544 HydrophobicContact CE2-CG2 3.73Å; Y502-V544 HydrophobicContact CG-CG2 4.03Å; H510-V544 HydrophobicContact CB-CG2 4.24Å; V511-V544 PolarHBondContact O-N 3.2Å; I512-V544 CarbonylContact C-O 3.41Å; I512-V544 WeakPolarHBondContact CA-O 3.19Å; I512-V544 HydrophobicContact CG1-CB 4.33Å; V513-V544 PolarHBondContact N-O 3.07Å; V544-R567 CarbonylContact C-O 3.6Å; V544-R567 WeakPolarHBondContact CA-O 3.2Å; V544-F569 HydrophobicContact CG1-CD2 3.49Å; V544-F569 VanDerWaalsContact CG1-CD2 3.49Å; V544-F569 HydrophobicContact CG1-CE2 3.7Å; V544-T582 HydrophobicContact CG1-CG2 3.79Å
545	L	93.3	Very high	80.7	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	128.1	175.9	-55	-177.1	0	0	0	109.2	V513 I522 M543 L559 V566 R567 Y568 F569	V513-L545 HydrophobicContact CB-CD2 3.66Å; V513-L545 HydrophobicContact CG1-CD2 4.08Å; V513-L545 HydrophobicContact CG2-CD2 4.09Å; V513-L545 WeakPolarHBondContact O-CA 3.36Å; I522-L545 HydrophobicContact CD1-CD2 4.1Å; M543-L545 HydrophobicContact CG-CD2 3.9Å; M543-L545 HydrophobicContact SD-CD2 3.69Å; L545-L559 HydrophobicContact CD1-CD1 3.93Å; L545-L559 HydrophobicContact CD1-CD2 3.84Å; L545-V566 HydrophobicContact CD1-CG1 3.7Å; L545-V566 HydrophobicContact CD2-CG1 4.38Å; L545-V566 HydrophobicContact CG-CG1 3.73Å; L545-R567 PolarHBondContact N-O 3.5Å; L545-Y568 HydrophobicContact CB-CD2 3.96Å; L545-Y568 HydrophobicContact CD1-CD2 4.31Å; L545-F569 PolarHBondContact O-N 3.08Å
546	L	92.4	Very high	82.2	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.01	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	113	176.9	-178.1	66.7	0	0	0	109.5	V513 F569 P573 D578 L579 T582	V513-L546 PolarHBondContact O-N 3.15Å; L546-F569 WeakPolarHBondContact CA-O 3.43Å; L546-F569 HydrophobicContact CD1-CB 4.06Å; L546-P573 HydrophobicContact CD2-CB 4.33Å; L546-D578 HydrophobicContact CD1-CB 4.43Å; L546-L579 HydrophobicContact CD2-CD2 4.47Å; L546-T582 HydrophobicContact CD1-CG2 4.18Å; L546-T582 HydrophobicContact CD2-CG2 4.42Å
547	R	90.1	Very high	83.4	Confident	22 Å²	22	63.6 Å²	63.6	8%	0.083	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	150.3	177.8	-68.6	-175.2	81.4	-177	6.2	111.5	N516 F517 I549 Y568 F569 L570 G571	N516-R547 PolarHBondContact OD1-NH2 3.38Å; F517-R547 HydrophobicContact CE1-CG 3.97Å; F517-R547 VanDerWaalsContact CZ-CD 3.45Å; F517-R547 HydrophobicContact CZ-CG 3.77Å; F517-R547 PolarHBondContact O-NH2 2.8Å; R547-I549 VanDerWaalsContact C-N 3.27Å; R547-I549 PolarHBondContact O-N 3.22Å; R547-Y568 HydrophobicContact CB-CE2 4.27Å; R547-Y568 WeakPolarHBondContact CB-OH 3.3Å; R547-Y568 HydrophobicContact CG-CE2 4.28Å; R547-F569 PolarHBondContact N-O 2.84Å; R547-L570 CarbonylContact O-C 3.57Å; R547-L570 VanDerWaalsContact O-CA 3.32Å; R547-L570 WeakPolarHBondContact O-CA 3.32Å; R547-G571 CarbonylContact C-O 3.56Å; R547-G571 PolarHBondContact O-N 3.43Å; R547-G571 VanDerWaalsContact O-O 3.13Å
548	P	87.6	Confident	84.9	Confident	85 Å²	85	61.8 Å²	61.8	55%	0.552	31%	0.307	S	S	*	.	S	Bend	trans	-75	-12.7	175.4	27.3	-31.5	0	0	0	114.5	L570 T572	P548-L570 VanDerWaalsContact C-CD1 3.49Å; P548-L570 WeakPolarHBondContact O-CD1 3.3Å; P548-T572 HydrophobicContact CB-CG2 3.82Å; P548-T572 HydrophobicContact CG-CG2 4.43Å
549	I	86.4	Confident	86.3	Confident	83 Å²	83	55.8 Å²	55.8	43%	0.426	29%	0.285	S	S	.	.	S	Bend	trans	-95.8	143.9	-175	-56.8	168.3	0	0	0	108.9	R547 Y568 L570	R547-I549 VanDerWaalsContact C-N 3.27Å; R547-I549 PolarHBondContact O-N 3.22Å; I549-Y568 PolarHBondContact O-OH 3.42Å; I549-L570 VanDerWaalsContact C-CD1 3.42Å; I549-L570 VanDerWaalsContact O-CD1 3.31Å; I549-L570 WeakPolarHBondContact O-CD1 3.03Å
550	P	83.5	Confident	87.6	Confident	87 Å²	87	55.5 Å²	55.5	57%	0.565	29%	0.292	S	S	*	.			trans	-61	158.6	171.7	26.1	-35.3	0	0	0	112.1	D552	P550-D552 PolarHBondContact O-N 3.28Å; P550-D552 VanDerWaalsContact O-N 3.13Å
551	L	84.3	Confident	88.4	Confident	66 Å²	66	51.2 Å²	51.2	35%	0.346	29%	0.287	S	S	.	.			trans	-68.9	110.4	-179.1	-179.5	66.3	0	0	0	110.5	L555 K556 L559 Y568	L551-L555 HydrophobicContact CD1-CB 3.92Å; L551-L555 HydrophobicContact CD1-CD2 3.78Å; L551-L555 HydrophobicContact CD1-CG 3.65Å; L551-K556 HydrophobicContact CD2-CB 3.87Å; L551-K556 HydrophobicContact CD2-CD 4.37Å; L551-K556 HydrophobicContact CD2-CG 3.92Å; L551-K556 HydrophobicContact CG-CB 4.02Å; L551-L559 HydrophobicContact CD1-CD1 3.87Å; L551-Y568 HydrophobicContact CB-CD1 4.01Å; L551-Y568 HydrophobicContact CB-CE1 3.9Å; L551-Y568 HydrophobicContact CD1-CD1 4.41Å; L551-Y568 HydrophobicContact CD1-CD2 3.99Å; L551-Y568 HydrophobicContact CD1-CE2 4.13Å; L551-Y568 HydrophobicContact CD1-CG 4.11Å
552	D	84.9	Confident	88.5	Confident	78 Å²	78	53.3 Å²	53.3	42%	0.417	30%	0.295	S	S	.	.			trans	-64.2	152	173.1	-179.7	27.7	0	0	0	112	N519 P550 A554 L555 K556	N519-D552 PolarHBondContact ND2-OD2 2.87Å; P550-D552 PolarHBondContact O-N 3.28Å; P550-D552 VanDerWaalsContact O-N 3.13Å; D552-A554 PolarHBondContact O-N 2.75Å; D552-L555 HydrophobicContact CB-CB 4.34Å; D552-L555 PolarHBondContact O-N 3.2Å; D552-K556 WeakPolarHBondContact O-CB 3.5Å; D552-K556 PolarHBondContact O-N 2.94Å
553	Y	88	Confident	88.3	Confident	198 Å²	198	59.3 Å²	59.3	78%	0.776	32%	0.323	S	S	*	.	H	α-helix	trans	-64	-39.4	-179.6	-69.3	-73.3	0	0	0	112.2	K556 A557	Y553-K556 WeakPolarHBondContact O-CB 3.31Å; Y553-K556 PolarHBondContact O-N 3.28Å; Y553-A557 PolarHBondContact O-N 2.85Å
554	A	88.9	Confident	87.8	Confident	47 Å²	47	63 Å²	63	39%	0.388	35%	0.353	S	S	.	.	H	α-helix	trans	-63.1	-44.7	175.7	0	0	0	0	0	111.1	D552 K556 A557 I558	D552-A554 PolarHBondContact O-N 2.75Å; A554-K556 PolarHBondContact O-N 2.98Å; A554-A557 WeakPolarHBondContact O-CB 3.27Å; A554-A557 PolarHBondContact O-N 3.19Å; A554-I558 WeakPolarHBondContact O-CG1 3.36Å; A554-I558 PolarHBondContact O-N 3.27Å; A554-I558 VanDerWaalsContact O-N 3.08Å
555	L	87.8	Confident	87.5	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-65.5	-38.7	174.7	-172.8	55.4	0	0	0	111.8	I522 L551 D552 A557 I558 L559 Y568	I522-L555 HydrophobicContact CG2-CD1 3.68Å; L551-L555 HydrophobicContact CD1-CB 3.92Å; L551-L555 HydrophobicContact CD1-CD2 3.78Å; L551-L555 HydrophobicContact CD1-CG 3.65Å; D552-L555 HydrophobicContact CB-CB 4.34Å; D552-L555 PolarHBondContact O-N 3.2Å; L555-A557 VanDerWaalsContact C-N 3.31Å; L555-A557 PolarHBondContact O-N 2.96Å; L555-I558 PolarHBondContact O-N 2.95Å; L555-L559 HydrophobicContact CD1-CD1 4.28Å; L555-L559 HydrophobicContact CD1-CG 4.1Å; L555-L559 HydrophobicContact CG-CD1 4.01Å; L555-L559 HydrophobicContact CG-CG 4.24Å; L555-L559 WeakPolarHBondContact O-CB 3.37Å; L555-L559 VanDerWaalsContact O-CG 3.27Å; L555-L559 WeakPolarHBondContact O-CG 3.18Å; L555-L559 PolarHBondContact O-N 3.06Å; L555-Y568 HydrophobicContact CD2-CE2 4.07Å
556	K	88.6	Confident	87.3	Confident	120 Å²	120	68 Å²	68	52%	0.522	37%	0.372	S	S	.	.	H	α-helix	trans	-60.1	-41.4	174.9	-171.5	177.1	179.6	-177.6	0	111.5	L551 D552 Y553 A554 L559 S560	L551-K556 HydrophobicContact CD2-CB 3.87Å; L551-K556 HydrophobicContact CD2-CD 4.37Å; L551-K556 HydrophobicContact CD2-CG 3.92Å; L551-K556 HydrophobicContact CG-CB 4.02Å; D552-K556 WeakPolarHBondContact O-CB 3.5Å; D552-K556 PolarHBondContact O-N 2.94Å; Y553-K556 WeakPolarHBondContact O-CB 3.31Å; Y553-K556 PolarHBondContact O-N 3.28Å; A554-K556 PolarHBondContact O-N 2.98Å; K556-L559 PolarHBondContact O-N 3.03Å; K556-S560 WeakPolarHBondContact O-CB 3.34Å; K556-S560 PolarHBondContact O-N 3.31Å
557	A	89.2	Confident	87.2	Confident	62 Å²	62	73.3 Å²	73.3	51%	0.512	39%	0.392	S	S	.	.	H	α-helix	trans	-62.4	-45.3	174.8	0	0	0	0	0	111.3	Y553 A554 L555 L559 S560 P561	Y553-A557 PolarHBondContact O-N 2.85Å; A554-A557 WeakPolarHBondContact O-CB 3.27Å; A554-A557 PolarHBondContact O-N 3.19Å; L555-A557 VanDerWaalsContact C-N 3.31Å; L555-A557 PolarHBondContact O-N 2.96Å; A557-L559 VanDerWaalsContact C-N 3.35Å; A557-L559 PolarHBondContact O-N 2.79Å; A557-S560 PolarHBondContact O-N 2.84Å; A557-S560 PolarHBondContact O-OG 3.39Å; A557-P561 WeakPolarHBondContact O-CD 3.25Å
558	I	88.5	Confident	87.2	Confident	27 Å²	27	74.5 Å²	74.5	14%	0.138	40%	0.397	C	S	.	.	H	α-helix	trans	-62.9	-38.4	177.3	-66.1	166.7	0	0	0	112.1	N519 R523 A554 L555 P561 Y562	N519-I558 HydrophobicContact CB-CD1 3.86Å; N519-I558 WeakPolarHBondContact O-CD1 3.37Å; R523-I558 HydrophobicContact CB-CG2 4.06Å; R523-I558 HydrophobicContact CG-CG2 4.17Å; A554-I558 WeakPolarHBondContact O-CG1 3.36Å; A554-I558 PolarHBondContact O-N 3.27Å; A554-I558 VanDerWaalsContact O-N 3.08Å; L555-I558 PolarHBondContact O-N 2.95Å; I558-P561 VanDerWaalsContact O-CD 3.28Å; I558-P561 WeakPolarHBondContact O-CD 3.34Å; I558-Y562 WeakPolarHBondContact O-CD2 3.41Å
559	L	89.3	Confident	87.3	Confident	14 Å²	14	71.1 Å²	71.1	7%	0.073	37%	0.373	C	S	.	.	H	α-helix	trans	-82	-21.9	-178.3	-66.5	-177.8	0	0	0	113.7	I526 L545 L551 L555 K556 A557 P561 Y562 H563 V566 Y568	I526-L559 HydrophobicContact CD1-CD2 3.55Å; L545-L559 HydrophobicContact CD1-CD1 3.93Å; L545-L559 HydrophobicContact CD1-CD2 3.84Å; L551-L559 HydrophobicContact CD1-CD1 3.87Å; L555-L559 HydrophobicContact CD1-CD1 4.28Å; L555-L559 HydrophobicContact CD1-CG 4.1Å; L555-L559 HydrophobicContact CG-CD1 4.01Å; L555-L559 HydrophobicContact CG-CG 4.24Å; L555-L559 WeakPolarHBondContact O-CB 3.37Å; L555-L559 VanDerWaalsContact O-CG 3.27Å; L555-L559 WeakPolarHBondContact O-CG 3.18Å; L555-L559 PolarHBondContact O-N 3.06Å; K556-L559 PolarHBondContact O-N 3.03Å; A557-L559 VanDerWaalsContact C-N 3.35Å; A557-L559 PolarHBondContact O-N 2.79Å; L559-P561 VanDerWaalsContact C-CD 3.41Å; L559-Y562 CarbonylContact O-C 3.54Å; L559-Y562 PolarHBondContact O-N 3.49Å; L559-H563 PolarHBondContact O-N 2.67Å; L559-H563 VanDerWaalsContact O-N 3.14Å; L559-V566 HydrophobicContact CD2-CB 4.43Å; L559-V566 HydrophobicContact CD2-CG1 3.82Å; L559-Y568 HydrophobicContact CD1-CD2 4.32Å
560	S	88.7	Confident	87.4	Confident	80 Å²	80	69.5 Å²	69.5	56%	0.559	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-53.6	-41	-176.7	71.7	0	0	0	0	114.4	K556 A557 Y562	K556-S560 WeakPolarHBondContact O-CB 3.34Å; K556-S560 PolarHBondContact O-N 3.31Å; A557-S560 PolarHBondContact O-N 2.84Å; A557-S560 PolarHBondContact O-OG 3.39Å; S560-Y562 VanDerWaalsContact C-N 3.26Å; S560-Y562 PolarHBondContact O-N 2.75Å
561	P	88.1	Confident	87.6	Confident	90 Å²	90	65.8 Å²	65.8	58%	0.584	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-72.3	-21.7	178.1	-15.1	33.1	0	0	0	112.6	A557 I558 L559	A557-P561 WeakPolarHBondContact O-CD 3.25Å; I558-P561 VanDerWaalsContact O-CD 3.28Å; I558-P561 WeakPolarHBondContact O-CD 3.34Å; L559-P561 VanDerWaalsContact C-CD 3.41Å
562	Y	86.4	Confident	87.9	Confident	49 Å²	49	65 Å²	65	19%	0.192	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-105.1	12	-175.3	-52.8	-70.5	0	0	0	113.3	I526 L530 I558 L559 S560 A564 W565 V566	I526-Y562 HydrophobicContact CG2-CD1 4.32Å; I526-Y562 HydrophobicContact CG2-CD2 3.92Å; I526-Y562 HydrophobicContact CG2-CE1 4.46Å; I526-Y562 HydrophobicContact CG2-CE2 4.08Å; I526-Y562 HydrophobicContact CG2-CG 4.04Å; L530-Y562 HydrophobicContact CD1-CD1 3.29Å; L530-Y562 HydrophobicContact CD1-CE1 3.69Å; L530-Y562 HydrophobicContact CD1-CG 4.01Å; I558-Y562 WeakPolarHBondContact O-CD2 3.41Å; L559-Y562 CarbonylContact O-C 3.54Å; L559-Y562 PolarHBondContact O-N 3.49Å; S560-Y562 VanDerWaalsContact C-N 3.26Å; S560-Y562 PolarHBondContact O-N 2.75Å; Y562-A564 PolarHBondContact O-N 3.46Å; Y562-W565 HydrophobicContact CD1-CE3 4.11Å; Y562-W565 HydrophobicContact CD1-CZ3 4.22Å; Y562-W565 PolarHBondContact O-N 3Å; Y562-V566 PolarHBondContact O-N 2.95Å
563	H	83.8	Confident	88.2	Confident	135 Å²	135	61.6 Å²	61.6	63%	0.625	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-27.6	-174.4	-172.4	70.5	0	0	0	114	L559	L559-H563 PolarHBondContact O-N 2.67Å; L559-H563 VanDerWaalsContact O-N 3.14Å
564	A	82.1	Confident	88.4	Confident	77 Å²	77	55.9 Å²	55.9	64%	0.636	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-32.6	175.9	0	0	0	0	0	113.4	Y562	Y562-A564 PolarHBondContact O-N 3.46Å
565	W	85.8	Confident	88.5	Confident	103 Å²	103	56.2 Å²	56.2	39%	0.39	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-25.7	-174.8	-56.4	-63.2	0	0	0	113.4	L530 N542 M543 Y562	L530-W565 HydrophobicContact CD1-CE3 4.26Å; L530-W565 HydrophobicContact CD2-CB 4.14Å; L530-W565 HydrophobicContact CD2-CG 4.44Å; N542-W565 CarbonylContact C-O 3.51Å; N542-W565 WeakPolarHBondContact CA-O 3.45Å; M543-W565 PolarHBondContact N-O 3.32Å; Y562-W565 HydrophobicContact CD1-CE3 4.11Å; Y562-W565 HydrophobicContact CD1-CZ3 4.22Å; Y562-W565 PolarHBondContact O-N 3Å
566	V	89.7	Confident	88.6	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.018	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.9	-174.6	-171.3	0	0	0	0	110.1	I526 M543 L545 L559 Y562	I526-V566 HydrophobicContact CD1-CG1 4.49Å; I526-V566 HydrophobicContact CG2-CG2 4.38Å; M543-V566 HydrophobicContact CB-CG1 4.35Å; M543-V566 HydrophobicContact CB-CG2 4.15Å; M543-V566 HydrophobicContact CG-CG1 4.44Å; M543-V566 CarbonylContact O-C 3.52Å; M543-V566 WeakPolarHBondContact O-CA 3.48Å; M543-V566 HydrophobicContact SD-CG1 4.38Å; M543-V566 HydrophobicContact SD-CG2 4.44Å; L545-V566 HydrophobicContact CD1-CG1 3.7Å; L545-V566 HydrophobicContact CD2-CG1 4.38Å; L545-V566 HydrophobicContact CG-CG1 3.73Å; L559-V566 HydrophobicContact CD2-CB 4.43Å; L559-V566 HydrophobicContact CD2-CG1 3.82Å; Y562-V566 PolarHBondContact O-N 2.95Å
567	R	89.8	Confident	88.7	Confident	113 Å²	113	59.9 Å²	59.9	43%	0.426	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	138.5	173.9	-66	-156.4	178.3	-161.3	3.6	111.5	M543 V544 L545 F569	M543-R567 PolarHBondContact O-N 3.13Å; V544-R567 CarbonylContact C-O 3.6Å; V544-R567 WeakPolarHBondContact CA-O 3.2Å; L545-R567 PolarHBondContact N-O 3.5Å; R567-F569 HydrophobicContact CB-CE2 3.89Å
568	Y	90.1	Very high	88.7	Confident	47 Å²	47	57.9 Å²	57.9	18%	0.184	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	135.3	-179.9	-170.9	-91.9	0	0	0	111.3	L545 R547 I549 L551 L555 L559	L545-Y568 HydrophobicContact CB-CD2 3.96Å; L545-Y568 HydrophobicContact CD1-CD2 4.31Å; R547-Y568 HydrophobicContact CB-CE2 4.27Å; R547-Y568 WeakPolarHBondContact CB-OH 3.3Å; R547-Y568 HydrophobicContact CG-CE2 4.28Å; I549-Y568 PolarHBondContact O-OH 3.42Å; L551-Y568 HydrophobicContact CB-CD1 4.01Å; L551-Y568 HydrophobicContact CB-CE1 3.9Å; L551-Y568 HydrophobicContact CD1-CD1 4.41Å; L551-Y568 HydrophobicContact CD1-CD2 3.99Å; L551-Y568 HydrophobicContact CD1-CE2 4.13Å; L551-Y568 HydrophobicContact CD1-CG 4.11Å; L555-Y568 HydrophobicContact CD2-CE2 4.07Å; L559-Y568 HydrophobicContact CD1-CD2 4.32Å
569	F	89.7	Confident	88.8	Confident	14 Å²	14	56.9 Å²	56.9	6%	0.061	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	135.7	173.5	-67.6	-88.9	0	0	0	110.7	D500 Y502 V544 L545 L546 R547 R567 R581 T582	D500-F569 HydrophobicContact CB-CE1 4.38Å; D500-F569 WeakPolarHBondContact O-CE1 3.35Å; Y502-F569 HydrophobicContact CD2-CE2 4.18Å; Y502-F569 HydrophobicContact CD2-CZ 4.29Å; V544-F569 HydrophobicContact CG1-CD2 3.49Å; V544-F569 VanDerWaalsContact CG1-CD2 3.49Å; V544-F569 HydrophobicContact CG1-CE2 3.7Å; L545-F569 PolarHBondContact O-N 3.08Å; L546-F569 WeakPolarHBondContact CA-O 3.43Å; L546-F569 HydrophobicContact CD1-CB 4.06Å; R547-F569 PolarHBondContact N-O 2.84Å; R567-F569 HydrophobicContact CB-CE2 3.89Å; F569-R581 HydrophobicContact CD1-CG 4.48Å; F569-T582 HydrophobicContact CB-CG2 4.49Å; F569-T582 HydrophobicContact CD2-CG2 4.44Å; F569-T582 HydrophobicContact CG-CG2 4.44Å
570	L	88.8	Confident	88.9	Confident	49 Å²	49	59.6 Å²	59.6	26%	0.257	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	112.4	174.3	178.9	70.6	0	0	0	110.3	N497 R547 P548 I549 R581	N497-L570 HydrophobicContact CB-CD2 4.48Å; R547-L570 CarbonylContact O-C 3.57Å; R547-L570 VanDerWaalsContact O-CA 3.32Å; R547-L570 WeakPolarHBondContact O-CA 3.32Å; P548-L570 VanDerWaalsContact C-CD1 3.49Å; P548-L570 WeakPolarHBondContact O-CD1 3.3Å; I549-L570 VanDerWaalsContact C-CD1 3.42Å; I549-L570 VanDerWaalsContact O-CD1 3.31Å; I549-L570 WeakPolarHBondContact O-CD1 3.03Å; L570-R581 PolarHBondContact O-NH2 3.45Å
571	G	87.6	Confident	88.9	Confident	9 Å²	9	57.8 Å²	57.8	9%	0.093	31%	0.305	C	S	.	.			trans	170.7	179.3	176.1	0	0	0	0	0	113.7	R547 D578	R547-G571 CarbonylContact C-O 3.56Å; R547-G571 PolarHBondContact O-N 3.43Å; R547-G571 VanDerWaalsContact O-O 3.13Å; G571-D578 WeakPolarHBondContact CA-OD2 3.47Å
572	T	90.9	Very high	89	Confident	51 Å²	51	53.5 Å²	53.5	31%	0.313	28%	0.277	S	S	.	.			trans	-116.6	146.3	177.4	63.4	0	0	0	0	111.2	P548 N574 N575 D578	P548-T572 HydrophobicContact CB-CG2 3.82Å; P548-T572 HydrophobicContact CG-CG2 4.43Å; T572-N574 PolarHBondContact O-N 3.49Å; T572-N575 PolarHBondContact O-N 3.08Å; T572-N575 PolarHBondContact OG1-N 2.84Å; T572-D578 PolarHBondContact N-OD2 2.89Å; T572-D578 WeakPolarHBondContact O-CB 3.4Å
573	P	91.2	Very high	89.2	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.032	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-16.8	174.6	30.4	-35.8	0	0	0	112.6	C514 L546 N575 L579 Q611 I615	C514-P573 HydrophobicContact CB-CG 4.23Å; L546-P573 HydrophobicContact CD2-CB 4.33Å; P573-N575 VanDerWaalsContact C-N 3.27Å; P573-L579 HydrophobicContact CB-CD2 3.92Å; P573-L579 WeakPolarHBondContact O-CD1 3.44Å; P573-L579 WeakPolarHBondContact O-CG 3.39Å; P573-Q611 HydrophobicContact CG-CB 3.72Å; P573-Q611 HydrophobicContact CG-CG 3.49Å; P573-Q611 VanDerWaalsContact CG-CG 3.49Å; P573-I615 HydrophobicContact CB-CD1 4.18Å; P573-I615 HydrophobicContact CB-CG1 4.2Å
574	N	90.9	Very high	89.5	Confident	78 Å²	78	48.1 Å²	48.1	42%	0.417	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-29.6	174	-66.8	-8.8	0	0	0	111.4	T572 P576	T572-N574 PolarHBondContact O-N 3.49Å; N574-P576 WeakPolarHBondContact O-CD 3.16Å
575	N	90.6	Very high	89.8	Confident	55 Å²	55	53.4 Å²	53.4	29%	0.294	26%	0.262	S	S	.	.	S	Bend	trans	-80.5	119.4	175	-178	4.6	0	0	0	111.2	T572 P573 H577 D578 L579	T572-N575 PolarHBondContact O-N 3.08Å; T572-N575 PolarHBondContact OG1-N 2.84Å; P573-N575 VanDerWaalsContact C-N 3.27Å; N575-H577 VanDerWaalsContact C-N 3.26Å; N575-H577 PolarHBondContact O-N 3.03Å; N575-H577 PolarHBondContact OD1-N 3.39Å; N575-H577 VanDerWaalsContact OD1-N 3.11Å; N575-D578 HydrophobicContact CB-CB 4.31Å; N575-D578 WeakPolarHBondContact CB-OD2 3.43Å; N575-D578 PolarHBondContact ND2-OD2 2.73Å; N575-D578 PolarHBondContact O-N 3.15Å; N575-L579 PolarHBondContact O-N 3.27Å
576	P	90.6	Very high	90	Very high	50 Å²	50	53.7 Å²	53.7	33%	0.325	27%	0.268	S	S	.	.	H	α-helix	trans	-67	-23.6	-179.1	28.4	-36.9	0	0	0	114.2	N574 A580	N574-P576 WeakPolarHBondContact O-CD 3.16Å; P576-A580 WeakPolarHBondContact O-CB 3.46Å; P576-A580 PolarHBondContact O-N 2.9Å; P576-A580 VanDerWaalsContact O-N 3.09Å
577	H	90.2	Very high	90	Very high	146 Å²	146	53.6 Å²	53.6	68%	0.676	27%	0.267	S	S	*	.	H	α-helix	trans	-69.2	-37.4	176.6	-67.8	-72.4	0	0	0	111.8	N575 A580 R581	N575-H577 VanDerWaalsContact C-N 3.26Å; N575-H577 PolarHBondContact O-N 3.03Å; N575-H577 PolarHBondContact OD1-N 3.39Å; N575-H577 VanDerWaalsContact OD1-N 3.11Å; H577-A580 WeakPolarHBondContact O-CB 3.33Å; H577-A580 PolarHBondContact O-N 2.9Å; H577-R581 PolarHBondContact O-N 3.4Å
578	D	90.3	Very high	90	Very high	20 Å²	20	53.2 Å²	53.2	11%	0.107	27%	0.266	C	S	.	.	H	α-helix	trans	-69.4	-42.1	178.3	-66.1	-28.4	0	0	0	111.1	L546 G571 T572 N575 A580 R581 T582	L546-D578 HydrophobicContact CD1-CB 4.43Å; G571-D578 WeakPolarHBondContact CA-OD2 3.47Å; T572-D578 PolarHBondContact N-OD2 2.89Å; T572-D578 WeakPolarHBondContact O-CB 3.4Å; N575-D578 HydrophobicContact CB-CB 4.31Å; N575-D578 WeakPolarHBondContact CB-OD2 3.43Å; N575-D578 PolarHBondContact ND2-OD2 2.73Å; N575-D578 PolarHBondContact O-N 3.15Å; D578-A580 VanDerWaalsContact C-N 3.26Å; D578-A580 PolarHBondContact O-N 2.99Å; D578-R581 WeakPolarHBondContact O-CB 3.31Å; D578-R581 PolarHBondContact O-N 3.43Å; D578-R581 VanDerWaalsContact O-N 3.15Å; D578-R581 IonicContact OD1-CZ 3.39Å; D578-R581 IonicContact OD1-NE 2.73Å; D578-R581 IonicContact OD1-NH2 3.03Å; D578-R581 PolarHBondContact OD1-NH2 2.79Å; D578-T582 PolarHBondContact O-N 2.85Å; D578-T582 PolarHBondContact O-OG1 2.96Å
579	L	91.2	Very high	90.1	Very high	7 Å²	7	51 Å²	51	4%	0.037	26%	0.257	C	S	.	.	H	α-helix	trans	-62	-32.3	172.2	-67.7	-177.7	0	0	0	113.2	L546 P573 N575 T582 K583 L584 I615 R618	L546-L579 HydrophobicContact CD2-CD2 4.47Å; P573-L579 HydrophobicContact CB-CD2 3.92Å; P573-L579 WeakPolarHBondContact O-CD1 3.44Å; P573-L579 WeakPolarHBondContact O-CG 3.39Å; N575-L579 PolarHBondContact O-N 3.27Å; L579-T582 PolarHBondContact O-OG1 3.47Å; L579-K583 PolarHBondContact O-N 3.06Å; L579-L584 HydrophobicContact CB-CB 4.38Å; L579-L584 HydrophobicContact CB-CD2 4.24Å; L579-L584 HydrophobicContact CD1-CD2 3.91Å; L579-L584 HydrophobicContact CD2-CD2 4.15Å; L579-L584 HydrophobicContact CG-CD2 4.34Å; L579-L584 WeakPolarHBondContact O-CB 3.47Å; L579-L584 PolarHBondContact O-N 3.45Å; L579-L584 VanDerWaalsContact O-N 3.13Å; L579-I615 HydrophobicContact CD2-CG1 4.23Å; L579-R618 HydrophobicContact CD1-CG 4.02Å
580	A	90.6	Very high	90.4	Very high	70 Å²	70	50.3 Å²	50.3	58%	0.579	25%	0.254	S	S	*	.	H	α-helix	trans	-71.6	-38.8	174.6	0	0	0	0	0	111.5	P576 H577 D578 K583	P576-A580 WeakPolarHBondContact O-CB 3.46Å; P576-A580 PolarHBondContact O-N 2.9Å; P576-A580 VanDerWaalsContact O-N 3.09Å; H577-A580 WeakPolarHBondContact O-CB 3.33Å; H577-A580 PolarHBondContact O-N 2.9Å; D578-A580 VanDerWaalsContact C-N 3.26Å; D578-A580 PolarHBondContact O-N 2.99Å; A580-K583 PolarHBondContact O-N 3.17Å; A580-K583 VanDerWaalsContact O-N 3.16Å
581	R	89.5	Confident	90.7	Very high	43 Å²	43	48 Å²	48	16%	0.162	24%	0.242	C	C	.	.	H	α-helix	trans	-65.5	-36.7	177.6	-176.4	172.8	50.2	167.5	-6.5	112.7	D500 R501 Y502 F569 L570 H577 D578 K583	D500-R581 WeakPolarHBondContact O-CD 3.32Å; D500-R581 VanDerWaalsContact O-CG 3.23Å; D500-R581 WeakPolarHBondContact O-CG 3.21Å; R501-R581 HydrophobicContact CG-CG 4.31Å; Y502-R581 PolarHBondContact N-O 3.35Å; F569-R581 HydrophobicContact CD1-CG 4.48Å; L570-R581 PolarHBondContact O-NH2 3.45Å; H577-R581 PolarHBondContact O-N 3.4Å; D578-R581 WeakPolarHBondContact O-CB 3.31Å; D578-R581 PolarHBondContact O-N 3.43Å; D578-R581 VanDerWaalsContact O-N 3.15Å; D578-R581 IonicContact OD1-CZ 3.39Å; D578-R581 IonicContact OD1-NE 2.73Å; D578-R581 IonicContact OD1-NH2 3.03Å; D578-R581 PolarHBondContact OD1-NH2 2.79Å; R581-K583 PolarHBondContact O-N 3.26Å
582	T	89.6	Confident	91	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	0.2	174.3	59.1	0	0	0	0	113.8	H510 V544 L546 F569 D578 L579 L584	H510-T582 PolarHBondContact NE2-O 3.42Å; H510-T582 VanDerWaalsContact NE2-O 3.15Å; V544-T582 HydrophobicContact CG1-CG2 3.79Å; L546-T582 HydrophobicContact CD1-CG2 4.18Å; L546-T582 HydrophobicContact CD2-CG2 4.42Å; F569-T582 HydrophobicContact CB-CG2 4.49Å; F569-T582 HydrophobicContact CD2-CG2 4.44Å; F569-T582 HydrophobicContact CG-CG2 4.44Å; D578-T582 PolarHBondContact O-N 2.85Å; D578-T582 PolarHBondContact O-OG1 2.96Å; L579-T582 PolarHBondContact O-OG1 3.47Å; T582-L584 PolarHBondContact O-N 2.82Å
583	K	89.8	Confident	91.2	Very high	65 Å²	65	45.2 Å²	45.2	28%	0.283	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	47.1	-178.4	-64	-167	176.2	-171.4	0	114.4	Y502 P504 H510 L579 A580 R581 K585 E586 A587	Y502-K583 WeakPolarHBondContact O-CD 3.44Å; Y502-K583 WeakPolarHBondContact O-CE 3.34Å; P504-K583 HydrophobicContact CG-CD 3.76Å; H510-K583 PolarHBondContact CE1-O 3.02Å; H510-K583 PolarHBondContact NE2-O 3.37Å; L579-K583 PolarHBondContact O-N 3.06Å; A580-K583 PolarHBondContact O-N 3.17Å; A580-K583 VanDerWaalsContact O-N 3.16Å; R581-K583 PolarHBondContact O-N 3.26Å; K583-K585 PolarHBondContact O-N 3.4Å; K583-E586 PolarHBondContact O-N 3.03Å; K583-A587 PolarHBondContact O-N 3.26Å
584	L	90.8	Very high	91.2	Very high	6 Å²	6	45 Å²	45	3%	0.031	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.6	-33.4	175.9	-176	69.5	0	0	0	114.4	I512 L579 T582 E586 A587 I615 R618 K619 L622	I512-L584 HydrophobicContact CD1-CB 4.09Å; I512-L584 HydrophobicContact CD1-CD1 3.55Å; I512-L584 HydrophobicContact CD1-CG 4.46Å; L579-L584 HydrophobicContact CB-CB 4.38Å; L579-L584 HydrophobicContact CB-CD2 4.24Å; L579-L584 HydrophobicContact CD1-CD2 3.91Å; L579-L584 HydrophobicContact CD2-CD2 4.15Å; L579-L584 HydrophobicContact CG-CD2 4.34Å; L579-L584 WeakPolarHBondContact O-CB 3.47Å; L579-L584 PolarHBondContact O-N 3.45Å; L579-L584 VanDerWaalsContact O-N 3.13Å; T582-L584 PolarHBondContact O-N 2.82Å; L584-E586 PolarHBondContact O-N 3.02Å; L584-A587 WeakPolarHBondContact O-CB 3.47Å; L584-A587 PolarHBondContact O-N 3.45Å; L584-I615 HydrophobicContact CD1-CG2 4.11Å; L584-I615 HydrophobicContact CD2-CG2 4.37Å; L584-R618 HydrophobicContact CD2-CB 3.82Å; L584-K619 WeakPolarHBondContact O-CD 3.46Å; L584-L622 HydrophobicContact CD1-CD2 3.51Å; L584-L622 HydrophobicContact CG-CD2 4.38Å
585	K	89.4	Confident	91.1	Very high	188 Å²	188	41.6 Å²	41.6	82%	0.817	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-36.8	177.7	-69.2	-174.6	178.7	-179.2	0	112.6	K583 K619	K583-K585 PolarHBondContact O-N 3.4Å; K585-K619 PolarHBondContact O-NZ 2.85Å
586	E	89.2	Confident	90.7	Very high	109 Å²	109	39.6 Å²	39.6	51%	0.509	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-13.6	-178.2	-65.3	173.9	-150.6	0	0	113.1	P504 K583 L584	P504-E586 WeakPolarHBondContact CG-OE2 3.26Å; K583-E586 PolarHBondContact O-N 3.03Å; L584-E586 PolarHBondContact O-N 3.02Å
587	A	90.4	Very high	89.9	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.008	19%	0.185	C	C	.	.			trans	-57.4	142.3	178.8	0	0	0	0	0	112.3	H510 I512 K583 L584 K619 L622	H510-A587 PolarHBondContact CE1-N 3.36Å; H510-A587 WeakPolarHBondContact NE2-CB 3.32Å; I512-A587 HydrophobicContact CD1-CB 3.88Å; I512-A587 HydrophobicContact CG1-CB 4.25Å; K583-A587 PolarHBondContact O-N 3.26Å; L584-A587 WeakPolarHBondContact O-CB 3.47Å; L584-A587 PolarHBondContact O-N 3.45Å; A587-K619 PolarHBondContact O-NZ 3.01Å; A587-L622 HydrophobicContact CB-CD1 4.06Å; A587-L622 WeakPolarHBondContact O-CD1 3.11Å
588	R	89.6	Confident	89.3	Confident	104 Å²	104	32.9 Å²	32.9	39%	0.392	16%	0.161	S	C	.	.	S	Bend	trans	-77.8	-43	175.9	178	177.2	177.2	115.9	5.9	111.8	R509 H510	R509-R588 HydrophobicContact CB-CB 4.18Å; H510-R588 PolarHBondContact O-N 3.32Å
589	A	92.2	Very high	88.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	166.2	179.9	0	0	0	0	0	110.5	V511 I512 R623 F1115	V511-A589 WeakPolarHBondContact CA-O 3.4Å; V511-A589 HydrophobicContact CG2-CB 4.33Å; I512-A589 PolarHBondContact N-O 3.17Å; I512-A589 VanDerWaalsContact N-O 3.14Å; A589-R623 CarbonylContact C-O 3.58Å; A589-R623 WeakPolarHBondContact CA-O 3.29Å; A589-R623 HydrophobicContact CB-CB 4.08Å; A589-R623 HydrophobicContact CB-CG 4.4Å; A589-R623 WeakPolarHBondContact CB-O 3.38Å; A589-F1115 HydrophobicContact CB-CD2 4.26Å; A589-F1115 HydrophobicContact CB-CE2 3.58Å
590	A	94.1	Very high	87.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	137.9	168.1	0	0	0	0	0	110.6	I512 I615 L622 R623 V624 I625	I512-A590 HydrophobicContact CB-CB 4.43Å; I512-A590 CarbonylContact O-C 3.57Å; I512-A590 WeakPolarHBondContact O-CA 3.47Å; A590-I615 HydrophobicContact CB-CD1 4.11Å; A590-I615 HydrophobicContact CB-CG2 4.31Å; A590-L622 HydrophobicContact CB-CD2 3.88Å; A590-R623 PolarHBondContact N-O 3.3Å; A590-V624 WeakPolarHBondContact O-CA 3.37Å; A590-I625 PolarHBondContact O-N 3.14Å
591	F	95.1	Very high	87.6	Confident	1 Å²	1	40.5 Å²	40.5	0%	0.004	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137.1	167.4	-69.8	-92.5	0	0	0	109	V511 I512 V513 C514 F525 F529 L593 I625 F1115	V511-F591 HydrophobicContact CG1-CD2 3.34Å; V511-F591 HydrophobicContact CG1-CE2 3.52Å; I512-F591 PolarHBondContact O-N 2.82Å; V513-F591 WeakPolarHBondContact CA-O 3.33Å; V513-F591 HydrophobicContact CG1-CB 4.28Å; V513-F591 HydrophobicContact CG2-CB 4.28Å; V513-F591 HydrophobicContact CG2-CD2 4.28Å; C514-F591 PolarHBondContact N-O 3.44Å; F525-F591 HydrophobicContact CE2-CD1 4.02Å; F525-F591 AromaticContact CE2-CE1 3.89Å; F525-F591 HydrophobicContact CE2-CE1 3.89Å; F525-F591 HydrophobicContact CE2-CG 4.43Å; F525-F591 HydrophobicContact CE2-CZ 4.21Å; F525-F591 HydrophobicContact CZ-CB 4.5Å; F525-F591 AromaticContact CZ-CD1 3.9Å; F525-F591 HydrophobicContact CZ-CD1 3.9Å; F525-F591 AromaticContact CZ-CD2 3.89Å; F525-F591 HydrophobicContact CZ-CD2 3.89Å; F525-F591 AromaticContact CZ-CE1 3.92Å; F525-F591 HydrophobicContact CZ-CE1 3.92Å; F525-F591 AromaticContact CZ-CE2 3.93Å; F525-F591 HydrophobicContact CZ-CE2 3.93Å; F525-F591 AromaticContact CZ-CG 3.85Å; F525-F591 HydrophobicContact CZ-CG 3.85Å; F525-F591 AromaticContact CZ-CZ 3.91Å; F525-F591 HydrophobicContact CZ-CZ 3.91Å; F529-F591 HydrophobicContact CD2-CE2 4.33Å; F529-F591 HydrophobicContact CD2-CZ 4.28Å; F529-F591 AromaticContact CE2-CE2 3.82Å; F529-F591 HydrophobicContact CE2-CE2 3.82Å; F529-F591 HydrophobicContact CE2-CZ 4.01Å; F591-L593 HydrophobicContact CB-CD2 4.35Å; F591-I625 WeakPolarHBondContact CA-O 3.41Å; F591-I625 HydrophobicContact CD1-CB 3.76Å; F591-I625 HydrophobicContact CD1-CD1 4.06Å; F591-I625 HydrophobicContact CD1-CG1 4.41Å; F591-I625 HydrophobicContact CD1-CG2 3.93Å; F591-I625 HydrophobicContact CE1-CB 4.06Å; F591-I625 HydrophobicContact CE1-CD1 3.45Å; F591-I625 VanDerWaalsContact CE1-CD1 3.45Å; F591-I625 HydrophobicContact CE1-CG1 4.28Å; F591-I625 HydrophobicContact CE1-CG2 4.12Å; F591-I625 HydrophobicContact CG-CB 4.49Å; F591-I625 HydrophobicContact CZ-CD1 3.82Å; F591-F1115 HydrophobicContact CE1-CB 4.08Å; F591-F1115 HydrophobicContact CE2-CD2 4.13Å; F591-F1115 HydrophobicContact CE2-CG 4.25Å; F591-F1115 HydrophobicContact CZ-CB 3.5Å; F591-F1115 VanDerWaalsContact CZ-CB 3.5Å; F591-F1115 HydrophobicContact CZ-CD1 4.45Å; F591-F1115 AromaticContact CZ-CD2 3.85Å; F591-F1115 HydrophobicContact CZ-CD2 3.85Å; F591-F1115 AromaticContact CZ-CG 3.67Å; F591-F1115 HydrophobicContact CZ-CG 3.67Å
592	I	95.4	Very high	87.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	105.8	170.1	-58.8	166.9	0	0	0	105.3	C514 N608 Q611 A612 I615 V624 I625 L626 Q627	C514-I592 WeakPolarHBondContact O-CA 3.29Å; I592-N608 HydrophobicContact CG2-CB 3.74Å; I592-N608 WeakPolarHBondContact CG2-OD1 3.34Å; I592-Q611 HydrophobicContact CD1-CB 4.25Å; I592-Q611 HydrophobicContact CG2-CB 4.48Å; I592-A612 HydrophobicContact CD1-CB 3.53Å; I592-I615 HydrophobicContact CD1-CD1 4.12Å; I592-I615 HydrophobicContact CG1-CD1 4.26Å; I592-V624 HydrophobicContact CD1-CG1 3.9Å; I592-I625 PolarHBondContact N-O 3.5Å; I592-L626 HydrophobicContact CB-CD1 3.84Å; I592-L626 HydrophobicContact CD1-CD1 4.08Å; I592-L626 HydrophobicContact CG2-CD1 3.76Å; I592-Q627 WeakPolarHBondContact O-CB 3.49Å; I592-Q627 PolarHBondContact O-N 3.24Å
593	L	94.1	Very high	87.4	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	149.8	-177.1	-56.5	-179.1	0	0	0	110.2	V513 C514 G515 N516 F517 I522 F525 F591 N608 L1111	V513-L593 HydrophobicContact CG1-CD1 3.6Å; V513-L593 HydrophobicContact CG1-CG 3.96Å; C514-L593 PolarHBondContact O-N 3.09Å; G515-L593 VanDerWaalsContact CA-O 3.27Å; G515-L593 WeakPolarHBondContact CA-O 3.43Å; N516-L593 PolarHBondContact N-O 2.82Å; N516-L593 CarbonylContact O-C 3.41Å; F517-L593 HydrophobicContact CB-CB 4.43Å; F517-L593 HydrophobicContact CB-CD1 4.4Å; F517-L593 HydrophobicContact CD1-CB 4.29Å; F517-L593 HydrophobicContact CD1-CD1 4.03Å; F517-L593 HydrophobicContact CG-CD1 4.4Å; I522-L593 HydrophobicContact CD1-CD1 4.19Å; F525-L593 HydrophobicContact CD1-CD1 4.36Å; F525-L593 HydrophobicContact CG-CD1 4.42Å; F591-L593 HydrophobicContact CB-CD2 4.35Å; L593-N608 PolarHBondContact O-ND2 3.33Å; L593-L1111 HydrophobicContact CD2-CD1 3.64Å
594	A	91.7	Very high	87.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.2	C	C	.	.			trans	-105.1	153.6	165.4	0	0	0	0	0	108.3	N516 E604 Q627 Y1108	N516-A594 CarbonylContact O-C 3.49Å; N516-A594 WeakPolarHBondContact O-CA 3.44Å; A594-E604 WeakPolarHBondContact CA-OE1 3.44Å; A594-Q627 HydrophobicContact CB-CB 4.46Å; A594-Q627 HydrophobicContact CB-CG 4.16Å; A594-Y1108 VanDerWaalsContact O-CE1 3.27Å; A594-Y1108 WeakPolarHBondContact O-CE1 3.38Å; A594-Y1108 VanDerWaalsContact O-CZ 3.27Å; A594-Y1108 PolarHBondContact O-OH 3.3Å
595	T	88	Confident	87.4	Confident	8 Å²	8	43 Å²	43	5%	0.049	20%	0.198	C	C	.	.			trans	-77	133.6	170.7	-78.5	0	0	0	0	108.7	N516 F517 D518 T598 E604 H629	N516-T595 VanDerWaalsContact C-OG1 3.28Å; N516-T595 PolarHBondContact ND2-OG1 3.31Å; N516-T595 PolarHBondContact O-N 2.64Å; N516-T595 VanDerWaalsContact O-N 3.14Å; F517-T595 VanDerWaalsContact CA-OG1 3.25Å; F517-T595 WeakPolarHBondContact CA-OG1 3.46Å; F517-T595 PolarHBondContact N-OG1 3.47Å; F517-T595 VanDerWaalsContact N-OG1 3.17Å; D518-T595 VanDerWaalsContact CG-CG2 3.5Å; D518-T595 WeakPolarHBondContact OD1-CG2 3.31Å; D518-T595 PolarHBondContact OD1-OG1 2.71Å; D518-T595 WeakPolarHBondContact OD2-CG2 3.21Å; T595-T598 HydrophobicContact CG2-CG2 3.27Å; T595-T598 WeakPolarHBondContact O-CG2 3.19Å; T595-E604 PolarHBondContact N-OE1 3.14Å; T595-H629 PolarHBondContact O-CE1 3.09Å; T595-H629 PolarHBondContact O-NE2 3.12Å
596	P	82	Confident	87.6	Confident	13 Å²	13	37.1 Å²	37.1	8%	0.084	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	146.7	176.7	26.4	-30.9	0	0	0	110.3	T598 N1104 Y1108	P596-T598 VanDerWaalsContact C-N 3.25Å; P596-T598 PolarHBondContact O-N 2.85Å; P596-T598 VanDerWaalsContact O-N 3.14Å; P596-N1104 HydrophobicContact CB-CB 4.46Å; P596-Y1108 HydrophobicContact CB-CE2 3.84Å; P596-Y1108 VanDerWaalsContact CD-OH 3.23Å; P596-Y1108 WeakPolarHBondContact CD-OH 3.4Å; P596-Y1108 HydrophobicContact CG-CE2 4.07Å
597	N	74.9	Confident	87.7	Confident	26 Å²	26	33.9 Å²	33.9	14%	0.139	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	26.4	167.7	-49.6	-29.7	0	0	0	115.4	H1068 N1104	N597-H1068 VanDerWaalsContact CG-CD2 3.43Å; N597-H1068 WeakPolarHBondContact ND2-CA 3.45Å; N597-H1068 PolarHBondContact ND2-O 3.22Å; N597-N1104 PolarHBondContact OD1-ND2 2.85Å
598	T	78.4	Confident	87.9	Confident	28 Å²	28	33.9 Å²	33.9	17%	0.172	17%	0.173	C	C	.	.			trans	-65.5	153.7	175.2	61.7	0	0	0	0	112.1	T595 P596 R601 E604	T595-T598 HydrophobicContact CG2-CG2 3.27Å; T595-T598 WeakPolarHBondContact O-CG2 3.19Å; P596-T598 VanDerWaalsContact C-N 3.25Å; P596-T598 PolarHBondContact O-N 2.85Å; P596-T598 VanDerWaalsContact O-N 3.14Å; T598-R601 WeakPolarHBondContact O-CG 3.33Å; T598-R601 PolarHBondContact O-NE 2.86Å; T598-E604 WeakPolarHBondContact CB-OE2 3.36Å; T598-E604 WeakPolarHBondContact CG2-OE2 3.42Å; T598-E604 PolarHBondContact OG1-OE2 2.9Å
599	K	70.8	Confident	88.1	Confident	101 Å²	101	29.9 Å²	29.9	44%	0.439	16%	0.159	S	C	.	.	S	Bend	trans	-69.5	-46.8	174.1	-61.7	-176.4	-178.3	-175.7	0	111.4	R601 E1027	K599-R601 PolarHBondContact O-N 2.86Å; K599-E1027 WeakPolarHBondContact CE-OE2 3.43Å; K599-E1027 IonicContact NZ-OE2 2.64Å; K599-E1027 PolarHBondContact NZ-OE2 2.98Å
600	F	79.3	Confident	88.1	Confident	129 Å²	129	35.4 Å²	35.4	57%	0.566	19%	0.186	S	C	*	.			trans	-99.2	64	-175.4	-58.6	-73.5	0	0	0	111.8	D602 D603 E604	F600-D602 VanDerWaalsContact C-N 3.32Å; F600-D602 PolarHBondContact O-N 3.25Å; F600-D603 HydrophobicContact CB-CB 4.19Å; F600-D603 PolarHBondContact O-N 3.41Å; F600-E604 WeakPolarHBondContact O-CB 3.39Å; F600-E604 PolarHBondContact O-N 3.13Å; F600-E604 VanDerWaalsContact O-N 3.11Å
601	R	84.7	Confident	88.1	Confident	27 Å²	27	36.8 Å²	36.8	10%	0.102	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-35.8	-175.2	-62.6	-175.1	-174.8	-173.4	-4.6	113.4	T598 K599 D605 H629 Y630 E655	T598-R601 WeakPolarHBondContact O-CG 3.33Å; T598-R601 PolarHBondContact O-NE 2.86Å; K599-R601 PolarHBondContact O-N 2.86Å; R601-D605 WeakPolarHBondContact O-CB 3.41Å; R601-D605 PolarHBondContact O-N 2.9Å; R601-H629 HydrophobicContact CB-CB 3.9Å; R601-H629 HydrophobicContact CG-CB 4.34Å; R601-Y630 HydrophobicContact CB-CD2 4.29Å; R601-Y630 HydrophobicContact CB-CE2 3.61Å; R601-E655 IonicContact CZ-OE1 3.17Å; R601-E655 IonicContact NH1-OE1 3.75Å; R601-E655 PolarHBondContact NH1-OE1 2.62Å; R601-E655 IonicContact NH2-OE1 3.02Å
602	D	85.9	Confident	88	Confident	48 Å²	48	36.8 Å²	36.8	26%	0.257	19%	0.193	S	C	.	.	H	α-helix	trans	-70.6	-42.7	178.8	-75.2	-59.7	0	0	0	113.2	F600 E604 D605 S606 Y630 R632 N633	F600-D602 VanDerWaalsContact C-N 3.32Å; F600-D602 PolarHBondContact O-N 3.25Å; D602-E604 VanDerWaalsContact C-N 3.3Å; D602-E604 PolarHBondContact O-N 3.15Å; D602-D605 PolarHBondContact O-N 2.88Å; D602-S606 WeakPolarHBondContact O-CB 3.35Å; D602-S606 PolarHBondContact O-N 3.41Å; D602-Y630 WeakPolarHBondContact OD1-CD2 3.44Å; D602-Y630 WeakPolarHBondContact OD1-CE2 3.23Å; D602-Y630 WeakPolarHBondContact OD2-CE2 3.16Å; D602-R632 IonicContact OD1-CZ 3.82Å; D602-R632 IonicContact OD1-NE 3.24Å; D602-R632 PolarHBondContact OD1-NE 3.48Å; D602-R632 IonicContact OD1-NH2 2.97Å; D602-R632 PolarHBondContact OD1-NH2 3.04Å; D602-R632 IonicContact OD2-CZ 2.94Å; D602-R632 IonicContact OD2-NH2 3.63Å; D602-R632 PolarHBondContact OD2-NH2 2.92Å; D602-N633 PolarHBondContact OD1-ND2 2.96Å
603	D	88.9	Confident	87.8	Confident	102 Å²	102	39.9 Å²	39.9	55%	0.545	21%	0.209	S	C	.	.	H	α-helix	trans	-64.7	-40.6	178	-63.3	-32.2	0	0	0	110.2	F600 S606 A607	F600-D603 HydrophobicContact CB-CB 4.19Å; F600-D603 PolarHBondContact O-N 3.41Å; D603-S606 PolarHBondContact O-N 3.29Å; D603-S606 PolarHBondContact O-OG 3.47Å; D603-A607 WeakPolarHBondContact O-CB 3.32Å; D603-A607 PolarHBondContact O-N 2.84Å
604	E	89.2	Confident	87.7	Confident	16 Å²	16	40.9 Å²	40.9	8%	0.075	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-45.1	174.3	-175.8	171.7	-154.9	0	0	112.6	N516 A594 T595 T598 F600 D602 S606 A607 N608 H629	N516-E604 WeakPolarHBondContact CB-OE1 3.5Å; A594-E604 WeakPolarHBondContact CA-OE1 3.44Å; T595-E604 PolarHBondContact N-OE1 3.14Å; T598-E604 WeakPolarHBondContact CB-OE2 3.36Å; T598-E604 WeakPolarHBondContact CG2-OE2 3.42Å; T598-E604 PolarHBondContact OG1-OE2 2.9Å; F600-E604 WeakPolarHBondContact O-CB 3.39Å; F600-E604 PolarHBondContact O-N 3.13Å; F600-E604 VanDerWaalsContact O-N 3.11Å; D602-E604 VanDerWaalsContact C-N 3.3Å; D602-E604 PolarHBondContact O-N 3.15Å; E604-S606 VanDerWaalsContact C-N 3.3Å; E604-S606 PolarHBondContact O-N 2.79Å; E604-A607 PolarHBondContact O-N 2.89Å; E604-N608 WeakPolarHBondContact O-CB 3.3Å; E604-N608 PolarHBondContact O-N 2.93Å; E604-H629 IonicContact OE2-CD2 3.92Å; E604-H629 IonicContact OE2-CE1 2.76Å; E604-H629 IonicContact OE2-NE2 3.91Å; E604-H629 PolarHBondContact OE2-NE2 3.05Å
605	D	92.4	Very high	87.8	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.7	-43.1	173.8	-83.3	-5.4	0	0	0	111.2	R601 D602 A607 N608 I609 L628 H629 Y630 N633	R601-D605 WeakPolarHBondContact O-CB 3.41Å; R601-D605 PolarHBondContact O-N 2.9Å; D602-D605 PolarHBondContact O-N 2.88Å; D605-A607 PolarHBondContact O-N 2.91Å; D605-N608 PolarHBondContact O-N 2.88Å; D605-I609 WeakPolarHBondContact O-CB 3.24Å; D605-I609 VanDerWaalsContact O-CG1 3.22Å; D605-I609 WeakPolarHBondContact O-CG1 3.4Å; D605-I609 PolarHBondContact O-N 3.34Å; D605-L628 HydrophobicContact CB-CD2 4.07Å; D605-L628 VanDerWaalsContact OD1-CA 3.25Å; D605-L628 WeakPolarHBondContact OD1-CA 3.49Å; D605-H629 IonicContact OD1-CD2 3.71Å; D605-H629 IonicContact OD1-CG 3.56Å; D605-H629 PolarHBondContact OD1-N 3.29Å; D605-H629 PolarHBondContact OD2-N 3.37Å; D605-Y630 PolarHBondContact OD2-N 3.48Å; D605-N633 HydrophobicContact CB-CB 4.08Å; D605-N633 VanDerWaalsContact CB-ND2 3.29Å; D605-N633 WeakPolarHBondContact CB-ND2 3.26Å; D605-N633 PolarHBondContact OD2-ND2 3.3Å
606	S	92.7	Very high	87.9	Confident	65 Å²	65	40.5 Å²	40.5	46%	0.455	21%	0.214	S	C	.	.	H	α-helix	trans	-63	-41.6	177.9	84	0	0	0	0	111.9	D602 D603 E604 I609 M610	D602-S606 WeakPolarHBondContact O-CB 3.35Å; D602-S606 PolarHBondContact O-N 3.41Å; D603-S606 PolarHBondContact O-N 3.29Å; D603-S606 PolarHBondContact O-OG 3.47Å; E604-S606 VanDerWaalsContact C-N 3.3Å; E604-S606 PolarHBondContact O-N 2.79Å; S606-I609 PolarHBondContact O-N 3.17Å; S606-M610 WeakPolarHBondContact O-CB 3.39Å; S606-M610 PolarHBondContact O-N 3.41Å
607	A	92.7	Very high	88.3	Confident	41 Å²	41	42.3 Å²	42.3	34%	0.339	23%	0.231	S	C	.	.	H	α-helix	trans	-64.2	-47.1	175.7	0	0	0	0	0	110.5	D603 E604 D605 I609 M610 Q611	D603-A607 WeakPolarHBondContact O-CB 3.32Å; D603-A607 PolarHBondContact O-N 2.84Å; E604-A607 PolarHBondContact O-N 2.89Å; D605-A607 PolarHBondContact O-N 2.91Å; A607-I609 PolarHBondContact O-N 3.3Å; A607-M610 WeakPolarHBondContact O-CB 3.25Å; A607-M610 PolarHBondContact O-N 3.24Å; A607-M610 VanDerWaalsContact O-N 3.12Å; A607-Q611 VanDerWaalsContact O-CG 3.28Å; A607-Q611 WeakPolarHBondContact O-CG 3.26Å; A607-Q611 PolarHBondContact O-N 2.97Å
608	N	94	Very high	88.9	Confident	2 Å²	2	49 Å²	49	1%	0.011	25%	0.254	C	S	.	.	H	α-helix	trans	-63.1	-39.9	179.2	-75.7	-16.1	0	0	0	112.4	I592 L593 E604 D605 Q611 A612 L626 L628	I592-N608 HydrophobicContact CG2-CB 3.74Å; I592-N608 WeakPolarHBondContact CG2-OD1 3.34Å; L593-N608 PolarHBondContact O-ND2 3.33Å; E604-N608 WeakPolarHBondContact O-CB 3.3Å; E604-N608 PolarHBondContact O-N 2.93Å; D605-N608 PolarHBondContact O-N 2.88Å; N608-Q611 PolarHBondContact O-N 2.95Å; N608-A612 PolarHBondContact O-N 3.46Å; N608-L626 HydrophobicContact CB-CD1 3.82Å; N608-L628 HydrophobicContact CB-CD2 4.25Å
609	I	93.2	Very high	89.4	Confident	19 Å²	19	50.1 Å²	50.1	10%	0.097	26%	0.257	C	S	.	.	H	α-helix	trans	-59.7	-46	171.2	-72.6	167.2	0	0	0	110.5	D605 S606 A607 Q611 A612 I613 L626 L628 N633 L636 M637	D605-I609 WeakPolarHBondContact O-CB 3.24Å; D605-I609 VanDerWaalsContact O-CG1 3.22Å; D605-I609 WeakPolarHBondContact O-CG1 3.4Å; D605-I609 PolarHBondContact O-N 3.34Å; S606-I609 PolarHBondContact O-N 3.17Å; A607-I609 PolarHBondContact O-N 3.3Å; I609-Q611 VanDerWaalsContact C-N 3.35Å; I609-Q611 PolarHBondContact O-N 2.74Å; I609-A612 WeakPolarHBondContact O-CB 3.43Å; I609-A612 PolarHBondContact O-N 3.14Å; I609-A612 VanDerWaalsContact O-N 3.17Å; I609-I613 HydrophobicContact CG2-CD1 3.95Å; I609-I613 WeakPolarHBondContact O-CG1 3.42Å; I609-I613 PolarHBondContact O-N 2.76Å; I609-L626 HydrophobicContact CG1-CD2 4.36Å; I609-L628 HydrophobicContact CD1-CD1 4.42Å; I609-L628 HydrophobicContact CD1-CD2 4.4Å; I609-L628 HydrophobicContact CG1-CD1 4.42Å; I609-L628 HydrophobicContact CG1-CD2 3.98Å; I609-N633 HydrophobicContact CD1-CB 4.14Å; I609-L636 HydrophobicContact CD1-CD1 4.14Å; I609-M637 HydrophobicContact CB-SD 4.28Å; I609-M637 HydrophobicContact CG1-CG 4.31Å; I609-M637 HydrophobicContact CG1-SD 3.99Å; I609-M637 HydrophobicContact CG2-SD 3.76Å
610	M	93	Very high	90.1	Very high	116 Å²	116	51.3 Å²	51.3	57%	0.571	26%	0.262	S	S	*	.	H	α-helix	trans	-62.5	-40.9	178.5	-166.8	174.3	-72.6	0	0	112.2	S606 A607 A612 I613 A614	S606-M610 WeakPolarHBondContact O-CB 3.39Å; S606-M610 PolarHBondContact O-N 3.41Å; A607-M610 WeakPolarHBondContact O-CB 3.25Å; A607-M610 PolarHBondContact O-N 3.24Å; A607-M610 VanDerWaalsContact O-N 3.12Å; M610-A612 VanDerWaalsContact C-N 3.34Å; M610-A612 PolarHBondContact O-N 3.36Å; M610-I613 PolarHBondContact O-N 3.07Å; M610-A614 PolarHBondContact O-N 3.38Å
611	Q	93.6	Very high	90.4	Very high	30 Å²	30	52 Å²	52	14%	0.14	27%	0.271	C	S	.	.	H	α-helix	trans	-63.3	-39.7	174.4	-63.9	-176	24.6	0	0	111.7	P573 I592 A607 N608 I609 A614 I615	P573-Q611 HydrophobicContact CG-CB 3.72Å; P573-Q611 HydrophobicContact CG-CG 3.49Å; P573-Q611 VanDerWaalsContact CG-CG 3.49Å; I592-Q611 HydrophobicContact CD1-CB 4.25Å; I592-Q611 HydrophobicContact CG2-CB 4.48Å; A607-Q611 VanDerWaalsContact O-CG 3.28Å; A607-Q611 WeakPolarHBondContact O-CG 3.26Å; A607-Q611 PolarHBondContact O-N 2.97Å; N608-Q611 PolarHBondContact O-N 2.95Å; I609-Q611 VanDerWaalsContact C-N 3.35Å; I609-Q611 PolarHBondContact O-N 2.74Å; Q611-A614 PolarHBondContact O-N 3.04Å; Q611-I615 WeakPolarHBondContact O-CG1 3.21Å; Q611-I615 PolarHBondContact O-N 3.49Å
612	A	92.7	Very high	90.7	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.8	-43.6	176.2	0	0	0	0	0	111.5	I592 N608 I609 M610 I615 K616 L626 M637 W643	I592-A612 HydrophobicContact CD1-CB 3.53Å; N608-A612 PolarHBondContact O-N 3.46Å; I609-A612 WeakPolarHBondContact O-CB 3.43Å; I609-A612 PolarHBondContact O-N 3.14Å; I609-A612 VanDerWaalsContact O-N 3.17Å; M610-A612 VanDerWaalsContact C-N 3.34Å; M610-A612 PolarHBondContact O-N 3.36Å; A612-I615 PolarHBondContact O-N 3.42Å; A612-K616 WeakPolarHBondContact O-CB 3.37Å; A612-K616 WeakPolarHBondContact O-CG 3.39Å; A612-K616 PolarHBondContact O-N 3.43Å; A612-L626 HydrophobicContact CB-CD1 4.29Å; A612-L626 HydrophobicContact CB-CD2 4.1Å; A612-M637 HydrophobicContact CB-CE 4.25Å; A612-W643 HydrophobicContact CB-CZ3 4.23Å
613	I	91.6	Very high	90.9	Very high	66 Å²	66	50 Å²	50	34%	0.338	26%	0.26	S	S	.	.	H	α-helix	trans	-61.1	-45.6	174.4	-66.6	167.2	0	0	0	110.2	I609 M610 I615 K616 A617 F640	I609-I613 HydrophobicContact CG2-CD1 3.95Å; I609-I613 WeakPolarHBondContact O-CG1 3.42Å; I609-I613 PolarHBondContact O-N 2.76Å; M610-I613 PolarHBondContact O-N 3.07Å; I613-I615 PolarHBondContact O-N 2.98Å; I613-K616 PolarHBondContact O-N 3.1Å; I613-A617 VanDerWaalsContact O-CB 3.23Å; I613-A617 WeakPolarHBondContact O-CB 3.46Å; I613-A617 PolarHBondContact O-N 3.24Å; I613-F640 HydrophobicContact CB-CZ 4.49Å; I613-F640 HydrophobicContact CG1-CD2 4.42Å; I613-F640 HydrophobicContact CG1-CE2 4.23Å; I613-F640 HydrophobicContact CG1-CZ 4.29Å; I613-F640 HydrophobicContact CG2-CE2 4.13Å; I613-F640 HydrophobicContact CG2-CZ 4.12Å
614	A	92.6	Very high	91.1	Very high	21 Å²	21	45.1 Å²	45.1	17%	0.174	23%	0.234	C	C	.	.	H	α-helix	trans	-60.9	-42.3	179.4	0	0	0	0	0	112.8	M610 Q611 A617 R618	M610-A614 PolarHBondContact O-N 3.38Å; Q611-A614 PolarHBondContact O-N 3.04Å; A614-A617 WeakPolarHBondContact O-CB 3.4Å; A614-A617 PolarHBondContact O-N 3.2Å; A614-R618 PolarHBondContact O-N 3.36Å
615	I	93	Very high	91.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66.4	-48.7	176.9	-73.9	167.4	0	0	0	111.2	P573 L579 L584 A590 I592 Q611 A612 I613 A617 R618 K619 L622 V624	P573-I615 HydrophobicContact CB-CD1 4.18Å; P573-I615 HydrophobicContact CB-CG1 4.2Å; L579-I615 HydrophobicContact CD2-CG1 4.23Å; L584-I615 HydrophobicContact CD1-CG2 4.11Å; L584-I615 HydrophobicContact CD2-CG2 4.37Å; A590-I615 HydrophobicContact CB-CD1 4.11Å; A590-I615 HydrophobicContact CB-CG2 4.31Å; I592-I615 HydrophobicContact CD1-CD1 4.12Å; I592-I615 HydrophobicContact CG1-CD1 4.26Å; Q611-I615 WeakPolarHBondContact O-CG1 3.21Å; Q611-I615 PolarHBondContact O-N 3.49Å; A612-I615 PolarHBondContact O-N 3.42Å; I613-I615 PolarHBondContact O-N 2.98Å; I615-A617 PolarHBondContact O-N 3.2Å; I615-R618 PolarHBondContact O-N 3.31Å; I615-R618 VanDerWaalsContact O-N 3.14Å; I615-K619 PolarHBondContact O-N 2.95Å; I615-L622 HydrophobicContact CG2-CD2 3.45Å; I615-L622 VanDerWaalsContact CG2-CD2 3.45Å; I615-V624 HydrophobicContact CG2-CG2 3.86Å
616	K	90.5	Very high	91.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67.6	-24	177.3	-73.7	-64.4	-159.9	171	0	113.1	A612 I613 R618 K620 L622 V624 F640 R642 D649	A612-K616 WeakPolarHBondContact O-CB 3.37Å; A612-K616 WeakPolarHBondContact O-CG 3.39Å; A612-K616 PolarHBondContact O-N 3.43Å; I613-K616 PolarHBondContact O-N 3.1Å; K616-R618 VanDerWaalsContact C-N 3.27Å; K616-R618 PolarHBondContact O-N 2.88Å; K616-K620 PolarHBondContact NZ-O 3.06Å; K616-K620 VanDerWaalsContact NZ-O 3.14Å; K616-L622 WeakPolarHBondContact CE-O 3.36Å; K616-L622 PolarHBondContact NZ-O 2.96Å; K616-V624 HydrophobicContact CD-CG2 4Å; K616-V624 HydrophobicContact CG-CG2 4.19Å; K616-F640 HydrophobicContact CB-CE1 3.8Å; K616-F640 HydrophobicContact CB-CZ 4.35Å; K616-F640 HydrophobicContact CG-CE1 4.32Å; K616-R642 PolarHBondContact O-NH1 3.3Å; K616-D649 VanDerWaalsContact CE-CG 3.46Å; K616-D649 VanDerWaalsContact CE-OD1 3.25Å; K616-D649 WeakPolarHBondContact CE-OD1 3.26Å; K616-D649 WeakPolarHBondContact CE-OD2 3.42Å; K616-D649 IonicContact NZ-OD1 3.52Å; K616-D649 PolarHBondContact NZ-OD1 3Å; K616-D649 IonicContact NZ-OD2 3.37Å; K616-D649 PolarHBondContact NZ-OD2 3.26Å
617	A	89.5	Confident	91.4	Very high	52 Å²	52	41.4 Å²	41.4	43%	0.43	21%	0.21	S	C	.	.	H	α-helix	trans	-61.8	-38.6	172.7	0	0	0	0	0	110.8	I613 A614 I615 R642	I613-A617 VanDerWaalsContact O-CB 3.23Å; I613-A617 WeakPolarHBondContact O-CB 3.46Å; I613-A617 PolarHBondContact O-N 3.24Å; A614-A617 WeakPolarHBondContact O-CB 3.4Å; A614-A617 PolarHBondContact O-N 3.2Å; I615-A617 PolarHBondContact O-N 3.2Å; A617-R642 VanDerWaalsContact CA-NH1 3.27Å; A617-R642 PolarHBondContact O-NH1 3.38Å
618	R	89.2	Confident	91.4	Very high	167 Å²	167	39.4 Å²	39.4	63%	0.63	19%	0.193	S	C	*	.	H	α-helix	trans	-89	-38.6	-177.2	-65.8	-64.3	176.2	165.6	-7.3	114.5	L579 L584 A614 I615 K616	L579-R618 HydrophobicContact CD1-CG 4.02Å; L584-R618 HydrophobicContact CD2-CB 3.82Å; A614-R618 PolarHBondContact O-N 3.36Å; I615-R618 PolarHBondContact O-N 3.31Å; I615-R618 VanDerWaalsContact O-N 3.14Å; K616-R618 VanDerWaalsContact C-N 3.27Å; K616-R618 PolarHBondContact O-N 2.88Å
619	K	88.9	Confident	91.1	Very high	51 Å²	51	39.6 Å²	39.6	22%	0.222	19%	0.194	C	C	.	.			trans	-135.1	102.1	177.2	-174	174.7	166.6	175.4	0	110.9	L584 K585 A587 I615 N621 L622	L584-K619 WeakPolarHBondContact O-CD 3.46Å; K585-K619 PolarHBondContact O-NZ 2.85Å; A587-K619 PolarHBondContact O-NZ 3.01Å; I615-K619 PolarHBondContact O-N 2.95Å; K619-N621 PolarHBondContact O-N 3.04Å; K619-L622 HydrophobicContact CB-CB 4.08Å; K619-L622 HydrophobicContact CD-CB 3.82Å; K619-L622 HydrophobicContact CD-CD1 4.01Å; K619-L622 HydrophobicContact CD-CG 4.42Å; K619-L622 HydrophobicContact CG-CB 3.8Å; K619-L622 PolarHBondContact O-N 2.83Å
620	K	84.6	Confident	90.7	Very high	126 Å²	126	39 Å²	39	55%	0.548	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-44.6	-176.7	-60.5	-176.5	-178.2	179.8	0	112.8	K616 L622	K616-K620 PolarHBondContact NZ-O 3.06Å; K616-K620 VanDerWaalsContact NZ-O 3.14Å; K620-L622 VanDerWaalsContact C-N 3.32Å; K620-L622 PolarHBondContact O-N 3.18Å
621	N	86	Confident	90.1	Very high	143 Å²	143	34 Å²	34	77%	0.765	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	12.9	-174.3	-59.3	1	0	0	0	113.5	K619	K619-N621 PolarHBondContact O-N 3.04Å
622	L	90	Very high	89.5	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	18%	0.179	C	C	.	.			trans	-76	131.8	173.5	-174.9	72.7	0	0	0	108.8	L584 A587 A590 I615 K616 K619 K620 V624	L584-L622 HydrophobicContact CD1-CD2 3.51Å; L584-L622 HydrophobicContact CG-CD2 4.38Å; A587-L622 HydrophobicContact CB-CD1 4.06Å; A587-L622 WeakPolarHBondContact O-CD1 3.11Å; A590-L622 HydrophobicContact CB-CD2 3.88Å; I615-L622 HydrophobicContact CG2-CD2 3.45Å; I615-L622 VanDerWaalsContact CG2-CD2 3.45Å; K616-L622 WeakPolarHBondContact CE-O 3.36Å; K616-L622 PolarHBondContact NZ-O 2.96Å; K619-L622 HydrophobicContact CB-CB 4.08Å; K619-L622 HydrophobicContact CD-CB 3.82Å; K619-L622 HydrophobicContact CD-CD1 4.01Å; K619-L622 HydrophobicContact CD-CG 4.42Å; K619-L622 HydrophobicContact CG-CB 3.8Å; K619-L622 PolarHBondContact O-N 2.83Å; K620-L622 VanDerWaalsContact C-N 3.32Å; K620-L622 PolarHBondContact O-N 3.18Å; L622-V624 HydrophobicContact CD2-CG2 4.3Å; L622-V624 PolarHBondContact O-N 2.97Å
623	R	91	Very high	89.2	Confident	31 Å²	31	38.9 Å²	38.9	12%	0.117	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	121.5	170	179.7	173.8	177.6	-173.6	-4.4	110	A589 A590 A647 N648 M650 F1114 F1115 D1118	A589-R623 CarbonylContact C-O 3.58Å; A589-R623 WeakPolarHBondContact CA-O 3.29Å; A589-R623 HydrophobicContact CB-CB 4.08Å; A589-R623 HydrophobicContact CB-CG 4.4Å; A589-R623 WeakPolarHBondContact CB-O 3.38Å; A590-R623 PolarHBondContact N-O 3.3Å; R623-A647 WeakPolarHBondContact CB-O 3.44Å; R623-N648 WeakPolarHBondContact CG-O 3.48Å; R623-N648 PolarHBondContact NE-O 2.74Å; R623-M650 PolarHBondContact NH2-SD 3.26Å; R623-F1114 PolarHBondContact NH2-O 2.9Å; R623-F1115 PolarHBondContact NH1-O 3.44Å; R623-F1115 PolarHBondContact NH2-O 3.08Å; R623-D1118 IonicContact CZ-OD1 2.73Å; R623-D1118 IonicContact CZ-OD2 3.67Å; R623-D1118 IonicContact NH1-OD1 3.97Å; R623-D1118 PolarHBondContact NH1-OD1 2.77Å; R623-D1118 IonicContact NH1-OD2 3.97Å; R623-D1118 IonicContact NH2-OD1 3.4Å; R623-D1118 PolarHBondContact NH2-OD1 3.25Å; R623-D1118 IonicContact NH2-OD2 3.23Å
624	V	92.5	Very high	88.9	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	130.3	176.4	-178.6	0	0	0	0	110	A590 I592 I615 K616 L622 W643 D649 M650	A590-V624 WeakPolarHBondContact O-CA 3.37Å; I592-V624 HydrophobicContact CD1-CG1 3.9Å; I615-V624 HydrophobicContact CG2-CG2 3.86Å; K616-V624 HydrophobicContact CD-CG2 4Å; K616-V624 HydrophobicContact CG-CG2 4.19Å; L622-V624 HydrophobicContact CD2-CG2 4.3Å; L622-V624 PolarHBondContact O-N 2.97Å; V624-W643 HydrophobicContact CB-CH2 4.08Å; V624-W643 HydrophobicContact CB-CZ3 4.08Å; V624-W643 HydrophobicContact CG1-CH2 3.99Å; V624-W643 HydrophobicContact CG1-CZ3 4.09Å; V624-D649 PolarHBondContact N-OD1 3.11Å; V624-D649 VanDerWaalsContact N-OD1 3.1Å; V624-D649 WeakPolarHBondContact O-CA 3.5Å; V624-M650 PolarHBondContact O-N 3.25Å
625	I	93	Very high	88.1	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	106.9	172.7	-57.1	179.5	0	0	0	106.7	A590 F591 I592 M650 V652 F1115	A590-I625 PolarHBondContact O-N 3.14Å; F591-I625 WeakPolarHBondContact CA-O 3.41Å; F591-I625 HydrophobicContact CD1-CB 3.76Å; F591-I625 HydrophobicContact CD1-CD1 4.06Å; F591-I625 HydrophobicContact CD1-CG1 4.41Å; F591-I625 HydrophobicContact CD1-CG2 3.93Å; F591-I625 HydrophobicContact CE1-CB 4.06Å; F591-I625 HydrophobicContact CE1-CD1 3.45Å; F591-I625 VanDerWaalsContact CE1-CD1 3.45Å; F591-I625 HydrophobicContact CE1-CG1 4.28Å; F591-I625 HydrophobicContact CE1-CG2 4.12Å; F591-I625 HydrophobicContact CG-CB 4.49Å; F591-I625 HydrophobicContact CZ-CD1 3.82Å; I592-I625 PolarHBondContact N-O 3.5Å; I625-M650 WeakPolarHBondContact CA-O 3.45Å; I625-M650 HydrophobicContact CB-CE 4.48Å; I625-M650 HydrophobicContact CD1-CE 3.37Å; I625-M650 HydrophobicContact CG1-CE 3.59Å; I625-M650 HydrophobicContact CG2-CE 4.14Å; I625-V652 HydrophobicContact CG2-CG2 4.29Å; I625-F1115 HydrophobicContact CD1-CB 3.69Å; I625-F1115 HydrophobicContact CD1-CD2 3.79Å; I625-F1115 HydrophobicContact CD1-CG 4.23Å
626	L	93.7	Very high	87.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	122.3	-177.4	174.8	62.8	0	0	0	109	I592 N608 I609 A612 L628 M637 W643 M650 V651 V652	I592-L626 HydrophobicContact CB-CD1 3.84Å; I592-L626 HydrophobicContact CD1-CD1 4.08Å; I592-L626 HydrophobicContact CG2-CD1 3.76Å; N608-L626 HydrophobicContact CB-CD1 3.82Å; I609-L626 HydrophobicContact CG1-CD2 4.36Å; A612-L626 HydrophobicContact CB-CD1 4.29Å; A612-L626 HydrophobicContact CB-CD2 4.1Å; L626-L628 HydrophobicContact CD1-CD2 4.07Å; L626-L628 HydrophobicContact CD2-CD1 4.24Å; L626-L628 HydrophobicContact CD2-CD2 4.13Å; L626-L628 HydrophobicContact CD2-CG 4.21Å; L626-L628 HydrophobicContact CG-CD2 3.99Å; L626-L628 HydrophobicContact CG-CG 4.03Å; L626-M637 HydrophobicContact CD2-CE 4.11Å; L626-M637 HydrophobicContact CD2-CG 3.87Å; L626-M637 HydrophobicContact CD2-SD 3.99Å; L626-W643 HydrophobicContact CB-CH2 3.84Å; L626-W643 HydrophobicContact CB-CZ2 4.41Å; L626-W643 HydrophobicContact CD2-CH2 4.32Å; L626-M650 PolarHBondContact N-O 3.17Å; L626-V651 HydrophobicContact CD2-CG1 4.43Å; L626-V651 HydrophobicContact CD2-CG2 4.46Å; L626-V651 CarbonylContact O-C 3.6Å; L626-V651 WeakPolarHBondContact O-CA 3.43Å; L626-V652 PolarHBondContact O-N 3.02Å
627	Q	93.6	Very high	87.2	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	130.9	170.7	-169.3	178.8	9.2	0	0	109.2	I592 A594 V652 M654 Y1108	I592-Q627 WeakPolarHBondContact O-CB 3.49Å; I592-Q627 PolarHBondContact O-N 3.24Å; A594-Q627 HydrophobicContact CB-CB 4.46Å; A594-Q627 HydrophobicContact CB-CG 4.16Å; Q627-V652 WeakPolarHBondContact CA-O 3.31Å; Q627-M654 HydrophobicContact CG-CG 3.69Å; Q627-M654 HydrophobicContact CG-SD 3.97Å; Q627-M654 PolarHBondContact NE2-SD 3.47Å; Q627-Y1108 PolarHBondContact NE2-OH 3.18Å; Q627-Y1108 VanDerWaalsContact NE2-OH 3.12Å
628	L	92.3	Very high	86.3	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	156.4	173.9	-60.8	178.2	0	0	0	109.6	D605 N608 I609 L626 N633 K634 V651 V652 C653 M654	D605-L628 HydrophobicContact CB-CD2 4.07Å; D605-L628 VanDerWaalsContact OD1-CA 3.25Å; D605-L628 WeakPolarHBondContact OD1-CA 3.49Å; N608-L628 HydrophobicContact CB-CD2 4.25Å; I609-L628 HydrophobicContact CD1-CD1 4.42Å; I609-L628 HydrophobicContact CD1-CD2 4.4Å; I609-L628 HydrophobicContact CG1-CD1 4.42Å; I609-L628 HydrophobicContact CG1-CD2 3.98Å; L626-L628 HydrophobicContact CD1-CD2 4.07Å; L626-L628 HydrophobicContact CD2-CD1 4.24Å; L626-L628 HydrophobicContact CD2-CD2 4.13Å; L626-L628 HydrophobicContact CD2-CG 4.21Å; L626-L628 HydrophobicContact CG-CD2 3.99Å; L626-L628 HydrophobicContact CG-CG 4.03Å; L628-N633 HydrophobicContact CD1-CB 4.33Å; L628-K634 HydrophobicContact CD1-CB 4.37Å; L628-V651 HydrophobicContact CD1-CG1 3.54Å; L628-V651 HydrophobicContact CG-CG1 3.98Å; L628-V652 PolarHBondContact N-O 3.37Å; L628-C653 CarbonylContact O-C 3.45Å; L628-C653 WeakPolarHBondContact O-CA 3.41Å; L628-M654 PolarHBondContact O-N 3.39Å
629	H	88.3	Confident	85.7	Confident	5 Å²	5	38.9 Å²	38.9	2%	0.023	19%	0.188	C	C	.	.	S	Bend	trans	-80.2	-52.8	172.6	-70.7	-60.3	0	0	0	111.2	T595 R601 E604 D605 C653 E655	T595-H629 PolarHBondContact O-CE1 3.09Å; T595-H629 PolarHBondContact O-NE2 3.12Å; R601-H629 HydrophobicContact CB-CB 3.9Å; R601-H629 HydrophobicContact CG-CB 4.34Å; E604-H629 IonicContact OE2-CD2 3.92Å; E604-H629 IonicContact OE2-CE1 2.76Å; E604-H629 IonicContact OE2-NE2 3.91Å; E604-H629 PolarHBondContact OE2-NE2 3.05Å; D605-H629 IonicContact OD1-CD2 3.71Å; D605-H629 IonicContact OD1-CG 3.56Å; D605-H629 PolarHBondContact OD1-N 3.29Å; D605-H629 PolarHBondContact OD2-N 3.37Å; H629-C653 PolarHBondContact O-SG 3.49Å; H629-E655 VanDerWaalsContact O-CB 3.24Å; H629-E655 WeakPolarHBondContact O-CB 3.38Å; H629-E655 VanDerWaalsContact O-CG 3.25Å; H629-E655 WeakPolarHBondContact O-CG 3.45Å; H629-E655 PolarHBondContact O-N 3.19Å
630	Y	84.6	Confident	85.2	Confident	7 Å²	7	38.5 Å²	38.5	3%	0.027	19%	0.186	C	C	.	.			trans	-106.1	139	-169.8	-62	-48	0	0	0	114.5	R601 D602 D605 R632 N633 K634 C653 E655 P952 N954	R601-Y630 HydrophobicContact CB-CD2 4.29Å; R601-Y630 HydrophobicContact CB-CE2 3.61Å; D602-Y630 WeakPolarHBondContact OD1-CD2 3.44Å; D602-Y630 WeakPolarHBondContact OD1-CE2 3.23Å; D602-Y630 WeakPolarHBondContact OD2-CE2 3.16Å; D605-Y630 PolarHBondContact OD2-N 3.48Å; Y630-R632 VanDerWaalsContact C-N 3.27Å; Y630-R632 PolarHBondContact O-N 3.1Å; Y630-N633 PolarHBondContact O-N 3.25Å; Y630-K634 PolarHBondContact O-N 3.46Å; Y630-C653 VanDerWaalsContact C-SG 3.58Å; Y630-E655 HydrophobicContact CD1-CG 4.43Å; Y630-P952 HydrophobicContact CE1-CG 4.41Å; Y630-N954 WeakPolarHBondContact CD1-ND2 3.2Å; Y630-N954 WeakPolarHBondContact CE1-ND2 3.38Å
631	F	81.6	Confident	84.7	Confident	11 Å²	11	37.2 Å²	37.2	5%	0.048	19%	0.19	C	C	.	.	H	α-helix	trans	-63.4	-30.8	176.8	-180	-100	0	0	0	112.7	N633 K634 C653 E1137 F1140	F631-N633 VanDerWaalsContact C-N 3.26Å; F631-N633 PolarHBondContact O-N 3.14Å; F631-K634 HydrophobicContact CD2-CD 3.79Å; F631-K634 HydrophobicContact CE2-CD 3.96Å; F631-K634 WeakPolarHBondContact O-CB 3.32Å; F631-K634 PolarHBondContact O-N 3Å; F631-C653 PolarHBondContact N-SG 2.92Å; F631-E1137 HydrophobicContact CE2-CG 3.76Å; F631-E1137 HydrophobicContact CZ-CG 3.6Å; F631-F1140 HydrophobicContact CE1-CB 4Å; F631-F1140 HydrophobicContact CE1-CD2 4.07Å; F631-F1140 HydrophobicContact CE1-CG 4.05Å; F631-F1140 HydrophobicContact CZ-CD2 4.39Å
632	R	80.9	Confident	84.2	Confident	112 Å²	112	34.7 Å²	34.7	42%	0.423	17%	0.17	S	C	.	.	H	α-helix	trans	-60	-37.9	175.9	72.4	178.6	179	179.4	-5.6	112.6	D602 Y630 K634 C635	D602-R632 IonicContact OD1-CZ 3.82Å; D602-R632 IonicContact OD1-NE 3.24Å; D602-R632 PolarHBondContact OD1-NE 3.48Å; D602-R632 IonicContact OD1-NH2 2.97Å; D602-R632 PolarHBondContact OD1-NH2 3.04Å; D602-R632 IonicContact OD2-CZ 2.94Å; D602-R632 IonicContact OD2-NH2 3.63Å; D602-R632 PolarHBondContact OD2-NH2 2.92Å; Y630-R632 VanDerWaalsContact C-N 3.27Å; Y630-R632 PolarHBondContact O-N 3.1Å; R632-K634 VanDerWaalsContact C-N 3.33Å; R632-C635 WeakPolarHBondContact O-CB 3.34Å; R632-C635 PolarHBondContact O-N 2.74Å
633	N	85.9	Confident	83.6	Confident	20 Å²	20	36.3 Å²	36.3	11%	0.107	18%	0.176	C	C	.	.	H	α-helix	trans	-76	-27.3	-177.4	-66.3	-24.4	0	0	0	110.8	D602 D605 I609 L628 Y630 F631 C635 L636	D602-N633 PolarHBondContact OD1-ND2 2.96Å; D605-N633 HydrophobicContact CB-CB 4.08Å; D605-N633 VanDerWaalsContact CB-ND2 3.29Å; D605-N633 WeakPolarHBondContact CB-ND2 3.26Å; D605-N633 PolarHBondContact OD2-ND2 3.3Å; I609-N633 HydrophobicContact CD1-CB 4.14Å; L628-N633 HydrophobicContact CD1-CB 4.33Å; Y630-N633 PolarHBondContact O-N 3.25Å; F631-N633 VanDerWaalsContact C-N 3.26Å; F631-N633 PolarHBondContact O-N 3.14Å; N633-C635 VanDerWaalsContact C-N 3.29Å; N633-C635 PolarHBondContact O-N 3.23Å; N633-L636 WeakPolarHBondContact O-CB 3.33Å; N633-L636 PolarHBondContact O-N 2.74Å
634	K	85.3	Confident	82.4	Confident	6 Å²	6	36.7 Å²	36.7	3%	0.026	18%	0.182	C	C	.	.	H	α-helix	trans	-57.2	-40.6	170.8	-174.5	-174.8	-170.9	-173.6	0	112	L628 Y630 F631 R632 L636 M637 V651 C653 E656 E1137	L628-K634 HydrophobicContact CD1-CB 4.37Å; Y630-K634 PolarHBondContact O-N 3.46Å; F631-K634 HydrophobicContact CD2-CD 3.79Å; F631-K634 HydrophobicContact CE2-CD 3.96Å; F631-K634 WeakPolarHBondContact O-CB 3.32Å; F631-K634 PolarHBondContact O-N 3Å; R632-K634 VanDerWaalsContact C-N 3.33Å; K634-L636 PolarHBondContact O-N 3.17Å; K634-M637 WeakPolarHBondContact O-CB 3.45Å; K634-M637 PolarHBondContact O-N 3.14Å; K634-M637 VanDerWaalsContact O-N 3.1Å; K634-V651 HydrophobicContact CB-CG1 4.22Å; K634-V651 HydrophobicContact CG-CB 4.05Å; K634-V651 HydrophobicContact CG-CG1 3.73Å; K634-C653 HydrophobicContact CD-CB 4.44Å; K634-E656 IonicContact NZ-OE1 2.63Å; K634-E656 PolarHBondContact NZ-OE1 2.89Å; K634-E656 IonicContact NZ-OE2 3.82Å; K634-E656 PolarHBondContact NZ-OE2 3.5Å; K634-E1137 VanDerWaalsContact CE-OE1 3.28Å; K634-E1137 WeakPolarHBondContact CE-OE1 3.48Å; K634-E1137 IonicContact NZ-OE1 3.65Å; K634-E1137 PolarHBondContact NZ-OE1 2.69Å
635	C	76.7	Confident	81.1	Confident	13 Å²	13	44 Å²	44	9%	0.088	21%	0.211	C	C	.	.	H	α-helix	trans	-60.3	-30.8	179.5	-65.3	0	0	0	0	113.2	R632 N633 M637 N638	R632-C635 WeakPolarHBondContact O-CB 3.34Å; R632-C635 PolarHBondContact O-N 2.74Å; N633-C635 VanDerWaalsContact C-N 3.29Å; N633-C635 PolarHBondContact O-N 3.23Å; C635-M637 PolarHBondContact O-N 3.36Å; C635-N638 PolarHBondContact O-N 2.95Å
636	L	80.3	Confident	79.5	Confident	95 Å²	95	47.7 Å²	47.7	50%	0.497	23%	0.23	S	C	.	.	H	α-helix	trans	-62.8	-31.3	178	-59.7	171.3	0	0	0	112.1	I609 N633 K634 N639	I609-L636 HydrophobicContact CD1-CD1 4.14Å; N633-L636 WeakPolarHBondContact O-CB 3.33Å; N633-L636 PolarHBondContact O-N 2.74Å; K634-L636 PolarHBondContact O-N 3.17Å; L636-N639 PolarHBondContact O-N 3.36Å
637	M	82.5	Confident	77.9	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-72.9	-28.1	179.8	-68.4	-58.4	-59.6	0	0	113	I609 A612 L626 K634 C635 N639 F640 W643 V651	I609-M637 HydrophobicContact CB-SD 4.28Å; I609-M637 HydrophobicContact CG1-CG 4.31Å; I609-M637 HydrophobicContact CG1-SD 3.99Å; I609-M637 HydrophobicContact CG2-SD 3.76Å; A612-M637 HydrophobicContact CB-CE 4.25Å; L626-M637 HydrophobicContact CD2-CE 4.11Å; L626-M637 HydrophobicContact CD2-CG 3.87Å; L626-M637 HydrophobicContact CD2-SD 3.99Å; K634-M637 WeakPolarHBondContact O-CB 3.45Å; K634-M637 PolarHBondContact O-N 3.14Å; K634-M637 VanDerWaalsContact O-N 3.1Å; C635-M637 PolarHBondContact O-N 3.36Å; M637-N639 PolarHBondContact O-N 2.96Å; M637-F640 WeakPolarHBondContact O-CB 3.28Å; M637-F640 PolarHBondContact O-N 3.23Å; M637-W643 HydrophobicContact CE-CD2 3.59Å; M637-W643 HydrophobicContact CE-CE3 3.14Å; M637-W643 HydrophobicContact CE-CG 4.3Å; M637-W643 HydrophobicContact CE-CH2 4.01Å; M637-W643 HydrophobicContact CE-CZ2 4.39Å; M637-W643 HydrophobicContact CE-CZ3 3.37Å; M637-V651 HydrophobicContact CB-CG2 4.16Å; M637-V651 HydrophobicContact CG-CG2 4.33Å
638	N	72.3	Confident	77.1	Confident	76 Å²	76	51.5 Å²	51.5	41%	0.406	25%	0.254	S	S	.	.	H	α-helix	trans	-65	-24.3	176.1	-72.3	-17.9	0	0	0	112	C635 F640	C635-N638 PolarHBondContact O-N 2.95Å; N638-F640 VanDerWaalsContact C-N 3.31Å
639	N	75	Confident	76.8	Confident	115 Å²	115	52.2 Å²	52.2	62%	0.615	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-15.3	175.3	-63.5	-25.9	0	0	0	112.9	L636 M637 P641	L636-N639 PolarHBondContact O-N 3.36Å; M637-N639 PolarHBondContact O-N 2.96Å; N639-P641 WeakPolarHBondContact O-CD 3.32Å
640	F	79.7	Confident	76.8	Confident	43 Å²	43	52.6 Å²	52.6	19%	0.189	26%	0.259	C	S	.	.			trans	-81.7	115.3	-176.5	-172.7	-120.1	0	0	0	111.2	I613 K616 M637 N638 R642 W643	I613-F640 HydrophobicContact CB-CZ 4.49Å; I613-F640 HydrophobicContact CG1-CD2 4.42Å; I613-F640 HydrophobicContact CG1-CE2 4.23Å; I613-F640 HydrophobicContact CG1-CZ 4.29Å; I613-F640 HydrophobicContact CG2-CE2 4.13Å; I613-F640 HydrophobicContact CG2-CZ 4.12Å; K616-F640 HydrophobicContact CB-CE1 3.8Å; K616-F640 HydrophobicContact CB-CZ 4.35Å; K616-F640 HydrophobicContact CG-CE1 4.32Å; M637-F640 WeakPolarHBondContact O-CB 3.28Å; M637-F640 PolarHBondContact O-N 3.23Å; N638-F640 VanDerWaalsContact C-N 3.31Å; F640-R642 HydrophobicContact CD1-CB 4.13Å; F640-R642 HydrophobicContact CE1-CB 3.61Å; F640-R642 HydrophobicContact CE1-CG 4.33Å; F640-R642 HydrophobicContact CZ-CB 4.04Å; F640-R642 HydrophobicContact CZ-CG 4.26Å; F640-R642 PolarHBondContact O-N 2.96Å; F640-R642 VanDerWaalsContact O-N 3.09Å; F640-W643 HydrophobicContact CB-CB 4.26Å; F640-W643 HydrophobicContact CD1-CB 4.1Å; F640-W643 VanDerWaalsContact O-CB 3.27Å; F640-W643 WeakPolarHBondContact O-CB 3.16Å; F640-W643 PolarHBondContact O-N 2.86Å
641	P	72.7	Confident	77.1	Confident	98 Å²	98	52.7 Å²	52.7	64%	0.636	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-22.1	-167.8	25.7	-36	0	0	0	114.3	N639	N639-P641 WeakPolarHBondContact O-CD 3.32Å
642	R	76.8	Confident	77.5	Confident	91 Å²	91	52.2 Å²	52.2	34%	0.343	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-9	177.2	-57.7	-178.8	179.5	-165.2	7.4	112.8	K616 A617 F640 T644	K616-R642 PolarHBondContact O-NH1 3.3Å; A617-R642 VanDerWaalsContact CA-NH1 3.27Å; A617-R642 PolarHBondContact O-NH1 3.38Å; F640-R642 HydrophobicContact CD1-CB 4.13Å; F640-R642 HydrophobicContact CE1-CB 3.61Å; F640-R642 HydrophobicContact CE1-CG 4.33Å; F640-R642 HydrophobicContact CZ-CB 4.04Å; F640-R642 HydrophobicContact CZ-CG 4.26Å; F640-R642 PolarHBondContact O-N 2.96Å; F640-R642 VanDerWaalsContact O-N 3.09Å; R642-T644 PolarHBondContact O-N 3.31Å
643	W	76.7	Confident	78	Confident	34 Å²	34	46.9 Å²	46.9	13%	0.129	24%	0.239	C	C	.	.			trans	-76.3	109.8	170.5	-158.1	-99.2	0	0	0	107.5	A612 V624 L626 M637 F640 D649 V651	A612-W643 HydrophobicContact CB-CZ3 4.23Å; V624-W643 HydrophobicContact CB-CH2 4.08Å; V624-W643 HydrophobicContact CB-CZ3 4.08Å; V624-W643 HydrophobicContact CG1-CH2 3.99Å; V624-W643 HydrophobicContact CG1-CZ3 4.09Å; L626-W643 HydrophobicContact CB-CH2 3.84Å; L626-W643 HydrophobicContact CB-CZ2 4.41Å; L626-W643 HydrophobicContact CD2-CH2 4.32Å; M637-W643 HydrophobicContact CE-CD2 3.59Å; M637-W643 HydrophobicContact CE-CE3 3.14Å; M637-W643 HydrophobicContact CE-CG 4.3Å; M637-W643 HydrophobicContact CE-CH2 4.01Å; M637-W643 HydrophobicContact CE-CZ2 4.39Å; M637-W643 HydrophobicContact CE-CZ3 3.37Å; F640-W643 HydrophobicContact CB-CB 4.26Å; F640-W643 HydrophobicContact CD1-CB 4.1Å; F640-W643 VanDerWaalsContact O-CB 3.27Å; F640-W643 WeakPolarHBondContact O-CB 3.16Å; F640-W643 PolarHBondContact O-N 2.86Å; W643-D649 HydrophobicContact CD2-CB 3.95Å; W643-D649 HydrophobicContact CE3-CB 4.43Å; W643-D649 HydrophobicContact CG-CB 4.43Å; W643-D649 HydrophobicContact CH2-CB 4.27Å; W643-D649 HydrophobicContact CZ2-CB 3.74Å; W643-V651 HydrophobicContact CH2-CG2 4.24Å; W643-V651 HydrophobicContact CZ2-CG2 3.3Å
644	T	67.1	Low	78.1	Confident	40 Å²	40	46.3 Å²	46.3	25%	0.245	24%	0.235	C	C	.	.			trans	-129.5	131.6	-174.3	59.8	0	0	0	0	109.8	R642 L646 A647 D649	R642-T644 PolarHBondContact O-N 3.31Å; T644-L646 PolarHBondContact O-N 3.48Å; T644-L646 VanDerWaalsContact O-N 3.08Å; T644-A647 PolarHBondContact O-N 2.9Å; T644-A647 VanDerWaalsContact O-N 3.09Å; T644-A647 PolarHBondContact OG1-N 3.5Å; T644-D649 PolarHBondContact N-OD2 3.42Å; T644-D649 VanDerWaalsContact N-OD2 3.15Å
645	Y	65	Low	78.2	Confident	152 Å²	152	46.2 Å²	46.2	60%	0.596	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-56.6	-24.9	170.8	62.9	-94.9	0	0	0	111.8	N648 Y817	Y645-N648 WeakPolarHBondContact O-CA 3.29Å; Y645-N648 PolarHBondContact O-N 3.39Å; Y645-N648 VanDerWaalsContact O-N 3.11Å; Y645-N648 PolarHBondContact O-OD1 3.14Å; Y645-Y817 WeakPolarHBondContact CE2-OH 3.49Å; Y645-Y817 PolarHBondContact OH-OH 3.05Å
646	L	58.2	Low	78.7	Confident	81 Å²	81	45.7 Å²	45.7	42%	0.424	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-61.4	-40	174.6	-83.4	173.5	0	0	0	115.7	T644 N648 Y817	T644-L646 PolarHBondContact O-N 3.48Å; T644-L646 VanDerWaalsContact O-N 3.08Å; L646-N648 PolarHBondContact O-N 3.38Å; L646-Y817 HydrophobicContact CD1-CD1 3.28Å; L646-Y817 HydrophobicContact CD1-CD2 4.22Å; L646-Y817 HydrophobicContact CD1-CE1 2.99Å; L646-Y817 HydrophobicContact CD1-CE2 4.02Å; L646-Y817 HydrophobicContact CD1-CG 3.94Å; L646-Y817 VanDerWaalsContact CD1-CZ 3.43Å; L646-Y817 HydrophobicContact CD2-CD2 4.28Å; L646-Y817 HydrophobicContact CD2-CE1 3.73Å; L646-Y817 HydrophobicContact CD2-CE2 3.42Å; L646-Y817 VanDerWaalsContact CD2-CE2 3.42Å; L646-Y817 WeakPolarHBondContact CD2-OH 3.42Å; L646-Y817 HydrophobicContact CG-CD1 4.29Å; L646-Y817 HydrophobicContact CG-CE1 3.53Å; L646-Y817 HydrophobicContact CG-CE2 4.18Å; L646-Y817 VanDerWaalsContact CG-CZ 3.49Å; L646-Y817 WeakPolarHBondContact CG-OH 3.33Å
647	A	61.2	Low	79.2	Confident	20 Å²	20	41.3 Å²	41.3	17%	0.165	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-77.2	3.5	176.2	0	0	0	0	0	111.8	R623 T644 D649	R623-A647 WeakPolarHBondContact CB-O 3.44Å; T644-A647 PolarHBondContact O-N 2.9Å; T644-A647 VanDerWaalsContact O-N 3.09Å; T644-A647 PolarHBondContact OG1-N 3.5Å; A647-D649 PolarHBondContact O-N 3.16Å
648	N	76.3	Confident	79.6	Confident	61 Å²	61	41.2 Å²	41.2	33%	0.326	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	38.3	-169.5	-61.7	-11.5	0	0	0	112	R623 Y645 L646 D1118	R623-N648 WeakPolarHBondContact CG-O 3.48Å; R623-N648 PolarHBondContact NE-O 2.74Å; Y645-N648 WeakPolarHBondContact O-CA 3.29Å; Y645-N648 PolarHBondContact O-N 3.39Å; Y645-N648 VanDerWaalsContact O-N 3.11Å; Y645-N648 PolarHBondContact O-OD1 3.14Å; L646-N648 PolarHBondContact O-N 3.38Å; N648-D1118 WeakPolarHBondContact CB-OD2 3.11Å; N648-D1118 VanDerWaalsContact CG-OD2 3.26Å; N648-D1118 PolarHBondContact ND2-OD2 3.36Å
649	D	86.1	Confident	80.6	Confident	15 Å²	15	37.6 Å²	37.6	8%	0.08	19%	0.189	C	C	.	.			trans	-65.8	137.4	172.3	-63.7	-32.6	0	0	0	109.8	K616 V624 W643 T644 A647	K616-D649 VanDerWaalsContact CE-CG 3.46Å; K616-D649 VanDerWaalsContact CE-OD1 3.25Å; K616-D649 WeakPolarHBondContact CE-OD1 3.26Å; K616-D649 WeakPolarHBondContact CE-OD2 3.42Å; K616-D649 IonicContact NZ-OD1 3.52Å; K616-D649 PolarHBondContact NZ-OD1 3Å; K616-D649 IonicContact NZ-OD2 3.37Å; K616-D649 PolarHBondContact NZ-OD2 3.26Å; V624-D649 PolarHBondContact N-OD1 3.11Å; V624-D649 VanDerWaalsContact N-OD1 3.1Å; V624-D649 WeakPolarHBondContact O-CA 3.5Å; W643-D649 HydrophobicContact CD2-CB 3.95Å; W643-D649 HydrophobicContact CE3-CB 4.43Å; W643-D649 HydrophobicContact CG-CB 4.43Å; W643-D649 HydrophobicContact CH2-CB 4.27Å; W643-D649 HydrophobicContact CZ2-CB 3.74Å; T644-D649 PolarHBondContact N-OD2 3.42Å; T644-D649 VanDerWaalsContact N-OD2 3.15Å; A647-D649 PolarHBondContact O-N 3.16Å
650	M	88.3	Confident	81.4	Confident	12 Å²	12	32.1 Å²	32.1	6%	0.059	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	131.7	-175.7	-59	-171.8	-50.1	0	0	110	R623 V624 I625 L626 F1114 F1121	R623-M650 PolarHBondContact NH2-SD 3.26Å; V624-M650 PolarHBondContact O-N 3.25Å; I625-M650 WeakPolarHBondContact CA-O 3.45Å; I625-M650 HydrophobicContact CB-CE 4.48Å; I625-M650 HydrophobicContact CD1-CE 3.37Å; I625-M650 HydrophobicContact CG1-CE 3.59Å; I625-M650 HydrophobicContact CG2-CE 4.14Å; L626-M650 PolarHBondContact N-O 3.17Å; M650-F1114 HydrophobicContact CE-CB 3.8Å; M650-F1121 HydrophobicContact SD-CB 4.37Å; M650-F1121 HydrophobicContact SD-CD1 4.21Å; M650-F1121 HydrophobicContact SD-CG 4.47Å
651	V	90.1	Very high	82	Confident	10 Å²	10	30.2 Å²	30.2	6%	0.061	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	113.3	168.7	-171.1	0	0	0	0	107.6	L626 L628 K634 M637 W643 F1121	L626-V651 HydrophobicContact CD2-CG1 4.43Å; L626-V651 HydrophobicContact CD2-CG2 4.46Å; L626-V651 CarbonylContact O-C 3.6Å; L626-V651 WeakPolarHBondContact O-CA 3.43Å; L628-V651 HydrophobicContact CD1-CG1 3.54Å; L628-V651 HydrophobicContact CG-CG1 3.98Å; K634-V651 HydrophobicContact CB-CG1 4.22Å; K634-V651 HydrophobicContact CG-CB 4.05Å; K634-V651 HydrophobicContact CG-CG1 3.73Å; M637-V651 HydrophobicContact CB-CG2 4.16Å; M637-V651 HydrophobicContact CG-CG2 4.33Å; W643-V651 HydrophobicContact CH2-CG2 4.24Å; W643-V651 HydrophobicContact CZ2-CG2 3.3Å; V651-F1121 VanDerWaalsContact O-CZ 3.31Å; V651-F1121 WeakPolarHBondContact O-CZ 3.32Å
652	V	91.1	Very high	83	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	110.2	179.2	-176.7	0	0	0	0	107.8	I625 L626 Q627 L628 M654 L657 L1111 F1114 F1121	I625-V652 HydrophobicContact CG2-CG2 4.29Å; L626-V652 PolarHBondContact O-N 3.02Å; Q627-V652 WeakPolarHBondContact CA-O 3.31Å; L628-V652 PolarHBondContact N-O 3.37Å; V652-M654 HydrophobicContact CG1-SD 4.37Å; V652-L657 HydrophobicContact CG1-CD1 3.62Å; V652-L1111 HydrophobicContact CB-CD2 4.08Å; V652-L1111 HydrophobicContact CG1-CD2 3.89Å; V652-L1111 HydrophobicContact CG2-CD2 3.97Å; V652-F1114 HydrophobicContact CG1-CE2 4.22Å; V652-F1114 HydrophobicContact CG2-CD2 4.11Å; V652-F1121 HydrophobicContact CB-CE2 4.41Å; V652-F1121 HydrophobicContact CG1-CE2 4.33Å; V652-F1121 HydrophobicContact CG2-CD2 4.35Å; V652-F1121 HydrophobicContact CG2-CE2 3.92Å; V652-F1121 HydrophobicContact CG2-CZ 4.26Å
653	C	90	Very high	83.8	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.007	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	119	173.8	-179.3	0	0	0	0	109.1	L628 H629 Y630 F631 K634 E656 L657	L628-C653 CarbonylContact O-C 3.45Å; L628-C653 WeakPolarHBondContact O-CA 3.41Å; H629-C653 PolarHBondContact O-SG 3.49Å; Y630-C653 VanDerWaalsContact C-SG 3.58Å; F631-C653 PolarHBondContact N-SG 2.92Å; K634-C653 HydrophobicContact CD-CB 4.44Å; C653-E656 HydrophobicContact CB-CB 3.7Å; C653-E656 WeakPolarHBondContact CB-OE2 3.49Å; C653-L657 PolarHBondContact O-N 2.97Å
654	M	89.1	Confident	84.6	Confident	7 Å²	7	19.8 Å²	19.8	3%	0.034	10%	0.099	C	C	.	.	H	α-helix	trans	-70.2	-42	-175.7	-65.9	-59.7	-73.4	0	0	112.2	Q627 L628 V652 E656 L657 K658 L1107 Y1108	Q627-M654 HydrophobicContact CG-CG 3.69Å; Q627-M654 HydrophobicContact CG-SD 3.97Å; Q627-M654 PolarHBondContact NE2-SD 3.47Å; L628-M654 PolarHBondContact O-N 3.39Å; V652-M654 HydrophobicContact CG1-SD 4.37Å; M654-E656 VanDerWaalsContact C-N 3.34Å; M654-E656 PolarHBondContact O-N 3.45Å; M654-L657 PolarHBondContact O-N 3.2Å; M654-K658 VanDerWaalsContact O-CB 3.29Å; M654-K658 WeakPolarHBondContact O-CB 3.44Å; M654-K658 PolarHBondContact O-N 3.22Å; M654-L1107 HydrophobicContact CE-CB 3.48Å; M654-L1107 VanDerWaalsContact CE-CB 3.48Å; M654-L1107 HydrophobicContact CE-CD1 4.04Å; M654-L1107 HydrophobicContact CE-CG 4.41Å; M654-Y1108 HydrophobicContact CE-CD2 4.06Å; M654-Y1108 HydrophobicContact CE-CE2 3.76Å
655	E	87.2	Confident	85.9	Confident	4 Å²	4	17.9 Å²	17.9	2%	0.019	9%	0.087	C	C	.	.	H	α-helix	trans	-66.9	-34.5	178.1	-71.4	-66.4	156.3	0	0	112.3	R601 H629 Y630 K658 L659	R601-E655 IonicContact CZ-OE1 3.17Å; R601-E655 IonicContact NH1-OE1 3.75Å; R601-E655 PolarHBondContact NH1-OE1 2.62Å; R601-E655 IonicContact NH2-OE1 3.02Å; H629-E655 VanDerWaalsContact O-CB 3.24Å; H629-E655 WeakPolarHBondContact O-CB 3.38Å; H629-E655 VanDerWaalsContact O-CG 3.25Å; H629-E655 WeakPolarHBondContact O-CG 3.45Å; H629-E655 PolarHBondContact O-N 3.19Å; Y630-E655 HydrophobicContact CD1-CG 4.43Å; E655-K658 IonicContact OE1-NZ 3.75Å; E655-K658 PolarHBondContact OE1-NZ 2.8Å; E655-K658 WeakPolarHBondContact OE2-CE 3.35Å; E655-K658 IonicContact OE2-NZ 3.03Å; E655-K658 PolarHBondContact OE2-NZ 2.9Å; E655-L659 VanDerWaalsContact O-CB 3.26Å; E655-L659 WeakPolarHBondContact O-CB 3.29Å; E655-L659 WeakPolarHBondContact O-CG 3.35Å; E655-L659 PolarHBondContact O-N 3.19Å
656	E	88.2	Confident	87.2	Confident	2 Å²	2	10.7 Å²	10.7	1%	0.009	6%	0.059	C	C	.	.	H	α-helix	trans	-60.5	-47	173.9	-176.8	-172.7	160.9	0	0	110.9	K634 C653 M654 G660	K634-E656 IonicContact NZ-OE1 2.63Å; K634-E656 PolarHBondContact NZ-OE1 2.89Å; K634-E656 IonicContact NZ-OE2 3.82Å; K634-E656 PolarHBondContact NZ-OE2 3.5Å; C653-E656 HydrophobicContact CB-CB 3.7Å; C653-E656 WeakPolarHBondContact CB-OE2 3.49Å; M654-E656 VanDerWaalsContact C-N 3.34Å; M654-E656 PolarHBondContact O-N 3.45Å; E656-G660 WeakPolarHBondContact O-CA 3.37Å; E656-G660 PolarHBondContact O-N 3.12Å
657	L	90.8	Very high	88.8	Confident	4 Å²	4	8.7 Å²	8.7	2%	0.021	5%	0.049	C	C	.	.	H	α-helix	trans	-70.6	-45.3	179.1	-67.5	-179.3	0	0	0	112.3	V652 C653 M654 L661 L1107 F1114 L1124 I1128	V652-L657 HydrophobicContact CG1-CD1 3.62Å; C653-L657 PolarHBondContact O-N 2.97Å; M654-L657 PolarHBondContact O-N 3.2Å; L657-L661 WeakPolarHBondContact O-CB 3.45Å; L657-L661 WeakPolarHBondContact O-CG 3.43Å; L657-L661 PolarHBondContact O-N 2.91Å; L657-L1107 HydrophobicContact CB-CD1 4.13Å; L657-F1114 HydrophobicContact CD1-CE2 4.05Å; L657-F1114 HydrophobicContact CD1-CZ 4.25Å; L657-L1124 HydrophobicContact CD2-CB 4.43Å; L657-L1124 HydrophobicContact CD2-CD1 4.36Å; L657-I1128 HydrophobicContact CD2-CD1 3.85Å
658	K	90.9	Very high	90.2	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-57.9	-61.7	179.4	175	-172.3	96.7	-179.3	0	110.9	M654 E655 G660 L661 M662 E1066 F1102 N1104 L1107	M654-K658 VanDerWaalsContact O-CB 3.29Å; M654-K658 WeakPolarHBondContact O-CB 3.44Å; M654-K658 PolarHBondContact O-N 3.22Å; E655-K658 IonicContact OE1-NZ 3.75Å; E655-K658 PolarHBondContact OE1-NZ 2.8Å; E655-K658 WeakPolarHBondContact OE2-CE 3.35Å; E655-K658 IonicContact OE2-NZ 3.03Å; E655-K658 PolarHBondContact OE2-NZ 2.9Å; K658-G660 VanDerWaalsContact C-N 3.32Å; K658-G660 PolarHBondContact O-N 3.42Å; K658-L661 PolarHBondContact O-N 2.96Å; K658-M662 HydrophobicContact CG-SD 3.99Å; K658-M662 WeakPolarHBondContact O-CG 3.49Å; K658-M662 PolarHBondContact O-N 3.16Å; K658-E1066 WeakPolarHBondContact CD-OE1 3.41Å; K658-E1066 WeakPolarHBondContact CE-OE1 3.2Å; K658-E1066 IonicContact NZ-OE1 3.4Å; K658-E1066 PolarHBondContact NZ-OE1 3.22Å; K658-E1066 IonicContact NZ-OE2 2.74Å; K658-E1066 PolarHBondContact NZ-OE2 3.06Å; K658-F1102 HydrophobicContact CB-CE1 3.93Å; K658-F1102 HydrophobicContact CG-CD1 3.9Å; K658-F1102 HydrophobicContact CG-CE1 3.59Å; K658-N1104 WeakPolarHBondContact CD-OD1 3.4Å; K658-N1104 WeakPolarHBondContact CG-OD1 3.44Å; K658-L1107 HydrophobicContact CB-CD1 4.35Å
659	L	92	Very high	91	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-67.8	-35.8	-175.2	-65.4	178.1	0	0	0	111.2	E655 M662 A663 N954 N957 F958 L1022	E655-L659 VanDerWaalsContact O-CB 3.26Å; E655-L659 WeakPolarHBondContact O-CB 3.29Å; E655-L659 WeakPolarHBondContact O-CG 3.35Å; E655-L659 PolarHBondContact O-N 3.19Å; L659-M662 PolarHBondContact O-N 3.27Å; L659-A663 WeakPolarHBondContact O-CB 3.44Å; L659-A663 PolarHBondContact O-N 3.33Å; L659-N954 HydrophobicContact CD1-CB 4.38Å; L659-N954 VanDerWaalsContact CD1-O 3.25Å; L659-N954 WeakPolarHBondContact CD1-O 3.46Å; L659-N957 HydrophobicContact CB-CB 4Å; L659-N957 HydrophobicContact CD1-CB 4.17Å; L659-F958 HydrophobicContact CB-CB 3.99Å; L659-F958 HydrophobicContact CD2-CB 4.48Å; L659-F958 WeakPolarHBondContact O-CD2 3.46Å; L659-L1022 HydrophobicContact CD2-CD1 4.47Å; L659-L1022 HydrophobicContact CD2-CD2 4.24Å
660	G	92	Very high	91.3	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-61.8	-43.9	174.9	0	0	0	0	0	113	E656 K658 Y664	E656-G660 WeakPolarHBondContact O-CA 3.37Å; E656-G660 PolarHBondContact O-N 3.12Å; K658-G660 VanDerWaalsContact C-N 3.32Å; K658-G660 PolarHBondContact O-N 3.42Å; G660-Y664 WeakPolarHBondContact O-CD2 3.04Å; G660-Y664 PolarHBondContact O-N 3.02Å
661	L	93.1	Very high	91.5	Very high	2 Å²	2	4.9 Å²	4.9	1%	0.01	3%	0.027	C	C	.	.	H	α-helix	trans	-71.8	-39.3	177.4	-70.9	172.4	0	0	0	112.5	L657 K658 A663 Y664 N665 I675 V676 F1102 L1107	L657-L661 WeakPolarHBondContact O-CB 3.45Å; L657-L661 WeakPolarHBondContact O-CG 3.43Å; L657-L661 PolarHBondContact O-N 2.91Å; K658-L661 PolarHBondContact O-N 2.96Å; L661-A663 VanDerWaalsContact C-N 3.3Å; L661-A663 PolarHBondContact O-N 2.77Å; L661-Y664 PolarHBondContact O-N 2.92Å; L661-N665 PolarHBondContact O-N 2.5Å; L661-I675 HydrophobicContact CD2-CB 4.08Å; L661-I675 HydrophobicContact CD2-CG2 3.81Å; L661-V676 HydrophobicContact CD1-CG2 3.94Å; L661-F1102 HydrophobicContact CB-CE2 3.99Å; L661-F1102 HydrophobicContact CB-CZ 4.31Å; L661-F1102 HydrophobicContact CD1-CE2 4.16Å; L661-F1102 HydrophobicContact CD1-CZ 4.17Å; L661-L1107 HydrophobicContact CD1-CD2 4.1Å
662	M	93.4	Very high	91.7	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-63.6	-36	174.9	-70.9	179	74.4	0	0	112	K658 L659 Y664 N665 F958 V1020 L1022 T1064 E1066 F1102	K658-M662 HydrophobicContact CG-SD 3.99Å; K658-M662 WeakPolarHBondContact O-CG 3.49Å; K658-M662 PolarHBondContact O-N 3.16Å; L659-M662 PolarHBondContact O-N 3.27Å; M662-Y664 VanDerWaalsContact C-N 3.26Å; M662-Y664 PolarHBondContact O-N 3.36Å; M662-N665 WeakPolarHBondContact O-CB 3.49Å; M662-N665 PolarHBondContact O-N 3.49Å; M662-N665 VanDerWaalsContact O-N 3.1Å; M662-F958 HydrophobicContact CB-CD2 4.37Å; M662-F958 HydrophobicContact CB-CE2 4.17Å; M662-V1020 HydrophobicContact CE-CG1 3.64Å; M662-L1022 HydrophobicContact CE-CD2 3.65Å; M662-L1022 HydrophobicContact SD-CD2 4.25Å; M662-T1064 HydrophobicContact CE-CG2 4.07Å; M662-E1066 HydrophobicContact CE-CB 4.11Å; M662-F1102 HydrophobicContact CG-CB 4.01Å; M662-F1102 HydrophobicContact CG-CD1 4.05Å; M662-F1102 HydrophobicContact CG-CD2 4.16Å; M662-F1102 HydrophobicContact CG-CG 3.79Å; M662-F1102 HydrophobicContact SD-CB 4.15Å; M662-F1102 HydrophobicContact SD-CD1 4Å; M662-F1102 HydrophobicContact SD-CG 4.16Å
663	A	93.6	Very high	91.8	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-59.5	-37.7	174.4	0	0	0	0	0	112.1	L659 L661 N665 C666 F958 P961 L962	L659-A663 WeakPolarHBondContact O-CB 3.44Å; L659-A663 PolarHBondContact O-N 3.33Å; L661-A663 VanDerWaalsContact C-N 3.3Å; L661-A663 PolarHBondContact O-N 2.77Å; A663-N665 VanDerWaalsContact C-N 3.3Å; A663-N665 PolarHBondContact O-N 2.85Å; A663-C666 VanDerWaalsContact O-CB 3.26Å; A663-C666 WeakPolarHBondContact O-CB 3.46Å; A663-C666 PolarHBondContact O-N 2.85Å; A663-C666 VanDerWaalsContact O-N 3.14Å; A663-F958 HydrophobicContact CB-CD2 3.89Å; A663-F958 HydrophobicContact CB-CE2 4.05Å; A663-F958 HydrophobicContact CB-CG 4.3Å; A663-F958 WeakPolarHBondContact CB-O 3.21Å; A663-P961 HydrophobicContact CB-CB 4.16Å; A663-P961 HydrophobicContact CB-CG 4.16Å; A663-L962 HydrophobicContact CB-CD2 4.47Å; A663-L962 HydrophobicContact CB-CG 4.2Å; A663-L962 WeakPolarHBondContact O-CD2 3.41Å
664	Y	93.6	Very high	92	Very high	4 Å²	4	4.5 Å²	4.5	2%	0.016	3%	0.025	C	C	.	.	H	α-helix	trans	-66.8	-27.3	176.2	-81.4	-69.5	0	0	0	113.9	G660 L661 M662 C666 L667 A668 F671 P961 L1127 I1128 V1162	G660-Y664 WeakPolarHBondContact O-CD2 3.04Å; G660-Y664 PolarHBondContact O-N 3.02Å; L661-Y664 PolarHBondContact O-N 2.92Å; M662-Y664 VanDerWaalsContact C-N 3.26Å; M662-Y664 PolarHBondContact O-N 3.36Å; Y664-C666 PolarHBondContact O-N 3.11Å; Y664-L667 HydrophobicContact CD1-CD1 3.82Å; Y664-L667 HydrophobicContact CE1-CD1 4Å; Y664-L667 PolarHBondContact O-N 2.95Å; Y664-A668 PolarHBondContact O-N 2.82Å; Y664-F671 VanDerWaalsContact CB-CD1 3.42Å; Y664-F671 HydrophobicContact CD1-CD1 4.32Å; Y664-F671 HydrophobicContact CD1-CE1 4.22Å; Y664-F671 HydrophobicContact CD2-CD1 4.48Å; Y664-F671 HydrophobicContact CD2-CE1 4.28Å; Y664-F671 AromaticContact CG-CD1 3.85Å; Y664-F671 HydrophobicContact CG-CD1 3.85Å; Y664-F671 AromaticContact CG-CE1 3.91Å; Y664-F671 HydrophobicContact CG-CE1 3.91Å; Y664-P961 HydrophobicContact CE2-CB 4.23Å; Y664-L1127 HydrophobicContact CE2-CD2 4.34Å; Y664-L1127 HydrophobicContact CE2-CG 3.88Å; Y664-L1127 PolarHBondContact OH-O 2.89Å; Y664-I1128 HydrophobicContact CE2-CG1 4.49Å; Y664-V1162 HydrophobicContact CD1-CB 4.02Å; Y664-V1162 HydrophobicContact CD1-CG1 4.13Å; Y664-V1162 HydrophobicContact CD1-CG2 3.96Å; Y664-V1162 HydrophobicContact CE1-CB 3.94Å; Y664-V1162 HydrophobicContact CE1-CG1 4.5Å; Y664-V1162 HydrophobicContact CE1-CG2 3.49Å; Y664-V1162 VanDerWaalsContact CE1-CG2 3.49Å
665	N	93.6	Very high	92.2	Very high	0 Å²	0	4.3 Å²	4.3	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-62	-29.2	172.6	-80.7	-1.1	0	0	0	112.3	L661 M662 A663 L667 A668 F671 S672 T1064 G1099	L661-N665 PolarHBondContact O-N 2.5Å; M662-N665 WeakPolarHBondContact O-CB 3.49Å; M662-N665 PolarHBondContact O-N 3.49Å; M662-N665 VanDerWaalsContact O-N 3.1Å; A663-N665 VanDerWaalsContact C-N 3.3Å; A663-N665 PolarHBondContact O-N 2.85Å; N665-L667 VanDerWaalsContact C-N 3.29Å; N665-L667 PolarHBondContact O-N 3.34Å; N665-A668 WeakPolarHBondContact CA-O 3.27Å; N665-A668 CarbonylContact O-C 3.37Å; N665-F671 PolarHBondContact OD1-N 2.63Å; N665-F671 VanDerWaalsContact OD1-N 3.13Å; N665-S672 PolarHBondContact ND2-OG 3.42Å; N665-S672 WeakPolarHBondContact OD1-CB 3.33Å; N665-S672 PolarHBondContact OD1-N 3.16Å; N665-S672 PolarHBondContact OD1-OG 3.03Å; N665-S672 VanDerWaalsContact OD1-OG 3.1Å; N665-T1064 PolarHBondContact ND2-OG1 2.71Å; N665-G1099 PolarHBondContact ND2-O 2.79Å
666	C	92.8	Very high	92.4	Very high	2 Å²	2	4.1 Å²	4.1	1%	0.014	2%	0.023	C	C	.	.	H	α-helix	trans	-65.8	-32.8	173.4	-59.8	0	0	0	0	112.6	A663 Y664 F940 L962 N1017 A1018 V1020	A663-C666 VanDerWaalsContact O-CB 3.26Å; A663-C666 WeakPolarHBondContact O-CB 3.46Å; A663-C666 PolarHBondContact O-N 2.85Å; A663-C666 VanDerWaalsContact O-N 3.14Å; Y664-C666 PolarHBondContact O-N 3.11Å; C666-F940 HydrophobicContact CB-CD1 3.82Å; C666-F940 HydrophobicContact CB-CE1 3.77Å; C666-F940 HydrophobicContact CB-CG 4.31Å; C666-F940 HydrophobicContact CB-CZ 4.21Å; C666-F940 VanDerWaalsContact O-CE1 3.26Å; C666-F940 WeakPolarHBondContact O-CE1 3.23Å; C666-L962 HydrophobicContact CB-CD2 4.26Å; C666-N1017 PolarHBondContact O-ND2 2.86Å; C666-A1018 HydrophobicContact CB-CB 4.06Å; C666-V1020 WeakPolarHBondContact SG-CG2 3.47Å
667	L	91.1	Very high	92.6	Very high	38 Å²	38	4.2 Å²	4.2	20%	0.199	2%	0.024	C	C	.	.	H	α-helix	trans	-83	-45.3	178.9	-61.6	176.5	0	0	0	111.7	Y664 N665 F940 L962 Q967	Y664-L667 HydrophobicContact CD1-CD1 3.82Å; Y664-L667 HydrophobicContact CE1-CD1 4Å; Y664-L667 PolarHBondContact O-N 2.95Å; N665-L667 VanDerWaalsContact C-N 3.29Å; N665-L667 PolarHBondContact O-N 3.34Å; L667-F940 HydrophobicContact CD2-CZ 4.08Å; L667-L962 HydrophobicContact CD1-CD2 4.1Å; L667-L962 HydrophobicContact CD2-CD2 3.82Å; L667-L962 HydrophobicContact CG-CD2 3.71Å; L667-Q967 VanDerWaalsContact CD1-NE2 3.35Å
668	A	92.1	Very high	92.6	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.024	C	C	.	.	S	Bend	trans	-139.5	102.9	-179.2	0	0	0	0	0	108.9	Y664 N665 G670 F671 V1162 L1164 Y1232	Y664-A668 PolarHBondContact O-N 2.82Å; N665-A668 WeakPolarHBondContact CA-O 3.27Å; N665-A668 CarbonylContact O-C 3.37Å; A668-G670 PolarHBondContact O-N 2.87Å; A668-F671 HydrophobicContact CB-CB 4.06Å; A668-F671 WeakPolarHBondContact O-CB 2.87Å; A668-F671 PolarHBondContact O-N 3.27Å; A668-V1162 HydrophobicContact CB-CG1 4.35Å; A668-L1164 HydrophobicContact CB-CB 3.99Å; A668-Y1232 HydrophobicContact CB-CD1 4.21Å; A668-Y1232 HydrophobicContact CB-CE1 4.16Å
669	P	92.5	Very high	92.5	Very high	28 Å²	28	4.3 Å²	4.3	18%	0.182	2%	0.024	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47	133.5	177.3	-33.3	37.6	0	0	0	112.6	F671 H1062 L1164 Y1205 Y1232	P669-F671 VanDerWaalsContact C-N 3.27Å; P669-F671 PolarHBondContact O-N 3.44Å; P669-H1062 HydrophobicContact CB-CB 4.19Å; P669-H1062 HydrophobicContact CG-CB 3.87Å; P669-L1164 HydrophobicContact CG-CD2 4.45Å; P669-Y1205 HydrophobicContact CB-CE1 4.05Å; P669-Y1232 VanDerWaalsContact O-CE1 3.31Å; P669-Y1232 WeakPolarHBondContact O-CE1 3.37Å; P669-Y1232 PolarHBondContact O-OH 2.9Å
670	G	91.5	Very high	92	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	3%	0.025	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	1.5	-179.5	0	0	0	0	0	116.8	A668 S672 T673 L674	A668-G670 PolarHBondContact O-N 2.87Å; G670-S672 VanDerWaalsContact C-N 3.29Å; G670-S672 PolarHBondContact O-N 2.89Å; G670-T673 PolarHBondContact O-N 2.82Å; G670-T673 VanDerWaalsContact O-N 3.16Å; G670-T673 PolarHBondContact O-OG1 3.22Å; G670-L674 PolarHBondContact O-N 3.26Å
671	F	94.3	Very high	91	Very high	1 Å²	1	4.8 Å²	4.8	0%	0.004	3%	0.028	C	C	.	.	H	α-helix	trans	-61	-34.9	178.5	-174.2	-92.2	0	0	0	113.4	Y664 N665 A668 P669 T673 L674 I675 L1127 V1162 L1202 Y1232 F1234	Y664-F671 VanDerWaalsContact CB-CD1 3.42Å; Y664-F671 HydrophobicContact CD1-CD1 4.32Å; Y664-F671 HydrophobicContact CD1-CE1 4.22Å; Y664-F671 HydrophobicContact CD2-CD1 4.48Å; Y664-F671 HydrophobicContact CD2-CE1 4.28Å; Y664-F671 AromaticContact CG-CD1 3.85Å; Y664-F671 HydrophobicContact CG-CD1 3.85Å; Y664-F671 AromaticContact CG-CE1 3.91Å; Y664-F671 HydrophobicContact CG-CE1 3.91Å; N665-F671 PolarHBondContact OD1-N 2.63Å; N665-F671 VanDerWaalsContact OD1-N 3.13Å; A668-F671 HydrophobicContact CB-CB 4.06Å; A668-F671 WeakPolarHBondContact O-CB 2.87Å; A668-F671 PolarHBondContact O-N 3.27Å; P669-F671 VanDerWaalsContact C-N 3.27Å; P669-F671 PolarHBondContact O-N 3.44Å; F671-T673 VanDerWaalsContact C-N 3.3Å; F671-T673 PolarHBondContact O-N 2.98Å; F671-L674 HydrophobicContact CD2-CD2 4.23Å; F671-L674 HydrophobicContact CE2-CD2 4.31Å; F671-L674 WeakPolarHBondContact O-CB 3.38Å; F671-L674 PolarHBondContact O-N 3.21Å; F671-I675 HydrophobicContact CD1-CG1 3.94Å; F671-I675 HydrophobicContact CE1-CD1 4.08Å; F671-I675 HydrophobicContact CE1-CG1 3.5Å; F671-I675 HydrophobicContact CE2-CD1 4.46Å; F671-I675 HydrophobicContact CE2-CG1 4.47Å; F671-I675 HydrophobicContact CZ-CD1 3.86Å; F671-I675 HydrophobicContact CZ-CG1 3.8Å; F671-I675 WeakPolarHBondContact O-CG1 2.96Å; F671-I675 PolarHBondContact O-N 2.82Å; F671-I675 VanDerWaalsContact O-N 3.1Å; F671-L1127 HydrophobicContact CE1-CD2 4.2Å; F671-L1127 HydrophobicContact CZ-CD2 4.4Å; F671-V1162 HydrophobicContact CD2-CG1 3.78Å; F671-V1162 HydrophobicContact CE1-CG1 4.44Å; F671-V1162 HydrophobicContact CE2-CG1 3.58Å; F671-V1162 HydrophobicContact CG-CG1 4.29Å; F671-V1162 HydrophobicContact CZ-CG1 3.93Å; F671-V1162 HydrophobicContact CZ-CG2 4.41Å; F671-L1202 HydrophobicContact CE2-CD1 4.07Å; F671-Y1232 HydrophobicContact CB-CE1 4.24Å; F671-Y1232 HydrophobicContact CD2-CD1 4.04Å; F671-F1234 AromaticContact CE2-CE1 3.99Å; F671-F1234 HydrophobicContact CE2-CE1 3.99Å; F671-F1234 AromaticContact CZ-CE1 3.91Å; F671-F1234 HydrophobicContact CZ-CE1 3.91Å; F671-F1234 HydrophobicContact CZ-CZ 4.27Å
672	S	93.4	Very high	89.8	Confident	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-58.7	-43.7	175.7	68.2	0	0	0	0	111.3	N665 G670 I675 V676	N665-S672 PolarHBondContact ND2-OG 3.42Å; N665-S672 WeakPolarHBondContact OD1-CB 3.33Å; N665-S672 PolarHBondContact OD1-N 3.16Å; N665-S672 PolarHBondContact OD1-OG 3.03Å; N665-S672 VanDerWaalsContact OD1-OG 3.1Å; G670-S672 VanDerWaalsContact C-N 3.29Å; G670-S672 PolarHBondContact O-N 2.89Å; S672-I675 PolarHBondContact O-N 2.93Å; S672-V676 WeakPolarHBondContact O-CB 3.33Å; S672-V676 WeakPolarHBondContact O-CG2 3.47Å; S672-V676 PolarHBondContact O-N 3.18Å
673	T	93.5	Very high	88.3	Confident	1 Å²	1	8 Å²	8	1%	0.006	5%	0.051	C	C	.	.	H	α-helix	trans	-68.3	-38.3	-179.8	67.4	0	0	0	0	112.3	G670 F671 I675 V676 N677 F1096 G1099 V1215	G670-T673 PolarHBondContact O-N 2.82Å; G670-T673 VanDerWaalsContact O-N 3.16Å; G670-T673 PolarHBondContact O-OG1 3.22Å; F671-T673 VanDerWaalsContact C-N 3.3Å; F671-T673 PolarHBondContact O-N 2.98Å; T673-I675 VanDerWaalsContact C-N 3.32Å; T673-I675 PolarHBondContact O-N 3.31Å; T673-V676 PolarHBondContact O-N 3.15Å; T673-N677 VanDerWaalsContact O-CB 3.31Å; T673-N677 WeakPolarHBondContact O-CB 3.34Å; T673-N677 PolarHBondContact O-N 3.32Å; T673-F1096 HydrophobicContact CG2-CD2 4.22Å; T673-F1096 HydrophobicContact CG2-CE2 3.98Å; T673-F1096 HydrophobicContact CG2-CZ 4.21Å; T673-F1096 WeakPolarHBondContact CG2-O 3.47Å; T673-G1099 VanDerWaalsContact CG2-CA 3.5Å; T673-V1215 WeakPolarHBondContact OG1-CG2 3.44Å
674	L	94	Very high	86.3	Confident	1 Å²	1	12.5 Å²	12.5	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-54.6	-50.8	171.8	-174.7	83.2	0	0	0	110.2	G670 F671 L678 L1202 V1215 A1217 Y1232	G670-L674 PolarHBondContact O-N 3.26Å; F671-L674 HydrophobicContact CD2-CD2 4.23Å; F671-L674 HydrophobicContact CE2-CD2 4.31Å; F671-L674 WeakPolarHBondContact O-CB 3.38Å; F671-L674 PolarHBondContact O-N 3.21Å; L674-L678 HydrophobicContact CG-CD1 4.37Å; L674-L678 WeakPolarHBondContact O-CB 3.45Å; L674-L678 WeakPolarHBondContact O-CG 3.36Å; L674-L678 PolarHBondContact O-N 2.79Å; L674-L1202 HydrophobicContact CD2-CB 4.17Å; L674-L1202 HydrophobicContact CD2-CD1 4.21Å; L674-V1215 HydrophobicContact CB-CG1 3.74Å; L674-V1215 HydrophobicContact CD1-CG1 3.44Å; L674-V1215 VanDerWaalsContact CD1-CG1 3.44Å; L674-V1215 HydrophobicContact CG-CG1 4.22Å; L674-A1217 HydrophobicContact CD1-CB 3.62Å; L674-Y1232 HydrophobicContact CD1-CD2 4.31Å; L674-Y1232 HydrophobicContact CD2-CD2 4.22Å; L674-Y1232 HydrophobicContact CD2-CG 4.11Å
675	I	93.6	Very high	84.4	Confident	3 Å²	3	19.4 Å²	19.4	2%	0.015	11%	0.113	C	C	.	.	H	α-helix	trans	-70.7	-44.1	-177.6	-63	-60.6	0	0	0	111.8	L661 F671 S672 T673 N677 L678 L679 L1124	L661-I675 HydrophobicContact CD2-CB 4.08Å; L661-I675 HydrophobicContact CD2-CG2 3.81Å; F671-I675 HydrophobicContact CD1-CG1 3.94Å; F671-I675 HydrophobicContact CE1-CD1 4.08Å; F671-I675 HydrophobicContact CE1-CG1 3.5Å; F671-I675 HydrophobicContact CE2-CD1 4.46Å; F671-I675 HydrophobicContact CE2-CG1 4.47Å; F671-I675 HydrophobicContact CZ-CD1 3.86Å; F671-I675 HydrophobicContact CZ-CG1 3.8Å; F671-I675 WeakPolarHBondContact O-CG1 2.96Å; F671-I675 PolarHBondContact O-N 2.82Å; F671-I675 VanDerWaalsContact O-N 3.1Å; S672-I675 PolarHBondContact O-N 2.93Å; T673-I675 VanDerWaalsContact C-N 3.32Å; T673-I675 PolarHBondContact O-N 3.31Å; I675-N677 VanDerWaalsContact C-N 3.33Å; I675-N677 PolarHBondContact O-N 2.75Å; I675-L678 PolarHBondContact O-N 3.28Å; I675-L679 HydrophobicContact CG2-CD1 3.83Å; I675-L679 HydrophobicContact CG2-CG 4.2Å; I675-L679 VanDerWaalsContact O-CG 3.23Å; I675-L679 WeakPolarHBondContact O-CG 3.49Å; I675-L679 PolarHBondContact O-N 2.85Å; I675-L1124 HydrophobicContact CG2-CD2 3.78Å
676	V	91.8	Very high	82.5	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.006	13%	0.126	C	C	.	.	H	α-helix	trans	-63.9	-38.7	-179.4	178.3	0	0	0	0	111.1	L661 S672 T673 L679 N680 W1091 F1102 L1106 L1107	L661-V676 HydrophobicContact CD1-CG2 3.94Å; S672-V676 WeakPolarHBondContact O-CB 3.33Å; S672-V676 WeakPolarHBondContact O-CG2 3.47Å; S672-V676 PolarHBondContact O-N 3.18Å; T673-V676 PolarHBondContact O-N 3.15Å; V676-L679 PolarHBondContact O-N 3.29Å; V676-N680 WeakPolarHBondContact CG1-ND2 3.49Å; V676-N680 PolarHBondContact O-N 2.91Å; V676-N680 PolarHBondContact O-ND2 3.18Å; V676-W1091 HydrophobicContact CG1-CH2 3.67Å; V676-W1091 HydrophobicContact CG1-CZ3 3.63Å; V676-F1102 HydrophobicContact CG2-CE2 4.05Å; V676-L1106 HydrophobicContact CG1-CB 4.2Å; V676-L1107 HydrophobicContact CG2-CD2 4.3Å
677	N	91.1	Very high	80.6	Confident	4 Å²	4	28.8 Å²	28.8	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-61.9	-45.8	172.9	-74.1	-6.9	0	0	0	111.6	T673 I675 L679 N680 Y698 F1096	T673-N677 VanDerWaalsContact O-CB 3.31Å; T673-N677 WeakPolarHBondContact O-CB 3.34Å; T673-N677 PolarHBondContact O-N 3.32Å; I675-N677 VanDerWaalsContact C-N 3.33Å; I675-N677 PolarHBondContact O-N 2.75Å; N677-L679 PolarHBondContact O-N 2.7Å; N677-N680 PolarHBondContact O-N 3.47Å; N677-Y698 PolarHBondContact ND2-OH 3.37Å; N677-F1096 VanDerWaalsContact OD1-CE1 3.3Å; N677-F1096 WeakPolarHBondContact OD1-CE1 3.37Å
678	L	90.8	Very high	78.9	Confident	4 Å²	4	31.8 Å²	31.8	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-64.8	-24.3	178.1	-74.5	177.7	0	0	0	114.1	L674 I675 M704 Q705 L706 I769 A1217	L674-L678 HydrophobicContact CG-CD1 4.37Å; L674-L678 WeakPolarHBondContact O-CB 3.45Å; L674-L678 WeakPolarHBondContact O-CG 3.36Å; L674-L678 PolarHBondContact O-N 2.79Å; I675-L678 PolarHBondContact O-N 3.28Å; L678-M704 HydrophobicContact CD2-CB 3.63Å; L678-Q705 CarbonylContact O-C 3.6Å; L678-Q705 WeakPolarHBondContact O-CA 3.13Å; L678-L706 HydrophobicContact CB-CD1 4.19Å; L678-L706 HydrophobicContact CB-CG 4.06Å; L678-L706 PolarHBondContact O-N 3.27Å; L678-I769 HydrophobicContact CD1-CD1 3.85Å; L678-I769 HydrophobicContact CD1-CG1 4.29Å; L678-I769 HydrophobicContact CD2-CD1 4.48Å; L678-I769 HydrophobicContact CD2-CG1 4.31Å; L678-I769 HydrophobicContact CD2-CG2 3.58Å; L678-A1217 HydrophobicContact CD2-CB 4.06Å; L678-A1217 HydrophobicContact CG-CB 4.34Å
679	L	88.5	Confident	77.1	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-83.7	-22.5	178.3	-71.7	171.9	0	0	0	113.1	I675 V676 N677 L706 C1110 S1113 F1114 I1120 L1124	I675-L679 HydrophobicContact CG2-CD1 3.83Å; I675-L679 HydrophobicContact CG2-CG 4.2Å; I675-L679 VanDerWaalsContact O-CG 3.23Å; I675-L679 WeakPolarHBondContact O-CG 3.49Å; I675-L679 PolarHBondContact O-N 2.85Å; V676-L679 PolarHBondContact O-N 3.29Å; N677-L679 PolarHBondContact O-N 2.7Å; L679-L706 HydrophobicContact CD2-CD1 3.94Å; L679-C1110 HydrophobicContact CB-CB 4.22Å; L679-C1110 VanDerWaalsContact CB-SG 3.58Å; L679-S1113 WeakPolarHBondContact O-CB 3.34Å; L679-S1113 PolarHBondContact O-OG 2.78Å; L679-F1114 HydrophobicContact CD2-CE1 4.06Å; L679-I1120 HydrophobicContact CD2-CG2 3.35Å; L679-L1124 HydrophobicContact CD1-CD1 3.65Å; L679-L1124 HydrophobicContact CD1-CD2 4.22Å; L679-L1124 HydrophobicContact CD2-CD1 3.84Å; L679-L1124 HydrophobicContact CD2-CG 4.39Å; L679-L1124 HydrophobicContact CG-CD1 4.39Å
680	N	82.5	Confident	75.3	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	22%	0.217	C	C	.	.	S	Bend	trans	-98.8	133.3	-171.1	-78	-47	0	0	0	112.3	V676 N677 H682 W1091 L1106 S1109 C1110	V676-N680 WeakPolarHBondContact CG1-ND2 3.49Å; V676-N680 PolarHBondContact O-N 2.91Å; V676-N680 PolarHBondContact O-ND2 3.18Å; N677-N680 PolarHBondContact O-N 3.47Å; N680-H682 WeakPolarHBondContact CB-CE1 3.25Å; N680-H682 VanDerWaalsContact CB-NE2 3.28Å; N680-H682 WeakPolarHBondContact CB-NE2 3.46Å; N680-H682 PolarHBondContact O-CD2 3.09Å; N680-H682 VanDerWaalsContact O-CD2 3.24Å; N680-H682 PolarHBondContact O-N 3.26Å; N680-W1091 HydrophobicContact CB-CH2 4.49Å; N680-W1091 WeakPolarHBondContact ND2-CH2 3.27Å; N680-L1106 PolarHBondContact ND2-O 2.94Å; N680-S1109 PolarHBondContact ND2-OG 2.64Å; N680-S1109 WeakPolarHBondContact OD1-CB 3.48Å; N680-S1109 PolarHBondContact OD1-OG 3.35Å; N680-C1110 PolarHBondContact ND2-SG 3.17Å; N680-C1110 PolarHBondContact OD1-N 3.49Å; N680-C1110 PolarHBondContact OD1-SG 3.41Å
681	A	70.6	Confident	73.9	Confident	8 Å²	8	48.4 Å²	48.4	7%	0.066	24%	0.243	C	C	.	.			trans	-83.2	99.9	173.2	0	0	0	0	0	108.9
682	H	68.3	Low	73	Confident	37 Å²	37	51.6 Å²	51.6	17%	0.171	26%	0.258	C	S	.	.			trans	-87.6	140.7	-179.6	-58.4	-67.6	0	0	0	111.6	N680 F702 W1091	N680-H682 WeakPolarHBondContact CB-CE1 3.25Å; N680-H682 VanDerWaalsContact CB-NE2 3.28Å; N680-H682 WeakPolarHBondContact CB-NE2 3.46Å; N680-H682 PolarHBondContact O-CD2 3.09Å; N680-H682 VanDerWaalsContact O-CD2 3.24Å; N680-H682 PolarHBondContact O-N 3.26Å; H682-F702 HydrophobicContact CB-CD1 4.14Å; H682-F702 HydrophobicContact CB-CE1 3.39Å; H682-F702 HydrophobicContact CB-CE2 4.46Å; H682-F702 HydrophobicContact CB-CZ 3.62Å; H682-F702 AromaticContact CD2-CD2 3.77Å; H682-F702 AromaticContact CD2-CE1 3.81Å; H682-F702 AromaticContact CD2-CE2 3.41Å; H682-F702 VanDerWaalsContact CD2-CE2 3.41Å; H682-F702 WeakPolarHBondContact CD2-CE2 3.25Å; H682-F702 AromaticContact CD2-CZ 3.47Å; H682-F702 VanDerWaalsContact CD2-CZ 3.47Å; H682-F702 WeakPolarHBondContact CD2-CZ 3.46Å; H682-F702 PolarHBondContact CD2-O 3.47Å; H682-F702 AromaticContact CE1-CE2 3.19Å; H682-F702 WeakPolarHBondContact CE1-CE2 3.38Å; H682-F702 AromaticContact CE1-CZ 3.37Å; H682-F702 WeakPolarHBondContact CE1-CZ 3.22Å; H682-F702 AromaticContact CG-CE1 3.39Å; H682-F702 AromaticContact CG-CE2 3.54Å; H682-F702 AromaticContact CG-CZ 3.08Å; H682-F702 AromaticContact ND1-CE1 3.84Å; H682-F702 AromaticContact ND1-CE2 3.43Å; H682-F702 WeakPolarHBondContact ND1-CE2 3.12Å; H682-F702 AromaticContact ND1-CZ 3.05Å; H682-F702 WeakPolarHBondContact ND1-CZ 3.39Å; H682-F702 AromaticContact NE2-CD2 3.72Å; H682-F702 AromaticContact NE2-CE2 3.19Å; H682-F702 WeakPolarHBondContact NE2-CE2 3.46Å; H682-F702 AromaticContact NE2-CZ 3.64Å; H682-W1091 AromaticContact CE1-CD2 3.8Å; H682-W1091 AromaticContact CE1-CE2 3.99Å; H682-W1091 AromaticContact CE1-CE3 3.78Å
683	G	60.4	Low	72.5	Confident	32 Å²	32	59.1 Å²	59.1	33%	0.33	29%	0.286	S	S	.	.			trans	-74.7	178	178.4	0	0	0	0	0	113.5	Y531	Y531-G683 VanDerWaalsContact CE1-CA 3.49Å
684	S	53.1	Low	72.2	Confident	95 Å²	95	59.1 Å²	59.1	66%	0.664	29%	0.286	S	S	*	.	S	Bend	trans	-57.7	148.1	179.3	44.6	0	0	0	0	113.3
685	K	53.8	Low	71.8	Confident	149 Å²	149	59.6 Å²	59.6	65%	0.648	29%	0.288	S	S	*	.			trans	-24.9	123.6	-179.7	-61.2	-174.5	176.7	-171.8	0	113.9	R687	K685-R687 PolarHBondContact O-N 3.48Å; K685-R687 VanDerWaalsContact O-N 3.12Å
686	P	53.4	Low	71.5	Confident	43 Å²	43	64.7 Å²	64.7	28%	0.279	31%	0.314	S	S	.	.			trans	-57.4	120.1	156.9	24.7	-29.5	0	0	0	107.1	V688 F689 F1092	P686-V688 PolarHBondContact O-N 2.95Å; P686-F689 HydrophobicContact CB-CD2 4.31Å; P686-F689 HydrophobicContact CB-CE2 3.93Å; P686-F689 HydrophobicContact CG-CD2 3.77Å; P686-F689 HydrophobicContact CG-CE2 3.42Å; P686-F689 VanDerWaalsContact CG-CE2 3.42Å; P686-F1092 HydrophobicContact CG-CE2 3.93Å; P686-F1092 HydrophobicContact CG-CZ 3.92Å
687	R	53.5	Low	71.3	Confident	157 Å²	157	66.5 Å²	66.5	59%	0.592	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	10.3	-177.4	-68.4	-175.8	178.1	-169.9	-0.9	113.6	N103 S106 K685	N103-R687 PolarHBondContact OD1-NH1 3.17Å; S106-R687 VanDerWaalsContact OG-CZ 3.3Å; S106-R687 PolarHBondContact OG-NH1 3.37Å; S106-R687 PolarHBondContact OG-NH2 3.44Å; K685-R687 PolarHBondContact O-N 3.48Å; K685-R687 VanDerWaalsContact O-N 3.12Å
688	V	53.8	Low	71.3	Confident	100 Å²	100	66.4 Å²	66.4	61%	0.606	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-1.9	-158.4	-173.7	0	0	0	0	113	P686	P686-V688 PolarHBondContact O-N 2.95Å
689	F	54	Low	71.1	Confident	51 Å²	51	67.8 Å²	67.8	22%	0.224	33%	0.328	C	S	.	.			trans	-109.5	99.8	-171.4	-58.4	-60.2	0	0	0	114.3	P686 L1088 F1092	P686-F689 HydrophobicContact CB-CD2 4.31Å; P686-F689 HydrophobicContact CB-CE2 3.93Å; P686-F689 HydrophobicContact CG-CD2 3.77Å; P686-F689 HydrophobicContact CG-CE2 3.42Å; P686-F689 VanDerWaalsContact CG-CE2 3.42Å; F689-L1088 HydrophobicContact CE1-CD1 3.69Å; F689-L1088 HydrophobicContact CE1-CD2 3.55Å; F689-L1088 HydrophobicContact CE1-CG 4.25Å; F689-L1088 HydrophobicContact CZ-CD1 3.8Å; F689-L1088 HydrophobicContact CZ-CD2 3.34Å; F689-L1088 HydrophobicContact CZ-CG 4.16Å; F689-F1092 HydrophobicContact CE2-CD1 4.41Å; F689-F1092 HydrophobicContact CE2-CG 4.39Å; F689-F1092 HydrophobicContact CZ-CB 4.43Å; F689-F1092 HydrophobicContact CZ-CG 4.48Å
690	E	55.5	Low	71.1	Confident	190 Å²	190	70.1 Å²	70.1	89%	0.888	34%	0.337	S	S	*	.			trans	-86.2	17.7	149.3	-86.2	-172.2	156.9	0	0	111.9
691	Y	62	Low	71.4	Confident	136 Å²	136	70.2 Å²	70.2	53%	0.533	34%	0.338	S	S	.	.			trans	-119.9	136.1	-160.9	-63.1	-76.4	0	0	0	115.1
692	E	74.5	Confident	72.1	Confident	69 Å²	69	70.4 Å²	70.4	32%	0.322	34%	0.337	S	S	.	.			trans	52.9	121.8	163.2	-56.7	-179.3	145.2	0	0	118.5	W694 R695 I696	E692-W694 PolarHBondContact O-N 3.27Å; E692-W694 VanDerWaalsContact O-N 3.08Å; E692-W694 PolarHBondContact OE2-NE1 3.44Å; E692-R695 HydrophobicContact CB-CG 4.3Å; E692-R695 PolarHBondContact O-N 3Å; E692-R695 IonicContact OE2-CZ 3.91Å; E692-R695 IonicContact OE2-NE 3.56Å; E692-R695 PolarHBondContact OE2-NE 2.83Å; E692-R695 IonicContact OE2-NH2 2.7Å; E692-I696 PolarHBondContact O-N 2.9Å
693	R	82.9	Confident	73	Confident	158 Å²	158	73.7 Å²	73.7	60%	0.596	35%	0.348	S	S	*	.	H	α-helix	trans	-49.4	-40.7	178.5	-177.9	-180	175.7	170.6	6.3	113.7	R695 I696 E697 Y1226	R693-R695 PolarHBondContact O-N 2.87Å; R693-I696 PolarHBondContact O-N 2.98Å; R693-E697 IonicContact CZ-OE1 3.51Å; R693-E697 IonicContact NE-OE1 3.97Å; R693-E697 PolarHBondContact NE-OE1 3.36Å; R693-E697 VanDerWaalsContact NE-OE1 3.14Å; R693-E697 IonicContact NH2-OE1 3.85Å; R693-E697 PolarHBondContact O-N 3.41Å; R693-Y1226 PolarHBondContact NH2-OH 3.45Å
694	W	87.3	Confident	74.4	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-68.7	-33.7	-177	75.4	-94.3	0	0	0	113	E692 I696 E697 Y698 E1094 A1097 Q1208 F1212 Y1214	E692-W694 PolarHBondContact O-N 3.27Å; E692-W694 VanDerWaalsContact O-N 3.08Å; E692-W694 PolarHBondContact OE2-NE1 3.44Å; W694-I696 VanDerWaalsContact C-N 3.34Å; W694-E697 PolarHBondContact O-N 2.94Å; W694-Y698 VanDerWaalsContact O-CB 3.28Å; W694-Y698 WeakPolarHBondContact O-CB 3.4Å; W694-Y698 PolarHBondContact O-N 3.48Å; W694-E1094 HydrophobicContact CH2-CB 4.46Å; W694-A1097 HydrophobicContact CZ3-CB 3.91Å; W694-Q1208 HydrophobicContact CB-CG 4.4Å; W694-Q1208 HydrophobicContact CG-CG 4.38Å; W694-F1212 HydrophobicContact CD2-CE2 4.31Å; W694-F1212 HydrophobicContact CD2-CZ 4.07Å; W694-F1212 AromaticContact CE2-CZ 3.86Å; W694-F1212 HydrophobicContact CE3-CE2 4.39Å; W694-F1212 HydrophobicContact CG-CZ 4.42Å; W694-F1212 HydrophobicContact CZ2-CZ 4.18Å; W694-Y1214 HydrophobicContact CB-CD1 4.18Å; W694-Y1214 HydrophobicContact CB-CE1 3.61Å; W694-Y1214 HydrophobicContact CB-CE2 4.17Å; W694-Y1214 HydrophobicContact CE3-CD2 4.39Å; W694-Y1214 HydrophobicContact CE3-CG 4.22Å
695	R	86.7	Confident	76.1	Confident	12 Å²	12	69 Å²	69	5%	0.045	31%	0.307	C	S	.	.	H	α-helix	trans	-68.4	-36.9	177.6	-68.1	-174.6	-174.2	-107.7	5.3	111.1	E692 R693 Y698 E699 D1085 F1092	E692-R695 HydrophobicContact CB-CG 4.3Å; E692-R695 PolarHBondContact O-N 3Å; E692-R695 IonicContact OE2-CZ 3.91Å; E692-R695 IonicContact OE2-NE 3.56Å; E692-R695 PolarHBondContact OE2-NE 2.83Å; E692-R695 IonicContact OE2-NH2 2.7Å; R693-R695 PolarHBondContact O-N 2.87Å; R695-Y698 PolarHBondContact O-N 3.33Å; R695-E699 VanDerWaalsContact O-CB 3.24Å; R695-E699 WeakPolarHBondContact O-CB 3.35Å; R695-E699 PolarHBondContact O-N 3.49Å; R695-D1085 IonicContact CZ-OD1 3.27Å; R695-D1085 IonicContact NH1-OD1 2.63Å; R695-D1085 PolarHBondContact NH1-OD1 3.41Å; R695-D1085 IonicContact NH2-OD1 3.65Å; R695-D1085 PolarHBondContact NH2-OD1 3.11Å; R695-F1092 PolarHBondContact NH1-O 3.2Å
696	I	86.6	Confident	77.9	Confident	109 Å²	109	62.1 Å²	62.1	56%	0.559	28%	0.278	S	S	*	.	H	α-helix	trans	-64.2	-45.7	175.1	-59.4	171.7	0	0	0	110.5	E692 R693 W694 E699 Y700	E692-I696 PolarHBondContact O-N 2.9Å; R693-I696 PolarHBondContact O-N 2.98Å; W694-I696 VanDerWaalsContact C-N 3.34Å; I696-E699 PolarHBondContact O-N 3.04Å; I696-Y700 PolarHBondContact O-N 3.35Å; I696-Y700 VanDerWaalsContact O-N 3.1Å
697	E	88.2	Confident	79.5	Confident	40 Å²	40	60.3 Å²	60.3	19%	0.187	27%	0.265	C	S	.	.	H	α-helix	trans	-65.3	-39.9	177	-68.4	-176.2	-165	0	0	111.7	R693 W694 G701 R1206 Y1214 I1216	R693-E697 IonicContact CZ-OE1 3.51Å; R693-E697 IonicContact NE-OE1 3.97Å; R693-E697 PolarHBondContact NE-OE1 3.36Å; R693-E697 VanDerWaalsContact NE-OE1 3.14Å; R693-E697 IonicContact NH2-OE1 3.85Å; R693-E697 PolarHBondContact O-N 3.41Å; W694-E697 PolarHBondContact O-N 2.94Å; E697-G701 PolarHBondContact O-N 3.23Å; E697-R1206 IonicContact OE1-NH1 2.7Å; E697-R1206 WeakPolarHBondContact OE2-CD 3.41Å; E697-R1206 IonicContact OE2-CZ 3.97Å; E697-R1206 IonicContact OE2-NE 3.34Å; E697-R1206 IonicContact OE2-NH1 3.92Å; E697-R1206 PolarHBondContact OE2-NH1 2.75Å; E697-Y1214 HydrophobicContact CB-CE2 4.22Å; E697-Y1214 PolarHBondContact OE2-OH 2.86Å; E697-Y1214 VanDerWaalsContact OE2-OH 3.06Å; E697-I1216 HydrophobicContact CB-CD1 4.08Å
698	Y	90.7	Very high	81.2	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-64.6	-46.7	174.1	-179.7	-95.5	0	0	0	112.2	N677 W694 R695 Y700 G701 F702 W1091 F1092 F1096 A1097 V1215	N677-Y698 PolarHBondContact ND2-OH 3.37Å; W694-Y698 VanDerWaalsContact O-CB 3.28Å; W694-Y698 WeakPolarHBondContact O-CB 3.4Å; W694-Y698 PolarHBondContact O-N 3.48Å; R695-Y698 PolarHBondContact O-N 3.33Å; Y698-Y700 PolarHBondContact O-N 3.32Å; Y698-G701 CarbonylContact O-C 3.6Å; Y698-G701 PolarHBondContact O-N 3.27Å; Y698-F702 HydrophobicContact CE1-CB 4.36Å; Y698-F702 HydrophobicContact CE1-CD2 4.46Å; Y698-F702 WeakPolarHBondContact O-CB 3.47Å; Y698-F702 PolarHBondContact O-N 3.02Å; Y698-W1091 WeakPolarHBondContact CE1-O 3.47Å; Y698-W1091 PolarHBondContact OH-O 3.42Å; Y698-W1091 VanDerWaalsContact OH-O 3.07Å; Y698-F1092 HydrophobicContact CD1-CD1 4.42Å; Y698-F1092 HydrophobicContact CE1-CD1 4.47Å; Y698-F1096 WeakPolarHBondContact OH-CD1 3.42Å; Y698-F1096 WeakPolarHBondContact OH-CE1 3.27Å; Y698-A1097 HydrophobicContact CD2-CB 3.78Å; Y698-A1097 HydrophobicContact CE1-CB 4.46Å; Y698-A1097 HydrophobicContact CE2-CB 3.52Å; Y698-A1097 HydrophobicContact CG-CB 4.37Å; Y698-V1215 WeakPolarHBondContact CD2-O 3.43Å
699	E	87.4	Confident	82.9	Confident	33 Å²	33	48.4 Å²	48.4	15%	0.154	21%	0.21	C	C	.	.	H	α-helix	trans	-58.7	-38.3	178.8	-174.3	-171.4	166.6	0	0	110.9	R695 I696 G701 F702 R703 F1092	R695-E699 VanDerWaalsContact O-CB 3.24Å; R695-E699 WeakPolarHBondContact O-CB 3.35Å; R695-E699 PolarHBondContact O-N 3.49Å; I696-E699 PolarHBondContact O-N 3.04Å; E699-G701 VanDerWaalsContact C-N 3.34Å; E699-G701 PolarHBondContact O-N 3.18Å; E699-F702 WeakPolarHBondContact O-CB 3.49Å; E699-F702 PolarHBondContact O-N 3.43Å; E699-R703 WeakPolarHBondContact O-CG 3.41Å; E699-R703 PolarHBondContact O-N 2.93Å; E699-R703 VanDerWaalsContact O-N 3.08Å; E699-F1092 HydrophobicContact CB-CE1 4.33Å; E699-F1092 HydrophobicContact CG-CE1 4.16Å
700	Y	88.3	Confident	84.6	Confident	51 Å²	51	46.4 Å²	46.4	20%	0.2	20%	0.204	C	C	.	.	H	α-helix	trans	-59.5	-45.8	174.9	-178.8	-96.4	0	0	0	111.9	I696 Y698 R703 M704 N732 N1218 M1220	I696-Y700 PolarHBondContact O-N 3.35Å; I696-Y700 VanDerWaalsContact O-N 3.1Å; Y698-Y700 PolarHBondContact O-N 3.32Å; Y700-R703 PolarHBondContact O-N 2.96Å; Y700-M704 HydrophobicContact CD1-CE 4.2Å; Y700-M704 HydrophobicContact CE1-CE 3.4Å; Y700-M704 HydrophobicContact CE2-CE 4.19Å; Y700-M704 WeakPolarHBondContact OH-CE 3.49Å; Y700-N732 PolarHBondContact OH-ND2 2.98Å; Y700-N1218 WeakPolarHBondContact CE1-O 3.49Å; Y700-M1220 HydrophobicContact CD1-CG 4.39Å; Y700-M1220 HydrophobicContact CD2-CE 3.73Å; Y700-M1220 HydrophobicContact CD2-CG 4.46Å; Y700-M1220 HydrophobicContact CE1-CB 4.46Å; Y700-M1220 HydrophobicContact CE1-CG 3.67Å; Y700-M1220 HydrophobicContact CE2-CE 3.27Å; Y700-M1220 HydrophobicContact CE2-CG 3.78Å; Y700-M1220 HydrophobicContact CE2-SD 4.39Å; Y700-M1220 WeakPolarHBondContact OH-CG 3.46Å
701	G	87.7	Confident	86.2	Confident	2 Å²	2	37.4 Å²	37.4	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-68.5	-34.3	175.5	0	0	0	0	0	113.2	E697 Y698 E699 R703 M704 A1217	E697-G701 PolarHBondContact O-N 3.23Å; Y698-G701 CarbonylContact O-C 3.6Å; Y698-G701 PolarHBondContact O-N 3.27Å; E699-G701 VanDerWaalsContact C-N 3.34Å; E699-G701 PolarHBondContact O-N 3.18Å; G701-R703 PolarHBondContact O-N 3.22Å; G701-M704 VanDerWaalsContact O-CB 3.29Å; G701-M704 WeakPolarHBondContact O-CB 3.41Å; G701-M704 PolarHBondContact O-N 3.06Å; G701-M704 VanDerWaalsContact O-N 3.1Å; G701-A1217 VanDerWaalsContact CA-O 3.28Å; G701-A1217 WeakPolarHBondContact CA-O 3.39Å
702	F	87.1	Confident	87.4	Confident	13 Å²	13	31.2 Å²	31.2	6%	0.057	14%	0.138	C	C	.	.	H	α-helix	trans	-62.5	-28	175.3	176	-102	0	0	0	113.1	H682 Y698 E699 M704 W1091 F1092	H682-F702 HydrophobicContact CB-CD1 4.14Å; H682-F702 HydrophobicContact CB-CE1 3.39Å; H682-F702 HydrophobicContact CB-CE2 4.46Å; H682-F702 HydrophobicContact CB-CZ 3.62Å; H682-F702 AromaticContact CD2-CD2 3.77Å; H682-F702 AromaticContact CD2-CE1 3.81Å; H682-F702 AromaticContact CD2-CE2 3.41Å; H682-F702 VanDerWaalsContact CD2-CE2 3.41Å; H682-F702 WeakPolarHBondContact CD2-CE2 3.25Å; H682-F702 AromaticContact CD2-CZ 3.47Å; H682-F702 VanDerWaalsContact CD2-CZ 3.47Å; H682-F702 WeakPolarHBondContact CD2-CZ 3.46Å; H682-F702 PolarHBondContact CD2-O 3.47Å; H682-F702 AromaticContact CE1-CE2 3.19Å; H682-F702 WeakPolarHBondContact CE1-CE2 3.38Å; H682-F702 AromaticContact CE1-CZ 3.37Å; H682-F702 WeakPolarHBondContact CE1-CZ 3.22Å; H682-F702 AromaticContact CG-CE1 3.39Å; H682-F702 AromaticContact CG-CE2 3.54Å; H682-F702 AromaticContact CG-CZ 3.08Å; H682-F702 AromaticContact ND1-CE1 3.84Å; H682-F702 AromaticContact ND1-CE2 3.43Å; H682-F702 WeakPolarHBondContact ND1-CE2 3.12Å; H682-F702 AromaticContact ND1-CZ 3.05Å; H682-F702 WeakPolarHBondContact ND1-CZ 3.39Å; H682-F702 AromaticContact NE2-CD2 3.72Å; H682-F702 AromaticContact NE2-CE2 3.19Å; H682-F702 WeakPolarHBondContact NE2-CE2 3.46Å; H682-F702 AromaticContact NE2-CZ 3.64Å; Y698-F702 HydrophobicContact CE1-CB 4.36Å; Y698-F702 HydrophobicContact CE1-CD2 4.46Å; Y698-F702 WeakPolarHBondContact O-CB 3.47Å; Y698-F702 PolarHBondContact O-N 3.02Å; E699-F702 WeakPolarHBondContact O-CB 3.49Å; E699-F702 PolarHBondContact O-N 3.43Å; F702-M704 VanDerWaalsContact C-N 3.27Å; F702-M704 PolarHBondContact O-N 3.48Å; F702-W1091 HydrophobicContact CE2-CB 3.61Å; F702-W1091 HydrophobicContact CE2-CD2 4.05Å; F702-W1091 AromaticContact CE2-CE3 3.98Å; F702-W1091 HydrophobicContact CE2-CE3 3.98Å; F702-W1091 AromaticContact CE2-CG 3.9Å; F702-W1091 HydrophobicContact CE2-CG 3.9Å; F702-W1091 HydrophobicContact CZ-CB 3.95Å; F702-W1091 HydrophobicContact CZ-CG 4.16Å; F702-F1092 HydrophobicContact CD1-CE1 4.12Å; F702-F1092 AromaticContact CD1-CZ 3.77Å; F702-F1092 HydrophobicContact CD1-CZ 3.77Å; F702-F1092 HydrophobicContact CE1-CE1 4.23Å; F702-F1092 AromaticContact CE1-CE2 4Å; F702-F1092 HydrophobicContact CE1-CE2 4Å; F702-F1092 AromaticContact CE1-CZ 3.46Å; F702-F1092 HydrophobicContact CE1-CZ 3.46Å; F702-F1092 VanDerWaalsContact CE1-CZ 3.46Å; F702-F1092 HydrophobicContact CG-CZ 4.49Å; F702-F1092 HydrophobicContact CZ-CE2 4.1Å; F702-F1092 AromaticContact CZ-CZ 3.96Å; F702-F1092 HydrophobicContact CZ-CZ 3.96Å
703	R	85.5	Confident	87.9	Confident	106 Å²	106	30.3 Å²	30.3	40%	0.4	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-14.7	175	-70.6	178.8	65.2	-161.4	-4.7	113.9	E699 Y700 G701	E699-R703 WeakPolarHBondContact O-CG 3.41Å; E699-R703 PolarHBondContact O-N 2.93Å; E699-R703 VanDerWaalsContact O-N 3.08Å; Y700-R703 PolarHBondContact O-N 2.96Å; G701-R703 PolarHBondContact O-N 3.22Å
704	M	89.7	Confident	88	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.01	12%	0.121	C	C	.	.			trans	-72.9	140.4	-179.5	-63.1	-69.8	169.9	0	0	110.7	L678 Y700 G701 F702 I769 S770 S771 A1217 N1218	L678-M704 HydrophobicContact CD2-CB 3.63Å; Y700-M704 HydrophobicContact CD1-CE 4.2Å; Y700-M704 HydrophobicContact CE1-CE 3.4Å; Y700-M704 HydrophobicContact CE2-CE 4.19Å; Y700-M704 WeakPolarHBondContact OH-CE 3.49Å; G701-M704 VanDerWaalsContact O-CB 3.29Å; G701-M704 WeakPolarHBondContact O-CB 3.41Å; G701-M704 PolarHBondContact O-N 3.06Å; G701-M704 VanDerWaalsContact O-N 3.1Å; F702-M704 VanDerWaalsContact C-N 3.27Å; F702-M704 PolarHBondContact O-N 3.48Å; M704-I769 HydrophobicContact CB-CG2 3.87Å; M704-I769 HydrophobicContact CG-CG2 4.42Å; M704-I769 HydrophobicContact SD-CG2 4.43Å; M704-S770 VanDerWaalsContact SD-C 3.54Å; M704-S771 PolarHBondContact SD-N 3.33Å; M704-S771 VanDerWaalsContact SD-N 3.41Å; M704-A1217 HydrophobicContact CB-CB 4.36Å; M704-N1218 HydrophobicContact CE-CB 4.32Å; M704-N1218 WeakPolarHBondContact CE-O 3.29Å; M704-N1218 HydrophobicContact CG-CB 4.05Å; M704-N1218 HydrophobicContact SD-CB 4.05Å
705	Q	89.2	Confident	88	Confident	26 Å²	26	26.7 Å²	26.7	12%	0.121	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	155.4	-177.8	-66.8	175.8	22.2	0	0	111.3	L678 I769 S770	L678-Q705 CarbonylContact O-C 3.6Å; L678-Q705 WeakPolarHBondContact O-CA 3.13Å; Q705-I769 WeakPolarHBondContact O-CA 3.42Å; Q705-S770 PolarHBondContact N-O 3.11Å; Q705-S770 PolarHBondContact O-N 3.25Å
706	L	91.4	Very high	87.9	Confident	5 Å²	5	29.1 Å²	29.1	3%	0.026	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	130.6	171	-70.8	167.1	0	0	0	111.1	L678 L679 L736 I767 I769 I1120 F1123	L678-L706 HydrophobicContact CB-CD1 4.19Å; L678-L706 HydrophobicContact CB-CG 4.06Å; L678-L706 PolarHBondContact O-N 3.27Å; L679-L706 HydrophobicContact CD2-CD1 3.94Å; L706-L736 HydrophobicContact CD2-CD2 3.54Å; L706-I767 HydrophobicContact CD2-CG2 4.03Å; L706-I769 HydrophobicContact CD2-CG1 3.65Å; L706-I1120 HydrophobicContact CB-CD1 3.63Å; L706-I1120 HydrophobicContact CB-CG1 4.17Å; L706-I1120 HydrophobicContact CB-CG2 4.48Å; L706-I1120 HydrophobicContact CD1-CG2 4.17Å; L706-I1120 WeakPolarHBondContact O-CD1 3.05Å; L706-F1123 HydrophobicContact CD1-CE1 4.48Å
707	H	88.7	Confident	87.7	Confident	4 Å²	4	30.3 Å²	30.3	2%	0.019	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	140.7	175.3	-57.2	-57.5	0	0	0	112.2	V709 I767 V768 S770 Y773 A776	H707-V709 HydrophobicContact CB-CG2 4.14Å; H707-I767 WeakPolarHBondContact O-CA 2.94Å; H707-V768 HydrophobicContact CB-CG2 4.27Å; H707-V768 PolarHBondContact N-O 3.35Å; H707-V768 PolarHBondContact O-N 3.09Å; H707-S770 PolarHBondContact CD2-OG 3.24Å; H707-S770 PolarHBondContact NE2-OG 3.4Å; H707-Y773 HydrophobicContact CB-CD2 4.16Å; H707-Y773 HydrophobicContact CB-CE2 4.5Å; H707-Y773 AromaticContact CG-CD2 3.88Å; H707-Y773 AromaticContact ND1-CD2 3.76Å; H707-A776 HydrophobicContact CB-CB 4.06Å
708	D	89.1	Confident	87.7	Confident	7 Å²	7	31.1 Å²	31.1	4%	0.037	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	114.2	171.7	167	24.3	0	0	0	110	R765 N1117 N1119	D708-R765 VanDerWaalsContact CG-NH2 3.33Å; D708-R765 PolarHBondContact O-NH2 3.25Å; D708-R765 IonicContact OD1-CZ 2.66Å; D708-R765 IonicContact OD1-NE 2.79Å; D708-R765 PolarHBondContact OD1-NE 3.34Å; D708-R765 IonicContact OD1-NH1 3.33Å; D708-R765 IonicContact OD1-NH2 3.16Å; D708-R765 PolarHBondContact OD1-NH2 3.16Å; D708-R765 IonicContact OD2-CZ 3.98Å; D708-R765 IonicContact OD2-NE 3.17Å; D708-R765 IonicContact OD2-NH1 3.06Å; D708-R765 PolarHBondContact OD2-NH1 3.36Å; D708-R765 IonicContact OD2-NH2 3.68Å; D708-R765 PolarHBondContact OD2-NH2 2.97Å; D708-N1117 HydrophobicContact CB-CB 4.35Å; D708-N1119 HydrophobicContact CB-CB 4.38Å; D708-N1119 VanDerWaalsContact CG-ND2 3.29Å; D708-N1119 PolarHBondContact OD1-ND2 2.92Å; D708-N1119 PolarHBondContact OD2-ND2 3.05Å
709	V	89.3	Confident	87.5	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.7	-173.5	-171.8	0	0	0	0	111.1	H707 A766 V768 Y773 A776 L779 Q780	H707-V709 HydrophobicContact CB-CG2 4.14Å; V709-A766 PolarHBondContact N-O 3.29Å; V709-A766 PolarHBondContact O-N 3.25Å; V709-V768 HydrophobicContact CG2-CG2 4.25Å; V709-Y773 HydrophobicContact CG2-CE2 4.46Å; V709-A776 WeakPolarHBondContact CG1-O 3.37Å; V709-A776 HydrophobicContact CG2-CB 3.77Å; V709-L779 HydrophobicContact CG1-CB 4.42Å; V709-Q780 HydrophobicContact CG1-CB 3.75Å
710	G	87.9	Confident	87.5	Confident	9 Å²	9	33.9 Å²	33.9	9%	0.093	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	151.3	171.5	0	0	0	0	0	111.2	Q780	G710-Q780 VanDerWaalsContact O-CA 3.32Å; G710-Q780 WeakPolarHBondContact O-CA 3.27Å; G710-Q780 VanDerWaalsContact O-CB 3.31Å; G710-Q780 WeakPolarHBondContact O-CB 3.31Å
711	I	89.2	Confident	87.5	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.01	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-91.5	139	178.1	-54.3	170.2	0	0	0	108.5	F715 L723 V759 N761 M764 A766	I711-F715 HydrophobicContact CG2-CB 3.88Å; I711-F715 HydrophobicContact CG2-CD2 3.87Å; I711-F715 HydrophobicContact CG2-CG 4.29Å; I711-L723 HydrophobicContact CD1-CD2 4.34Å; I711-L723 HydrophobicContact CG2-CD2 4.1Å; I711-V759 HydrophobicContact CB-CG1 4.37Å; I711-V759 HydrophobicContact CD1-CG1 3.95Å; I711-V759 HydrophobicContact CG2-CG1 3.7Å; I711-N761 PolarHBondContact O-ND2 3.49Å; I711-N761 PolarHBondContact O-OD1 2.89Å; I711-M764 HydrophobicContact CD1-CB 4Å; I711-A766 HydrophobicContact CD1-CB 4.24Å; I711-A766 HydrophobicContact CG1-CB 3.95Å
712	S	88.4	Confident	87.6	Confident	5 Å²	5	37 Å²	37	4%	0.035	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-67	157.4	175.9	-173	0	0	0	0	112.9	E714 F715 L779 Y782	S712-E714 VanDerWaalsContact C-N 3.26Å; S712-E714 PolarHBondContact O-N 3.22Å; S712-F715 PolarHBondContact O-N 3.37Å; S712-L779 WeakPolarHBondContact CB-O 3.45Å; S712-L779 PolarHBondContact N-O 2.76Å; S712-L779 VanDerWaalsContact N-O 3.09Å; S712-Y782 WeakPolarHBondContact CB-O 3.28Å; S712-Y782 PolarHBondContact OG-O 3.43Å
713	H	84.2	Confident	87.8	Confident	50 Å²	50	36.4 Å²	36.4	23%	0.231	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-63.7	-26	174.5	66.3	-55.4	0	0	0	114	F715 S716 N761 S798	H713-F715 PolarHBondContact O-N 2.84Å; H713-S716 VanDerWaalsContact O-CB 3.28Å; H713-S716 WeakPolarHBondContact O-CB 3.35Å; H713-S716 PolarHBondContact O-N 2.94Å; H713-S716 PolarHBondContact O-OG 3.4Å; H713-N761 WeakPolarHBondContact CA-ND2 3.32Å; H713-N761 WeakPolarHBondContact CB-ND2 3.29Å; H713-N761 PolarHBondContact N-ND2 3.03Å; H713-S798 PolarHBondContact CD2-OG 3.21Å; H713-S798 PolarHBondContact NE2-OG 3.35Å
714	E	85.5	Confident	88.1	Confident	72 Å²	72	31.4 Å²	31.4	34%	0.336	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-60.8	-26.9	176.6	-59.4	-66.7	-179.9	0	0	112.5	S712 S716 Y782 C783 V784	S712-E714 VanDerWaalsContact C-N 3.26Å; S712-E714 PolarHBondContact O-N 3.22Å; E714-S716 VanDerWaalsContact C-N 3.3Å; E714-Y782 HydrophobicContact CB-CD1 4.09Å; E714-Y782 HydrophobicContact CB-CE1 4.39Å; E714-Y782 HydrophobicContact CG-CD1 4.15Å; E714-C783 WeakPolarHBondContact OE1-CA 3.41Å; E714-C783 PolarHBondContact OE1-SG 3.11Å; E714-V784 PolarHBondContact OE1-N 2.9Å; E714-V784 VanDerWaalsContact OE1-N 3.13Å
715	F	87.4	Confident	88.2	Confident	10 Å²	10	32.5 Å²	32.5	4%	0.044	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-89.5	6.5	179.4	-54.9	-64.5	0	0	0	112.7	I711 S712 H713 N717 L718 L723 F726 W731 V759 L779 Y782	I711-F715 HydrophobicContact CG2-CB 3.88Å; I711-F715 HydrophobicContact CG2-CD2 3.87Å; I711-F715 HydrophobicContact CG2-CG 4.29Å; S712-F715 PolarHBondContact O-N 3.37Å; H713-F715 PolarHBondContact O-N 2.84Å; F715-N717 PolarHBondContact O-N 3.4Å; F715-L718 HydrophobicContact CD1-CD2 4.08Å; F715-L718 WeakPolarHBondContact O-CB 3.39Å; F715-L718 PolarHBondContact O-N 3.08Å; F715-L723 HydrophobicContact CB-CD1 3.96Å; F715-L723 HydrophobicContact CD1-CD1 3.43Å; F715-L723 VanDerWaalsContact CD1-CD1 3.43Å; F715-L723 HydrophobicContact CD2-CD1 3.9Å; F715-L723 HydrophobicContact CE1-CD1 3.8Å; F715-L723 HydrophobicContact CE2-CD1 4.23Å; F715-L723 HydrophobicContact CG-CD1 3.48Å; F715-L723 VanDerWaalsContact CG-CD1 3.48Å; F715-L723 HydrophobicContact CZ-CD1 4.18Å; F715-F726 AromaticContact CE1-CD1 3.63Å; F715-F726 HydrophobicContact CE1-CD1 3.63Å; F715-F726 AromaticContact CE1-CE1 3.62Å; F715-F726 HydrophobicContact CE1-CE1 3.62Å; F715-F726 HydrophobicContact CE1-CG 4.41Å; F715-F726 HydrophobicContact CE1-CZ 4.36Å; F715-F726 AromaticContact CZ-CD1 3.89Å; F715-F726 HydrophobicContact CZ-CD1 3.89Å; F715-F726 AromaticContact CZ-CE1 3.62Å; F715-F726 HydrophobicContact CZ-CE1 3.62Å; F715-W731 HydrophobicContact CZ-CH2 4.46Å; F715-V759 HydrophobicContact CB-CG1 4.27Å; F715-V759 VanDerWaalsContact O-CB 3.29Å; F715-V759 WeakPolarHBondContact O-CB 3.48Å; F715-V759 WeakPolarHBondContact O-CG1 3.41Å; F715-L779 HydrophobicContact CD2-CD1 4.26Å; F715-L779 HydrophobicContact CE2-CD1 3.89Å; F715-Y782 HydrophobicContact CE1-CD1 4.05Å; F715-Y782 HydrophobicContact CE1-CE1 4.22Å; F715-Y782 AromaticContact CE2-CD1 3.73Å; F715-Y782 HydrophobicContact CE2-CD1 3.73Å; F715-Y782 HydrophobicContact CE2-CG 4.14Å; F715-Y782 AromaticContact CZ-CD1 3.33Å; F715-Y782 HydrophobicContact CZ-CD1 3.33Å; F715-Y782 AromaticContact CZ-CE1 3.89Å; F715-Y782 HydrophobicContact CZ-CE1 3.89Å; F715-Y782 AromaticContact CZ-CG 3.9Å; F715-Y782 HydrophobicContact CZ-CG 3.9Å
716	S	83.6	Confident	88.3	Confident	63 Å²	63	33.8 Å²	33.8	44%	0.441	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	135.3	178.4	66.5	0	0	0	0	110.9	H713 E714 L718 V759	H713-S716 VanDerWaalsContact O-CB 3.28Å; H713-S716 WeakPolarHBondContact O-CB 3.35Å; H713-S716 PolarHBondContact O-N 2.94Å; H713-S716 PolarHBondContact O-OG 3.4Å; E714-S716 VanDerWaalsContact C-N 3.3Å; S716-L718 PolarHBondContact O-N 3.44Å; S716-V759 WeakPolarHBondContact CA-O 3.23Å
717	N	83.6	Confident	88.3	Confident	134 Å²	134	33.7 Å²	33.7	72%	0.717	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.4	3.9	-176.7	-53.9	-31.2	0	0	0	115.9	F715 V759	F715-N717 PolarHBondContact O-N 3.4Å; N717-V759 PolarHBondContact N-O 2.73Å
718	L	87.2	Confident	88.5	Confident	58 Å²	58	33.6 Å²	33.6	30%	0.304	17%	0.171	S	C	.	.			trans	-73.7	145.8	168.8	-168.5	66.4	0	0	0	109.7	F715 S716 D722 L723 V759	F715-L718 HydrophobicContact CD1-CD2 4.08Å; F715-L718 WeakPolarHBondContact O-CB 3.39Å; F715-L718 PolarHBondContact O-N 3.08Å; S716-L718 PolarHBondContact O-N 3.44Å; L718-D722 HydrophobicContact CD1-CB 4.06Å; L718-D722 HydrophobicContact CD2-CB 4.39Å; L718-D722 HydrophobicContact CG-CB 4.13Å; L718-L723 HydrophobicContact CD2-CB 4.11Å; L718-V759 WeakPolarHBondContact O-CB 3.2Å; L718-V759 VanDerWaalsContact O-CG2 3.29Å; L718-V759 WeakPolarHBondContact O-CG2 3.49Å; L718-V759 PolarHBondContact O-N 3.21Å
719	F	87.5	Confident	88.6	Confident	89 Å²	89	37.9 Å²	37.9	39%	0.39	19%	0.191	S	C	.	.	B	Isolated β-bridge	trans	-68.1	140.2	170.3	-69.2	-66.9	0	0	0	110.4	R721 D722 L723 N756	F719-R721 PolarHBondContact O-N 3.08Å; F719-D722 PolarHBondContact O-N 3.38Å; F719-L723 PolarHBondContact O-N 3.41Å; F719-N756 HydrophobicContact CD1-CB 4.1Å; F719-N756 HydrophobicContact CE1-CB 4.05Å
720	I	87.9	Confident	88.6	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.015	22%	0.219	C	C	.	.	H	α-helix	trans	-59.4	-31.7	-178.9	-67	167.4	0	0	0	112.2	L723 A724 L735 V738 P752 C757 V759	I720-L723 WeakPolarHBondContact O-CB 3.44Å; I720-L723 PolarHBondContact O-N 2.88Å; I720-A724 WeakPolarHBondContact O-CB 3.26Å; I720-A724 PolarHBondContact O-N 3.18Å; I720-L735 HydrophobicContact CG2-CD2 3.6Å; I720-V738 HydrophobicContact CD1-CG2 4.47Å; I720-P752 HydrophobicContact CD1-CB 3.82Å; I720-P752 HydrophobicContact CD1-CG 4.39Å; I720-P752 HydrophobicContact CG2-CB 3.92Å; I720-P752 HydrophobicContact CG2-CG 3.48Å; I720-P752 VanDerWaalsContact CG2-CG 3.48Å; I720-C757 HydrophobicContact CD1-CB 3.88Å; I720-C757 WeakPolarHBondContact CG1-O 3.26Å; I720-C757 PolarHBondContact N-O 3.01Å; I720-V759 HydrophobicContact CB-CG2 4.44Å; I720-V759 HydrophobicContact CG1-CG2 3.53Å
721	R	88.1	Confident	88.7	Confident	60 Å²	60	46.2 Å²	46.2	23%	0.226	22%	0.223	C	C	.	.	H	α-helix	trans	-57.3	-49.9	173.4	-179.1	-178.3	59.6	-126.9	-7.6	111.9	F719 L723 A724 I725 I753 N756 I1194	F719-R721 PolarHBondContact O-N 3.08Å; R721-L723 VanDerWaalsContact C-N 3.3Å; R721-L723 PolarHBondContact O-N 2.89Å; R721-A724 WeakPolarHBondContact O-CB 3.5Å; R721-A724 PolarHBondContact O-N 2.88Å; R721-I725 HydrophobicContact CG-CD1 4.31Å; R721-I725 WeakPolarHBondContact O-CG1 2.91Å; R721-I725 PolarHBondContact O-N 3.16Å; R721-I725 VanDerWaalsContact O-N 3.13Å; R721-I753 HydrophobicContact CB-CG2 4.08Å; R721-I753 HydrophobicContact CG-CG2 3.98Å; R721-N756 PolarHBondContact NH1-OD1 3.14Å; R721-I1194 HydrophobicContact CG-CG2 3.75Å
722	D	89.8	Confident	88.8	Confident	58 Å²	58	47.4 Å²	47.4	31%	0.31	23%	0.23	S	C	.	.	H	α-helix	trans	-70.8	-33.5	-176.6	-52.5	-26	0	0	0	110.1	L718 F719 F726	L718-D722 HydrophobicContact CD1-CB 4.06Å; L718-D722 HydrophobicContact CD2-CB 4.39Å; L718-D722 HydrophobicContact CG-CB 4.13Å; F719-D722 PolarHBondContact O-N 3.38Å; D722-F726 WeakPolarHBondContact O-CB 3.43Å; D722-F726 PolarHBondContact O-N 2.82Å
723	L	90.6	Very high	89	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-60.8	-46.1	169.3	-179.7	64.7	0	0	0	112	I711 F715 L718 F719 I720 R721 I725 F726 V727 L735 V759 L779	I711-L723 HydrophobicContact CD1-CD2 4.34Å; I711-L723 HydrophobicContact CG2-CD2 4.1Å; F715-L723 HydrophobicContact CB-CD1 3.96Å; F715-L723 HydrophobicContact CD1-CD1 3.43Å; F715-L723 VanDerWaalsContact CD1-CD1 3.43Å; F715-L723 HydrophobicContact CD2-CD1 3.9Å; F715-L723 HydrophobicContact CE1-CD1 3.8Å; F715-L723 HydrophobicContact CE2-CD1 4.23Å; F715-L723 HydrophobicContact CG-CD1 3.48Å; F715-L723 VanDerWaalsContact CG-CD1 3.48Å; F715-L723 HydrophobicContact CZ-CD1 4.18Å; L718-L723 HydrophobicContact CD2-CB 4.11Å; F719-L723 PolarHBondContact O-N 3.41Å; I720-L723 WeakPolarHBondContact O-CB 3.44Å; I720-L723 PolarHBondContact O-N 2.88Å; R721-L723 VanDerWaalsContact C-N 3.3Å; R721-L723 PolarHBondContact O-N 2.89Å; L723-I725 VanDerWaalsContact C-N 3.33Å; L723-I725 PolarHBondContact O-N 3.1Å; L723-F726 PolarHBondContact O-N 2.85Å; L723-V727 HydrophobicContact CD1-CG2 3.74Å; L723-V727 HydrophobicContact CG-CG2 4.15Å; L723-V727 VanDerWaalsContact O-CB 3.31Å; L723-V727 WeakPolarHBondContact O-CB 3.37Å; L723-V727 WeakPolarHBondContact O-CG2 3.27Å; L723-V727 PolarHBondContact O-N 3.45Å; L723-L735 HydrophobicContact CD2-CD2 4.34Å; L723-V759 HydrophobicContact CB-CG2 4.49Å; L723-V759 HydrophobicContact CD2-CG1 4.49Å; L723-V759 HydrophobicContact CD2-CG2 3.77Å; L723-L779 HydrophobicContact CD1-CD1 4.22Å
724	A	91.1	Very high	89.5	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-42.6	-179.2	0	0	0	0	0	111.5	I720 R721 Y728 L735	I720-A724 WeakPolarHBondContact O-CB 3.26Å; I720-A724 PolarHBondContact O-N 3.18Å; R721-A724 WeakPolarHBondContact O-CB 3.5Å; R721-A724 PolarHBondContact O-N 2.88Å; A724-Y728 VanDerWaalsContact O-CB 3.31Å; A724-Y728 WeakPolarHBondContact O-CB 3.45Å; A724-Y728 PolarHBondContact O-N 3.28Å; A724-Y728 VanDerWaalsContact O-N 3.09Å; A724-L735 HydrophobicContact CB-CB 4.15Å; A724-L735 HydrophobicContact CB-CD2 4.21Å
725	I	91.6	Very high	89.8	Confident	26 Å²	26	41.6 Å²	41.6	13%	0.133	20%	0.202	C	C	.	.	H	α-helix	trans	-63.6	-50.7	175.9	-63.3	165.8	0	0	0	110.1	R721 L723 V727 Y728 E729 I1194 T1195	R721-I725 HydrophobicContact CG-CD1 4.31Å; R721-I725 WeakPolarHBondContact O-CG1 2.91Å; R721-I725 PolarHBondContact O-N 3.16Å; R721-I725 VanDerWaalsContact O-N 3.13Å; L723-I725 VanDerWaalsContact C-N 3.33Å; L723-I725 PolarHBondContact O-N 3.1Å; I725-V727 VanDerWaalsContact C-N 3.34Å; I725-V727 PolarHBondContact O-N 3.37Å; I725-Y728 PolarHBondContact O-N 2.94Å; I725-E729 HydrophobicContact CG2-CG 4.4Å; I725-E729 WeakPolarHBondContact O-CG 3.42Å; I725-E729 PolarHBondContact O-N 3.5Å; I725-I1194 HydrophobicContact CD1-CG2 4.06Å; I725-I1194 HydrophobicContact CG1-CG2 3.89Å; I725-T1195 HydrophobicContact CD1-CG2 3.57Å
726	F	91.9	Very high	90.1	Very high	53 Å²	53	41.2 Å²	41.2	23%	0.232	20%	0.2	C	C	.	.	H	α-helix	trans	-57.1	-46.8	-178.9	179	-90.6	0	0	0	112.5	F715 D722 L723 E729 K730 W731 Y782	F715-F726 AromaticContact CE1-CD1 3.63Å; F715-F726 HydrophobicContact CE1-CD1 3.63Å; F715-F726 AromaticContact CE1-CE1 3.62Å; F715-F726 HydrophobicContact CE1-CE1 3.62Å; F715-F726 HydrophobicContact CE1-CG 4.41Å; F715-F726 HydrophobicContact CE1-CZ 4.36Å; F715-F726 AromaticContact CZ-CD1 3.89Å; F715-F726 HydrophobicContact CZ-CD1 3.89Å; F715-F726 AromaticContact CZ-CE1 3.62Å; F715-F726 HydrophobicContact CZ-CE1 3.62Å; D722-F726 WeakPolarHBondContact O-CB 3.43Å; D722-F726 PolarHBondContact O-N 2.82Å; L723-F726 PolarHBondContact O-N 2.85Å; F726-E729 PolarHBondContact O-N 2.94Å; F726-K730 HydrophobicContact CD1-CG 4.4Å; F726-K730 HydrophobicContact CD2-CG 4.42Å; F726-K730 HydrophobicContact CE1-CG 4.04Å; F726-K730 HydrophobicContact CE2-CG 4.09Å; F726-K730 HydrophobicContact CZ-CG 3.89Å; F726-K730 WeakPolarHBondContact O-CB 3.27Å; F726-K730 WeakPolarHBondContact O-CG 3.44Å; F726-K730 PolarHBondContact O-N 3.05Å; F726-W731 HydrophobicContact CE1-CH2 4.42Å; F726-Y782 HydrophobicContact CE1-CE1 4.35Å; F726-Y782 HydrophobicContact CZ-CE1 4.13Å; F726-Y782 HydrophobicContact CZ-CE2 4.34Å; F726-Y782 AromaticContact CZ-CZ 3.8Å
727	V	92.3	Very high	90.5	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.012	18%	0.179	C	C	.	.	H	α-helix	trans	-67.8	-38.5	-177	169.3	0	0	0	0	111.5	L723 I725 W731 L733 L779	L723-V727 HydrophobicContact CD1-CG2 3.74Å; L723-V727 HydrophobicContact CG-CG2 4.15Å; L723-V727 VanDerWaalsContact O-CB 3.31Å; L723-V727 WeakPolarHBondContact O-CB 3.37Å; L723-V727 WeakPolarHBondContact O-CG2 3.27Å; L723-V727 PolarHBondContact O-N 3.45Å; I725-V727 VanDerWaalsContact C-N 3.34Å; I725-V727 PolarHBondContact O-N 3.37Å; V727-W731 HydrophobicContact CG1-CE3 4.21Å; V727-W731 HydrophobicContact CG2-CZ3 4.23Å; V727-W731 PolarHBondContact O-N 3.29Å; V727-L733 HydrophobicContact CG1-CB 3.6Å; V727-L733 HydrophobicContact CG1-CD1 3.72Å; V727-L733 HydrophobicContact CG1-CG 3.89Å; V727-L779 HydrophobicContact CG2-CD1 3.6Å
728	Y	92.9	Very high	90.8	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-66.3	-46.5	175.8	-176.4	-101.7	0	0	0	111.5	A724 I725 K730 N732 L733 I734 F1186 K1187 Y1190	A724-Y728 VanDerWaalsContact O-CB 3.31Å; A724-Y728 WeakPolarHBondContact O-CB 3.45Å; A724-Y728 PolarHBondContact O-N 3.28Å; A724-Y728 VanDerWaalsContact O-N 3.09Å; I725-Y728 PolarHBondContact O-N 2.94Å; Y728-K730 PolarHBondContact O-N 3.39Å; Y728-N732 VanDerWaalsContact CE2-OD1 3.25Å; Y728-N732 WeakPolarHBondContact CE2-OD1 3.28Å; Y728-N732 VanDerWaalsContact O-CA 3.23Å; Y728-N732 WeakPolarHBondContact O-CA 3.25Å; Y728-N732 PolarHBondContact O-N 3.45Å; Y728-L733 WeakPolarHBondContact CA-O 3.41Å; Y728-I734 HydrophobicContact CD2-CG1 4.01Å; Y728-I734 HydrophobicContact CE2-CG1 4.09Å; Y728-F1186 VanDerWaalsContact OH-CD1 3.26Å; Y728-F1186 WeakPolarHBondContact OH-CD1 3.33Å; Y728-K1187 HydrophobicContact CE1-CB 4.25Å; Y728-K1187 HydrophobicContact CE1-CG 4.07Å; Y728-Y1190 AromaticContact CD1-CD1 3.29Å; Y728-Y1190 HydrophobicContact CD1-CD1 3.29Å; Y728-Y1190 AromaticContact CD1-CE1 3.55Å; Y728-Y1190 HydrophobicContact CD1-CE1 3.55Å; Y728-Y1190 HydrophobicContact CD1-CG 4.13Å; Y728-Y1190 AromaticContact CD2-CD1 4Å; Y728-Y1190 HydrophobicContact CD2-CD1 4Å; Y728-Y1190 AromaticContact CD2-CE1 3.68Å; Y728-Y1190 HydrophobicContact CD2-CE1 3.68Å; Y728-Y1190 HydrophobicContact CD2-CE2 4.43Å; Y728-Y1190 HydrophobicContact CD2-CG 4.49Å; Y728-Y1190 AromaticContact CD2-CZ 3.92Å; Y728-Y1190 AromaticContact CE1-CD1 3.55Å; Y728-Y1190 HydrophobicContact CE1-CD1 3.55Å; Y728-Y1190 HydrophobicContact CE1-CE1 4.18Å; Y728-Y1190 AromaticContact CE1-CG 3.93Å; Y728-Y1190 HydrophobicContact CE1-CG 3.93Å; Y728-Y1190 HydrophobicContact CE2-CD1 4.23Å; Y728-Y1190 HydrophobicContact CE2-CE1 4.31Å; Y728-Y1190 HydrophobicContact CE2-CG 4.33Å; Y728-Y1190 AromaticContact CG-CD1 3.54Å; Y728-Y1190 HydrophobicContact CG-CD1 3.54Å; Y728-Y1190 AromaticContact CG-CE1 3.26Å; Y728-Y1190 HydrophobicContact CG-CE1 3.26Å; Y728-Y1190 HydrophobicContact CG-CG 4.41Å; Y728-Y1190 AromaticContact CG-CZ 3.97Å
729	E	90.9	Very high	90.9	Very high	98 Å²	98	30.5 Å²	30.5	46%	0.458	14%	0.136	S	C	.	.	H	α-helix	trans	-65.9	-35.9	180	-70.3	-157.6	119.3	0	0	113.9	I725 F726 K1187 I1191	I725-E729 HydrophobicContact CG2-CG 4.4Å; I725-E729 WeakPolarHBondContact O-CG 3.42Å; I725-E729 PolarHBondContact O-N 3.5Å; F726-E729 PolarHBondContact O-N 2.94Å; E729-K1187 VanDerWaalsContact OE1-CE 3.23Å; E729-K1187 WeakPolarHBondContact OE1-CE 3.47Å; E729-K1187 IonicContact OE1-NZ 3.17Å; E729-K1187 PolarHBondContact OE1-NZ 3.44Å; E729-I1191 HydrophobicContact CG-CD1 3.94Å; E729-I1191 WeakPolarHBondContact OE1-CD1 3.32Å
730	K	89.1	Confident	90.8	Very high	137 Å²	137	28.1 Å²	28.1	60%	0.596	13%	0.128	S	C	*	.	H	α-helix	trans	-84.5	-38.8	-176.4	-69.4	-63.9	-175.5	-176.2	0	113.8	F726 Y728	F726-K730 HydrophobicContact CD1-CG 4.4Å; F726-K730 HydrophobicContact CD2-CG 4.42Å; F726-K730 HydrophobicContact CE1-CG 4.04Å; F726-K730 HydrophobicContact CE2-CG 4.09Å; F726-K730 HydrophobicContact CZ-CG 3.89Å; F726-K730 WeakPolarHBondContact O-CB 3.27Å; F726-K730 WeakPolarHBondContact O-CG 3.44Å; F726-K730 PolarHBondContact O-N 3.05Å; Y728-K730 PolarHBondContact O-N 3.39Å
731	W	89.4	Confident	90.3	Very high	47 Å²	47	31.3 Å²	31.3	18%	0.178	15%	0.145	C	C	.	.	H	α-helix	trans	-132.1	5	-169.1	-57.8	-41.8	0	0	0	114.3	F715 F726 V727 L733 N778 L779 Y782	F715-W731 HydrophobicContact CZ-CH2 4.46Å; F726-W731 HydrophobicContact CE1-CH2 4.42Å; V727-W731 HydrophobicContact CG1-CE3 4.21Å; V727-W731 HydrophobicContact CG2-CZ3 4.23Å; V727-W731 PolarHBondContact O-N 3.29Å; W731-L733 HydrophobicContact CB-CD1 4.11Å; W731-L733 HydrophobicContact CB-CD2 4.15Å; W731-L733 HydrophobicContact CB-CG 3.75Å; W731-L733 HydrophobicContact CE3-CD1 3.96Å; W731-L733 WeakPolarHBondContact O-CD2 3.49Å; W731-L733 PolarHBondContact O-N 2.93Å; W731-N778 HydrophobicContact CD2-CB 3.76Å; W731-N778 HydrophobicContact CE3-CB 4.13Å; W731-N778 HydrophobicContact CG-CB 4.29Å; W731-N778 HydrophobicContact CH2-CB 4.23Å; W731-N778 WeakPolarHBondContact CH2-O 3.46Å; W731-N778 HydrophobicContact CZ2-CB 3.81Å; W731-N778 HydrophobicContact CZ3-CB 4.37Å; W731-L779 VanDerWaalsContact CZ3-CA 3.48Å; W731-L779 HydrophobicContact CZ3-CB 4.04Å; W731-L779 HydrophobicContact CZ3-CD1 4.21Å; W731-Y782 AromaticContact CH2-CD2 3.77Å; W731-Y782 HydrophobicContact CH2-CD2 3.77Å; W731-Y782 AromaticContact CH2-CG 3.87Å; W731-Y782 HydrophobicContact CH2-CG 3.87Å; W731-Y782 AromaticContact CZ2-CD2 3.62Å; W731-Y782 HydrophobicContact CZ2-CD2 3.62Å; W731-Y782 HydrophobicContact CZ2-CE2 4.3Å; W731-Y782 HydrophobicContact CZ2-CG 4.2Å
732	N	92.2	Very high	89.3	Confident	26 Å²	26	30.6 Å²	30.6	14%	0.139	16%	0.155	C	C	.	.			trans	54.2	36.9	-175.7	-167.8	38.6	0	0	0	113.3	Y700 Y728 N1218 P1221	Y700-N732 PolarHBondContact OH-ND2 2.98Å; Y728-N732 VanDerWaalsContact CE2-OD1 3.25Å; Y728-N732 WeakPolarHBondContact CE2-OD1 3.28Å; Y728-N732 VanDerWaalsContact O-CA 3.23Å; Y728-N732 WeakPolarHBondContact O-CA 3.25Å; Y728-N732 PolarHBondContact O-N 3.45Å; N732-N1218 PolarHBondContact O-ND2 3.21Å; N732-P1221 HydrophobicContact CB-CG 4.19Å
733	L	93	Very high	87.7	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	19%	0.186	C	C	.	.			trans	-98.8	132.1	173.8	-30.5	170.6	0	0	0	109.8	V727 Y728 W731 V768 I769	V727-L733 HydrophobicContact CG1-CB 3.6Å; V727-L733 HydrophobicContact CG1-CD1 3.72Å; V727-L733 HydrophobicContact CG1-CG 3.89Å; Y728-L733 WeakPolarHBondContact CA-O 3.41Å; W731-L733 HydrophobicContact CB-CD1 4.11Å; W731-L733 HydrophobicContact CB-CD2 4.15Å; W731-L733 HydrophobicContact CB-CG 3.75Å; W731-L733 HydrophobicContact CE3-CD1 3.96Å; W731-L733 WeakPolarHBondContact O-CD2 3.49Å; W731-L733 PolarHBondContact O-N 2.93Å; L733-V768 HydrophobicContact CB-CB 4.35Å; L733-I769 WeakPolarHBondContact CA-O 3.35Å
734	I	93.6	Very high	86.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	117.6	172.2	-62.2	179.1	0	0	0	108.2	Y728 L736 V768 I769 Y1190 L1200 N1218	Y728-I734 HydrophobicContact CD2-CG1 4.01Å; Y728-I734 HydrophobicContact CE2-CG1 4.09Å; I734-L736 PolarHBondContact O-N 3.41Å; I734-V768 CarbonylContact O-C 3.45Å; I734-V768 VanDerWaalsContact O-CA 3.26Å; I734-V768 WeakPolarHBondContact O-CA 3.1Å; I734-I769 HydrophobicContact CB-CB 4.22Å; I734-I769 HydrophobicContact CB-CD1 4.41Å; I734-I769 HydrophobicContact CG2-CD1 4.42Å; I734-I769 PolarHBondContact N-O 3.42Å; I734-I769 PolarHBondContact O-N 3.25Å; I734-Y1190 HydrophobicContact CD1-CE2 4.3Å; I734-Y1190 HydrophobicContact CG1-CE2 4.09Å; I734-Y1190 HydrophobicContact CG2-CE2 4.2Å; I734-L1200 HydrophobicContact CG2-CD1 3.86Å; I734-L1200 HydrophobicContact CG2-CD2 4.49Å; I734-L1200 HydrophobicContact CG2-CG 4.38Å; I734-N1218 HydrophobicContact CD1-CB 3.74Å; I734-N1218 WeakPolarHBondContact CD1-OD1 3.46Å; I734-N1218 HydrophobicContact CG1-CB 4.47Å; I734-N1218 WeakPolarHBondContact CG1-OD1 3.33Å
735	L	93.2	Very high	84.9	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	105.4	172.4	-178	64.4	0	0	0	109.9	I720 L723 A724 V738 A766 V768	I720-L735 HydrophobicContact CG2-CD2 3.6Å; L723-L735 HydrophobicContact CD2-CD2 4.34Å; A724-L735 HydrophobicContact CB-CB 4.15Å; A724-L735 HydrophobicContact CB-CD2 4.21Å; L735-V738 HydrophobicContact CD1-CG2 4.21Å; L735-V738 HydrophobicContact CD2-CG2 4.4Å; L735-A766 HydrophobicContact CD1-CB 3.45Å; L735-A766 VanDerWaalsContact CD1-CB 3.45Å; L735-V768 HydrophobicContact CD1-CG1 3.95Å
736	L	92.5	Very high	84	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-49.3	-172.8	-173.7	65.8	0	0	0	112.9	L706 I734 N751 I767 F1123 L1200 L1202 F1234	L706-L736 HydrophobicContact CD2-CD2 3.54Å; I734-L736 PolarHBondContact O-N 3.41Å; L736-N751 PolarHBondContact O-N 3.17Å; L736-N751 VanDerWaalsContact O-N 3.11Å; L736-I767 WeakPolarHBondContact CB-O 3.48Å; L736-I767 HydrophobicContact CD2-CG2 4.43Å; L736-I767 PolarHBondContact N-O 3.26Å; L736-F1123 HydrophobicContact CD2-CE1 3.91Å; L736-F1123 HydrophobicContact CD2-CE2 3.8Å; L736-F1123 HydrophobicContact CD2-CZ 3.47Å; L736-F1123 VanDerWaalsContact CD2-CZ 3.47Å; L736-F1123 HydrophobicContact CG-CE2 4.05Å; L736-F1123 HydrophobicContact CG-CZ 4.14Å; L736-L1200 HydrophobicContact CD1-CD2 3.99Å; L736-L1202 HydrophobicContact CD1-CD2 3.3Å; L736-F1234 HydrophobicContact CD1-CD2 4.04Å; L736-F1234 HydrophobicContact CD1-CE2 3.44Å; L736-F1234 VanDerWaalsContact CD1-CE2 3.44Å; L736-F1234 HydrophobicContact CD1-CZ 4.28Å; L736-F1234 HydrophobicContact CG-CE2 4.33Å
737	A	91.3	Very high	83.4	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	157.2	-174.3	0	0	0	0	0	110.8	I748 L749 I767 F1123	A737-I748 HydrophobicContact CB-CG2 4.02Å; A737-L749 CarbonylContact C-O 3.6Å; A737-L749 VanDerWaalsContact CA-O 3.25Å; A737-L749 WeakPolarHBondContact CA-O 3.31Å; A737-L749 WeakPolarHBondContact CB-O 3.39Å; A737-I767 HydrophobicContact CB-CB 4.27Å; A737-I767 HydrophobicContact CB-CD1 4.26Å; A737-I767 PolarHBondContact N-O 3.22Å; A737-I767 PolarHBondContact O-N 3.15Å; A737-F1123 HydrophobicContact CB-CD2 4.04Å; A737-F1123 HydrophobicContact CB-CE2 4.46Å
738	V	90.9	Very high	83.1	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.006	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	130.7	175.2	173.5	0	0	0	0	109.1	I720 L735 I740 L749 P752 M764 R765	I720-V738 HydrophobicContact CD1-CG2 4.47Å; L735-V738 HydrophobicContact CD1-CG2 4.21Å; L735-V738 HydrophobicContact CD2-CG2 4.4Å; V738-I740 HydrophobicContact CG1-CG1 4.24Å; V738-L749 PolarHBondContact N-O 2.73Å; V738-L749 PolarHBondContact O-N 2.89Å; V738-P752 HydrophobicContact CB-CG 4.35Å; V738-P752 HydrophobicContact CG2-CB 4.5Å; V738-P752 HydrophobicContact CG2-CG 3.91Å; V738-M764 HydrophobicContact CG1-CB 3.83Å; V738-M764 HydrophobicContact CG1-CG 4.02Å; V738-M764 HydrophobicContact CG1-SD 4.02Å; V738-R765 CarbonylContact C-O 3.59Å; V738-R765 WeakPolarHBondContact CA-O 3.5Å
739	R	89	Confident	82.8	Confident	29 Å²	29	54 Å²	54	11%	0.109	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	123.2	170.7	-175.7	-176.4	73.4	96.3	24.6	109.4	N741 S747 I748 M764 R765 N1119	R739-N741 PolarHBondContact NH1-OD1 3.13Å; R739-N741 PolarHBondContact NH2-ND2 2.93Å; R739-N741 PolarHBondContact NH2-OD1 3.11Å; R739-N741 VanDerWaalsContact NH2-OD1 3.11Å; R739-S747 CarbonylContact C-O 3.54Å; R739-S747 WeakPolarHBondContact CA-O 3.44Å; R739-I748 HydrophobicContact CB-CG1 4.15Å; R739-I748 HydrophobicContact CG-CG1 4.09Å; R739-M764 CarbonylContact O-C 3.46Å; R739-M764 VanDerWaalsContact O-CA 3.25Å; R739-M764 WeakPolarHBondContact O-CA 3.25Å; R739-R765 PolarHBondContact N-O 2.72Å; R739-R765 PolarHBondContact O-N 2.82Å; R739-N1119 WeakPolarHBondContact CD-OD1 3.26Å; R739-N1119 PolarHBondContact NE-ND2 3.34Å
740	I	85	Confident	82.6	Confident	40 Å²	40	50 Å²	50	21%	0.205	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	118.1	177.8	-54.3	175.6	0	0	0	108	V738 G742 S746 S747 M764	V738-I740 HydrophobicContact CG1-CG1 4.24Å; I740-G742 PolarHBondContact O-N 3.34Å; I740-S746 WeakPolarHBondContact O-CA 3.32Å; I740-S747 PolarHBondContact N-O 3.14Å; I740-S747 PolarHBondContact O-N 3.36Å; I740-M764 HydrophobicContact CD1-CE 4.23Å; I740-M764 HydrophobicContact CG1-CE 4.21Å; I740-M764 HydrophobicContact CG1-CG 4.33Å
741	N	77.4	Confident	82.4	Confident	70 Å²	70	43.6 Å²	43.6	37%	0.374	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	100.6	168.8	-79.4	-11.8	0	0	0	109.7	R739 S763	R739-N741 PolarHBondContact NH1-OD1 3.13Å; R739-N741 PolarHBondContact NH2-ND2 2.93Å; R739-N741 PolarHBondContact NH2-OD1 3.11Å; R739-N741 VanDerWaalsContact NH2-OD1 3.11Å; N741-S763 WeakPolarHBondContact CB-O 3.41Å; N741-S763 PolarHBondContact N-O 3.35Å
742	G	67.1	Low	81.8	Confident	44 Å²	44	41.5 Å²	41.5	45%	0.454	22%	0.224	S	C	.	.			trans	-77.8	171.9	166.4	0	0	0	0	0	112.5	I740 E744 K745	I740-G742 PolarHBondContact O-N 3.34Å; G742-E744 VanDerWaalsContact C-N 3.32Å; G742-K745 WeakPolarHBondContact CA-O 3.11Å; G742-K745 PolarHBondContact N-O 2.81Å
743	L	57.3	Low	80.9	Confident	182 Å²	182	40.4 Å²	40.4	95%	0.953	22%	0.219	S	C	*	.	S	Bend	trans	-64.7	-34.1	176.6	-76.6	159.8	0	0	0	112.6
744	E	56.9	Low	79.6	Confident	187 Å²	187	42.9 Å²	42.9	87%	0.874	23%	0.23	S	C	*	.	S	Bend	trans	-113.2	-39.3	-175.9	-64.2	-171.9	167.1	0	0	113.7	G742	G742-E744 VanDerWaalsContact C-N 3.32Å
745	K	64.9	Low	78.3	Confident	132 Å²	132	46.1 Å²	46.1	57%	0.574	25%	0.25	S	C	*	.			trans	-137.1	139.5	-179.2	-65.6	-176.4	-177.1	178.4	0	111	G742 E1135	G742-K745 WeakPolarHBondContact CA-O 3.11Å; G742-K745 PolarHBondContact N-O 2.81Å; K745-E1135 IonicContact NZ-OE1 3.9Å; K745-E1135 PolarHBondContact NZ-OE1 3.2Å; K745-E1135 VanDerWaalsContact NZ-OE1 3.08Å
746	S	72.9	Confident	77.1	Confident	51 Å²	51	50.2 Å²	50.2	36%	0.357	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	121	169.4	64.1	0	0	0	0	109.7	I740	I740-S746 WeakPolarHBondContact O-CA 3.32Å
747	S	78.9	Confident	76.4	Confident	55 Å²	55	51.4 Å²	51.4	39%	0.385	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	153.9	175.9	57	0	0	0	0	110.9	R739 I740	R739-S747 CarbonylContact C-O 3.54Å; R739-S747 WeakPolarHBondContact CA-O 3.44Å; I740-S747 PolarHBondContact N-O 3.14Å; I740-S747 PolarHBondContact O-N 3.36Å
748	I	86.2	Confident	76	Confident	7 Å²	7	54.5 Å²	54.5	4%	0.036	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	121.1	169.6	-65.9	-177.6	0	0	0	107.4	A737 R739 N1119 R1122 F1123 V1126	A737-I748 HydrophobicContact CB-CG2 4.02Å; R739-I748 HydrophobicContact CB-CG1 4.15Å; R739-I748 HydrophobicContact CG-CG1 4.09Å; I748-N1119 WeakPolarHBondContact CD1-O 3.03Å; I748-R1122 HydrophobicContact CD1-CB 3.28Å; I748-R1122 HydrophobicContact CD1-CG 4.47Å; I748-R1122 HydrophobicContact CG1-CB 4.46Å; I748-F1123 HydrophobicContact CD1-CB 4.39Å; I748-F1123 HydrophobicContact CG2-CB 4.48Å; I748-V1126 HydrophobicContact CB-CG2 4.34Å
749	L	86.7	Confident	75.7	Confident	21 Å²	21	54.5 Å²	54.5	11%	0.11	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	114.4	174.7	-173.2	63	0	0	0	108.6	A737 V738 P752 V755	A737-L749 CarbonylContact C-O 3.6Å; A737-L749 VanDerWaalsContact CA-O 3.25Å; A737-L749 WeakPolarHBondContact CA-O 3.31Å; A737-L749 WeakPolarHBondContact CB-O 3.39Å; V738-L749 PolarHBondContact N-O 2.73Å; V738-L749 PolarHBondContact O-N 2.89Å; L749-P752 HydrophobicContact CD2-CB 3.75Å; L749-P752 HydrophobicContact CG-CB 4.1Å; L749-V755 HydrophobicContact CD2-CB 4.19Å; L749-V755 HydrophobicContact CD2-CG2 4.05Å
750	I	86.4	Confident	75.4	Confident	15 Å²	15	56.7 Å²	56.7	8%	0.077	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	136.1	173.8	-53.2	179.3	0	0	0	107.8	F1123 V1126 L1127 V1160 F1234	I750-F1123 HydrophobicContact CD1-CD2 4.05Å; I750-F1123 HydrophobicContact CD1-CE2 3.87Å; I750-F1123 HydrophobicContact CG1-CD2 4Å; I750-F1123 HydrophobicContact CG1-CE2 3.98Å; I750-F1123 HydrophobicContact CG2-CE2 4.14Å; I750-V1126 HydrophobicContact CD1-CB 4.4Å; I750-V1126 HydrophobicContact CD1-CG1 3.87Å; I750-V1126 HydrophobicContact CG1-CG1 4.21Å; I750-L1127 HydrophobicContact CD1-CB 4.14Å; I750-L1127 HydrophobicContact CD1-CD1 4.15Å; I750-V1160 HydrophobicContact CB-CG2 3.85Å; I750-V1160 HydrophobicContact CG2-CB 4.31Å; I750-V1160 HydrophobicContact CG2-CG2 3.82Å; I750-V1160 VanDerWaalsContact O-CG2 3.29Å; I750-V1160 WeakPolarHBondContact O-CG2 3.5Å; I750-F1234 HydrophobicContact CG2-CD2 3.72Å; I750-F1234 HydrophobicContact CG2-CE2 3.49Å; I750-F1234 VanDerWaalsContact CG2-CE2 3.49Å; I750-F1234 HydrophobicContact CG2-CZ 4.34Å
751	N	85.8	Confident	75	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.011	32%	0.315	C	S	.	.	S	Bend	trans	48.3	66.3	-172.7	-170.5	20.9	0	0	0	113.1	L736 I753 V1160 Q1198 F1234	L736-N751 PolarHBondContact O-N 3.17Å; L736-N751 VanDerWaalsContact O-N 3.11Å; N751-I753 PolarHBondContact O-N 3.17Å; N751-I753 WeakPolarHBondContact OD1-CB 3.48Å; N751-I753 WeakPolarHBondContact OD1-CD1 3.02Å; N751-I753 WeakPolarHBondContact OD1-CG1 3.35Å; N751-V1160 HydrophobicContact CB-CG2 3.88Å; N751-Q1198 PolarHBondContact ND2-O 2.9Å; N751-Q1198 VanDerWaalsContact ND2-O 3.13Å; N751-F1234 HydrophobicContact CB-CB 4.34Å
752	P	77.2	Confident	74.8	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.013	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	8.1	-179.3	31.7	-40	0	0	0	114.7	I720 V738 L749 E754	I720-P752 HydrophobicContact CD1-CB 3.82Å; I720-P752 HydrophobicContact CD1-CG 4.39Å; I720-P752 HydrophobicContact CG2-CB 3.92Å; I720-P752 HydrophobicContact CG2-CG 3.48Å; I720-P752 VanDerWaalsContact CG2-CG 3.48Å; V738-P752 HydrophobicContact CB-CG 4.35Å; V738-P752 HydrophobicContact CG2-CB 4.5Å; V738-P752 HydrophobicContact CG2-CG 3.91Å; L749-P752 HydrophobicContact CD2-CB 3.75Å; L749-P752 HydrophobicContact CG-CB 4.1Å; P752-E754 VanDerWaalsContact C-N 3.32Å
753	I	73	Confident	75.4	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.015	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-26.6	-179	-60.9	167.3	0	0	0	111.3	R721 N751 I1194 Q1198 L1200	R721-I753 HydrophobicContact CB-CG2 4.08Å; R721-I753 HydrophobicContact CG-CG2 3.98Å; N751-I753 PolarHBondContact O-N 3.17Å; N751-I753 WeakPolarHBondContact OD1-CB 3.48Å; N751-I753 WeakPolarHBondContact OD1-CD1 3.02Å; N751-I753 WeakPolarHBondContact OD1-CG1 3.35Å; I753-I1194 HydrophobicContact CD1-CD1 4.02Å; I753-I1194 HydrophobicContact CD1-CG1 3.96Å; I753-I1194 HydrophobicContact CD1-CG2 3.98Å; I753-I1194 HydrophobicContact CG2-CG2 4.33Å; I753-Q1198 HydrophobicContact CG2-CB 3.8Å; I753-Q1198 HydrophobicContact CG2-CG 3.93Å; I753-Q1198 PolarHBondContact O-NE2 3.44Å; I753-L1200 HydrophobicContact CD1-CB 4.46Å; I753-L1200 HydrophobicContact CD1-CD1 4.27Å
754	E	66.4	Low	76.8	Confident	53 Å²	53	49 Å²	49	25%	0.248	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-42.3	178.7	-175.2	172	-158.5	0	0	111.7	P752 P1236	P752-E754 VanDerWaalsContact C-N 3.32Å; E754-P1236 HydrophobicContact CG-CB 4.26Å
755	V	65	Low	78.4	Confident	69 Å²	69	44 Å²	44	42%	0.418	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	108.9	178.6	-171.3	0	0	0	0	106.8	L749 C757	L749-V755 HydrophobicContact CD2-CB 4.19Å; L749-V755 HydrophobicContact CD2-CG2 4.05Å; V755-C757 HydrophobicContact CG1-CB 4.2Å; V755-C757 PolarHBondContact O-N 3.18Å
756	N	69.4	Low	79.6	Confident	90 Å²	90	37.8 Å²	37.8	48%	0.481	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	65.7	175.3	-74	-33.6	0	0	0	111.2	F719 R721	F719-N756 HydrophobicContact CD1-CB 4.1Å; F719-N756 HydrophobicContact CE1-CB 4.05Å; R721-N756 PolarHBondContact NH1-OD1 3.14Å
757	C	76.3	Confident	80.6	Confident	26 Å²	26	35.3 Å²	35.3	18%	0.176	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-92	124.5	-172.8	-168.6	0	0	0	0	107.9	I720 V755 M764	I720-C757 HydrophobicContact CD1-CB 3.88Å; I720-C757 WeakPolarHBondContact CG1-O 3.26Å; I720-C757 PolarHBondContact N-O 3.01Å; V755-C757 HydrophobicContact CG1-CB 4.2Å; V755-C757 PolarHBondContact O-N 3.18Å; C757-M764 VanDerWaalsContact SG-CE 3.56Å
758	P	83.9	Confident	81.3	Confident	66 Å²	66	32.7 Å²	32.7	43%	0.429	18%	0.176	S	C	.	.	B	Isolated β-bridge	trans	-69.9	136.7	174.6	28.1	-32.8	0	0	0	109.9	N760 M764	P758-N760 PolarHBondContact O-N 2.96Å; P758-M764 WeakPolarHBondContact O-CE 3.38Å
759	V	83.8	Confident	81.7	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-67	126.4	178.9	170.3	0	0	0	0	110.1	I711 F715 S716 N717 L718 I720 L723	I711-V759 HydrophobicContact CB-CG1 4.37Å; I711-V759 HydrophobicContact CD1-CG1 3.95Å; I711-V759 HydrophobicContact CG2-CG1 3.7Å; F715-V759 HydrophobicContact CB-CG1 4.27Å; F715-V759 VanDerWaalsContact O-CB 3.29Å; F715-V759 WeakPolarHBondContact O-CB 3.48Å; F715-V759 WeakPolarHBondContact O-CG1 3.41Å; S716-V759 WeakPolarHBondContact CA-O 3.23Å; N717-V759 PolarHBondContact N-O 2.73Å; L718-V759 WeakPolarHBondContact O-CB 3.2Å; L718-V759 VanDerWaalsContact O-CG2 3.29Å; L718-V759 WeakPolarHBondContact O-CG2 3.49Å; L718-V759 PolarHBondContact O-N 3.21Å; I720-V759 HydrophobicContact CB-CG2 4.44Å; I720-V759 HydrophobicContact CG1-CG2 3.53Å; L723-V759 HydrophobicContact CB-CG2 4.49Å; L723-V759 HydrophobicContact CD2-CG1 4.49Å; L723-V759 HydrophobicContact CD2-CG2 3.77Å
760	N	83.4	Confident	81.9	Confident	75 Å²	75	31.5 Å²	31.5	40%	0.401	17%	0.17	S	C	.	.			trans	-118	104.8	171.1	-175.7	-10.8	0	0	0	110.1	P758 N762 S763 M764	P758-N760 PolarHBondContact O-N 2.96Å; N760-N762 PolarHBondContact O-N 2.7Å; N760-N762 VanDerWaalsContact O-N 3.11Å; N760-N762 PolarHBondContact OD1-N 2.87Å; N760-S763 WeakPolarHBondContact CB-OG 3.21Å; N760-S763 PolarHBondContact ND2-OG 2.92Å; N760-S763 PolarHBondContact O-N 2.64Å; N760-M764 HydrophobicContact CB-CE 4.42Å; N760-M764 HydrophobicContact CB-CG 4.45Å; N760-M764 PolarHBondContact N-SD 3.05Å; N760-M764 VanDerWaalsContact N-SD 3.41Å; N760-M764 WeakPolarHBondContact O-CB 3.23Å; N760-M764 WeakPolarHBondContact O-CG 3.45Å; N760-M764 PolarHBondContact O-N 3.14Å
761	N	76.5	Confident	81.9	Confident	43 Å²	43	32.3 Å²	32.3	23%	0.23	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-39.3	-178.5	173.7	-2.6	0	0	0	113	I711 H713	I711-N761 PolarHBondContact O-ND2 3.49Å; I711-N761 PolarHBondContact O-OD1 2.89Å; H713-N761 WeakPolarHBondContact CA-ND2 3.32Å; H713-N761 WeakPolarHBondContact CB-ND2 3.29Å; H713-N761 PolarHBondContact N-ND2 3.03Å
762	N	73.8	Confident	81.7	Confident	98 Å²	98	35.7 Å²	35.7	52%	0.524	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-34.4	-172.4	-68.1	-30.7	0	0	0	113.6	N760 L802	N760-N762 PolarHBondContact O-N 2.7Å; N760-N762 VanDerWaalsContact O-N 3.11Å; N760-N762 PolarHBondContact OD1-N 2.87Å; N762-L802 VanDerWaalsContact OD1-CD2 3.3Å; N762-L802 WeakPolarHBondContact OD1-CD2 3.44Å
763	S	78.7	Confident	82	Confident	26 Å²	26	37.3 Å²	37.3	18%	0.182	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-22.2	-177.8	59.8	0	0	0	0	112.6	N741 N760	N741-S763 WeakPolarHBondContact CB-O 3.41Å; N741-S763 PolarHBondContact N-O 3.35Å; N760-S763 WeakPolarHBondContact CB-OG 3.21Å; N760-S763 PolarHBondContact ND2-OG 2.92Å; N760-S763 PolarHBondContact O-N 2.64Å
764	M	87	Confident	82.5	Confident	9 Å²	9	41.1 Å²	41.1	4%	0.044	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	139.7	-171.2	-61.2	-175.1	179.9	0	0	113.3	I711 V738 R739 I740 C757 P758 N760	I711-M764 HydrophobicContact CD1-CB 4Å; V738-M764 HydrophobicContact CG1-CB 3.83Å; V738-M764 HydrophobicContact CG1-CG 4.02Å; V738-M764 HydrophobicContact CG1-SD 4.02Å; R739-M764 CarbonylContact O-C 3.46Å; R739-M764 VanDerWaalsContact O-CA 3.25Å; R739-M764 WeakPolarHBondContact O-CA 3.25Å; I740-M764 HydrophobicContact CD1-CE 4.23Å; I740-M764 HydrophobicContact CG1-CE 4.21Å; I740-M764 HydrophobicContact CG1-CG 4.33Å; C757-M764 VanDerWaalsContact SG-CE 3.56Å; P758-M764 WeakPolarHBondContact O-CE 3.38Å; N760-M764 HydrophobicContact CB-CE 4.42Å; N760-M764 HydrophobicContact CB-CG 4.45Å; N760-M764 PolarHBondContact N-SD 3.05Å; N760-M764 VanDerWaalsContact N-SD 3.41Å; N760-M764 WeakPolarHBondContact O-CB 3.23Å; N760-M764 WeakPolarHBondContact O-CG 3.45Å; N760-M764 PolarHBondContact O-N 3.14Å
765	R	89.4	Confident	83.4	Confident	82 Å²	82	40.2 Å²	40.2	31%	0.309	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	139	165.6	-63.4	-168.9	73.7	-157.2	-7.6	109.8	D708 V738 R739	D708-R765 VanDerWaalsContact CG-NH2 3.33Å; D708-R765 PolarHBondContact O-NH2 3.25Å; D708-R765 IonicContact OD1-CZ 2.66Å; D708-R765 IonicContact OD1-NE 2.79Å; D708-R765 PolarHBondContact OD1-NE 3.34Å; D708-R765 IonicContact OD1-NH1 3.33Å; D708-R765 IonicContact OD1-NH2 3.16Å; D708-R765 PolarHBondContact OD1-NH2 3.16Å; D708-R765 IonicContact OD2-CZ 3.98Å; D708-R765 IonicContact OD2-NE 3.17Å; D708-R765 IonicContact OD2-NH1 3.06Å; D708-R765 PolarHBondContact OD2-NH1 3.36Å; D708-R765 IonicContact OD2-NH2 3.68Å; D708-R765 PolarHBondContact OD2-NH2 2.97Å; V738-R765 CarbonylContact C-O 3.59Å; V738-R765 WeakPolarHBondContact CA-O 3.5Å; R739-R765 PolarHBondContact N-O 2.72Å; R739-R765 PolarHBondContact O-N 2.82Å
766	A	91.3	Very high	84.5	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	138.1	-176.7	0	0	0	0	0	110.9	V709 I711 L735 V768 L779	V709-A766 PolarHBondContact N-O 3.29Å; V709-A766 PolarHBondContact O-N 3.25Å; I711-A766 HydrophobicContact CD1-CB 4.24Å; I711-A766 HydrophobicContact CG1-CB 3.95Å; L735-A766 HydrophobicContact CD1-CB 3.45Å; L735-A766 VanDerWaalsContact CD1-CB 3.45Å; A766-V768 HydrophobicContact CB-CG1 4.21Å; A766-L779 HydrophobicContact CB-CD2 3.87Å
767	I	93.7	Very high	85.4	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	117.8	165.9	-58.9	178.3	0	0	0	106.7	L706 H707 L736 A737 N1119 F1123	L706-I767 HydrophobicContact CD2-CG2 4.03Å; H707-I767 WeakPolarHBondContact O-CA 2.94Å; L736-I767 WeakPolarHBondContact CB-O 3.48Å; L736-I767 HydrophobicContact CD2-CG2 4.43Å; L736-I767 PolarHBondContact N-O 3.26Å; A737-I767 HydrophobicContact CB-CB 4.27Å; A737-I767 HydrophobicContact CB-CD1 4.26Å; A737-I767 PolarHBondContact N-O 3.22Å; A737-I767 PolarHBondContact O-N 3.15Å; I767-N1119 HydrophobicContact CD1-CB 4.3Å; I767-F1123 HydrophobicContact CD1-CB 3.7Å; I767-F1123 HydrophobicContact CD1-CG 4.34Å
768	V	93.7	Very high	86	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	149.6	-175.8	-61.4	0	0	0	0	111.1	H707 V709 L733 I734 L735 A766 A776 L779	H707-V768 HydrophobicContact CB-CG2 4.27Å; H707-V768 PolarHBondContact N-O 3.35Å; H707-V768 PolarHBondContact O-N 3.09Å; V709-V768 HydrophobicContact CG2-CG2 4.25Å; L733-V768 HydrophobicContact CB-CB 4.35Å; I734-V768 CarbonylContact O-C 3.45Å; I734-V768 VanDerWaalsContact O-CA 3.26Å; I734-V768 WeakPolarHBondContact O-CA 3.1Å; L735-V768 HydrophobicContact CD1-CG1 3.95Å; A766-V768 HydrophobicContact CB-CG1 4.21Å; V768-A776 HydrophobicContact CG2-CB 3.91Å; V768-L779 HydrophobicContact CG1-CD2 4.06Å
769	I	94	Very high	86.3	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	127.6	168	-60.6	168.1	0	0	0	108.3	L678 M704 Q705 L706 L733 I734 L1202 N1218	L678-I769 HydrophobicContact CD1-CD1 3.85Å; L678-I769 HydrophobicContact CD1-CG1 4.29Å; L678-I769 HydrophobicContact CD2-CD1 4.48Å; L678-I769 HydrophobicContact CD2-CG1 4.31Å; L678-I769 HydrophobicContact CD2-CG2 3.58Å; M704-I769 HydrophobicContact CB-CG2 3.87Å; M704-I769 HydrophobicContact CG-CG2 4.42Å; M704-I769 HydrophobicContact SD-CG2 4.43Å; Q705-I769 WeakPolarHBondContact O-CA 3.42Å; L706-I769 HydrophobicContact CD2-CG1 3.65Å; L733-I769 WeakPolarHBondContact CA-O 3.35Å; I734-I769 HydrophobicContact CB-CB 4.22Å; I734-I769 HydrophobicContact CB-CD1 4.41Å; I734-I769 HydrophobicContact CG2-CD1 4.42Å; I734-I769 PolarHBondContact N-O 3.42Å; I734-I769 PolarHBondContact O-N 3.25Å; I769-L1202 HydrophobicContact CD1-CD2 4.41Å; I769-N1218 HydrophobicContact CG2-CB 3.97Å
770	S	90.6	Very high	86.5	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.014	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	164.7	173.6	73.8	0	0	0	0	112.5	M704 Q705 H707 D772	M704-S770 VanDerWaalsContact SD-C 3.54Å; Q705-S770 PolarHBondContact N-O 3.11Å; Q705-S770 PolarHBondContact O-N 3.25Å; H707-S770 PolarHBondContact CD2-OG 3.24Å; H707-S770 PolarHBondContact NE2-OG 3.4Å; S770-D772 PolarHBondContact OG-O 2.87Å; S770-D772 VanDerWaalsContact OG-O 3.13Å
771	S	86.5	Confident	86.7	Confident	32 Å²	32	31.2 Å²	31.2	22%	0.224	17%	0.169	C	C	.	.	S	Bend	trans	-69.3	-40	175.7	60.8	0	0	0	0	113	M704	M704-S771 PolarHBondContact SD-N 3.33Å; M704-S771 VanDerWaalsContact SD-N 3.41Å
772	D	82.9	Confident	87.3	Confident	73 Å²	73	31.3 Å²	31.3	39%	0.39	17%	0.166	S	C	.	.			trans	-136.1	141.5	-170.2	-58	-69	0	0	0	111.1	S770 S774 S775 A776	S770-D772 PolarHBondContact OG-O 2.87Å; S770-D772 VanDerWaalsContact OG-O 3.13Å; D772-S774 PolarHBondContact O-N 3.25Å; D772-S775 WeakPolarHBondContact O-CB 3.46Å; D772-S775 PolarHBondContact O-N 2.94Å; D772-S775 VanDerWaalsContact O-N 3.1Å; D772-A776 PolarHBondContact O-N 3.31Å
773	Y	83.5	Confident	87.9	Confident	35 Å²	35	26.7 Å²	26.7	14%	0.137	14%	0.141	C	C	.	.	H	α-helix	trans	-60.9	-32.8	178.2	-175.1	-116.3	0	0	0	112.6	K536 H707 V709 S775 A776 L777	K536-Y773 HydrophobicContact CB-CD1 4.48Å; K536-Y773 HydrophobicContact CG-CD1 4.2Å; K536-Y773 HydrophobicContact CG-CE1 4.41Å; K536-Y773 HydrophobicContact CG-CG 4.36Å; H707-Y773 HydrophobicContact CB-CD2 4.16Å; H707-Y773 HydrophobicContact CB-CE2 4.5Å; H707-Y773 AromaticContact CG-CD2 3.88Å; H707-Y773 AromaticContact ND1-CD2 3.76Å; V709-Y773 HydrophobicContact CG2-CE2 4.46Å; Y773-S775 VanDerWaalsContact C-N 3.35Å; Y773-S775 PolarHBondContact O-N 3.42Å; Y773-A776 WeakPolarHBondContact O-CB 3.21Å; Y773-A776 PolarHBondContact O-N 3.12Å; Y773-L777 HydrophobicContact CD1-CD1 3.89Å; Y773-L777 HydrophobicContact CD1-CG 4.15Å; Y773-L777 HydrophobicContact CE1-CD1 3.63Å; Y773-L777 HydrophobicContact CE1-CD2 4.01Å; Y773-L777 HydrophobicContact CE1-CG 3.83Å; Y773-L777 HydrophobicContact CE2-CD2 4.47Å; Y773-L777 HydrophobicContact CE2-CG 4.48Å; Y773-L777 WeakPolarHBondContact O-CG 3.19Å; Y773-L777 PolarHBondContact O-N 2.89Å
774	S	83.6	Confident	88.3	Confident	83 Å²	83	29.8 Å²	29.8	58%	0.58	16%	0.159	S	C	*	.	H	α-helix	trans	-61.2	-42.3	175.7	-58.5	0	0	0	0	112.1	D772 A776 L777 N778	D772-S774 PolarHBondContact O-N 3.25Å; S774-A776 VanDerWaalsContact C-N 3.33Å; S774-L777 WeakPolarHBondContact O-CB 3.45Å; S774-L777 PolarHBondContact O-N 3.32Å; S774-N778 PolarHBondContact O-N 3.4Å
775	S	85.8	Confident	88.1	Confident	35 Å²	35	34.5 Å²	34.5	25%	0.245	19%	0.188	C	C	.	.	H	α-helix	trans	-64.9	-40.4	176	-54.2	0	0	0	0	110.9	D772 Y773 L777 N778	D772-S775 WeakPolarHBondContact O-CB 3.46Å; D772-S775 PolarHBondContact O-N 2.94Å; D772-S775 VanDerWaalsContact O-N 3.1Å; Y773-S775 VanDerWaalsContact C-N 3.35Å; Y773-S775 PolarHBondContact O-N 3.42Å; S775-L777 VanDerWaalsContact C-N 3.33Å; S775-L777 PolarHBondContact O-N 2.96Å; S775-N778 WeakPolarHBondContact O-CB 3.24Å; S775-N778 PolarHBondContact O-N 2.63Å
776	A	87.8	Confident	87.8	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.9	-38.4	174.8	0	0	0	0	0	112.4	H707 V709 V768 D772 Y773 S774 N778 L779	H707-A776 HydrophobicContact CB-CB 4.06Å; V709-A776 WeakPolarHBondContact CG1-O 3.37Å; V709-A776 HydrophobicContact CG2-CB 3.77Å; V768-A776 HydrophobicContact CG2-CB 3.91Å; D772-A776 PolarHBondContact O-N 3.31Å; Y773-A776 WeakPolarHBondContact O-CB 3.21Å; Y773-A776 PolarHBondContact O-N 3.12Å; S774-A776 VanDerWaalsContact C-N 3.33Å; A776-N778 PolarHBondContact O-N 3.36Å; A776-L779 WeakPolarHBondContact O-CB 3.48Å; A776-L779 PolarHBondContact O-N 3.45Å
777	L	88.2	Confident	87.4	Confident	12 Å²	12	37.6 Å²	37.6	6%	0.063	21%	0.21	C	C	.	.	H	α-helix	trans	-63.4	-21.7	178.4	-77.2	175.6	0	0	0	113.7	Y773 S774 S775 L779 Q780 Y781	Y773-L777 HydrophobicContact CD1-CD1 3.89Å; Y773-L777 HydrophobicContact CD1-CG 4.15Å; Y773-L777 HydrophobicContact CE1-CD1 3.63Å; Y773-L777 HydrophobicContact CE1-CD2 4.01Å; Y773-L777 HydrophobicContact CE1-CG 3.83Å; Y773-L777 HydrophobicContact CE2-CD2 4.47Å; Y773-L777 HydrophobicContact CE2-CG 4.48Å; Y773-L777 WeakPolarHBondContact O-CG 3.19Å; Y773-L777 PolarHBondContact O-N 2.89Å; S774-L777 WeakPolarHBondContact O-CB 3.45Å; S774-L777 PolarHBondContact O-N 3.32Å; S775-L777 VanDerWaalsContact C-N 3.33Å; S775-L777 PolarHBondContact O-N 2.96Å; L777-L779 PolarHBondContact O-N 3.48Å; L777-Q780 WeakPolarHBondContact O-CB 3.49Å; L777-Q780 PolarHBondContact O-N 3.11Å; L777-Y781 HydrophobicContact CB-CD2 4.17Å; L777-Y781 HydrophobicContact CB-CE2 3.92Å; L777-Y781 HydrophobicContact CD1-CE2 4.04Å; L777-Y781 HydrophobicContact CD2-CE2 4.4Å; L777-Y781 HydrophobicContact CG-CE2 4.37Å; L777-Y781 PolarHBondContact O-N 2.7Å
778	N	89.1	Confident	86.6	Confident	34 Å²	34	37.8 Å²	37.8	18%	0.182	21%	0.213	C	C	.	.	H	α-helix	trans	-57.5	-34.1	175.4	-66.8	-20.8	0	0	0	111.6	W731 S774 S775 A776 Q780 Y781 Y782	W731-N778 HydrophobicContact CD2-CB 3.76Å; W731-N778 HydrophobicContact CE3-CB 4.13Å; W731-N778 HydrophobicContact CG-CB 4.29Å; W731-N778 HydrophobicContact CH2-CB 4.23Å; W731-N778 WeakPolarHBondContact CH2-O 3.46Å; W731-N778 HydrophobicContact CZ2-CB 3.81Å; W731-N778 HydrophobicContact CZ3-CB 4.37Å; S774-N778 PolarHBondContact O-N 3.4Å; S775-N778 WeakPolarHBondContact O-CB 3.24Å; S775-N778 PolarHBondContact O-N 2.63Å; A776-N778 PolarHBondContact O-N 3.36Å; N778-Q780 VanDerWaalsContact C-N 3.25Å; N778-Q780 PolarHBondContact O-N 3Å; N778-Y781 PolarHBondContact O-N 3.38Å; N778-Y782 WeakPolarHBondContact O-CB 3.39Å; N778-Y782 PolarHBondContact O-N 3.09Å
779	L	89.8	Confident	85.8	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-58.7	-35.8	173.7	179.9	60.5	0	0	0	113.2	V709 S712 F715 L723 V727 W731 A766 V768 A776 L777	V709-L779 HydrophobicContact CG1-CB 4.42Å; S712-L779 WeakPolarHBondContact CB-O 3.45Å; S712-L779 PolarHBondContact N-O 2.76Å; S712-L779 VanDerWaalsContact N-O 3.09Å; F715-L779 HydrophobicContact CD2-CD1 4.26Å; F715-L779 HydrophobicContact CE2-CD1 3.89Å; L723-L779 HydrophobicContact CD1-CD1 4.22Å; V727-L779 HydrophobicContact CG2-CD1 3.6Å; W731-L779 VanDerWaalsContact CZ3-CA 3.48Å; W731-L779 HydrophobicContact CZ3-CB 4.04Å; W731-L779 HydrophobicContact CZ3-CD1 4.21Å; A766-L779 HydrophobicContact CB-CD2 3.87Å; V768-L779 HydrophobicContact CG1-CD2 4.06Å; A776-L779 WeakPolarHBondContact O-CB 3.48Å; A776-L779 PolarHBondContact O-N 3.45Å; L777-L779 PolarHBondContact O-N 3.48Å
780	Q	87.5	Confident	85.2	Confident	79 Å²	79	45.3 Å²	45.3	37%	0.369	25%	0.251	S	S	.	.	H	α-helix	trans	-83.4	-35.5	179	-170.6	175.7	2.1	0	0	112.3	V709 G710 L777 N778	V709-Q780 HydrophobicContact CG1-CB 3.75Å; G710-Q780 VanDerWaalsContact O-CA 3.32Å; G710-Q780 WeakPolarHBondContact O-CA 3.27Å; G710-Q780 VanDerWaalsContact O-CB 3.31Å; G710-Q780 WeakPolarHBondContact O-CB 3.31Å; L777-Q780 WeakPolarHBondContact O-CB 3.49Å; L777-Q780 PolarHBondContact O-N 3.11Å; N778-Q780 VanDerWaalsContact C-N 3.25Å; N778-Q780 PolarHBondContact O-N 3Å
781	Y	87.5	Confident	84.5	Confident	10 Å²	10	50.7 Å²	50.7	4%	0.039	28%	0.278	C	S	.	.	H	α-helix	trans	-90.5	-7.7	-173.8	-61.5	-14.5	0	0	0	113.5	R538 L777 N778 C783 H789 G792 P794	R538-Y781 PolarHBondContact NH1-OH 2.74Å; R538-Y781 VanDerWaalsContact NH1-OH 3.08Å; R538-Y781 PolarHBondContact NH2-OH 3.43Å; L777-Y781 HydrophobicContact CB-CD2 4.17Å; L777-Y781 HydrophobicContact CB-CE2 3.92Å; L777-Y781 HydrophobicContact CD1-CE2 4.04Å; L777-Y781 HydrophobicContact CD2-CE2 4.4Å; L777-Y781 HydrophobicContact CG-CE2 4.37Å; L777-Y781 PolarHBondContact O-N 2.7Å; N778-Y781 PolarHBondContact O-N 3.38Å; Y781-C783 PolarHBondContact O-N 3.29Å; Y781-H789 PolarHBondContact O-N 2.87Å; Y781-G792 WeakPolarHBondContact CE2-O 3.47Å; Y781-P794 VanDerWaalsContact CD1-CA 3.49Å; Y781-P794 HydrophobicContact CD1-CB 3.97Å; Y781-P794 HydrophobicContact CE1-CB 3.63Å; Y781-P794 HydrophobicContact CE1-CG 4.48Å
782	Y	88.5	Confident	83.9	Confident	46 Å²	46	51.1 Å²	51.1	18%	0.18	29%	0.288	C	S	.	.			trans	-56	124.2	178.5	-168.4	-110.1	0	0	0	111.3	S712 E714 F715 F726 W731 N778 V784 H789	S712-Y782 WeakPolarHBondContact CB-O 3.28Å; S712-Y782 PolarHBondContact OG-O 3.43Å; E714-Y782 HydrophobicContact CB-CD1 4.09Å; E714-Y782 HydrophobicContact CB-CE1 4.39Å; E714-Y782 HydrophobicContact CG-CD1 4.15Å; F715-Y782 HydrophobicContact CE1-CD1 4.05Å; F715-Y782 HydrophobicContact CE1-CE1 4.22Å; F715-Y782 AromaticContact CE2-CD1 3.73Å; F715-Y782 HydrophobicContact CE2-CD1 3.73Å; F715-Y782 HydrophobicContact CE2-CG 4.14Å; F715-Y782 AromaticContact CZ-CD1 3.33Å; F715-Y782 HydrophobicContact CZ-CD1 3.33Å; F715-Y782 AromaticContact CZ-CE1 3.89Å; F715-Y782 HydrophobicContact CZ-CE1 3.89Å; F715-Y782 AromaticContact CZ-CG 3.9Å; F715-Y782 HydrophobicContact CZ-CG 3.9Å; F726-Y782 HydrophobicContact CE1-CE1 4.35Å; F726-Y782 HydrophobicContact CZ-CE1 4.13Å; F726-Y782 HydrophobicContact CZ-CE2 4.34Å; F726-Y782 AromaticContact CZ-CZ 3.8Å; W731-Y782 AromaticContact CH2-CD2 3.77Å; W731-Y782 HydrophobicContact CH2-CD2 3.77Å; W731-Y782 AromaticContact CH2-CG 3.87Å; W731-Y782 HydrophobicContact CH2-CG 3.87Å; W731-Y782 AromaticContact CZ2-CD2 3.62Å; W731-Y782 HydrophobicContact CZ2-CD2 3.62Å; W731-Y782 HydrophobicContact CZ2-CE2 4.3Å; W731-Y782 HydrophobicContact CZ2-CG 4.2Å; N778-Y782 WeakPolarHBondContact O-CB 3.39Å; N778-Y782 PolarHBondContact O-N 3.09Å; Y782-V784 HydrophobicContact CE1-CG2 4.19Å; Y782-H789 AromaticContact CD2-CE1 3.85Å; Y782-H789 AromaticContact CD2-CG 3.96Å; Y782-H789 AromaticContact CD2-ND1 3.82Å; Y782-H789 AromaticContact CD2-NE2 3.97Å; Y782-H789 AromaticContact CE2-CE1 3.92Å; Y782-H789 AromaticContact CE2-NE2 3.95Å
783	C	87.7	Confident	83.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.293	C	S	.	.			trans	-160.1	129.1	175.3	-177.8	0	0	0	0	106.7	E714 Y781 T785 C786 E787 C795	E714-C783 WeakPolarHBondContact OE1-CA 3.41Å; E714-C783 PolarHBondContact OE1-SG 3.11Å; Y781-C783 PolarHBondContact O-N 3.29Å; C783-T785 VanDerWaalsContact C-N 3.28Å; C783-T785 PolarHBondContact SG-OG1 3.49Å; C783-C786 WeakPolarHBondContact CB-SG 3.46Å; C783-E787 WeakPolarHBondContact O-CA 3.45Å; C783-E787 PolarHBondContact O-N 3.31Å; C783-E787 VanDerWaalsContact O-N 3.13Å; C783-C795 HydrophobicContact CB-CB 3.93Å; C783-C795 WeakPolarHBondContact CB-SG 3.47Å; C783-C795 PolarHBondContact SG-SG 2.8Å
784	V	85.7	Confident	83.2	Confident	92 Å²	92	53.7 Å²	53.7	56%	0.558	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-29.4	-177.3	-176.4	0	0	0	0	110	E714 Y782	E714-V784 PolarHBondContact OE1-N 2.9Å; E714-V784 VanDerWaalsContact OE1-N 3.13Å; Y782-V784 HydrophobicContact CE1-CG2 4.19Å
785	T	83.6	Confident	82.7	Confident	107 Å²	107	51 Å²	51	66%	0.656	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-44	-175.7	61	0	0	0	0	114.1	C783 C797	C783-T785 VanDerWaalsContact C-N 3.28Å; C783-T785 PolarHBondContact SG-OG1 3.49Å; T785-C797 PolarHBondContact OG1-SG 3.27Å
786	C	83.8	Confident	82.1	Confident	40 Å²	40	57.4 Å²	57.4	27%	0.27	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-11.2	-175.8	73.2	0	0	0	0	113.7	C783 G788 C795	C783-C786 WeakPolarHBondContact CB-SG 3.46Å; C786-G788 PolarHBondContact O-N 3.04Å; C786-G788 PolarHBondContact SG-N 3.25Å; C786-G788 VanDerWaalsContact SG-N 3.42Å; C786-C795 WeakPolarHBondContact CB-SG 3.49Å; C786-C795 WeakPolarHBondContact SG-CB 3.46Å; C786-C795 CovalentContact SG-SG 2.06Å; C786-C795 PolarHBondContact SG-SG 2.8Å
787	E	83.3	Confident	81.3	Confident	107 Å²	107	60.6 Å²	60.6	50%	0.5	33%	0.326	S	S	.	.			trans	47.9	29.8	-173.6	-59.9	-171.6	156.9	0	0	114.1	C783 H789 L790	C783-E787 WeakPolarHBondContact O-CA 3.45Å; C783-E787 PolarHBondContact O-N 3.31Å; C783-E787 VanDerWaalsContact O-N 3.13Å; E787-H789 PolarHBondContact O-N 3.49Å; E787-L790 HydrophobicContact CB-CD1 4.07Å; E787-L790 HydrophobicContact CB-CG 4.41Å; E787-L790 HydrophobicContact CG-CD1 4.49Å; E787-L790 WeakPolarHBondContact O-CB 3.46Å; E787-L790 PolarHBondContact O-N 3.46Å
788	G	75	Confident	80.2	Confident	5 Å²	5	62 Å²	62	5%	0.052	34%	0.336	C	S	.	.	H	α-helix	trans	-58.4	-24.6	-173	0	0	0	0	0	114.2	C786 I791 G792 Q793	C786-G788 PolarHBondContact O-N 3.04Å; C786-G788 PolarHBondContact SG-N 3.25Å; C786-G788 VanDerWaalsContact SG-N 3.42Å; G788-I791 PolarHBondContact O-N 3.13Å; G788-G792 PolarHBondContact O-N 2.55Å; G788-Q793 CarbonylContact C-O 3.4Å; G788-Q793 PolarHBondContact O-N 3.48Å; G788-Q793 VanDerWaalsContact O-O 3.07Å
789	H	78.1	Confident	78.8	Confident	33 Å²	33	66 Å²	66	15%	0.153	35%	0.349	C	S	.	.	H	α-helix	trans	-63	-34.8	172.6	62.6	-75.9	0	0	0	113.7	Y781 Y782 E787 I791 G792	Y781-H789 PolarHBondContact O-N 2.87Å; Y782-H789 AromaticContact CD2-CE1 3.85Å; Y782-H789 AromaticContact CD2-CG 3.96Å; Y782-H789 AromaticContact CD2-ND1 3.82Å; Y782-H789 AromaticContact CD2-NE2 3.97Å; Y782-H789 AromaticContact CE2-CE1 3.92Å; Y782-H789 AromaticContact CE2-NE2 3.95Å; E787-H789 PolarHBondContact O-N 3.49Å; H789-I791 VanDerWaalsContact C-N 3.34Å; H789-G792 PolarHBondContact O-N 3.19Å
790	L	81.4	Confident	77	Confident	125 Å²	125	70.8 Å²	70.8	65%	0.654	38%	0.38	S	S	*	.	H	α-helix	trans	-71.5	-31.9	175.8	-61.1	-179.9	0	0	0	111.9	E787	E787-L790 HydrophobicContact CB-CD1 4.07Å; E787-L790 HydrophobicContact CB-CG 4.41Å; E787-L790 HydrophobicContact CG-CD1 4.49Å; E787-L790 WeakPolarHBondContact O-CB 3.46Å; E787-L790 PolarHBondContact O-N 3.46Å
791	I	75.7	Confident	75.3	Confident	115 Å²	115	71.5 Å²	71.5	59%	0.59	39%	0.389	S	S	*	.	H	α-helix	trans	-87.6	-11.9	-178.5	-51	174.7	0	0	0	111.2	G788 H789 Q793	G788-I791 PolarHBondContact O-N 3.13Å; H789-I791 VanDerWaalsContact C-N 3.34Å; I791-Q793 HydrophobicContact CG2-CB 4.43Å; I791-Q793 HydrophobicContact CG2-CG 4.03Å; I791-Q793 PolarHBondContact O-N 2.98Å
792	G	74.2	Confident	73.6	Confident	41 Å²	41	74.3 Å²	74.3	42%	0.423	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	20.2	-173.9	0	0	0	0	0	113.6	Y781 G788 H789	Y781-G792 WeakPolarHBondContact CE2-O 3.47Å; G788-G792 PolarHBondContact O-N 2.55Å; H789-G792 PolarHBondContact O-N 3.19Å
793	Q	76.5	Confident	71.9	Confident	105 Å²	105	78.3 Å²	78.3	49%	0.491	43%	0.425	S	S	.	.	S	Bend	trans	-110.8	142.8	-179.9	-70.8	-170.1	15.1	0	0	111.6	G788 I791 C795	G788-Q793 CarbonylContact C-O 3.4Å; G788-Q793 PolarHBondContact O-N 3.48Å; G788-Q793 VanDerWaalsContact O-O 3.07Å; I791-Q793 HydrophobicContact CG2-CB 4.43Å; I791-Q793 HydrophobicContact CG2-CG 4.03Å; I791-Q793 PolarHBondContact O-N 2.98Å; Q793-C795 PolarHBondContact O-N 3.43Å
794	P	75.1	Confident	70.1	Confident	57 Å²	57	86.2 Å²	86.2	37%	0.37	46%	0.459	S	S	.	.			trans	-62.6	127.7	174.8	26.3	-33.3	0	0	0	110.4	Y781 R796	Y781-P794 VanDerWaalsContact CD1-CA 3.49Å; Y781-P794 HydrophobicContact CD1-CB 3.97Å; Y781-P794 HydrophobicContact CE1-CB 3.63Å; Y781-P794 HydrophobicContact CE1-CG 4.48Å; P794-R796 PolarHBondContact O-N 3.49Å
795	C	73.5	Confident	68.4	Low	28 Å²	28	89.5 Å²	89.5	19%	0.189	46%	0.462	C	S	.	.			trans	-57.1	138.9	179.1	-164.3	0	0	0	0	111.7	C783 C786 Q793 C797	C783-C795 HydrophobicContact CB-CB 3.93Å; C783-C795 WeakPolarHBondContact CB-SG 3.47Å; C783-C795 PolarHBondContact SG-SG 2.8Å; C786-C795 WeakPolarHBondContact CB-SG 3.49Å; C786-C795 WeakPolarHBondContact SG-CB 3.46Å; C786-C795 CovalentContact SG-SG 2.06Å; C786-C795 PolarHBondContact SG-SG 2.8Å; Q793-C795 PolarHBondContact O-N 3.43Å; C795-C797 PolarHBondContact SG-SG 3.28Å
796	R	73.2	Confident	66.9	Low	168 Å²	168	93.4 Å²	93.4	63%	0.634	46%	0.464	S	S	*	.			trans	-96.3	-9.6	179.8	-61	-171.5	-176.2	-173.5	3	113.7	P794 S798 R799	P794-R796 PolarHBondContact O-N 3.49Å; R796-S798 VanDerWaalsContact C-N 3.29Å; R796-S798 PolarHBondContact O-N 3.2Å; R796-S798 VanDerWaalsContact O-N 3.16Å; R796-R799 PolarHBondContact O-N 3.43Å
797	C	70.4	Confident	65.5	Low	68 Å²	68	98.8 Å²	98.8	46%	0.459	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-31	-171.1	-63.3	0	0	0	0	115	T785 C795	T785-C797 PolarHBondContact OG1-SG 3.27Å; C795-C797 PolarHBondContact SG-SG 3.28Å
798	S	65.1	Low	64.1	Low	40 Å²	40	98 Å²	98	28%	0.28	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	6.2	-177.8	-83.1	0	0	0	0	115.4	H713 R796 L802	H713-S798 PolarHBondContact CD2-OG 3.21Å; H713-S798 PolarHBondContact NE2-OG 3.35Å; R796-S798 VanDerWaalsContact C-N 3.29Å; R796-S798 PolarHBondContact O-N 3.2Å; R796-S798 VanDerWaalsContact O-N 3.16Å; S798-L802 WeakPolarHBondContact O-CD1 3.49Å; S798-L802 PolarHBondContact O-N 3.27Å
799	R	59.6	Low	63.1	Low	119 Å²	119	101.4 Å²	101.4	45%	0.449	50%	0.502	S	S	.	.	H	α-helix	trans	-60.6	-35	-173	-74.2	-173.5	-178.9	-173.9	1.1	116.1	R796 V801 E803	R796-R799 PolarHBondContact O-N 3.43Å; R799-V801 VanDerWaalsContact C-N 3.35Å; R799-V801 PolarHBondContact O-N 3.02Å; R799-E803 PolarHBondContact O-N 2.86Å
800	P	51.4	Low	62.2	Low	102 Å²	102	104.4 Å²	104.4	66%	0.662	52%	0.518	S	S	*	.	H	α-helix	trans	-67.2	-32.3	-175.3	-12.4	22.8	0	0	0	113.8
801	V	52.4	Low	61.1	Low	93 Å²	93	101.1 Å²	101.1	56%	0.564	51%	0.508	S	S	*	.	H	α-helix	trans	-85.8	-33.7	-177.3	-176.8	0	0	0	0	111.7	R799	R799-V801 VanDerWaalsContact C-N 3.35Å; R799-V801 PolarHBondContact O-N 3.02Å
802	L	51.5	Low	60.1	Low	70 Å²	70	104.3 Å²	104.3	37%	0.366	51%	0.513	S	S	.	.	H	α-helix	trans	-74	-37.3	-177.3	-75	165.1	0	0	0	112.9	N762 S798 R805 R806	N762-L802 VanDerWaalsContact OD1-CD2 3.3Å; N762-L802 WeakPolarHBondContact OD1-CD2 3.44Å; S798-L802 WeakPolarHBondContact O-CD1 3.49Å; S798-L802 PolarHBondContact O-N 3.27Å; L802-R805 PolarHBondContact O-N 3.25Å; L802-R806 WeakPolarHBondContact O-CB 3.33Å; L802-R806 PolarHBondContact O-N 3.13Å
803	E	53.3	Low	59.1	Low	130 Å²	130	106.1 Å²	106.1	61%	0.607	51%	0.513	S	S	*	.	H	α-helix	trans	-72.2	-36	-173.6	-150	161.5	-146.2	0	0	112.5	R799 K807	R799-E803 PolarHBondContact O-N 2.86Å; E803-K807 WeakPolarHBondContact O-CG 3.31Å; E803-K807 PolarHBondContact O-N 3.01Å
804	K	49.7	Very low	58.4	Low	166 Å²	166	106.4 Å²	106.4	72%	0.722	52%	0.518	S	S	*	.	H	α-helix	trans	-67	-41.3	174.2	-130.1	177	-174.4	179.1	0	111.5	I808	K804-I808 WeakPolarHBondContact O-CG1 3.34Å; K804-I808 PolarHBondContact O-N 2.96Å
805	R	49.3	Very low	57.8	Low	160 Å²	160	106 Å²	106	60%	0.604	52%	0.519	S	S	*	.	H	α-helix	trans	-74.6	-37.5	178.4	-76.2	-176.1	177.9	177.8	0.7	113.1	L802 K807 I808 T809	L802-R805 PolarHBondContact O-N 3.25Å; R805-K807 VanDerWaalsContact C-N 3.28Å; R805-K807 PolarHBondContact O-N 3.24Å; R805-I808 CarbonylContact O-C 3.44Å; R805-I808 WeakPolarHBondContact O-CA 3.4Å; R805-I808 WeakPolarHBondContact O-CB 3.38Å; R805-I808 PolarHBondContact O-N 3.04Å; R805-T809 PolarHBondContact O-N 2.99Å; R805-T809 PolarHBondContact O-OG1 3.15Å
806	R	52	Low	57.3	Low	189 Å²	189	108.7 Å²	108.7	71%	0.713	53%	0.531	S	S	*	.	H	α-helix	trans	-58.2	-41.5	175.3	-123.6	-179.5	-178.1	-174.4	0.7	111.9	L802 I808 T809 I810	L802-R806 WeakPolarHBondContact O-CB 3.33Å; L802-R806 PolarHBondContact O-N 3.13Å; R806-I808 VanDerWaalsContact C-N 3.32Å; R806-I808 PolarHBondContact O-N 3.24Å; R806-T809 PolarHBondContact O-N 2.63Å; R806-I810 WeakPolarHBondContact O-CB 3.46Å; R806-I810 WeakPolarHBondContact O-CD1 3.4Å; R806-I810 WeakPolarHBondContact O-CG1 3.34Å; R806-I810 PolarHBondContact O-N 3.34Å
807	K	54.2	Low	56.5	Low	153 Å²	153	104.1 Å²	104.1	67%	0.665	51%	0.514	S	S	*	.	H	α-helix	trans	-61.8	-39.7	174.1	-73.4	-179.1	179.9	-179.5	0	111.7	E803 R805 A811	E803-K807 WeakPolarHBondContact O-CG 3.31Å; E803-K807 PolarHBondContact O-N 3.01Å; R805-K807 VanDerWaalsContact C-N 3.28Å; R805-K807 PolarHBondContact O-N 3.24Å; K807-A811 WeakPolarHBondContact O-CB 3.43Å; K807-A811 PolarHBondContact O-N 3.45Å
808	I	55	Low	56.1	Low	92 Å²	92	106.6 Å²	106.6	47%	0.472	52%	0.519	S	S	.	.	H	α-helix	trans	-68.6	-43.5	177.4	-64.1	164.1	0	0	0	111.7	K804 R805 R806 A811 R812	K804-I808 WeakPolarHBondContact O-CG1 3.34Å; K804-I808 PolarHBondContact O-N 2.96Å; R805-I808 CarbonylContact O-C 3.44Å; R805-I808 WeakPolarHBondContact O-CA 3.4Å; R805-I808 WeakPolarHBondContact O-CB 3.38Å; R805-I808 PolarHBondContact O-N 3.04Å; R806-I808 VanDerWaalsContact C-N 3.32Å; R806-I808 PolarHBondContact O-N 3.24Å; I808-A811 PolarHBondContact O-N 3.35Å; I808-R812 WeakPolarHBondContact O-CB 3.32Å; I808-R812 PolarHBondContact O-N 3.24Å
809	T	54.8	Low	56	Low	76 Å²	76	111 Å²	111	47%	0.466	54%	0.535	S	S	.	.	H	α-helix	trans	-65.6	-46.6	178.2	-48.2	0	0	0	0	111.1	R805 R806 A811 R812 D813	R805-T809 PolarHBondContact O-N 2.99Å; R805-T809 PolarHBondContact O-OG1 3.15Å; R806-T809 PolarHBondContact O-N 2.63Å; T809-A811 VanDerWaalsContact C-N 3.31Å; T809-A811 PolarHBondContact O-N 3.22Å; T809-R812 PolarHBondContact O-N 3.09Å; T809-D813 WeakPolarHBondContact O-CB 3.31Å; T809-D813 VanDerWaalsContact O-CG 3.25Å; T809-D813 PolarHBondContact O-N 3.3Å
810	I	58.2	Low	56.2	Low	95 Å²	95	108.7 Å²	108.7	49%	0.487	53%	0.531	S	S	.	.	H	α-helix	trans	-60.8	-41.8	176.2	-66.8	166.1	0	0	0	110.7	R806 D813 L814	R806-I810 WeakPolarHBondContact O-CB 3.46Å; R806-I810 WeakPolarHBondContact O-CD1 3.4Å; R806-I810 WeakPolarHBondContact O-CG1 3.34Å; R806-I810 PolarHBondContact O-N 3.34Å; I810-D813 PolarHBondContact O-N 3.47Å; I810-L814 HydrophobicContact CG2-CD1 3.73Å; I810-L814 HydrophobicContact CG2-CG 4.44Å; I810-L814 VanDerWaalsContact O-CB 3.31Å; I810-L814 WeakPolarHBondContact O-CB 3.21Å; I810-L814 WeakPolarHBondContact O-CD1 3.33Å; I810-L814 VanDerWaalsContact O-CG 3.25Å; I810-L814 WeakPolarHBondContact O-CG 3.41Å; I810-L814 PolarHBondContact O-N 3.46Å
811	A	57.3	Low	56.3	Low	56 Å²	56	105.6 Å²	105.6	46%	0.463	52%	0.518	S	S	.	.	H	α-helix	trans	-65.6	-38.5	176.4	0	0	0	0	0	112.6	K807 I808 T809 A815	K807-A811 WeakPolarHBondContact O-CB 3.43Å; K807-A811 PolarHBondContact O-N 3.45Å; I808-A811 PolarHBondContact O-N 3.35Å; T809-A811 VanDerWaalsContact C-N 3.31Å; T809-A811 PolarHBondContact O-N 3.22Å; A811-A815 WeakPolarHBondContact O-CB 2.9Å; A811-A815 PolarHBondContact O-N 3.5Å
812	R	56.5	Low	56.7	Low	182 Å²	182	106.6 Å²	106.6	69%	0.687	52%	0.515	S	S	*	.	H	α-helix	trans	-65.6	-46.9	174.3	-98.7	-171.9	169.5	127.4	-2.2	112.1	I808 T809 L814 A815 L816	I808-R812 WeakPolarHBondContact O-CB 3.32Å; I808-R812 PolarHBondContact O-N 3.24Å; T809-R812 PolarHBondContact O-N 3.09Å; R812-L814 VanDerWaalsContact C-N 3.35Å; R812-A815 PolarHBondContact O-N 2.96Å; R812-L816 PolarHBondContact O-N 3.23Å
813	D	52.5	Low	57	Low	80 Å²	80	106.2 Å²	106.2	43%	0.428	52%	0.522	S	S	.	.	H	α-helix	trans	-60	-48.8	177.9	-68.2	-12.1	0	0	0	109.3	T809 I810 A815 L816 Y817	T809-D813 WeakPolarHBondContact O-CB 3.31Å; T809-D813 VanDerWaalsContact O-CG 3.25Å; T809-D813 PolarHBondContact O-N 3.3Å; I810-D813 PolarHBondContact O-N 3.47Å; D813-A815 VanDerWaalsContact C-N 3.33Å; D813-A815 PolarHBondContact O-N 2.89Å; D813-L816 PolarHBondContact O-N 3.13Å; D813-Y817 HydrophobicContact CB-CD2 4.46Å; D813-Y817 HydrophobicContact CB-CE2 4.21Å; D813-Y817 WeakPolarHBondContact O-CD2 3.22Å; D813-Y817 PolarHBondContact O-N 3.23Å
814	L	61.6	Low	56.9	Low	111 Å²	111	107.7 Å²	107.7	58%	0.581	52%	0.522	S	S	*	.	H	α-helix	trans	-56.6	-42.3	174.9	-77.7	162.4	0	0	0	112.7	I810 R812 Y817 E818	I810-L814 HydrophobicContact CG2-CD1 3.73Å; I810-L814 HydrophobicContact CG2-CG 4.44Å; I810-L814 VanDerWaalsContact O-CB 3.31Å; I810-L814 WeakPolarHBondContact O-CB 3.21Å; I810-L814 WeakPolarHBondContact O-CD1 3.33Å; I810-L814 VanDerWaalsContact O-CG 3.25Å; I810-L814 WeakPolarHBondContact O-CG 3.41Å; I810-L814 PolarHBondContact O-N 3.46Å; R812-L814 VanDerWaalsContact C-N 3.35Å; L814-Y817 PolarHBondContact O-N 3.15Å; L814-E818 PolarHBondContact O-N 3.4Å
815	A	63.4	Low	57.1	Low	48 Å²	48	104.7 Å²	104.7	40%	0.397	51%	0.51	S	S	.	.	H	α-helix	trans	-67.1	-41.2	178.3	0	0	0	0	0	112.6	A811 R812 D813 Y817 E818 Q819	A811-A815 WeakPolarHBondContact O-CB 2.9Å; A811-A815 PolarHBondContact O-N 3.5Å; R812-A815 PolarHBondContact O-N 2.96Å; D813-A815 VanDerWaalsContact C-N 3.33Å; D813-A815 PolarHBondContact O-N 2.89Å; A815-Y817 VanDerWaalsContact C-N 3.31Å; A815-Y817 PolarHBondContact O-N 3.29Å; A815-E818 PolarHBondContact O-N 2.9Å; A815-Q819 PolarHBondContact O-N 2.95Å
816	L	63.1	Low	57.4	Low	85 Å²	85	102 Å²	102	45%	0.445	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-40.7	173.9	-167.5	77.1	0	0	0	110.5	R812 D813 E818 Q819 I820	R812-L816 PolarHBondContact O-N 3.23Å; D813-L816 PolarHBondContact O-N 3.13Å; L816-E818 PolarHBondContact O-N 3.47Å; L816-Q819 PolarHBondContact O-N 3.45Å; L816-I820 HydrophobicContact CD2-CD1 4.46Å; L816-I820 HydrophobicContact CG-CD1 4.16Å; L816-I820 WeakPolarHBondContact O-CG1 3.48Å; L816-I820 PolarHBondContact O-N 3.5Å
817	Y	55.5	Low	57.5	Low	71 Å²	71	95.4 Å²	95.4	28%	0.278	49%	0.494	S	S	.	.	H	α-helix	trans	-64.1	-38.6	174.7	-77.3	-58.4	0	0	0	113.2	Y645 L646 D813 L814 A815 Q819 I820 G821	Y645-Y817 WeakPolarHBondContact CE2-OH 3.49Å; Y645-Y817 PolarHBondContact OH-OH 3.05Å; L646-Y817 HydrophobicContact CD1-CD1 3.28Å; L646-Y817 HydrophobicContact CD1-CD2 4.22Å; L646-Y817 HydrophobicContact CD1-CE1 2.99Å; L646-Y817 HydrophobicContact CD1-CE2 4.02Å; L646-Y817 HydrophobicContact CD1-CG 3.94Å; L646-Y817 VanDerWaalsContact CD1-CZ 3.43Å; L646-Y817 HydrophobicContact CD2-CD2 4.28Å; L646-Y817 HydrophobicContact CD2-CE1 3.73Å; L646-Y817 HydrophobicContact CD2-CE2 3.42Å; L646-Y817 VanDerWaalsContact CD2-CE2 3.42Å; L646-Y817 WeakPolarHBondContact CD2-OH 3.42Å; L646-Y817 HydrophobicContact CG-CD1 4.29Å; L646-Y817 HydrophobicContact CG-CE1 3.53Å; L646-Y817 HydrophobicContact CG-CE2 4.18Å; L646-Y817 VanDerWaalsContact CG-CZ 3.49Å; L646-Y817 WeakPolarHBondContact CG-OH 3.33Å; D813-Y817 HydrophobicContact CB-CD2 4.46Å; D813-Y817 HydrophobicContact CB-CE2 4.21Å; D813-Y817 WeakPolarHBondContact O-CD2 3.22Å; D813-Y817 PolarHBondContact O-N 3.23Å; L814-Y817 PolarHBondContact O-N 3.15Å; A815-Y817 VanDerWaalsContact C-N 3.31Å; A815-Y817 PolarHBondContact O-N 3.29Å; Y817-Q819 VanDerWaalsContact C-N 3.32Å; Y817-I820 PolarHBondContact O-N 2.8Å; Y817-G821 PolarHBondContact O-N 2.96Å
818	E	62.6	Low	57.4	Low	120 Å²	120	92.4 Å²	92.4	56%	0.561	49%	0.488	S	S	*	.	H	α-helix	trans	-63.5	-39	174.2	-120	-169.3	136.7	0	0	111.8	L814 A815 L816 K822	L814-E818 PolarHBondContact O-N 3.4Å; A815-E818 PolarHBondContact O-N 2.9Å; L816-E818 PolarHBondContact O-N 3.47Å; E818-K822 WeakPolarHBondContact O-CB 3.44Å; E818-K822 VanDerWaalsContact O-CG 3.32Å; E818-K822 WeakPolarHBondContact O-CG 3.48Å; E818-K822 PolarHBondContact O-N 2.93Å; E818-K822 IonicContact OE1-NZ 2.86Å
819	Q	63	Low	57.1	Low	132 Å²	132	93.3 Å²	93.3	62%	0.617	49%	0.489	S	S	*	.	H	α-helix	trans	-66.6	-46.9	176	-74.3	-179.1	-13.7	0	0	112.1	A815 L816 Y817 G821 K822 A823	A815-Q819 PolarHBondContact O-N 2.95Å; L816-Q819 PolarHBondContact O-N 3.45Å; Y817-Q819 VanDerWaalsContact C-N 3.32Å; Q819-G821 VanDerWaalsContact C-N 3.32Å; Q819-G821 PolarHBondContact O-N 3.37Å; Q819-K822 PolarHBondContact O-N 3.29Å; Q819-A823 WeakPolarHBondContact O-CB 3.14Å; Q819-A823 PolarHBondContact O-N 2.87Å
820	I	63.9	Low	56.9	Low	71 Å²	71	93 Å²	93	36%	0.364	49%	0.494	S	S	.	.	H	α-helix	trans	-63.9	-40.1	177.2	-64.5	166.7	0	0	0	110.6	L816 Y817 A823 R824	L816-I820 HydrophobicContact CD2-CD1 4.46Å; L816-I820 HydrophobicContact CG-CD1 4.16Å; L816-I820 WeakPolarHBondContact O-CG1 3.48Å; L816-I820 PolarHBondContact O-N 3.5Å; Y817-I820 PolarHBondContact O-N 2.8Å; I820-A823 PolarHBondContact O-N 2.91Å; I820-R824 PolarHBondContact O-N 3.42Å
821	G	52.9	Low	56.2	Low	38 Å²	38	94 Å²	94	39%	0.392	50%	0.496	S	S	.	.	H	α-helix	trans	-60.3	-48.5	175.2	0	0	0	0	0	112.4	Y817 Q819 R824 E825	Y817-G821 PolarHBondContact O-N 2.96Å; Q819-G821 VanDerWaalsContact C-N 3.32Å; Q819-G821 PolarHBondContact O-N 3.37Å; G821-R824 PolarHBondContact O-N 3.32Å; G821-E825 WeakPolarHBondContact O-CB 3.48Å; G821-E825 PolarHBondContact O-N 3.2Å
822	K	60.2	Low	55.6	Low	114 Å²	114	95.5 Å²	95.5	50%	0.496	50%	0.5	S	S	.	.	H	α-helix	trans	-64.2	-39.9	176.2	-76	173.3	-177.3	168.6	0	112.5	E818 Q819 R824 E825 N826	E818-K822 WeakPolarHBondContact O-CB 3.44Å; E818-K822 VanDerWaalsContact O-CG 3.32Å; E818-K822 WeakPolarHBondContact O-CG 3.48Å; E818-K822 PolarHBondContact O-N 2.93Å; E818-K822 IonicContact OE1-NZ 2.86Å; Q819-K822 PolarHBondContact O-N 3.29Å; K822-R824 VanDerWaalsContact C-N 3.34Å; K822-R824 PolarHBondContact O-N 3.45Å; K822-E825 PolarHBondContact O-N 2.87Å; K822-N826 WeakPolarHBondContact O-CB 3.49Å; K822-N826 VanDerWaalsContact O-CG 3.23Å; K822-N826 PolarHBondContact O-N 3.15Å; K822-N826 PolarHBondContact O-ND2 3.44Å
823	A	57.5	Low	54.8	Low	62 Å²	62	98.2 Å²	98.2	51%	0.512	51%	0.51	S	S	.	.	H	α-helix	trans	-61.5	-43.2	176.3	0	0	0	0	0	111.7	Q819 I820 N826 A827	Q819-A823 WeakPolarHBondContact O-CB 3.14Å; Q819-A823 PolarHBondContact O-N 2.87Å; I820-A823 PolarHBondContact O-N 2.91Å; A823-N826 PolarHBondContact O-N 3.47Å; A823-A827 PolarHBondContact O-N 2.99Å; A823-A827 VanDerWaalsContact O-N 3.09Å
824	R	50.9	Low	54	Low	161 Å²	161	98.7 Å²	98.7	61%	0.608	52%	0.52	S	S	*	.	H	α-helix	trans	-67.3	-41	174.9	-76.7	-177.3	169.9	-173.5	-4.2	112.6	I820 G821 K822 N826 A827 V828	I820-R824 PolarHBondContact O-N 3.42Å; G821-R824 PolarHBondContact O-N 3.32Å; K822-R824 VanDerWaalsContact C-N 3.34Å; K822-R824 PolarHBondContact O-N 3.45Å; R824-N826 VanDerWaalsContact C-N 3.31Å; R824-N826 PolarHBondContact O-N 3.12Å; R824-A827 PolarHBondContact O-N 2.73Å; R824-V828 WeakPolarHBondContact O-CG2 3.45Å; R824-V828 PolarHBondContact O-N 2.93Å
825	E	55.3	Low	52.6	Low	102 Å²	102	103.8 Å²	103.8	48%	0.477	53%	0.533	S	S	.	.	H	α-helix	trans	-64	-37.8	177.4	-161.6	-175.3	156.2	0	0	111.8	G821 K822 V828 K829	G821-E825 WeakPolarHBondContact O-CB 3.48Å; G821-E825 PolarHBondContact O-N 3.2Å; K822-E825 PolarHBondContact O-N 2.87Å; E825-V828 PolarHBondContact O-N 3.29Å; E825-K829 WeakPolarHBondContact O-CB 3.15Å; E825-K829 WeakPolarHBondContact O-CG 3.45Å; E825-K829 PolarHBondContact O-N 3.16Å; E825-K829 WeakPolarHBondContact OE1-CE 3.34Å; E825-K829 IonicContact OE1-NZ 3.57Å; E825-K829 PolarHBondContact OE1-NZ 2.92Å
826	N	55.4	Low	51.1	Low	104 Å²	104	108.3 Å²	108.3	56%	0.556	55%	0.55	S	S	*	*	H	α-helix	trans	-67.3	-37	174.5	-71.4	-12.6	0	0	0	112.3	K822 A823 R824 K829 A830	K822-N826 WeakPolarHBondContact O-CB 3.49Å; K822-N826 VanDerWaalsContact O-CG 3.23Å; K822-N826 PolarHBondContact O-N 3.15Å; K822-N826 PolarHBondContact O-ND2 3.44Å; A823-N826 PolarHBondContact O-N 3.47Å; R824-N826 VanDerWaalsContact C-N 3.31Å; R824-N826 PolarHBondContact O-N 3.12Å; N826-K829 PolarHBondContact O-N 2.89Å; N826-A830 WeakPolarHBondContact O-CB 3.27Å; N826-A830 PolarHBondContact O-N 3.19Å
827	A	54.3	Low	49.5	Very low	51 Å²	51	109.7 Å²	109.7	42%	0.421	56%	0.562	S	S	.	*	H	α-helix	trans	-63.5	-45.2	174	0	0	0	0	0	111.6	A823 R824 K829 A830 E831	A823-A827 PolarHBondContact O-N 2.99Å; A823-A827 VanDerWaalsContact O-N 3.09Å; R824-A827 PolarHBondContact O-N 2.73Å; A827-K829 VanDerWaalsContact C-N 3.33Å; A827-K829 PolarHBondContact O-N 3.23Å; A827-A830 PolarHBondContact O-N 3.01Å; A827-E831 PolarHBondContact O-N 3.42Å
828	V	51.1	Low	48.1	Very low	89 Å²	89	118 Å²	118	54%	0.539	59%	0.593	S	S	.	*	H	α-helix	trans	-64.3	-36.8	176.2	175.4	0	0	0	0	111.8	R824 E825 E831 T832	R824-V828 WeakPolarHBondContact O-CG2 3.45Å; R824-V828 PolarHBondContact O-N 2.93Å; E825-V828 PolarHBondContact O-N 3.29Å; V828-E831 PolarHBondContact O-N 3.38Å; V828-T832 PolarHBondContact O-N 3.42Å; V828-T832 PolarHBondContact O-OG1 3.2Å
829	K	48.6	Very low	46.6	Very low	112 Å²	112	117.1 Å²	117.1	49%	0.487	60%	0.601	S	S	.	*	H	α-helix	trans	-69.4	-34.7	174.3	-76.6	175.9	-173.9	164.5	0	112.9	E825 N826 A827 E831 T832	E825-K829 WeakPolarHBondContact O-CB 3.15Å; E825-K829 WeakPolarHBondContact O-CG 3.45Å; E825-K829 PolarHBondContact O-N 3.16Å; E825-K829 WeakPolarHBondContact OE1-CE 3.34Å; E825-K829 IonicContact OE1-NZ 3.57Å; E825-K829 PolarHBondContact OE1-NZ 2.92Å; N826-K829 PolarHBondContact O-N 2.89Å; A827-K829 VanDerWaalsContact C-N 3.33Å; A827-K829 PolarHBondContact O-N 3.23Å; K829-E831 VanDerWaalsContact C-N 3.34Å; K829-T832 VanDerWaalsContact CA-OG1 3.3Å; K829-T832 WeakPolarHBondContact CA-OG1 3.42Å; K829-T832 PolarHBondContact O-N 2.96Å; K829-T832 PolarHBondContact O-OG1 3.45Å
830	A	50.6	Low	44.8	Very low	69 Å²	69	117.7 Å²	117.7	57%	0.57	61%	0.613	S	S	*	*	H	α-helix	trans	-67.8	-35.8	175.6	0	0	0	0	0	111.5	N826 A827	N826-A830 WeakPolarHBondContact O-CB 3.27Å; N826-A830 PolarHBondContact O-N 3.19Å; A827-A830 PolarHBondContact O-N 3.01Å
831	E	44.9	Very low	43.2	Very low	115 Å²	115	121.5 Å²	121.5	54%	0.537	63%	0.629	S	S	.	*	H	α-helix	trans	-71.6	-25.2	175.2	-74.6	174.7	176.7	0	0	113.4	A827 V828 K829 W833	A827-E831 PolarHBondContact O-N 3.42Å; V828-E831 PolarHBondContact O-N 3.38Å; K829-E831 VanDerWaalsContact C-N 3.34Å; E831-W833 VanDerWaalsContact C-N 3.3Å; E831-W833 PolarHBondContact O-N 2.64Å
832	T	44.6	Very low	42	Very low	89 Å²	89	129.4 Å²	129.4	55%	0.546	65%	0.653	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.8	-7.6	178.8	18.2	0	0	0	0	114	V828 K829	V828-T832 PolarHBondContact O-N 3.42Å; V828-T832 PolarHBondContact O-OG1 3.2Å; K829-T832 VanDerWaalsContact CA-OG1 3.3Å; K829-T832 WeakPolarHBondContact CA-OG1 3.42Å; K829-T832 PolarHBondContact O-N 2.96Å; K829-T832 PolarHBondContact O-OG1 3.45Å
833	W	39.2	Very low	40.4	Very low	239 Å²	239	133.2 Å²	133.2	91%	0.905	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	6.5	178.3	-83.5	49.5	0	0	0	114.2	E831	E831-W833 VanDerWaalsContact C-N 3.3Å; E831-W833 PolarHBondContact O-N 2.64Å
834	S	35.9	Very low	38.9	Very low	90 Å²	90	140.9 Å²	140.9	63%	0.629	69%	0.686	S	S	*	*			trans	-114.6	64.8	173.1	65.1	0	0	0	0	111.6
835	Y	31.1	Very low	37.8	Very low	217 Å²	217	140.3 Å²	140.3	85%	0.851	69%	0.69	S	S	*	*			trans	-99.3	82.2	161.2	-94.2	-86.6	0	0	0	108.2
836	D	32	Very low	36.4	Very low	143 Å²	143	139.5 Å²	139.5	77%	0.765	70%	0.695	S	S	*	*			trans	-151.4	115.9	159.8	-109	-24.7	0	0	0	111.9
837	T	30.7	Very low	35	Very low	114 Å²	114	143.9 Å²	143.9	70%	0.699	71%	0.71	S	S	*	*			trans	56.2	114.5	150.9	52.4	0	0	0	0	121.3
838	R	26	Very low	33.6	Very low	245 Å²	245	146.3 Å²	146.3	93%	0.925	72%	0.72	S	S	*	*			trans	51.2	82	139.6	-62.9	-179.3	-178.2	169.1	0.7	116.9
839	S	30.4	Very low	32.5	Very low	103 Å²	103	145.9 Å²	145.9	72%	0.72	73%	0.725	S	S	*	*			trans	-161.5	119.6	138.5	54.5	0	0	0	0	110.8	H841	S839-H841 PolarHBondContact O-N 3.18Å; S839-H841 VanDerWaalsContact O-N 3.11Å
840	T	25.9	Very low	31.4	Very low	143 Å²	143	146.1 Å²	146.1	88%	0.877	74%	0.736	S	S	*	*			trans	-74.7	87.8	166.9	45.6	0	0	0	0	108.1
841	H	29.5	Very low	30.2	Very low	151 Å²	151	148 Å²	148	70%	0.699	75%	0.745	S	S	*	*			trans	-133.6	118.9	167.3	-93.9	-77.1	0	0	0	110.7	S839 F843	S839-H841 PolarHBondContact O-N 3.18Å; S839-H841 VanDerWaalsContact O-N 3.11Å; H841-F843 PolarHBondContact O-N 2.98Å
842	F	27.4	Very low	29.2	Very low	205 Å²	205	147.9 Å²	147.9	90%	0.899	76%	0.755	S	S	*	*			trans	-25.9	112.3	165	-76.8	-101.1	0	0	0	113.6	R844	F842-R844 PolarHBondContact O-N 3.23Å; F842-R844 VanDerWaalsContact O-N 3.07Å
843	F	27.6	Very low	28.3	Very low	193 Å²	193	150 Å²	150	85%	0.846	76%	0.762	S	S	*	*			trans	-75.2	99.6	170.1	-93.3	-86.1	0	0	0	110.4	H841 H845	H841-F843 PolarHBondContact O-N 2.98Å; F843-H845 PolarHBondContact O-N 3.43Å
844	R	25.1	Very low	27.6	Very low	224 Å²	224	145.7 Å²	145.7	85%	0.845	76%	0.756	S	S	*	*			trans	-60.2	111.5	158.2	-90.2	176.1	162.7	169.1	-4.4	109.3	F842 S846	F842-R844 PolarHBondContact O-N 3.23Å; F842-R844 VanDerWaalsContact O-N 3.07Å; R844-S846 PolarHBondContact O-N 2.96Å
845	H	28.7	Very low	27.1	Very low	148 Å²	148	148.8 Å²	148.8	69%	0.685	77%	0.765	S	S	*	*			trans	-87.2	86.2	150.3	-82.5	-65.2	0	0	0	108.7	F843 F847	F843-H845 PolarHBondContact O-N 3.43Å; H845-F847 PolarHBondContact O-N 3.4Å
846	S	25.5	Very low	26.9	Very low	85 Å²	85	146.8 Å²	146.8	59%	0.594	76%	0.763	S	S	*	*			trans	-74.3	98.5	165.7	46.5	0	0	0	0	109.5	R844 T848	R844-S846 PolarHBondContact O-N 2.96Å; S846-T848 VanDerWaalsContact C-N 3.26Å; S846-T848 PolarHBondContact O-N 3.42Å
847	F	26.6	Very low	26.6	Very low	196 Å²	196	146 Å²	146	86%	0.86	76%	0.759	S	S	*	*			trans	-76.6	87.3	150.3	-92.8	-84.5	0	0	0	107.3	H845 A849	H845-F847 PolarHBondContact O-N 3.4Å; F847-A849 VanDerWaalsContact C-N 3.3Å; F847-A849 PolarHBondContact O-N 3.21Å
848	T	24.4	Very low	26.6	Very low	103 Å²	103	147.2 Å²	147.2	63%	0.632	77%	0.766	S	S	*	*			trans	-68.3	93.2	162	41.6	0	0	0	0	107.9	S846 T850	S846-T848 VanDerWaalsContact C-N 3.26Å; S846-T848 PolarHBondContact O-N 3.42Å; T848-T850 PolarHBondContact O-N 2.91Å
849	A	27.3	Very low	26.5	Very low	79 Å²	79	146.3 Å²	146.3	65%	0.653	76%	0.763	S	S	*	*			trans	-68.9	81.9	158.8	0	0	0	0	0	107.9	F847	F847-A849 VanDerWaalsContact C-N 3.3Å; F847-A849 PolarHBondContact O-N 3.21Å
850	T	26.3	Very low	26.3	Very low	117 Å²	117	148.2 Å²	148.2	72%	0.718	77%	0.765	S	S	*	*			trans	-71	120	162.9	38.7	0	0	0	0	107.9	T848	T848-T850 PolarHBondContact O-N 2.91Å
851	S	24.2	Very low	26.5	Very low	108 Å²	108	149.3 Å²	149.3	76%	0.755	77%	0.765	S	S	*	*			trans	-49	148.8	171	60.4	0	0	0	0	112.3
852	P	25.1	Very low	26.2	Very low	114 Å²	114	149 Å²	149	74%	0.74	77%	0.767	S	S	*	*			trans	-136.8	82.8	137.2	33.4	-16.6	0	0	0	110.6	L854	P852-L854 PolarHBondContact O-N 3.39Å
853	N	25	Very low	26.2	Very low	132 Å²	132	147.6 Å²	147.6	71%	0.706	76%	0.761	S	S	*	*			trans	-76.3	80.6	144.8	-82.4	-15.9	0	0	0	106.2
854	L	25.8	Very low	26.3	Very low	149 Å²	149	145.7 Å²	145.7	78%	0.78	76%	0.76	S	S	*	*			trans	173.2	104.1	165	-99.7	144.9	0	0	0	107.9	P852	P852-L854 PolarHBondContact O-N 3.39Å
855	L	25.1	Very low	26.5	Very low	156 Å²	156	143 Å²	143	82%	0.817	76%	0.757	S	S	*	*			trans	164.1	83.7	133.5	-86.8	155.6	0	0	0	109.4
856	H	25.4	Very low	26.6	Very low	175 Å²	175	142.2 Å²	142.2	81%	0.81	77%	0.765	S	S	*	*			trans	-64.8	149	137.4	-112.6	0.2	0	0	0	107.9
857	D	26.1	Very low	26.5	Very low	126 Å²	126	149.5 Å²	149.5	67%	0.674	78%	0.779	S	S	*	*			trans	69.3	108.5	176.4	-54.8	-31.1	0	0	0	114.2
858	T	30	Very low	26.6	Very low	139 Å²	139	144.2 Å²	144.2	85%	0.853	78%	0.78	S	S	*	*				-177.7	145.9	68.8	29.5	0	0	0	0	109.5
859	R	25.4	Very low	26.6	Very low	226 Å²	226	150.7 Å²	150.7	85%	0.853	79%	0.793	S	S	*	*			trans	-71.1	153	168	-72.7	172.5	162.9	119.3	-6	110.4
860	N	26.5	Very low	26.7	Very low	144 Å²	144	152.1 Å²	152.1	77%	0.77	80%	0.798	S	S	*	*			trans	87.2	144.4	157.4	-53.3	-27.3	0	0	0	117.6
861	L	28.6	Very low	26.7	Very low	166 Å²	166	154.5 Å²	154.5	87%	0.869	80%	0.801	S	S	*	*			trans	88.3	89.1	174.1	-53.6	157.7	0	0	0	112.8
862	L	24.3	Very low	26.7	Very low	144 Å²	144	155.1 Å²	155.1	75%	0.754	80%	0.801	S	S	*	*			cis	50.4	114.4	49.8	-83	-177.6	0	0	0	114.8
863	F	26.9	Very low	26.8	Very low	176 Å²	176	161.4 Å²	161.4	77%	0.772	81%	0.81	S	S	*	*			trans	66.2	108.1	161.2	-69.2	-80.4	0	0	0	118.7
864	D	29.2	Very low	26.8	Very low	152 Å²	152	164.6 Å²	164.6	81%	0.813	82%	0.817	S	S	*	*				161.8	133.6	97.1	-97.8	-23.3	0	0	0	112
865	Q	29.3	Very low	26.8	Very low	169 Å²	169	165.7 Å²	165.7	79%	0.79	82%	0.82	S	S	*	*			trans	-84.7	154.6	157.9	-84.4	-173.6	-7.9	0	0	108.4
866	P	30.8	Very low	26.8	Very low	130 Å²	130	165.5 Å²	165.5	84%	0.844	82%	0.82	S	S	*	*				-149.9	167.7	98.9	32.2	-11.3	0	0	0	116.8
867	R	24.1	Very low	27.1	Very low	239 Å²	239	164.2 Å²	164.2	90%	0.902	82%	0.818	S	S	*	*			trans	-63	149	-179.9	-62.3	164.2	177	169.1	-2.3	113.7
868	G	29.5	Very low	27	Very low	85 Å²	85	164.8 Å²	164.8	88%	0.876	82%	0.821	S	S	*	*			trans	-157.8	131.5	163.8	0	0	0	0	0	111
869	R	23.4	Very low	26.9	Very low	238 Å²	238	163.3 Å²	163.3	90%	0.898	82%	0.816	S	S	*	*			trans	-119.4	130.5	-162.5	-174.7	-171.6	-166.3	-178.5	3.2	108.8
870	S	29.7	Very low	27	Very low	110 Å²	110	163.5 Å²	163.5	77%	0.769	82%	0.817	S	S	*	*			trans	-174.7	101.6	156	56.1	0	0	0	0	108.4
871	E	25.9	Very low	27.1	Very low	167 Å²	167	164.5 Å²	164.5	78%	0.78	82%	0.822	S	S	*	*				73.9	111.5	88.3	-82.1	-172.6	177.4	0	0	116.1
872	T	25.1	Very low	27	Very low	121 Å²	121	164.6 Å²	164.6	74%	0.742	82%	0.823	S	S	*	*			trans	69.6	112	140.2	62.9	0	0	0	0	120
873	R	26.8	Very low	27.1	Very low	246 Å²	246	161 Å²	161	93%	0.928	82%	0.82	S	S	*	*				-165	113	112.2	-99.6	175.9	-151.7	-164	6.3	110.2
874	K	24.2	Very low	27.1	Very low	198 Å²	198	160.2 Å²	160.2	86%	0.861	82%	0.823	S	S	*	*			trans	-73.3	133.8	158.7	-77	178.9	172.5	-179.2	0	108
875	M	27.1	Very low	27	Very low	172 Å²	172	159 Å²	159	85%	0.847	82%	0.824	S	S	*	*			trans	-136.5	104.5	155.8	-105.8	-176.3	160.7	0	0	107.8
876	D	25.5	Very low	27	Very low	152 Å²	152	158.1 Å²	158.1	81%	0.813	82%	0.824	S	S	*	*			trans	-66.9	123.8	156.8	-69.9	-47.8	0	0	0	108.1
877	I	30.5	Very low	27	Very low	149 Å²	149	158.4 Å²	158.4	76%	0.764	82%	0.819	S	S	*	*			trans	-139.4	113.4	155.1	-61.6	-175.7	0	0	0	109.5
878	N	25.2	Very low	27.3	Very low	138 Å²	138	154 Å²	154	74%	0.738	81%	0.811	S	S	*	*			trans	-48.3	149.8	167.8	-71.4	-43.1	0	0	0	114.6
879	S	28	Very low	27.2	Very low	108 Å²	108	154.7 Å²	154.7	76%	0.755	80%	0.801	S	S	*	*			trans	41	92.7	138.8	68.6	0	0	0	0	117.1
880	R	27.1	Very low	27.5	Very low	229 Å²	229	150.4 Å²	150.4	86%	0.864	80%	0.801	S	S	*	*			trans	-141.5	106.4	147.7	-73.5	-164.8	175.5	162.9	-1.2	110.8	L882	R880-L882 PolarHBondContact O-N 3.13Å
881	N	27.2	Very low	27.3	Very low	166 Å²	166	155.6 Å²	155.6	89%	0.888	80%	0.804	S	S	*	*			trans	-32.2	119.5	149.3	-65.7	-37.4	0	0	0	110.2
882	L	27.4	Very low	27.2	Very low	168 Å²	168	153.2 Å²	153.2	88%	0.88	80%	0.804	S	S	*	*			trans	-103.8	100.9	156.5	-113.8	87.4	0	0	0	107	R880	R880-L882 PolarHBondContact O-N 3.13Å
883	G	26.2	Very low	27.2	Very low	68 Å²	68	156.1 Å²	156.1	70%	0.701	81%	0.811	S	S	*	*			trans	-60.4	137.5	174.2	0	0	0	0	0	111.1
884	L	26.5	Very low	27.1	Very low	160 Å²	160	151.7 Å²	151.7	84%	0.838	81%	0.806	S	S	*	*			trans	-59.2	134.2	161.2	-77.5	106.2	0	0	0	109.1	N886	L884-N886 PolarHBondContact O-N 2.99Å; L884-N886 VanDerWaalsContact O-N 3.14Å
885	P	28.7	Very low	27.1	Very low	126 Å²	126	149 Å²	149	82%	0.818	81%	0.811	S	S	*	*			trans	-72.7	108	165.1	29.2	-27.3	0	0	0	108	N887	P885-N887 PolarHBondContact O-N 3.37Å
886	N	27.9	Very low	27.1	Very low	150 Å²	150	145.1 Å²	145.1	80%	0.802	80%	0.8	S	S	*	*			trans	-55.1	114.7	153.6	-84.1	-21.6	0	0	0	107.8	L884	L884-N886 PolarHBondContact O-N 2.99Å; L884-N886 VanDerWaalsContact O-N 3.14Å
887	N	30.4	Very low	27.3	Very low	136 Å²	136	142.7 Å²	142.7	73%	0.727	79%	0.793	S	S	*	*			trans	-167.4	103	147.7	-96.3	-19.1	0	0	0	112.4	P885	P885-N887 PolarHBondContact O-N 3.37Å
888	I	30.7	Very low	27.6	Very low	146 Å²	146	140.1 Å²	140.1	75%	0.749	78%	0.78	S	S	*	*				71.2	143.9	128	-54.7	160.7	0	0	0	118.2
889	P	27.6	Very low	28.3	Very low	100 Å²	100	142.2 Å²	142.2	65%	0.649	78%	0.777	S	S	*	*			cis	-125.6	151.7	-13.8	27.1	-7.2	0	0	0	114.7	R891	P889-R891 PolarHBondContact O-N 3.43Å
890	V	30.1	Very low	28.5	Very low	149 Å²	149	142.4 Å²	142.4	90%	0.903	77%	0.774	S	S	*	*			trans	-56.8	112.4	147.4	174.6	0	0	0	0	108.5
891	R	25.1	Very low	28.6	Very low	219 Å²	219	137.1 Å²	137.1	83%	0.826	77%	0.77	S	S	*	*			trans	-154	126.1	161.4	-105.7	176.3	-171.1	-179.7	1.7	110.8	P889	P889-R891 PolarHBondContact O-N 3.43Å
892	C	24.9	Very low	28.9	Very low	117 Å²	117	134.5 Å²	134.5	79%	0.791	76%	0.764	S	S	*	*			trans	74.9	100.5	170.2	-56.9	0	0	0	0	114.6
893	M	24.5	Very low	29.8	Very low	182 Å²	182	135.4 Å²	135.4	90%	0.897	76%	0.763	S	S	*	*				33.4	85	57	-86.5	-170.6	-177.8	0	0	111.3
894	N	24.5	Very low	30.9	Very low	152 Å²	152	134.6 Å²	134.6	81%	0.813	75%	0.747	S	S	*	*			trans	-167.1	116.2	133.8	-91.9	-15.1	0	0	0	109.7	S896	N894-S896 PolarHBondContact O-N 3.39Å
895	C	24.7	Very low	32.4	Very low	142 Å²	142	130.9 Å²	130.9	96%	0.959	74%	0.735	S	S	*	*			trans	-48.2	116	165.7	-73	0	0	0	0	110.3
896	S	26.2	Very low	34.8	Very low	90 Å²	90	128.8 Å²	128.8	63%	0.629	71%	0.714	S	S	*	*			trans	-145.7	128.9	160.1	52.1	0	0	0	0	109.1	N894 I898	N894-S896 PolarHBondContact O-N 3.39Å; S896-I898 PolarHBondContact O-N 3.34Å
897	P	30.7	Very low	37.3	Very low	101 Å²	101	122.1 Å²	122.1	66%	0.656	68%	0.678	S	S	*	*			trans	-74.3	126.1	-179.5	29.8	-30.1	0	0	0	108.8	R899 L934	P897-R899 PolarHBondContact O-N 3.01Å; P897-L934 HydrophobicContact CB-CD2 4.09Å
898	I	37	Very low	39.8	Very low	96 Å²	96	115.7 Å²	115.7	49%	0.492	64%	0.644	S	S	.	*			trans	-75.7	90	-164.4	-65.5	169.4	0	0	0	110.7	S896 T900	S896-I898 PolarHBondContact O-N 3.34Å; I898-T900 VanDerWaalsContact C-N 3.31Å; I898-T900 HydrophobicContact CG2-CG2 3.64Å; I898-T900 WeakPolarHBondContact CG2-OG1 3.37Å
899	R	38.7	Very low	42.3	Very low	181 Å²	181	114.7 Å²	114.7	68%	0.683	63%	0.631	S	S	*	*			trans	-88.6	71.9	140.1	-78.2	-176.5	179.1	-179	1.2	107.5	P897 P901 N935	P897-R899 PolarHBondContact O-N 3.01Å; R899-P901 VanDerWaalsContact O-CD 3.26Å; R899-P901 WeakPolarHBondContact O-CD 3.38Å; R899-N935 PolarHBondContact NH2-O 3.25Å
900	T	32.6	Very low	44.7	Very low	112 Å²	112	111 Å²	111	69%	0.687	61%	0.606	S	S	*	*			trans	-66	117.9	163.8	37	0	0	0	0	107.7	I898	I898-T900 VanDerWaalsContact C-N 3.31Å; I898-T900 HydrophobicContact CG2-CG2 3.64Å; I898-T900 WeakPolarHBondContact CG2-OG1 3.37Å
901	P	28.6	Very low	47	Very low	119 Å²	119	104 Å²	104	77%	0.773	56%	0.564	S	S	*	*			trans	-85.2	117.9	178.5	32.7	-25.9	0	0	0	108.3	R899	R899-P901 VanDerWaalsContact O-CD 3.26Å; R899-P901 WeakPolarHBondContact O-CD 3.38Å
902	S	34.5	Very low	49.8	Very low	110 Å²	110	93.6 Å²	93.6	77%	0.769	53%	0.525	S	S	*	.			trans	174.5	138.4	143	40	0	0	0	0	109.6	S904	S902-S904 PolarHBondContact O-N 3.44Å
903	H	45.1	Very low	52.8	Low	187 Å²	187	88 Å²	88	87%	0.866	49%	0.487	S	S	*	.			trans	-45.8	100.9	172.3	-72	-110.2	0	0	0	111.1	S905	H903-S905 PolarHBondContact O-N 3.2Å
904	S	49.4	Very low	55.8	Low	52 Å²	52	80.8 Å²	80.8	36%	0.364	45%	0.451	S	S	.	.			trans	-70.9	91.6	162.3	59.6	0	0	0	0	106.5	S902 Q906	S902-S904 PolarHBondContact O-N 3.44Å; S904-Q906 PolarHBondContact O-N 2.99Å
905	S	59.3	Low	58.8	Low	82 Å²	82	74.5 Å²	74.5	57%	0.573	42%	0.416	S	S	*	.			trans	-69.7	11.5	175.5	56.4	0	0	0	0	113.3	H903	H903-S905 PolarHBondContact O-N 3.2Å
906	Q	77.4	Confident	61.9	Low	82 Å²	82	68.5 Å²	68.5	38%	0.383	38%	0.375	S	S	.	.			trans	-77.5	132.3	-177.5	-66.1	-174.9	-6.2	0	0	110	S904 W915	S904-Q906 PolarHBondContact O-N 2.99Å; Q906-W915 HydrophobicContact CB-CE3 4.4Å; Q906-W915 PolarHBondContact O-N 3.48Å
907	V	80.6	Confident	64.7	Low	9 Å²	9	68.1 Å²	68.1	6%	0.055	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-113.2	156.7	179.7	-139.4	0	0	0	0	107.8	F913 H965	V907-F913 CarbonylContact C-O 3.6Å; V907-F913 WeakPolarHBondContact CA-O 3.27Å; V907-F913 WeakPolarHBondContact CG1-O 3.26Å; V907-H965 HydrophobicContact CG1-CB 3.77Å
908	D	84.7	Confident	67.4	Low	2 Å²	2	67.9 Å²	67.9	1%	0.011	36%	0.364	C	S	.	.	B	Isolated β-bridge	trans	-66.1	171.9	172.2	79.8	-59.8	0	0	0	111.3	T910 G911 S912 F913 W915 L1146 Q1147	D908-T910 VanDerWaalsContact CG-OG1 3.28Å; D908-T910 PolarHBondContact O-N 3.32Å; D908-T910 VanDerWaalsContact O-N 3.16Å; D908-T910 PolarHBondContact OD1-OG1 3.48Å; D908-T910 VanDerWaalsContact OD2-CB 3.26Å; D908-T910 WeakPolarHBondContact OD2-CB 3.48Å; D908-T910 WeakPolarHBondContact OD2-CG2 3.31Å; D908-T910 PolarHBondContact OD2-N 3.04Å; D908-T910 PolarHBondContact OD2-OG1 3.49Å; D908-G911 PolarHBondContact O-N 2.99Å; D908-G911 PolarHBondContact OD1-N 3.32Å; D908-G911 VanDerWaalsContact OD1-N 3.11Å; D908-S912 PolarHBondContact OD1-N 2.96Å; D908-F913 PolarHBondContact N-O 3.17Å; D908-F913 PolarHBondContact OD1-N 3.21Å; D908-W915 HydrophobicContact CB-CB 4.3Å; D908-L1146 HydrophobicContact CB-CD2 4.29Å; D908-Q1147 CarbonylContact C-O 3.07Å; D908-Q1147 WeakPolarHBondContact CA-O 3.43Å
909	R	82	Confident	69.8	Low	125 Å²	125	65.5 Å²	65.5	47%	0.472	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-33.9	177.4	179.9	177.6	176.6	164.7	0.8	113.6	G911 Q1147	R909-G911 VanDerWaalsContact C-N 3.33Å; R909-Q1147 HydrophobicContact CB-CB 4.19Å; R909-Q1147 PolarHBondContact N-O 2.87Å
910	T	78.8	Confident	72.1	Confident	22 Å²	22	60.3 Å²	60.3	14%	0.135	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-22.4	178.2	74	0	0	0	0	112.4	D908 S912 S1132 M1157	D908-T910 VanDerWaalsContact CG-OG1 3.28Å; D908-T910 PolarHBondContact O-N 3.32Å; D908-T910 VanDerWaalsContact O-N 3.16Å; D908-T910 PolarHBondContact OD1-OG1 3.48Å; D908-T910 VanDerWaalsContact OD2-CB 3.26Å; D908-T910 WeakPolarHBondContact OD2-CB 3.48Å; D908-T910 WeakPolarHBondContact OD2-CG2 3.31Å; D908-T910 PolarHBondContact OD2-N 3.04Å; D908-T910 PolarHBondContact OD2-OG1 3.49Å; T910-S912 WeakPolarHBondContact OG1-CB 3.35Å; T910-S912 PolarHBondContact OG1-N 2.86Å; T910-S912 PolarHBondContact OG1-OG 3.45Å; T910-S912 VanDerWaalsContact OG1-OG 3.12Å; T910-S1132 WeakPolarHBondContact CB-OG 3.29Å; T910-S1132 PolarHBondContact OG1-OG 3.11Å; T910-M1157 WeakPolarHBondContact O-CE 3.42Å
911	G	78.8	Confident	74.7	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.01	32%	0.321	C	S	.	.	S	Bend	trans	78	20.9	-174.5	0	0	0	0	0	113.2	D908 R909 H965 M1157	D908-G911 PolarHBondContact O-N 2.99Å; D908-G911 PolarHBondContact OD1-N 3.32Å; D908-G911 VanDerWaalsContact OD1-N 3.11Å; R909-G911 VanDerWaalsContact C-N 3.33Å; G911-H965 PolarHBondContact O-CD2 2.85Å; G911-M1157 PolarHBondContact O-N 2.82Å
912	S	82.3	Confident	77.4	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.007	32%	0.318	C	S	.	.	S	Bend	trans	-96.8	-40.6	179.4	-62.4	0	0	0	0	112.5	D908 T910 F964 H965 S1132 M1157	D908-S912 PolarHBondContact OD1-N 2.96Å; T910-S912 WeakPolarHBondContact OG1-CB 3.35Å; T910-S912 PolarHBondContact OG1-N 2.86Å; T910-S912 PolarHBondContact OG1-OG 3.45Å; T910-S912 VanDerWaalsContact OG1-OG 3.12Å; S912-F964 CarbonylContact O-C 3.59Å; S912-F964 WeakPolarHBondContact O-CA 3.48Å; S912-H965 PolarHBondContact O-N 2.93Å; S912-S1132 PolarHBondContact OG-OG 2.95Å; S912-M1157 WeakPolarHBondContact OG-CE 3.38Å
913	F	88.3	Confident	79.8	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-119.9	149.3	-167.5	-57.6	-78	0	0	0	112.4	V907 D908 M960 R963 F964 S1129 L1136 L1146	V907-F913 CarbonylContact C-O 3.6Å; V907-F913 WeakPolarHBondContact CA-O 3.27Å; V907-F913 WeakPolarHBondContact CG1-O 3.26Å; D908-F913 PolarHBondContact N-O 3.17Å; D908-F913 PolarHBondContact OD1-N 3.21Å; F913-M960 WeakPolarHBondContact CD1-O 3.35Å; F913-M960 HydrophobicContact CE1-CB 4.06Å; F913-M960 HydrophobicContact CE1-CG 4.46Å; F913-M960 VanDerWaalsContact CE1-O 3.3Å; F913-M960 WeakPolarHBondContact CE1-O 3.39Å; F913-M960 HydrophobicContact CZ-CB 4.44Å; F913-M960 HydrophobicContact CZ-SD 4.41Å; F913-R963 WeakPolarHBondContact CA-O 3.41Å; F913-F964 AromaticContact CD1-CD1 3.92Å; F913-F964 HydrophobicContact CD1-CD1 3.92Å; F913-F964 HydrophobicContact CD1-CE1 4.19Å; F913-F964 AromaticContact CE1-CD1 3.6Å; F913-F964 HydrophobicContact CE1-CD1 3.6Å; F913-F964 AromaticContact CE1-CE1 3.4Å; F913-F964 HydrophobicContact CE1-CE1 3.4Å; F913-F964 VanDerWaalsContact CE1-CE1 3.4Å; F913-F964 HydrophobicContact CE1-CG 4.3Å; F913-F964 AromaticContact CE1-CZ 3.99Å; F913-F964 HydrophobicContact CE1-CZ 3.99Å; F913-F964 HydrophobicContact CZ-CD1 4.22Å; F913-F964 AromaticContact CZ-CE1 3.67Å; F913-F964 HydrophobicContact CZ-CE1 3.67Å; F913-F964 HydrophobicContact CZ-CZ 4.3Å; F913-S1129 WeakPolarHBondContact CZ-O 3.27Å; F913-L1136 HydrophobicContact CE2-CD1 4.19Å; F913-L1136 HydrophobicContact CE2-CD2 3.84Å; F913-L1136 HydrophobicContact CZ-CD2 4.28Å; F913-L1146 HydrophobicContact CD2-CD2 4.19Å
914	H	88.1	Confident	81.8	Confident	31 Å²	31	50.1 Å²	50.1	14%	0.144	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-63.5	135.5	166.9	-68.9	-76.4	0	0	0	110	R963 F964 H965 Q967 V969 P993	H914-R963 PolarHBondContact CD2-O 2.94Å; H914-R963 PolarHBondContact N-O 3.04Å; H914-F964 PolarHBondContact CD2-O 3.09Å; H914-F964 PolarHBondContact NE2-O 2.98Å; H914-H965 PolarHBondContact CE1-O 3.37Å; H914-H965 VanDerWaalsContact CE1-O 3.24Å; H914-H965 WeakPolarHBondContact NE2-CA 3.2Å; H914-H965 PolarHBondContact NE2-O 2.73Å; H914-Q967 PolarHBondContact NE2-O 3.43Å; H914-Q967 VanDerWaalsContact NE2-O 3.16Å; H914-V969 VanDerWaalsContact CD2-CG2 3.44Å; H914-V969 WeakPolarHBondContact CD2-CG2 3.23Å; H914-P993 HydrophobicContact CB-CG 3.84Å
915	W	88.1	Confident	83.6	Confident	19 Å²	19	49.7 Å²	49.7	7%	0.072	26%	0.263	C	S	.	.			trans	-124.9	143	-176.9	-178	88.9	0	0	0	111.6	Q906 D908 P917 L1146 Q1148	Q906-W915 HydrophobicContact CB-CE3 4.4Å; Q906-W915 PolarHBondContact O-N 3.48Å; D908-W915 HydrophobicContact CB-CB 4.3Å; W915-P917 HydrophobicContact CH2-CB 4.42Å; W915-P917 HydrophobicContact CH2-CG 4.17Å; W915-P917 HydrophobicContact CZ3-CG 4.11Å; W915-L1146 PolarHBondContact NE1-O 2.68Å; W915-Q1148 HydrophobicContact CD2-CB 4.35Å; W915-Q1148 HydrophobicContact CE3-CB 4.33Å; W915-Q1148 HydrophobicContact CE3-CG 4.01Å; W915-Q1148 HydrophobicContact CH2-CB 3.65Å; W915-Q1148 HydrophobicContact CH2-CG 3.71Å; W915-Q1148 HydrophobicContact CZ2-CB 3.67Å; W915-Q1148 HydrophobicContact CZ2-CG 4.23Å; W915-Q1148 HydrophobicContact CZ3-CB 3.99Å; W915-Q1148 HydrophobicContact CZ3-CG 3.59Å
916	V	88	Confident	85.1	Confident	17 Å²	17	46.9 Å²	46.9	10%	0.103	24%	0.241	C	C	.	.			trans	-132.8	153.9	171.6	-67.3	0	0	0	0	111.5	I919 N991 P993	V916-I919 HydrophobicContact CG2-CD1 3.92Å; V916-I919 HydrophobicContact CG2-CG1 4.39Å; V916-N991 WeakPolarHBondContact CG2-O 3.46Å; V916-N991 PolarHBondContact N-O 3.02Å; V916-N991 WeakPolarHBondContact O-CA 3.27Å; V916-N991 PolarHBondContact O-ND2 3.25Å; V916-N991 VanDerWaalsContact O-ND2 3.16Å; V916-P993 HydrophobicContact CG1-CB 3.79Å; V916-P993 HydrophobicContact CG1-CG 4.46Å
917	P	86.7	Confident	85.7	Confident	81 Å²	81	45.1 Å²	45.1	53%	0.526	24%	0.238	S	C	.	.			trans	-57.8	156.6	168.7	-21.7	32.6	0	0	0	112	W915 I919	W915-P917 HydrophobicContact CH2-CB 4.42Å; W915-P917 HydrophobicContact CH2-CG 4.17Å; W915-P917 HydrophobicContact CZ3-CG 4.11Å; P917-I919 PolarHBondContact O-N 3.34Å; P917-I919 VanDerWaalsContact O-N 3.13Å
918	D	86.7	Confident	86.1	Confident	96 Å²	96	46 Å²	46	51%	0.513	24%	0.244	S	C	.	.			trans	-51	115.4	-177	-72.8	4.8	0	0	0	112.9	K990 N991	D918-K990 HydrophobicContact CB-CD 4.22Å; D918-K990 WeakPolarHBondContact OD1-CE 3.49Å; D918-K990 IonicContact OD1-NZ 2.74Å; D918-K990 PolarHBondContact OD1-NZ 3.39Å; D918-K990 WeakPolarHBondContact OD2-CE 3.49Å; D918-K990 IonicContact OD2-NZ 2.77Å; D918-K990 PolarHBondContact OD2-NZ 2.75Å; D918-N991 PolarHBondContact OD1-ND2 3.22Å
919	I	87	Confident	86.3	Confident	46 Å²	46	52.7 Å²	52.7	24%	0.236	28%	0.28	C	S	.	.			trans	-92.5	124.7	174.4	-57.3	175.1	0	0	0	109	V916 P917 R923 W986 K990	V916-I919 HydrophobicContact CG2-CD1 3.92Å; V916-I919 HydrophobicContact CG2-CG1 4.39Å; P917-I919 PolarHBondContact O-N 3.34Å; P917-I919 VanDerWaalsContact O-N 3.13Å; I919-R923 HydrophobicContact CG2-CB 4.23Å; I919-R923 HydrophobicContact CG2-CG 4.47Å; I919-W986 HydrophobicContact CB-CZ2 4.36Å; I919-W986 HydrophobicContact CG2-CZ2 4.28Å; I919-W986 PolarHBondContact O-NE1 3.08Å; I919-K990 PolarHBondContact N-O 3.49Å
920	P	87.7	Confident	86.7	Confident	72 Å²	72	51.4 Å²	51.4	47%	0.468	28%	0.279	S	S	.	.			trans	-67.7	143.3	174.7	28.2	-33.6	0	0	0	111.1	T922 R923	P920-T922 VanDerWaalsContact C-N 3.26Å; P920-T922 PolarHBondContact O-N 3.22Å; P920-R923 HydrophobicContact CG-CB 4.07Å; P920-R923 WeakPolarHBondContact O-CB 3.18Å; P920-R923 PolarHBondContact O-N 3.43Å
921	L	85.9	Confident	87.2	Confident	50 Å²	50	50.4 Å²	50.4	26%	0.262	27%	0.273	S	S	.	.	H	α-helix	trans	-54	-41.8	-176.9	177.8	60.8	0	0	0	112.5	R923 A924 T925 W986 I997	L921-R923 PolarHBondContact O-N 3.05Å; L921-A924 PolarHBondContact O-N 3.35Å; L921-T925 HydrophobicContact CD1-CG2 3.78Å; L921-T925 HydrophobicContact CG-CG2 3.95Å; L921-T925 WeakPolarHBondContact O-CG2 3.27Å; L921-T925 PolarHBondContact O-N 3.23Å; L921-T925 PolarHBondContact O-OG1 2.82Å; L921-W986 HydrophobicContact CB-CG 4.05Å; L921-W986 HydrophobicContact CD1-CB 4.03Å; L921-W986 HydrophobicContact CD1-CD2 3.71Å; L921-W986 HydrophobicContact CD1-CE3 4.02Å; L921-W986 HydrophobicContact CD1-CG 3.69Å; L921-W986 HydrophobicContact CG-CG 4.38Å; L921-I997 HydrophobicContact CD1-CD1 3.81Å
922	T	85.8	Confident	87.7	Confident	116 Å²	116	52.7 Å²	52.7	71%	0.712	29%	0.292	S	S	*	.	H	α-helix	trans	-57.5	-24	179.9	53.3	0	0	0	0	114.2	P920 T925	P920-T922 VanDerWaalsContact C-N 3.26Å; P920-T922 PolarHBondContact O-N 3.22Å; T922-T925 WeakPolarHBondContact CA-OG1 3.38Å; T922-T925 PolarHBondContact O-OG1 3.5Å
923	R	86.3	Confident	88	Confident	144 Å²	144	56.8 Å²	56.8	54%	0.543	32%	0.321	S	S	.	.	H	α-helix	trans	-85.7	-22.2	178.1	-174.2	172.8	176.2	177.7	-3	112.7	I919 P920 L921	I919-R923 HydrophobicContact CG2-CB 4.23Å; I919-R923 HydrophobicContact CG2-CG 4.47Å; P920-R923 HydrophobicContact CG-CB 4.07Å; P920-R923 WeakPolarHBondContact O-CB 3.18Å; P920-R923 PolarHBondContact O-N 3.43Å; L921-R923 PolarHBondContact O-N 3.05Å
924	A	85.9	Confident	87.9	Confident	4 Å²	4	58.4 Å²	58.4	3%	0.033	33%	0.329	C	S	.	.	H	α-helix	trans	-92.5	-26.9	178.3	0	0	0	0	0	112.4	L921 W986 I997	L921-A924 PolarHBondContact O-N 3.35Å; A924-W986 HydrophobicContact CB-CH2 3.18Å; A924-W986 HydrophobicContact CB-CZ2 3.38Å; A924-W986 HydrophobicContact CB-CZ3 3.95Å; A924-I997 PolarHBondContact O-N 3.05Å
925	T	88.4	Confident	87.7	Confident	43 Å²	43	61.4 Å²	61.4	26%	0.264	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	129.5	176.2	53	0	0	0	0	111.6	L921 T922 I997	L921-T925 HydrophobicContact CD1-CG2 3.78Å; L921-T925 HydrophobicContact CG-CG2 3.95Å; L921-T925 WeakPolarHBondContact O-CG2 3.27Å; L921-T925 PolarHBondContact O-N 3.23Å; L921-T925 PolarHBondContact O-OG1 2.82Å; T922-T925 WeakPolarHBondContact CA-OG1 3.38Å; T922-T925 PolarHBondContact O-OG1 3.5Å; T925-I997 CarbonylContact C-O 3.52Å; T925-I997 VanDerWaalsContact CA-O 3.32Å; T925-I997 WeakPolarHBondContact CA-O 3.23Å; T925-I997 HydrophobicContact CG2-CB 4.33Å; T925-I997 HydrophobicContact CG2-CG2 4.41Å
926	L	90.2	Very high	87.7	Confident	23 Å²	23	60.8 Å²	60.8	12%	0.12	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145.1	-179.6	-60.4	171.1	0	0	0	109.3	Q930 L934 F936 F996 I997 V998 D999	L926-Q930 HydrophobicContact CB-CB 4.37Å; L926-Q930 HydrophobicContact CD2-CB 4.35Å; L926-L934 HydrophobicContact CD1-CD1 3.48Å; L926-L934 VanDerWaalsContact CD1-CD1 3.48Å; L926-L934 HydrophobicContact CD2-CD1 4.07Å; L926-L934 HydrophobicContact CG-CD1 4.44Å; L926-F936 HydrophobicContact CD1-CZ 4.1Å; L926-F996 HydrophobicContact CD1-CB 4.03Å; L926-F996 HydrophobicContact CD1-CD1 3.88Å; L926-F996 HydrophobicContact CD1-CG 4.28Å; L926-I997 PolarHBondContact N-O 3.26Å; L926-V998 HydrophobicContact CB-CG2 4.37Å; L926-V998 WeakPolarHBondContact O-CA 3.39Å; L926-D999 PolarHBondContact O-N 2.81Å; L926-D999 VanDerWaalsContact O-N 3.09Å
927	S	89.8	Confident	87.6	Confident	45 Å²	45	63.2 Å²	63.2	32%	0.315	36%	0.362	S	S	.	.			trans	-78.7	157.9	164.7	67.5	0	0	0	0	110.9	N929 Q930 A931	S927-N929 PolarHBondContact O-N 3.19Å; S927-Q930 CarbonylContact O-C 3.59Å; S927-Q930 WeakPolarHBondContact O-CA 3.33Å; S927-Q930 WeakPolarHBondContact O-CB 3.39Å; S927-Q930 PolarHBondContact O-N 2.88Å; S927-Q930 VanDerWaalsContact OG-CG 3.29Å; S927-Q930 WeakPolarHBondContact OG-CG 3.13Å; S927-Q930 PolarHBondContact OG-N 2.97Å; S927-A931 PolarHBondContact O-N 3.42Å
928	P	88.8	Confident	87.5	Confident	29 Å²	29	68.3 Å²	68.3	19%	0.188	37%	0.371	C	S	.	.	H	α-helix	trans	-54.1	-38.3	178	-28.2	36.1	0	0	0	112.8	Q930 A931 A932 V998 D999 S1010	P928-Q930 PolarHBondContact O-N 3.2Å; P928-A931 WeakPolarHBondContact O-CB 3.23Å; P928-A931 PolarHBondContact O-N 3.42Å; P928-A932 PolarHBondContact O-N 3.46Å; P928-V998 HydrophobicContact CG-CG1 4.36Å; P928-D999 VanDerWaalsContact CD-O 3.27Å; P928-D999 WeakPolarHBondContact CD-O 3.31Å; P928-D999 VanDerWaalsContact CG-O 3.31Å; P928-D999 WeakPolarHBondContact CG-O 3.46Å; P928-S1010 WeakPolarHBondContact O-CB 3.44Å
929	N	89.7	Confident	87.8	Confident	142 Å²	142	63.7 Å²	63.7	76%	0.759	35%	0.346	S	S	*	.	H	α-helix	trans	-66.6	-37	176.1	-66.3	-22.8	0	0	0	112.8	S927 S933	S927-N929 PolarHBondContact O-N 3.19Å; N929-S933 PolarHBondContact O-N 3.04Å
930	Q	90.6	Very high	88.2	Confident	98 Å²	98	61.7 Å²	61.7	46%	0.458	34%	0.335	S	S	.	.	H	α-helix	trans	-70.3	-39.1	174.2	-70.6	170.7	2.3	0	0	111	L926 S927 P928 A932 S933 L934	L926-Q930 HydrophobicContact CB-CB 4.37Å; L926-Q930 HydrophobicContact CD2-CB 4.35Å; S927-Q930 CarbonylContact O-C 3.59Å; S927-Q930 WeakPolarHBondContact O-CA 3.33Å; S927-Q930 WeakPolarHBondContact O-CB 3.39Å; S927-Q930 PolarHBondContact O-N 2.88Å; S927-Q930 VanDerWaalsContact OG-CG 3.29Å; S927-Q930 WeakPolarHBondContact OG-CG 3.13Å; S927-Q930 PolarHBondContact OG-N 2.97Å; P928-Q930 PolarHBondContact O-N 3.2Å; Q930-A932 VanDerWaalsContact C-N 3.34Å; Q930-A932 PolarHBondContact O-N 2.81Å; Q930-S933 WeakPolarHBondContact O-CB 3.38Å; Q930-S933 PolarHBondContact O-N 3.33Å; Q930-S933 PolarHBondContact O-OG 2.94Å; Q930-L934 PolarHBondContact O-N 2.69Å
931	A	89.1	Confident	88.5	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.2	-43.7	174.7	0	0	0	0	0	111.4	S927 P928 S933 L934 F936 V998 S1010	S927-A931 PolarHBondContact O-N 3.42Å; P928-A931 WeakPolarHBondContact O-CB 3.23Å; P928-A931 PolarHBondContact O-N 3.42Å; A931-S933 PolarHBondContact O-N 3.01Å; A931-L934 CarbonylContact O-C 3.53Å; A931-L934 WeakPolarHBondContact O-CA 3.33Å; A931-L934 WeakPolarHBondContact O-CB 3.31Å; A931-L934 PolarHBondContact O-N 3.26Å; A931-F936 HydrophobicContact CB-CE2 4.21Å; A931-V998 HydrophobicContact CB-CG1 4.06Å; A931-V998 HydrophobicContact CB-CG2 3.78Å; A931-S1010 CarbonylContact C-O 3.53Å
932	A	89.1	Confident	88.9	Confident	49 Å²	49	56 Å²	56	41%	0.405	30%	0.302	S	S	.	.	H	α-helix	trans	-62.1	-28.6	176.4	0	0	0	0	0	113.5	P928 Q930 L934 S1010	P928-A932 PolarHBondContact O-N 3.46Å; Q930-A932 VanDerWaalsContact C-N 3.34Å; Q930-A932 PolarHBondContact O-N 2.81Å; A932-L934 VanDerWaalsContact C-N 3.28Å; A932-S1010 WeakPolarHBondContact CA-O 3.35Å; A932-S1010 PolarHBondContact N-O 3.44Å
933	S	88.8	Confident	89.2	Confident	88 Å²	88	50.5 Å²	50.5	62%	0.615	27%	0.268	S	S	*	.	H	α-helix	trans	-74.5	-21	174.4	79.2	0	0	0	0	112.9	N929 Q930 A931	N929-S933 PolarHBondContact O-N 3.04Å; Q930-S933 WeakPolarHBondContact O-CB 3.38Å; Q930-S933 PolarHBondContact O-N 3.33Å; Q930-S933 PolarHBondContact O-OG 2.94Å; A931-S933 PolarHBondContact O-N 3.01Å
934	L	84.8	Confident	89.3	Confident	34 Å²	34	43.8 Å²	43.8	18%	0.178	24%	0.243	C	C	.	.	S	Bend	trans	-92.3	107.7	177.9	-67.2	172.2	0	0	0	109.4	P897 L926 Q930 A931 A932 F936	P897-L934 HydrophobicContact CB-CD2 4.09Å; L926-L934 HydrophobicContact CD1-CD1 3.48Å; L926-L934 VanDerWaalsContact CD1-CD1 3.48Å; L926-L934 HydrophobicContact CD2-CD1 4.07Å; L926-L934 HydrophobicContact CG-CD1 4.44Å; Q930-L934 PolarHBondContact O-N 2.69Å; A931-L934 CarbonylContact O-C 3.53Å; A931-L934 WeakPolarHBondContact O-CA 3.33Å; A931-L934 WeakPolarHBondContact O-CB 3.31Å; A931-L934 PolarHBondContact O-N 3.26Å; A932-L934 VanDerWaalsContact C-N 3.28Å; L934-F936 VanDerWaalsContact C-N 3.3Å; L934-F936 HydrophobicContact CB-CD2 4.33Å; L934-F936 HydrophobicContact CB-CE1 4.29Å; L934-F936 HydrophobicContact CB-CE2 3.83Å; L934-F936 HydrophobicContact CB-CZ 3.81Å; L934-F936 HydrophobicContact CD1-CE2 4.47Å; L934-F936 HydrophobicContact CD1-CZ 3.86Å; L934-F936 VanDerWaalsContact O-CD2 3.26Å; L934-F936 WeakPolarHBondContact O-CD2 3.21Å; L934-F936 PolarHBondContact O-N 3.27Å
935	N	85.2	Confident	89.2	Confident	93 Å²	93	43.6 Å²	43.6	50%	0.497	24%	0.242	S	C	.	.			trans	-70.7	82.6	179.4	-171.4	-4.9	0	0	0	111.7	R899 S937	R899-N935 PolarHBondContact NH2-O 3.25Å; N935-S937 PolarHBondContact O-N 2.96Å
936	F	87.2	Confident	88.5	Confident	6 Å²	6	42.6 Å²	42.6	3%	0.026	24%	0.239	C	C	.	.			trans	-74.8	116.1	175.6	-61.9	-67.3	0	0	0	110.8	L926 A931 L934 H939 D971 V973 F996 Q1015	L926-F936 HydrophobicContact CD1-CZ 4.1Å; A931-F936 HydrophobicContact CB-CE2 4.21Å; L934-F936 VanDerWaalsContact C-N 3.3Å; L934-F936 HydrophobicContact CB-CD2 4.33Å; L934-F936 HydrophobicContact CB-CE1 4.29Å; L934-F936 HydrophobicContact CB-CE2 3.83Å; L934-F936 HydrophobicContact CB-CZ 3.81Å; L934-F936 HydrophobicContact CD1-CE2 4.47Å; L934-F936 HydrophobicContact CD1-CZ 3.86Å; L934-F936 VanDerWaalsContact O-CD2 3.26Å; L934-F936 WeakPolarHBondContact O-CD2 3.21Å; L934-F936 PolarHBondContact O-N 3.27Å; F936-H939 HydrophobicContact CB-CB 4.4Å; F936-H939 WeakPolarHBondContact CB-ND1 3.36Å; F936-H939 PolarHBondContact O-ND1 3.42Å; F936-D971 HydrophobicContact CD1-CB 4.34Å; F936-V973 HydrophobicContact CD1-CG2 3.84Å; F936-V973 HydrophobicContact CD2-CG2 4.21Å; F936-V973 HydrophobicContact CE1-CG2 3.81Å; F936-V973 HydrophobicContact CE2-CG2 4.18Å; F936-V973 HydrophobicContact CG-CG2 4.05Å; F936-V973 HydrophobicContact CZ-CG2 3.98Å; F936-F996 AromaticContact CE1-CD2 3.78Å; F936-F996 HydrophobicContact CE1-CD2 3.78Å; F936-F996 HydrophobicContact CE1-CE2 4.07Å; F936-F996 HydrophobicContact CE1-CG 4.09Å; F936-F996 HydrophobicContact CZ-CB 4.41Å; F936-F996 HydrophobicContact CZ-CD2 4.38Å; F936-F996 HydrophobicContact CZ-CG 4.24Å; F936-Q1015 PolarHBondContact O-OE1 3.33Å
937	S	85.5	Confident	87.4	Confident	69 Å²	69	48.5 Å²	48.5	48%	0.483	26%	0.264	S	S	.	.			trans	-126.2	136.5	176.5	57.2	0	0	0	0	111.2	N935 H939	N935-S937 PolarHBondContact O-N 2.96Å; S937-H939 PolarHBondContact O-N 3.41Å
938	R	85.9	Confident	86	Confident	187 Å²	187	47.9 Å²	47.9	71%	0.706	26%	0.26	S	S	*	.	S	Bend	trans	53.3	35.1	-178	-56.8	-179.8	178	162.5	0.7	113.3	Q1015	R938-Q1015 WeakPolarHBondContact CA-O 3.36Å; R938-Q1015 PolarHBondContact N-O 3.27Å
939	H	92.3	Very high	84.3	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.278	C	S	.	.			trans	-85.9	169.4	178	68.9	-85.4	0	0	0	111.1	F936 S937 D971 V1011 H1012 C1016 N1017	F936-H939 HydrophobicContact CB-CB 4.4Å; F936-H939 WeakPolarHBondContact CB-ND1 3.36Å; F936-H939 PolarHBondContact O-ND1 3.42Å; S937-H939 PolarHBondContact O-N 3.41Å; H939-D971 CarbonylContact C-O 3.59Å; H939-D971 WeakPolarHBondContact CA-O 3.46Å; H939-D971 HydrophobicContact CB-CB 3.84Å; H939-D971 WeakPolarHBondContact CB-O 3.28Å; H939-V1011 PolarHBondContact CE1-O 2.91Å; H939-V1011 PolarHBondContact NE2-O 3.49Å; H939-H1012 PolarHBondContact CE1-O 2.82Å; H939-C1016 WeakPolarHBondContact NE2-CB 3.4Å; H939-C1016 WeakPolarHBondContact O-CA 3.44Å; H939-N1017 PolarHBondContact O-N 3.29Å
940	F	94.6	Very high	82.5	Confident	3 Å²	3	48.7 Å²	48.7	1%	0.013	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	128.2	169.3	-59.7	-50.2	0	0	0	109.3	C666 L667 L962 R970 D971 I972 V973 N1017 A1018	C666-F940 HydrophobicContact CB-CD1 3.82Å; C666-F940 HydrophobicContact CB-CE1 3.77Å; C666-F940 HydrophobicContact CB-CG 4.31Å; C666-F940 HydrophobicContact CB-CZ 4.21Å; C666-F940 VanDerWaalsContact O-CE1 3.26Å; C666-F940 WeakPolarHBondContact O-CE1 3.23Å; L667-F940 HydrophobicContact CD2-CZ 4.08Å; F940-L962 HydrophobicContact CD2-CD1 4.08Å; F940-L962 HydrophobicContact CE2-CD1 4.38Å; F940-L962 HydrophobicContact CE2-CD2 4.11Å; F940-R970 HydrophobicContact CD2-CB 4.23Å; F940-R970 HydrophobicContact CE2-CB 4Å; F940-R970 HydrophobicContact CE2-CG 4.37Å; F940-D971 PolarHBondContact N-O 3.36Å; F940-I972 HydrophobicContact CB-CG1 4.25Å; F940-I972 HydrophobicContact CD2-CG1 4.09Å; F940-I972 WeakPolarHBondContact O-CA 3.4Å; F940-V973 PolarHBondContact O-N 2.9Å; F940-N1017 HydrophobicContact CD1-CB 4.41Å; F940-N1017 HydrophobicContact CE1-CB 4.26Å; F940-A1018 HydrophobicContact CD1-CB 4.19Å
941	L	94.6	Very high	81.2	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	126.6	178.5	179	58.4	0	0	0	109.6	V973 L975 V1011 L1013 C1016 A1018 C1019 V1020	L941-V973 CarbonylContact C-O 3.48Å; L941-V973 WeakPolarHBondContact CA-O 3.32Å; L941-V973 HydrophobicContact CD1-CB 4.41Å; L941-L975 HydrophobicContact CD1-CB 4.2Å; L941-V1011 HydrophobicContact CD1-CB 4.39Å; L941-V1011 HydrophobicContact CD1-CG1 3.53Å; L941-L1013 HydrophobicContact CD2-CB 4.44Å; L941-L1013 HydrophobicContact CD2-CD1 3.58Å; L941-C1016 HydrophobicContact CB-CB 4.24Å; L941-A1018 PolarHBondContact N-O 3.31Å; L941-C1019 HydrophobicContact CB-CB 4.46Å; L941-C1019 CarbonylContact O-C 3.47Å; L941-C1019 WeakPolarHBondContact O-CA 3.38Å; L941-V1020 PolarHBondContact O-N 2.9Å
942	V	93.6	Very high	80.2	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	108.6	174.3	-176.7	0	0	0	0	108.1	F958 I972 V973 I974 L975 V1020 L1022	V942-F958 HydrophobicContact CG2-CD1 4.24Å; V942-F958 HydrophobicContact CG2-CE1 3.48Å; V942-F958 VanDerWaalsContact CG2-CE1 3.48Å; V942-F958 HydrophobicContact CG2-CZ 3.99Å; V942-I972 HydrophobicContact CG2-CG2 4.3Å; V942-V973 PolarHBondContact N-O 3.42Å; V942-I974 HydrophobicContact CB-CG1 4.32Å; V942-I974 HydrophobicContact CB-CG2 4.44Å; V942-I974 CarbonylContact O-C 3.59Å; V942-I974 WeakPolarHBondContact O-CA 3.48Å; V942-L975 PolarHBondContact O-N 3.44Å; V942-V1020 CarbonylContact C-O 3.54Å; V942-V1020 WeakPolarHBondContact CA-O 3.45Å; V942-L1022 HydrophobicContact CG1-CD1 3.89Å; V942-L1022 HydrophobicContact CG1-CG 4.3Å
943	C	92.7	Very high	79.4	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	119.6	176.6	-65.5	0	0	0	0	109.3	P1002 V1020 V1021 L1022	C943-P1002 HydrophobicContact CB-CB 3.78Å; C943-V1020 PolarHBondContact N-O 3.16Å; C943-V1021 HydrophobicContact CB-CG2 4.28Å; C943-V1021 WeakPolarHBondContact O-CA 3.26Å; C943-L1022 PolarHBondContact O-N 3.42Å
944	V	89.3	Confident	78.9	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.018	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	97.8	175.7	-177.7	0	0	0	0	107.9	L953 I974 L975 L980 P1002 Y1024	V944-L953 HydrophobicContact CG1-CD1 4.16Å; V944-L953 HydrophobicContact CG1-CD2 4.2Å; V944-L953 HydrophobicContact CG2-CD1 4.34Å; V944-I974 HydrophobicContact CG2-CG2 3.98Å; V944-L975 PolarHBondContact N-O 3.02Å; V944-L980 HydrophobicContact CG1-CD1 4.39Å; V944-P1002 WeakPolarHBondContact O-CG 3.31Å; V944-Y1024 HydrophobicContact CG1-CD2 3.85Å; V944-Y1024 HydrophobicContact CG1-CE2 4Å
945	A	83.6	Confident	79	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.008	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	121	-175.5	0	0	0	0	0	111	P1002 V1021 L1022 Y1024 V1042 C1046	A945-P1002 HydrophobicContact CB-CG 4.3Å; A945-V1021 HydrophobicContact CB-CG1 4.17Å; A945-L1022 PolarHBondContact N-O 3.07Å; A945-Y1024 PolarHBondContact O-N 2.86Å; A945-V1042 HydrophobicContact CB-CG1 4.38Å; A945-C1046 HydrophobicContact CB-CB 4.04Å
946	G	73.8	Confident	79	Confident	21 Å²	21	35.4 Å²	35.4	22%	0.216	20%	0.195	C	C	.	.	S	Bend	trans	110.7	171.1	178.9	0	0	0	0	0	113.5	L980	G946-L980 WeakPolarHBondContact O-CD1 3.42Å
947	K	65.6	Low	79.1	Confident	147 Å²	147	35.3 Å²	35.3	64%	0.639	20%	0.195	S	C	*	.			trans	-100.9	112.1	175.4	-66.2	-179.3	178.4	-179.5	0	109	T949 A1026	K947-T949 PolarHBondContact O-N 3.01Å; K947-A1026 HydrophobicContact CB-CB 4.18Å; K947-A1026 WeakPolarHBondContact O-CB 3.48Å
948	S	60.6	Low	79.4	Confident	32 Å²	32	32 Å²	32	22%	0.224	17%	0.172	C	C	.	.			trans	-71.3	109.5	170	-171.6	0	0	0	0	109.3	G951 L980	S948-G951 PolarHBondContact OG-O 3.04Å; S948-L980 VanDerWaalsContact CB-CD2 3.48Å
949	T	53.4	Low	79.6	Confident	93 Å²	93	23.2 Å²	23.2	57%	0.571	14%	0.138	S	C	*	.			trans	-85.3	-20.9	166	48.7	0	0	0	0	111.7	K947	K947-T949 PolarHBondContact O-N 3.01Å
950	N	52.7	Low	79.5	Confident	96 Å²	96	23.4 Å²	23.4	51%	0.513	14%	0.139	S	C	.	.	S	Bend	trans	-145.7	108	-169.1	-73.6	-37.4	0	0	0	113
951	G	62.6	Low	79.3	Confident	36 Å²	36	23.2 Å²	23.2	37%	0.371	14%	0.139	S	C	.	.	S	Bend	trans	103.9	151.8	163.9	0	0	0	0	0	116.1	S948	S948-G951 PolarHBondContact OG-O 3.04Å
952	P	68.4	Low	79.2	Confident	36 Å²	36	23.3 Å²	23.3	23%	0.234	14%	0.139	C	C	.	.			trans	-70.9	144.1	178.1	29.7	-34.3	0	0	0	111.9	Y630 N954	Y630-P952 HydrophobicContact CE1-CG 4.41Å; P952-N954 PolarHBondContact O-N 3.19Å; P952-N954 PolarHBondContact O-ND2 3.16Å
953	L	72	Confident	79	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.005	14%	0.139	C	C	.	.			trans	-70.1	-23.2	-179.9	-52.3	170	0	0	0	112.2	V944 L955 I981 E985 Y1024	V944-L953 HydrophobicContact CG1-CD1 4.16Å; V944-L953 HydrophobicContact CG1-CD2 4.2Å; V944-L953 HydrophobicContact CG2-CD1 4.34Å; L953-L955 VanDerWaalsContact C-N 3.28Å; L953-L955 HydrophobicContact CB-CD1 4.44Å; L953-L955 HydrophobicContact CB-CD2 4.39Å; L953-L955 HydrophobicContact CB-CG 3.9Å; L953-L955 HydrophobicContact CD1-CD1 4.04Å; L953-L955 HydrophobicContact CD1-CG 4.39Å; L953-L955 PolarHBondContact O-N 3.22Å; L953-I981 HydrophobicContact CD1-CG1 3.96Å; L953-E985 WeakPolarHBondContact CB-OE2 3.3Å; L953-E985 PolarHBondContact N-OE2 3.25Å; L953-Y1024 HydrophobicContact CD2-CD1 4.06Å; L953-Y1024 HydrophobicContact CD2-CD2 3.87Å; L953-Y1024 HydrophobicContact CD2-CE1 3.56Å; L953-Y1024 HydrophobicContact CD2-CE2 3.36Å; L953-Y1024 HydrophobicContact CD2-CG 4.2Å; L953-Y1024 WeakPolarHBondContact CD2-OH 3.48Å
954	N	78.8	Confident	78.8	Confident	3 Å²	3	23.3 Å²	23.3	2%	0.016	14%	0.139	C	C	.	.			trans	54.7	38.3	-176.4	-55.8	-69.7	0	0	0	114.1	Y630 L659 P952 E956 N957 E985	Y630-N954 WeakPolarHBondContact CD1-ND2 3.2Å; Y630-N954 WeakPolarHBondContact CE1-ND2 3.38Å; L659-N954 HydrophobicContact CD1-CB 4.38Å; L659-N954 VanDerWaalsContact CD1-O 3.25Å; L659-N954 WeakPolarHBondContact CD1-O 3.46Å; P952-N954 PolarHBondContact O-N 3.19Å; P952-N954 PolarHBondContact O-ND2 3.16Å; N954-E956 PolarHBondContact O-N 3.41Å; N954-N957 PolarHBondContact O-N 3.05Å; N954-E985 WeakPolarHBondContact CA-OE1 3.43Å; N954-E985 PolarHBondContact N-OE1 2.95Å
955	L	86.4	Confident	78.6	Confident	1 Å²	1	24.1 Å²	24.1	1%	0.005	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-19.8	174.7	-65.1	175.6	0	0	0	113	L953 N957 F958 I959 I974 I981 E985 L989 L1022	L953-L955 VanDerWaalsContact C-N 3.28Å; L953-L955 HydrophobicContact CB-CD1 4.44Å; L953-L955 HydrophobicContact CB-CD2 4.39Å; L953-L955 HydrophobicContact CB-CG 3.9Å; L953-L955 HydrophobicContact CD1-CD1 4.04Å; L953-L955 HydrophobicContact CD1-CG 4.39Å; L953-L955 PolarHBondContact O-N 3.22Å; L955-N957 PolarHBondContact O-N 2.95Å; L955-F958 WeakPolarHBondContact O-CB 2.92Å; L955-F958 PolarHBondContact O-N 3.39Å; L955-I959 HydrophobicContact CB-CD1 4.28Å; L955-I959 VanDerWaalsContact O-CG1 3.32Å; L955-I959 WeakPolarHBondContact O-CG1 3.38Å; L955-I959 PolarHBondContact O-N 3.49Å; L955-I974 HydrophobicContact CD1-CD1 3.96Å; L955-I974 HydrophobicContact CD1-CG2 4.38Å; L955-I981 HydrophobicContact CD1-CG1 4.45Å; L955-E985 VanDerWaalsContact CB-OE1 3.3Å; L955-E985 WeakPolarHBondContact CB-OE1 2.9Å; L955-E985 WeakPolarHBondContact CG-OE1 3.45Å; L955-E985 PolarHBondContact N-OE1 3.4Å; L955-L989 HydrophobicContact CB-CD1 4.34Å; L955-L1022 HydrophobicContact CD2-CD1 3.74Å
956	E	86.1	Confident	78.6	Confident	5 Å²	5	25.4 Å²	25.4	2%	0.023	15%	0.147	C	C	.	.	H	α-helix	trans	-47.3	-47.3	168.6	-163.5	-166.8	168.4	0	0	112.4	N954 F958 I959 M960 K988 L989 F1140	N954-E956 PolarHBondContact O-N 3.41Å; E956-F958 VanDerWaalsContact C-N 3.27Å; E956-F958 PolarHBondContact O-N 2.79Å; E956-I959 PolarHBondContact O-N 2.82Å; E956-M960 HydrophobicContact CB-CE 4.43Å; E956-M960 HydrophobicContact CG-CE 3.62Å; E956-M960 WeakPolarHBondContact O-CB 3.41Å; E956-M960 VanDerWaalsContact O-CG 3.32Å; E956-M960 WeakPolarHBondContact O-CG 3.44Å; E956-M960 PolarHBondContact O-N 3.35Å; E956-K988 HydrophobicContact CB-CB 4.41Å; E956-K988 HydrophobicContact CG-CB 4.14Å; E956-K988 VanDerWaalsContact OE2-CD 3.29Å; E956-K988 WeakPolarHBondContact OE2-CD 3.31Å; E956-K988 IonicContact OE2-NZ 3.69Å; E956-L989 HydrophobicContact CB-CD2 4.21Å; E956-F1140 WeakPolarHBondContact OE1-CE1 3.49Å; E956-F1140 WeakPolarHBondContact OE1-CZ 3.24Å
957	N	87.8	Confident	79.1	Confident	5 Å²	5	25.1 Å²	25.1	3%	0.027	14%	0.14	C	C	.	.	H	α-helix	trans	-68.7	-26.6	-179.8	-65.5	-29.7	0	0	0	112.7	L659 N954 L955 P961	L659-N957 HydrophobicContact CB-CB 4Å; L659-N957 HydrophobicContact CD1-CB 4.17Å; N954-N957 PolarHBondContact O-N 3.05Å; L955-N957 PolarHBondContact O-N 2.95Å; N957-P961 WeakPolarHBondContact O-CD 3.33Å
958	F	91.7	Very high	80	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-79.2	-40.2	175.2	-178	-95.6	0	0	0	111.8	L659 M662 A663 V942 L955 E956 L962 V1020	L659-F958 HydrophobicContact CB-CB 3.99Å; L659-F958 HydrophobicContact CD2-CB 4.48Å; L659-F958 WeakPolarHBondContact O-CD2 3.46Å; M662-F958 HydrophobicContact CB-CD2 4.37Å; M662-F958 HydrophobicContact CB-CE2 4.17Å; A663-F958 HydrophobicContact CB-CD2 3.89Å; A663-F958 HydrophobicContact CB-CE2 4.05Å; A663-F958 HydrophobicContact CB-CG 4.3Å; A663-F958 WeakPolarHBondContact CB-O 3.21Å; V942-F958 HydrophobicContact CG2-CD1 4.24Å; V942-F958 HydrophobicContact CG2-CE1 3.48Å; V942-F958 VanDerWaalsContact CG2-CE1 3.48Å; V942-F958 HydrophobicContact CG2-CZ 3.99Å; L955-F958 WeakPolarHBondContact O-CB 2.92Å; L955-F958 PolarHBondContact O-N 3.39Å; E956-F958 VanDerWaalsContact C-N 3.27Å; E956-F958 PolarHBondContact O-N 2.79Å; F958-L962 HydrophobicContact CD1-CD1 4.35Å; F958-L962 HydrophobicContact CE1-CD1 3.89Å; F958-L962 HydrophobicContact CZ-CD1 4.42Å; F958-V1020 HydrophobicContact CE2-CB 4.47Å; F958-V1020 HydrophobicContact CE2-CG1 4.18Å; F958-V1020 HydrophobicContact CE2-CG2 4.12Å; F958-V1020 HydrophobicContact CZ-CB 4.23Å; F958-V1020 HydrophobicContact CZ-CG1 4.41Å; F958-V1020 HydrophobicContact CZ-CG2 3.84Å
959	I	92.1	Very high	81.2	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-81.9	-34.1	-172.5	-64.5	173.4	0	0	0	111.4	L955 E956 L962 R963 I972 I974 L989 L992 I995	L955-I959 HydrophobicContact CB-CD1 4.28Å; L955-I959 VanDerWaalsContact O-CG1 3.32Å; L955-I959 WeakPolarHBondContact O-CG1 3.38Å; L955-I959 PolarHBondContact O-N 3.49Å; E956-I959 PolarHBondContact O-N 2.82Å; I959-L962 WeakPolarHBondContact O-CB 3.31Å; I959-L962 PolarHBondContact O-N 3.49Å; I959-R963 HydrophobicContact CG2-CG 3.91Å; I959-R963 WeakPolarHBondContact O-CG 3.3Å; I959-R963 PolarHBondContact O-N 3.4Å; I959-I972 HydrophobicContact CB-CD1 4.5Å; I959-I972 HydrophobicContact CG1-CD1 4.18Å; I959-I972 HydrophobicContact CG2-CD1 3.91Å; I959-I974 HydrophobicContact CD1-CD1 4.37Å; I959-L989 HydrophobicContact CB-CD2 4.44Å; I959-L989 HydrophobicContact CD1-CD1 3.97Å; I959-L989 HydrophobicContact CD1-CD2 3.79Å; I959-L992 HydrophobicContact CB-CD1 4.5Å; I959-L992 HydrophobicContact CG2-CD1 3.78Å; I959-I995 HydrophobicContact CD1-CD1 4.15Å; I959-I995 HydrophobicContact CG2-CD1 3.99Å
960	M	88.8	Confident	82.9	Confident	4 Å²	4	26.4 Å²	26.4	2%	0.02	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-51.5	-51.7	-179.4	-85.9	-166.2	-91.9	0	0	113.2	F913 E956 L962 R963 L1136	F913-M960 WeakPolarHBondContact CD1-O 3.35Å; F913-M960 HydrophobicContact CE1-CB 4.06Å; F913-M960 HydrophobicContact CE1-CG 4.46Å; F913-M960 VanDerWaalsContact CE1-O 3.3Å; F913-M960 WeakPolarHBondContact CE1-O 3.39Å; F913-M960 HydrophobicContact CZ-CB 4.44Å; F913-M960 HydrophobicContact CZ-SD 4.41Å; E956-M960 HydrophobicContact CB-CE 4.43Å; E956-M960 HydrophobicContact CG-CE 3.62Å; E956-M960 WeakPolarHBondContact O-CB 3.41Å; E956-M960 VanDerWaalsContact O-CG 3.32Å; E956-M960 WeakPolarHBondContact O-CG 3.44Å; E956-M960 PolarHBondContact O-N 3.35Å; M960-L962 PolarHBondContact O-N 2.81Å; M960-L962 VanDerWaalsContact O-N 3.11Å; M960-R963 PolarHBondContact O-N 3.03Å; M960-L1136 HydrophobicContact SD-CD2 4.14Å
961	P	90.1	Very high	84.8	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-62	-20.8	179	-22.4	31.9	0	0	0	114.9	A663 Y664 N957 R963 F964 Q967 I1128	A663-P961 HydrophobicContact CB-CB 4.16Å; A663-P961 HydrophobicContact CB-CG 4.16Å; Y664-P961 HydrophobicContact CE2-CB 4.23Å; N957-P961 WeakPolarHBondContact O-CD 3.33Å; P961-R963 VanDerWaalsContact C-N 3.35Å; P961-F964 HydrophobicContact CB-CE2 4.32Å; P961-F964 VanDerWaalsContact O-CD2 3.24Å; P961-F964 WeakPolarHBondContact O-CD2 3.23Å; P961-Q967 PolarHBondContact O-NE2 3.02Å; P961-Q967 PolarHBondContact O-OE1 3.26Å; P961-I1128 HydrophobicContact CG-CG2 4.02Å
962	L	92.1	Very high	86.3	Confident	2 Å²	2	21 Å²	21	1%	0.01	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-89	-1.4	178.2	-60.2	177.4	0	0	0	113.1	A663 C666 L667 F940 F958 I959 M960 Q967 I972	A663-L962 HydrophobicContact CB-CD2 4.47Å; A663-L962 HydrophobicContact CB-CG 4.2Å; A663-L962 WeakPolarHBondContact O-CD2 3.41Å; C666-L962 HydrophobicContact CB-CD2 4.26Å; L667-L962 HydrophobicContact CD1-CD2 4.1Å; L667-L962 HydrophobicContact CD2-CD2 3.82Å; L667-L962 HydrophobicContact CG-CD2 3.71Å; F940-L962 HydrophobicContact CD2-CD1 4.08Å; F940-L962 HydrophobicContact CE2-CD1 4.38Å; F940-L962 HydrophobicContact CE2-CD2 4.11Å; F958-L962 HydrophobicContact CD1-CD1 4.35Å; F958-L962 HydrophobicContact CE1-CD1 3.89Å; F958-L962 HydrophobicContact CZ-CD1 4.42Å; I959-L962 WeakPolarHBondContact O-CB 3.31Å; I959-L962 PolarHBondContact O-N 3.49Å; M960-L962 PolarHBondContact O-N 2.81Å; M960-L962 VanDerWaalsContact O-N 3.11Å; L962-Q967 VanDerWaalsContact CA-OE1 3.3Å; L962-I972 HydrophobicContact CB-CD1 4.3Å; L962-I972 HydrophobicContact CD1-CD1 3.87Å
963	R	91.1	Very high	87.5	Confident	1 Å²	1	19.2 Å²	19.2	0%	0.004	8%	0.08	C	C	.	.			trans	-125.2	16	-173.5	-67.7	-65.6	-177.4	-90.5	5.1	113.4	F913 H914 I959 M960 P961 R970 I972 L992 P993 R994	F913-R963 WeakPolarHBondContact CA-O 3.41Å; H914-R963 PolarHBondContact CD2-O 2.94Å; H914-R963 PolarHBondContact N-O 3.04Å; I959-R963 HydrophobicContact CG2-CG 3.91Å; I959-R963 WeakPolarHBondContact O-CG 3.3Å; I959-R963 PolarHBondContact O-N 3.4Å; M960-R963 PolarHBondContact O-N 3.03Å; P961-R963 VanDerWaalsContact C-N 3.35Å; R963-R970 PolarHBondContact NH1-O 2.65Å; R963-R970 PolarHBondContact NH2-O 3.3Å; R963-I972 VanDerWaalsContact CZ-CD1 3.46Å; R963-I972 VanDerWaalsContact NH1-CD1 3.35Å; R963-I972 VanDerWaalsContact NH2-CD1 3.34Å; R963-L992 HydrophobicContact CB-CD2 4.05Å; R963-L992 HydrophobicContact CG-CD2 4.28Å; R963-P993 PolarHBondContact NE-O 3.38Å; R963-P993 PolarHBondContact NH2-O 3.08Å; R963-P993 VanDerWaalsContact NH2-O 3.15Å; R963-R994 PolarHBondContact NH2-O 3.39Å; R963-R994 VanDerWaalsContact NH2-O 3.09Å
964	F	88.6	Confident	88.5	Confident	1 Å²	1	19.2 Å²	19.2	0%	0.004	8%	0.08	C	C	.	.	B	Isolated β-bridge	trans	-55.4	144.7	167	-74.7	-61.2	0	0	0	111.5	S912 F913 H914 P961 W966 Q967 I1128	S912-F964 CarbonylContact O-C 3.59Å; S912-F964 WeakPolarHBondContact O-CA 3.48Å; F913-F964 AromaticContact CD1-CD1 3.92Å; F913-F964 HydrophobicContact CD1-CD1 3.92Å; F913-F964 HydrophobicContact CD1-CE1 4.19Å; F913-F964 AromaticContact CE1-CD1 3.6Å; F913-F964 HydrophobicContact CE1-CD1 3.6Å; F913-F964 AromaticContact CE1-CE1 3.4Å; F913-F964 HydrophobicContact CE1-CE1 3.4Å; F913-F964 VanDerWaalsContact CE1-CE1 3.4Å; F913-F964 HydrophobicContact CE1-CG 4.3Å; F913-F964 AromaticContact CE1-CZ 3.99Å; F913-F964 HydrophobicContact CE1-CZ 3.99Å; F913-F964 HydrophobicContact CZ-CD1 4.22Å; F913-F964 AromaticContact CZ-CE1 3.67Å; F913-F964 HydrophobicContact CZ-CE1 3.67Å; F913-F964 HydrophobicContact CZ-CZ 4.3Å; H914-F964 PolarHBondContact CD2-O 3.09Å; H914-F964 PolarHBondContact NE2-O 2.98Å; P961-F964 HydrophobicContact CB-CE2 4.32Å; P961-F964 VanDerWaalsContact O-CD2 3.24Å; P961-F964 WeakPolarHBondContact O-CD2 3.23Å; F964-W966 HydrophobicContact CB-CD2 3.94Å; F964-W966 HydrophobicContact CB-CG 4.39Å; F964-W966 HydrophobicContact CB-CH2 4.22Å; F964-W966 HydrophobicContact CB-CZ2 3.68Å; F964-W966 AromaticContact CD1-CH2 3.47Å; F964-W966 HydrophobicContact CD1-CH2 3.47Å; F964-W966 VanDerWaalsContact CD1-CH2 3.47Å; F964-W966 AromaticContact CD1-CZ2 3.42Å; F964-W966 HydrophobicContact CD1-CZ2 3.42Å; F964-W966 VanDerWaalsContact CD1-CZ2 3.42Å; F964-W966 HydrophobicContact CD1-CZ3 4.31Å; F964-W966 AromaticContact CD2-CZ2 3.86Å; F964-W966 HydrophobicContact CD2-CZ2 3.86Å; F964-W966 AromaticContact CE1-CH2 3.95Å; F964-W966 HydrophobicContact CE1-CH2 3.95Å; F964-W966 AromaticContact CE1-CZ2 3.95Å; F964-W966 HydrophobicContact CE1-CZ2 3.95Å; F964-W966 HydrophobicContact CE2-CZ2 4.31Å; F964-W966 AromaticContact CG-CE2 3.75Å; F964-W966 AromaticContact CG-CH2 3.91Å; F964-W966 HydrophobicContact CG-CH2 3.91Å; F964-W966 AromaticContact CG-CZ2 3.38Å; F964-W966 HydrophobicContact CG-CZ2 3.38Å; F964-W966 HydrophobicContact CZ-CZ2 4.36Å; F964-W966 PolarHBondContact O-N 3.11Å; F964-Q967 HydrophobicContact CB-CB 4.46Å; F964-Q967 HydrophobicContact CB-CG 4.08Å; F964-Q967 WeakPolarHBondContact O-CB 3.46Å; F964-Q967 PolarHBondContact O-N 3.38Å; F964-I1128 VanDerWaalsContact CZ-O 3.32Å; F964-I1128 WeakPolarHBondContact CZ-O 3.2Å
965	H	84.3	Confident	89.1	Confident	21 Å²	21	19.1 Å²	19.1	10%	0.097	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-33.3	-174.1	80.4	80	0	0	0	113	V907 G911 S912 H914 Q967 M1157	V907-H965 HydrophobicContact CG1-CB 3.77Å; G911-H965 PolarHBondContact O-CD2 2.85Å; S912-H965 PolarHBondContact O-N 2.93Å; H914-H965 PolarHBondContact CE1-O 3.37Å; H914-H965 VanDerWaalsContact CE1-O 3.24Å; H914-H965 WeakPolarHBondContact NE2-CA 3.2Å; H914-H965 PolarHBondContact NE2-O 2.73Å; H965-Q967 VanDerWaalsContact C-N 3.3Å; H965-Q967 PolarHBondContact O-N 3.19Å; H965-M1157 PolarHBondContact NE2-O 3.33Å
966	W	83.2	Confident	89.1	Confident	28 Å²	28	19 Å²	19	11%	0.106	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-11.6	176.8	56.6	84.2	0	0	0	113.9	F964 V1160 I1237	F964-W966 HydrophobicContact CB-CD2 3.94Å; F964-W966 HydrophobicContact CB-CG 4.39Å; F964-W966 HydrophobicContact CB-CH2 4.22Å; F964-W966 HydrophobicContact CB-CZ2 3.68Å; F964-W966 AromaticContact CD1-CH2 3.47Å; F964-W966 HydrophobicContact CD1-CH2 3.47Å; F964-W966 VanDerWaalsContact CD1-CH2 3.47Å; F964-W966 AromaticContact CD1-CZ2 3.42Å; F964-W966 HydrophobicContact CD1-CZ2 3.42Å; F964-W966 VanDerWaalsContact CD1-CZ2 3.42Å; F964-W966 HydrophobicContact CD1-CZ3 4.31Å; F964-W966 AromaticContact CD2-CZ2 3.86Å; F964-W966 HydrophobicContact CD2-CZ2 3.86Å; F964-W966 AromaticContact CE1-CH2 3.95Å; F964-W966 HydrophobicContact CE1-CH2 3.95Å; F964-W966 AromaticContact CE1-CZ2 3.95Å; F964-W966 HydrophobicContact CE1-CZ2 3.95Å; F964-W966 HydrophobicContact CE2-CZ2 4.31Å; F964-W966 AromaticContact CG-CE2 3.75Å; F964-W966 AromaticContact CG-CH2 3.91Å; F964-W966 HydrophobicContact CG-CH2 3.91Å; F964-W966 AromaticContact CG-CZ2 3.38Å; F964-W966 HydrophobicContact CG-CZ2 3.38Å; F964-W966 HydrophobicContact CZ-CZ2 4.36Å; F964-W966 PolarHBondContact O-N 3.11Å; W966-V1160 PolarHBondContact NE1-O 2.79Å; W966-I1237 HydrophobicContact CB-CB 4.24Å; W966-I1237 HydrophobicContact CB-CD1 4.09Å; W966-I1237 HydrophobicContact CB-CG1 3.74Å; W966-I1237 HydrophobicContact CB-CG2 3.66Å; W966-I1237 HydrophobicContact CD2-CD1 4.1Å; W966-I1237 HydrophobicContact CD2-CG1 4.37Å; W966-I1237 HydrophobicContact CE3-CD1 3.79Å; W966-I1237 HydrophobicContact CG-CD1 4.23Å; W966-I1237 HydrophobicContact CG-CG1 4.03Å
967	Q	84.5	Confident	88.7	Confident	14 Å²	14	21.5 Å²	21.5	7%	0.065	9%	0.092	C	C	.	.	S	Bend	trans	-88.2	141.4	175.8	-67.9	-173.6	10.1	0	0	110.9	L667 H914 P961 L962 F964 H965 V969	L667-Q967 VanDerWaalsContact CD1-NE2 3.35Å; H914-Q967 PolarHBondContact NE2-O 3.43Å; H914-Q967 VanDerWaalsContact NE2-O 3.16Å; P961-Q967 PolarHBondContact O-NE2 3.02Å; P961-Q967 PolarHBondContact O-OE1 3.26Å; L962-Q967 VanDerWaalsContact CA-OE1 3.3Å; F964-Q967 HydrophobicContact CB-CB 4.46Å; F964-Q967 HydrophobicContact CB-CG 4.08Å; F964-Q967 WeakPolarHBondContact O-CB 3.46Å; F964-Q967 PolarHBondContact O-N 3.38Å; H965-Q967 VanDerWaalsContact C-N 3.3Å; H965-Q967 PolarHBondContact O-N 3.19Å; Q967-V969 PolarHBondContact O-N 3.34Å
968	R	83.8	Confident	88	Confident	194 Å²	194	22.6 Å²	22.6	73%	0.732	10%	0.1	S	C	*	.			trans	-68.8	119.1	174.1	179.3	178.4	175.4	168.5	2.1	109.4	R970	R968-R970 PolarHBondContact O-N 2.96Å; R968-R970 VanDerWaalsContact O-N 3.15Å
969	V	85.9	Confident	87	Confident	28 Å²	28	30 Å²	30	17%	0.17	13%	0.134	C	C	.	.			trans	-64.4	114	176.5	-170.8	0	0	0	0	110.3	H914 Q967 P993 R994	H914-V969 VanDerWaalsContact CD2-CG2 3.44Å; H914-V969 WeakPolarHBondContact CD2-CG2 3.23Å; Q967-V969 PolarHBondContact O-N 3.34Å; V969-P993 HydrophobicContact CG1-CB 4.35Å; V969-P993 HydrophobicContact CG1-CG 4.03Å; V969-P993 HydrophobicContact CG2-CG 4.44Å; V969-R994 HydrophobicContact CG1-CB 4.22Å; V969-R994 HydrophobicContact CG1-CG 4.33Å; V969-R994 PolarHBondContact O-NH1 3.16Å
970	R	90	Very high	85.6	Confident	77 Å²	77	31.2 Å²	31.2	29%	0.291	14%	0.141	S	C	.	.			trans	-107.4	152.4	171	-60.2	-176.4	-170.5	-176.3	2.1	109.6	F940 R963 R968 I972 N1017	F940-R970 HydrophobicContact CD2-CB 4.23Å; F940-R970 HydrophobicContact CE2-CB 4Å; F940-R970 HydrophobicContact CE2-CG 4.37Å; R963-R970 PolarHBondContact NH1-O 2.65Å; R963-R970 PolarHBondContact NH2-O 3.3Å; R968-R970 PolarHBondContact O-N 2.96Å; R968-R970 VanDerWaalsContact O-N 3.15Å; R970-I972 PolarHBondContact O-N 3.11Å; R970-N1017 PolarHBondContact NH1-ND2 3.22Å
971	D	92.7	Very high	84.6	Confident	18 Å²	18	31.1 Å²	31.1	10%	0.096	14%	0.141	C	C	.	.			trans	-60.2	133.8	174	-63.2	-39.8	0	0	0	109.7	F936 H939 F940 R994 F996	F936-D971 HydrophobicContact CD1-CB 4.34Å; H939-D971 CarbonylContact C-O 3.59Å; H939-D971 WeakPolarHBondContact CA-O 3.46Å; H939-D971 HydrophobicContact CB-CB 3.84Å; H939-D971 WeakPolarHBondContact CB-O 3.28Å; F940-D971 PolarHBondContact N-O 3.36Å; D971-R994 IonicContact OD1-CZ 3.6Å; D971-R994 IonicContact OD1-NE 2.82Å; D971-R994 PolarHBondContact OD1-NE 3.15Å; D971-R994 IonicContact OD1-NH2 3.93Å; D971-R994 PolarHBondContact OD1-NH2 2.97Å; D971-R994 IonicContact OD2-CZ 2.95Å; D971-R994 IonicContact OD2-NH2 3.69Å; D971-R994 PolarHBondContact OD2-NH2 3.36Å; D971-F996 HydrophobicContact CB-CD2 4.38Å; D971-F996 HydrophobicContact CB-CE2 4.22Å; D971-F996 WeakPolarHBondContact OD1-CE2 3.41Å
972	I	93.8	Very high	83.5	Confident	0 Å²	0	32 Å²	32	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	121.2	167.5	-65.7	171.7	0	0	0	106.3	F940 V942 I959 L962 R963 R970 I974 R994 F996	F940-I972 HydrophobicContact CB-CG1 4.25Å; F940-I972 HydrophobicContact CD2-CG1 4.09Å; F940-I972 WeakPolarHBondContact O-CA 3.4Å; V942-I972 HydrophobicContact CG2-CG2 4.3Å; I959-I972 HydrophobicContact CB-CD1 4.5Å; I959-I972 HydrophobicContact CG1-CD1 4.18Å; I959-I972 HydrophobicContact CG2-CD1 3.91Å; L962-I972 HydrophobicContact CB-CD1 4.3Å; L962-I972 HydrophobicContact CD1-CD1 3.87Å; R963-I972 VanDerWaalsContact CZ-CD1 3.46Å; R963-I972 VanDerWaalsContact NH1-CD1 3.35Å; R963-I972 VanDerWaalsContact NH2-CD1 3.34Å; R970-I972 PolarHBondContact O-N 3.11Å; I972-I974 HydrophobicContact CG2-CG1 4.15Å; I972-R994 PolarHBondContact N-O 2.95Å; I972-F996 PolarHBondContact O-N 3.48Å
973	V	93.5	Very high	82.4	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120.6	175.1	-169.2	0	0	0	0	108.1	F936 F940 L941 V942 F996 V998 V1011	F936-V973 HydrophobicContact CD1-CG2 3.84Å; F936-V973 HydrophobicContact CD2-CG2 4.21Å; F936-V973 HydrophobicContact CE1-CG2 3.81Å; F936-V973 HydrophobicContact CE2-CG2 4.18Å; F936-V973 HydrophobicContact CG-CG2 4.05Å; F936-V973 HydrophobicContact CZ-CG2 3.98Å; F940-V973 PolarHBondContact O-N 2.9Å; L941-V973 CarbonylContact C-O 3.48Å; L941-V973 WeakPolarHBondContact CA-O 3.32Å; L941-V973 HydrophobicContact CD1-CB 4.41Å; V942-V973 PolarHBondContact N-O 3.42Å; V973-F996 CarbonylContact C-O 3.17Å; V973-F996 WeakPolarHBondContact CA-O 3.34Å; V973-V998 HydrophobicContact CG1-CB 4.47Å; V973-V998 HydrophobicContact CG1-CG2 3.52Å; V973-V1011 HydrophobicContact CB-CG1 3.8Å; V973-V1011 HydrophobicContact CG1-CG1 3.43Å; V973-V1011 VanDerWaalsContact CG1-CG1 3.43Å; V973-V1011 HydrophobicContact CG1-CG2 4.36Å; V973-V1011 HydrophobicContact CG2-CG1 4.27Å
974	I	92.1	Very high	81.5	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	118.7	177.8	-53.3	160.6	0	0	0	107.2	V942 V944 L955 I959 I972 I981 I995 F996 I997 V998	V942-I974 HydrophobicContact CB-CG1 4.32Å; V942-I974 HydrophobicContact CB-CG2 4.44Å; V942-I974 CarbonylContact O-C 3.59Å; V942-I974 WeakPolarHBondContact O-CA 3.48Å; V944-I974 HydrophobicContact CG2-CG2 3.98Å; L955-I974 HydrophobicContact CD1-CD1 3.96Å; L955-I974 HydrophobicContact CD1-CG2 4.38Å; I959-I974 HydrophobicContact CD1-CD1 4.37Å; I972-I974 HydrophobicContact CG2-CG1 4.15Å; I974-I981 HydrophobicContact CB-CD1 4.15Å; I974-I981 HydrophobicContact CG2-CD1 3.45Å; I974-I981 VanDerWaalsContact CG2-CD1 3.45Å; I974-I995 HydrophobicContact CD1-CG2 3.97Å; I974-F996 PolarHBondContact N-O 3.15Å; I974-I997 HydrophobicContact CD1-CG1 4.3Å; I974-I997 CarbonylContact O-C 3.39Å; I974-V998 PolarHBondContact O-N 2.91Å
975	L	91.6	Very high	81	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	120.8	178	178.8	64.9	0	0	0	109.3	L941 V942 V944 V998 P1002 D1007 L1008 V1011	L941-L975 HydrophobicContact CD1-CB 4.2Å; V942-L975 PolarHBondContact O-N 3.44Å; V944-L975 PolarHBondContact N-O 3.02Å; L975-V998 HydrophobicContact CD1-CB 4.07Å; L975-V998 HydrophobicContact CD1-CG1 3.87Å; L975-P1002 HydrophobicContact CD2-CB 4.1Å; L975-P1002 HydrophobicContact CG-CB 4.31Å; L975-D1007 HydrophobicContact CD1-CB 4.22Å; L975-D1007 HydrophobicContact CD2-CB 4.45Å; L975-L1008 HydrophobicContact CD2-CD2 3.83Å; L975-L1008 HydrophobicContact CD2-CG 4.44Å; L975-V1011 HydrophobicContact CD1-CG2 4.34Å
976	G	86.7	Confident	81	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.1	178.1	178.6	0	0	0	0	0	110.5	S978 V998 D999 G1000	G976-S978 PolarHBondContact O-N 3.01Å; G976-V998 PolarHBondContact N-O 3.41Å; G976-D999 WeakPolarHBondContact O-CA 3.43Å; G976-G1000 CarbonylContact C-O 3.58Å; G976-G1000 WeakPolarHBondContact CA-O 3.06Å; G976-G1000 PolarHBondContact N-O 3.22Å; G976-G1000 PolarHBondContact O-N 3.4Å
977	D	79.2	Confident	81.1	Confident	56 Å²	56	46.5 Å²	46.5	30%	0.299	24%	0.236	S	C	.	.			trans	-63.2	122	175.6	174.9	0.3	0	0	0	109.9	H979 L980	D977-H979 PolarHBondContact O-N 2.97Å; D977-H979 VanDerWaalsContact O-N 3.16Å; D977-H979 WeakPolarHBondContact OD1-CB 3.49Å; D977-H979 IonicContact OD1-CD2 3.89Å; D977-H979 PolarHBondContact OD1-CD2 3.45Å; D977-H979 VanDerWaalsContact OD1-CD2 3.27Å; D977-H979 IonicContact OD1-CG 3.8Å; D977-H979 PolarHBondContact OD1-N 2.97Å; D977-L980 HydrophobicContact CB-CD1 3.67Å; D977-L980 HydrophobicContact CB-CG 3.83Å; D977-L980 VanDerWaalsContact O-CB 3.24Å; D977-L980 WeakPolarHBondContact O-CB 3.32Å; D977-L980 PolarHBondContact O-N 2.97Å
978	S	71.9	Confident	80.9	Confident	28 Å²	28	48.6 Å²	48.6	20%	0.196	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-24.7	-177.2	68.6	0	0	0	0	112.8	G976 L980 I981 D999	G976-S978 PolarHBondContact O-N 3.01Å; S978-L980 VanDerWaalsContact C-N 3.29Å; S978-L980 PolarHBondContact O-N 3.28Å; S978-I981 CarbonylContact O-C 2.99Å; S978-I981 PolarHBondContact O-N 3.21Å; S978-D999 WeakPolarHBondContact CB-OD2 3.42Å; S978-D999 PolarHBondContact N-OD1 3.2Å; S978-D999 PolarHBondContact OG-OD1 3.11Å; S978-D999 PolarHBondContact OG-OD2 3.02Å
979	H	70.2	Confident	81	Confident	155 Å²	155	39.4 Å²	39.4	72%	0.718	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-27.5	175	-67.7	-71.8	0	0	0	112.9	D977	D977-H979 PolarHBondContact O-N 2.97Å; D977-H979 VanDerWaalsContact O-N 3.16Å; D977-H979 WeakPolarHBondContact OD1-CB 3.49Å; D977-H979 IonicContact OD1-CD2 3.89Å; D977-H979 PolarHBondContact OD1-CD2 3.45Å; D977-H979 VanDerWaalsContact OD1-CD2 3.27Å; D977-H979 IonicContact OD1-CG 3.8Å; D977-H979 PolarHBondContact OD1-N 2.97Å
980	L	64.1	Low	81.1	Confident	28 Å²	28	40.7 Å²	40.7	15%	0.147	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-39.4	176.7	-60.5	170.9	0	0	0	111.2	V944 G946 S948 D977 S978 G982	V944-L980 HydrophobicContact CG1-CD1 4.39Å; G946-L980 WeakPolarHBondContact O-CD1 3.42Å; S948-L980 VanDerWaalsContact CB-CD2 3.48Å; D977-L980 HydrophobicContact CB-CD1 3.67Å; D977-L980 HydrophobicContact CB-CG 3.83Å; D977-L980 VanDerWaalsContact O-CB 3.24Å; D977-L980 WeakPolarHBondContact O-CB 3.32Å; D977-L980 PolarHBondContact O-N 2.97Å; S978-L980 VanDerWaalsContact C-N 3.29Å; S978-L980 PolarHBondContact O-N 3.28Å; L980-G982 PolarHBondContact O-N 2.91Å
981	I	68	Low	81	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.01	20%	0.202	C	C	.	.	S	Bend	trans	-87	64.6	175.6	-52.8	163.9	0	0	0	107.3	L953 L955 I974 S978 I997	L953-I981 HydrophobicContact CD1-CG1 3.96Å; L955-I981 HydrophobicContact CD1-CG1 4.45Å; I974-I981 HydrophobicContact CB-CD1 4.15Å; I974-I981 HydrophobicContact CG2-CD1 3.45Å; I974-I981 VanDerWaalsContact CG2-CD1 3.45Å; S978-I981 CarbonylContact O-C 2.99Å; S978-I981 PolarHBondContact O-N 3.21Å; I981-I997 HydrophobicContact CB-CD1 4.37Å; I981-I997 HydrophobicContact CD1-CD1 4.46Å; I981-I997 HydrophobicContact CD1-CG1 4.21Å; I981-I997 HydrophobicContact CD1-CG2 3.8Å; I981-I997 HydrophobicContact CG2-CD1 3.68Å
982	G	66.3	Low	80.8	Confident	17 Å²	17	36.8 Å²	36.8	18%	0.175	20%	0.198	C	C	.	.			trans	-62.5	171.1	-174	0	0	0	0	0	113.6	L980 L984 E985 W986	L980-G982 PolarHBondContact O-N 2.91Å; G982-L984 PolarHBondContact O-N 3.36Å; G982-L984 VanDerWaalsContact O-N 3.09Å; G982-E985 PolarHBondContact O-N 2.99Å; G982-W986 PolarHBondContact O-N 3.02Å
983	P	69	Low	80.6	Confident	95 Å²	95	37.2 Å²	37.2	62%	0.617	20%	0.201	S	C	*	.	H	α-helix	trans	-57.2	-29.9	178.5	23.4	-33.9	0	0	0	112.6	E985 W986 V987	P983-E985 PolarHBondContact O-N 3.3Å; P983-W986 PolarHBondContact O-N 3.01Å; P983-V987 VanDerWaalsContact O-CG2 3.26Å; P983-V987 WeakPolarHBondContact O-CG2 3.19Å; P983-V987 PolarHBondContact O-N 2.68Å
984	L	71.1	Confident	80.4	Confident	152 Å²	152	43 Å²	43	80%	0.796	22%	0.223	S	C	*	.	H	α-helix	trans	-63.9	-37.3	178.5	-66.8	173.8	0	0	0	113.1	G982	G982-L984 PolarHBondContact O-N 3.36Å; G982-L984 VanDerWaalsContact O-N 3.09Å
985	E	78.5	Confident	80.4	Confident	6 Å²	6	43.3 Å²	43.3	3%	0.028	23%	0.225	C	C	.	.	H	α-helix	trans	-80.2	-39.1	178.7	-175.8	156.8	-156.9	0	0	111.1	L953 N954 L955 G982 P983 V987 K988 L989	L953-E985 WeakPolarHBondContact CB-OE2 3.3Å; L953-E985 PolarHBondContact N-OE2 3.25Å; N954-E985 WeakPolarHBondContact CA-OE1 3.43Å; N954-E985 PolarHBondContact N-OE1 2.95Å; L955-E985 VanDerWaalsContact CB-OE1 3.3Å; L955-E985 WeakPolarHBondContact CB-OE1 2.9Å; L955-E985 WeakPolarHBondContact CG-OE1 3.45Å; L955-E985 PolarHBondContact N-OE1 3.4Å; G982-E985 PolarHBondContact O-N 2.99Å; P983-E985 PolarHBondContact O-N 3.3Å; E985-V987 VanDerWaalsContact C-N 3.26Å; E985-V987 PolarHBondContact O-N 3.37Å; E985-K988 WeakPolarHBondContact O-CB 3.21Å; E985-K988 PolarHBondContact O-N 3.5Å; E985-L989 HydrophobicContact CG-CD1 4.43Å
986	W	85.6	Confident	80.4	Confident	15 Å²	15	45.6 Å²	45.6	6%	0.057	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-32.7	178.7	-170.2	-105.9	0	0	0	113.5	I919 L921 A924 G982 P983 K988 L989 K990 I995 I997	I919-W986 HydrophobicContact CB-CZ2 4.36Å; I919-W986 HydrophobicContact CG2-CZ2 4.28Å; I919-W986 PolarHBondContact O-NE1 3.08Å; L921-W986 HydrophobicContact CB-CG 4.05Å; L921-W986 HydrophobicContact CD1-CB 4.03Å; L921-W986 HydrophobicContact CD1-CD2 3.71Å; L921-W986 HydrophobicContact CD1-CE3 4.02Å; L921-W986 HydrophobicContact CD1-CG 3.69Å; L921-W986 HydrophobicContact CG-CG 4.38Å; A924-W986 HydrophobicContact CB-CH2 3.18Å; A924-W986 HydrophobicContact CB-CZ2 3.38Å; A924-W986 HydrophobicContact CB-CZ3 3.95Å; G982-W986 PolarHBondContact O-N 3.02Å; P983-W986 PolarHBondContact O-N 3.01Å; W986-K988 PolarHBondContact O-N 2.93Å; W986-L989 HydrophobicContact CE3-CB 4.09Å; W986-L989 HydrophobicContact CE3-CD1 4.43Å; W986-L989 HydrophobicContact CZ3-CB 4.25Å; W986-L989 PolarHBondContact O-N 2.91Å; W986-K990 WeakPolarHBondContact O-CB 3.39Å; W986-K990 PolarHBondContact O-N 2.91Å; W986-I995 HydrophobicContact CH2-CB 4.32Å; W986-I995 HydrophobicContact CH2-CG2 4.32Å; W986-I995 HydrophobicContact CZ3-CB 4.49Å; W986-I995 HydrophobicContact CZ3-CG2 4.02Å; W986-I997 HydrophobicContact CE3-CD1 3.63Å; W986-I997 HydrophobicContact CZ3-CD1 3.62Å; W986-I997 HydrophobicContact CZ3-CG1 4.34Å
987	V	83.7	Confident	80.5	Confident	91 Å²	91	45.6 Å²	45.6	55%	0.552	24%	0.235	S	C	*	.	H	α-helix	trans	-54.1	-29.8	175.1	168.3	0	0	0	0	112.3	P983 E985 K990	P983-V987 VanDerWaalsContact O-CG2 3.26Å; P983-V987 WeakPolarHBondContact O-CG2 3.19Å; P983-V987 PolarHBondContact O-N 2.68Å; E985-V987 VanDerWaalsContact C-N 3.26Å; E985-V987 PolarHBondContact O-N 3.37Å; V987-K990 WeakPolarHBondContact O-CE 3.29Å; V987-K990 WeakPolarHBondContact O-CG 3.39Å
988	K	81.4	Confident	81.1	Confident	58 Å²	58	43 Å²	43	25%	0.252	22%	0.22	S	C	.	.	H	α-helix	trans	-83.3	-29	178	-61	164.2	163.1	-159.7	0	112.9	E956 E985 W986	E956-K988 HydrophobicContact CB-CB 4.41Å; E956-K988 HydrophobicContact CG-CB 4.14Å; E956-K988 VanDerWaalsContact OE2-CD 3.29Å; E956-K988 WeakPolarHBondContact OE2-CD 3.31Å; E956-K988 IonicContact OE2-NZ 3.69Å; E985-K988 WeakPolarHBondContact O-CB 3.21Å; E985-K988 PolarHBondContact O-N 3.5Å; W986-K988 PolarHBondContact O-N 2.93Å
989	L	86.7	Confident	81.9	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-95.1	-19.4	-174.5	-62	-179.7	0	0	0	114.1	L955 E956 I959 E985 W986 N991 L992 I995	L955-L989 HydrophobicContact CB-CD1 4.34Å; E956-L989 HydrophobicContact CB-CD2 4.21Å; I959-L989 HydrophobicContact CB-CD2 4.44Å; I959-L989 HydrophobicContact CD1-CD1 3.97Å; I959-L989 HydrophobicContact CD1-CD2 3.79Å; E985-L989 HydrophobicContact CG-CD1 4.43Å; W986-L989 HydrophobicContact CE3-CB 4.09Å; W986-L989 HydrophobicContact CE3-CD1 4.43Å; W986-L989 HydrophobicContact CZ3-CB 4.25Å; W986-L989 PolarHBondContact O-N 2.91Å; L989-N991 PolarHBondContact O-N 3.32Å; L989-L992 HydrophobicContact CD2-CD1 4.25Å; L989-L992 WeakPolarHBondContact O-CB 3.45Å; L989-L992 PolarHBondContact O-N 3.26Å; L989-I995 HydrophobicContact CB-CD1 4.36Å
990	K	86.5	Confident	82.7	Confident	54 Å²	54	38.1 Å²	38.1	24%	0.235	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-22.1	-172.5	69.4	-178.8	179.8	161.9	0	115.5	D918 I919 W986 V987	D918-K990 HydrophobicContact CB-CD 4.22Å; D918-K990 WeakPolarHBondContact OD1-CE 3.49Å; D918-K990 IonicContact OD1-NZ 2.74Å; D918-K990 PolarHBondContact OD1-NZ 3.39Å; D918-K990 WeakPolarHBondContact OD2-CE 3.49Å; D918-K990 IonicContact OD2-NZ 2.77Å; D918-K990 PolarHBondContact OD2-NZ 2.75Å; I919-K990 PolarHBondContact N-O 3.49Å; W986-K990 WeakPolarHBondContact O-CB 3.39Å; W986-K990 PolarHBondContact O-N 2.91Å; V987-K990 WeakPolarHBondContact O-CE 3.29Å; V987-K990 WeakPolarHBondContact O-CG 3.39Å
991	N	88.5	Confident	83.8	Confident	12 Å²	12	41 Å²	41	6%	0.064	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	6.1	-178	-63.2	109	0	0	0	113.9	V916 D918 L989 L1146	V916-N991 WeakPolarHBondContact CG2-O 3.46Å; V916-N991 PolarHBondContact N-O 3.02Å; V916-N991 WeakPolarHBondContact O-CA 3.27Å; V916-N991 PolarHBondContact O-ND2 3.25Å; V916-N991 VanDerWaalsContact O-ND2 3.16Å; D918-N991 PolarHBondContact OD1-ND2 3.22Å; L989-N991 PolarHBondContact O-N 3.32Å; N991-L1146 HydrophobicContact CB-CB 4.29Å
992	L	89.2	Confident	84.8	Confident	2 Å²	2	41 Å²	41	1%	0.01	22%	0.217	C	C	.	.	S	Bend	trans	-108.4	138.1	-179.8	-65.7	171.9	0	0	0	111.3	I959 R963 L989 I995 L1146	I959-L992 HydrophobicContact CB-CD1 4.5Å; I959-L992 HydrophobicContact CG2-CD1 3.78Å; R963-L992 HydrophobicContact CB-CD2 4.05Å; R963-L992 HydrophobicContact CG-CD2 4.28Å; L989-L992 HydrophobicContact CD2-CD1 4.25Å; L989-L992 WeakPolarHBondContact O-CB 3.45Å; L989-L992 PolarHBondContact O-N 3.26Å; L992-I995 HydrophobicContact CB-CD1 3.65Å; L992-L1146 HydrophobicContact CD2-CD1 3.67Å; L992-L1146 HydrophobicContact CG-CD1 4.14Å
993	P	89	Confident	85.8	Confident	9 Å²	9	41.4 Å²	41.4	6%	0.058	22%	0.217	C	C	.	.	S	Bend	trans	-76.5	150.7	-174.7	28.1	-34.4	0	0	0	113.6	H914 V916 R963 V969	H914-P993 HydrophobicContact CB-CG 3.84Å; V916-P993 HydrophobicContact CG1-CB 3.79Å; V916-P993 HydrophobicContact CG1-CG 4.46Å; R963-P993 PolarHBondContact NE-O 3.38Å; R963-P993 PolarHBondContact NH2-O 3.08Å; R963-P993 VanDerWaalsContact NH2-O 3.15Å; V969-P993 HydrophobicContact CG1-CB 4.35Å; V969-P993 HydrophobicContact CG1-CG 4.03Å; V969-P993 HydrophobicContact CG2-CG 4.44Å
994	R	89.1	Confident	86.8	Confident	120 Å²	120	38.6 Å²	38.6	45%	0.453	20%	0.199	S	C	.	.	S	Bend	trans	55.6	55.5	165.3	-60.5	178.8	67.7	-179.1	6.1	113.8	R963 V969 D971 I972 F996	R963-R994 PolarHBondContact NH2-O 3.39Å; R963-R994 VanDerWaalsContact NH2-O 3.09Å; V969-R994 HydrophobicContact CG1-CB 4.22Å; V969-R994 HydrophobicContact CG1-CG 4.33Å; V969-R994 PolarHBondContact O-NH1 3.16Å; D971-R994 IonicContact OD1-CZ 3.6Å; D971-R994 IonicContact OD1-NE 2.82Å; D971-R994 PolarHBondContact OD1-NE 3.15Å; D971-R994 IonicContact OD1-NH2 3.93Å; D971-R994 PolarHBondContact OD1-NH2 2.97Å; D971-R994 IonicContact OD2-CZ 2.95Å; D971-R994 IonicContact OD2-NH2 3.69Å; D971-R994 PolarHBondContact OD2-NH2 3.36Å; I972-R994 PolarHBondContact N-O 2.95Å; R994-F996 HydrophobicContact CB-CE2 4.45Å
995	I	91.1	Very high	87.7	Confident	9 Å²	9	36 Å²	36	5%	0.046	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	128.6	172.7	-57.7	167.7	0	0	0	107.1	I959 I974 W986 L989 L992	I959-I995 HydrophobicContact CD1-CD1 4.15Å; I959-I995 HydrophobicContact CG2-CD1 3.99Å; I974-I995 HydrophobicContact CD1-CG2 3.97Å; W986-I995 HydrophobicContact CH2-CB 4.32Å; W986-I995 HydrophobicContact CH2-CG2 4.32Å; W986-I995 HydrophobicContact CZ3-CB 4.49Å; W986-I995 HydrophobicContact CZ3-CG2 4.02Å; L989-I995 HydrophobicContact CB-CD1 4.36Å; L992-I995 HydrophobicContact CB-CD1 3.65Å
996	F	91.6	Very high	88.3	Confident	47 Å²	47	41.9 Å²	41.9	21%	0.206	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	134.6	179.5	-58.5	-81.8	0	0	0	109	L926 F936 D971 I972 V973 I974 R994	L926-F996 HydrophobicContact CD1-CB 4.03Å; L926-F996 HydrophobicContact CD1-CD1 3.88Å; L926-F996 HydrophobicContact CD1-CG 4.28Å; F936-F996 AromaticContact CE1-CD2 3.78Å; F936-F996 HydrophobicContact CE1-CD2 3.78Å; F936-F996 HydrophobicContact CE1-CE2 4.07Å; F936-F996 HydrophobicContact CE1-CG 4.09Å; F936-F996 HydrophobicContact CZ-CB 4.41Å; F936-F996 HydrophobicContact CZ-CD2 4.38Å; F936-F996 HydrophobicContact CZ-CG 4.24Å; D971-F996 HydrophobicContact CB-CD2 4.38Å; D971-F996 HydrophobicContact CB-CE2 4.22Å; D971-F996 WeakPolarHBondContact OD1-CE2 3.41Å; I972-F996 PolarHBondContact O-N 3.48Å; V973-F996 CarbonylContact C-O 3.17Å; V973-F996 WeakPolarHBondContact CA-O 3.34Å; I974-F996 PolarHBondContact N-O 3.15Å; R994-F996 HydrophobicContact CB-CE2 4.45Å
997	I	90.7	Very high	88.6	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	124.1	176.9	-63.4	165.3	0	0	0	106.7	L921 A924 T925 L926 I974 I981 W986	L921-I997 HydrophobicContact CD1-CD1 3.81Å; A924-I997 PolarHBondContact O-N 3.05Å; T925-I997 CarbonylContact C-O 3.52Å; T925-I997 VanDerWaalsContact CA-O 3.32Å; T925-I997 WeakPolarHBondContact CA-O 3.23Å; T925-I997 HydrophobicContact CG2-CB 4.33Å; T925-I997 HydrophobicContact CG2-CG2 4.41Å; L926-I997 PolarHBondContact N-O 3.26Å; I974-I997 HydrophobicContact CD1-CG1 4.3Å; I974-I997 CarbonylContact O-C 3.39Å; I981-I997 HydrophobicContact CB-CD1 4.37Å; I981-I997 HydrophobicContact CD1-CD1 4.46Å; I981-I997 HydrophobicContact CD1-CG1 4.21Å; I981-I997 HydrophobicContact CD1-CG2 3.8Å; I981-I997 HydrophobicContact CG2-CD1 3.68Å; W986-I997 HydrophobicContact CE3-CD1 3.63Å; W986-I997 HydrophobicContact CZ3-CD1 3.62Å; W986-I997 HydrophobicContact CZ3-CG1 4.34Å
998	V	91	Very high	89	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	117.5	178	-179.8	0	0	0	0	107.9	L926 P928 A931 V973 I974 L975 G976 G1000 V1011	L926-V998 HydrophobicContact CB-CG2 4.37Å; L926-V998 WeakPolarHBondContact O-CA 3.39Å; P928-V998 HydrophobicContact CG-CG1 4.36Å; A931-V998 HydrophobicContact CB-CG1 4.06Å; A931-V998 HydrophobicContact CB-CG2 3.78Å; V973-V998 HydrophobicContact CG1-CB 4.47Å; V973-V998 HydrophobicContact CG1-CG2 3.52Å; I974-V998 PolarHBondContact O-N 2.91Å; L975-V998 HydrophobicContact CD1-CB 4.07Å; L975-V998 HydrophobicContact CD1-CG1 3.87Å; G976-V998 PolarHBondContact N-O 3.41Å; V998-G1000 PolarHBondContact O-N 2.83Å; V998-V1011 HydrophobicContact CB-CG2 4.3Å; V998-V1011 HydrophobicContact CG1-CG2 4.11Å; V998-V1011 HydrophobicContact CG2-CG2 4.14Å
999	D	88.8	Confident	89.4	Confident	67 Å²	67	41.8 Å²	41.8	36%	0.358	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	101.6	179.5	-162.1	8.4	0	0	0	110	L926 P928 G976 S978	L926-D999 PolarHBondContact O-N 2.81Å; L926-D999 VanDerWaalsContact O-N 3.09Å; P928-D999 VanDerWaalsContact CD-O 3.27Å; P928-D999 WeakPolarHBondContact CD-O 3.31Å; P928-D999 VanDerWaalsContact CG-O 3.31Å; P928-D999 WeakPolarHBondContact CG-O 3.46Å; G976-D999 WeakPolarHBondContact O-CA 3.43Å; S978-D999 WeakPolarHBondContact CB-OD2 3.42Å; S978-D999 PolarHBondContact N-OD1 3.2Å; S978-D999 PolarHBondContact OG-OD1 3.11Å; S978-D999 PolarHBondContact OG-OD2 3.02Å
1000	G	86.8	Confident	89.6	Confident	15 Å²	15	42.2 Å²	42.2	16%	0.155	21%	0.213	C	C	.	.	S	Bend	trans	-172.5	171.7	-174.4	0	0	0	0	0	112.6	G976 V998	G976-G1000 CarbonylContact C-O 3.58Å; G976-G1000 WeakPolarHBondContact CA-O 3.06Å; G976-G1000 PolarHBondContact N-O 3.22Å; G976-G1000 PolarHBondContact O-N 3.4Å; V998-G1000 PolarHBondContact O-N 2.83Å
1001	D	88.1	Confident	89.8	Confident	87 Å²	87	39.7 Å²	39.7	47%	0.465	20%	0.201	S	C	.	.			trans	-95.7	120.9	179.3	-178.1	3.5	0	0	0	110	C1003 S1004 D1007	D1001-C1003 PolarHBondContact O-N 2.84Å; D1001-C1003 VanDerWaalsContact O-N 3.11Å; D1001-C1003 WeakPolarHBondContact OD1-CB 3.35Å; D1001-C1003 PolarHBondContact OD1-N 3.5Å; D1001-S1004 VanDerWaalsContact O-CB 3.31Å; D1001-S1004 WeakPolarHBondContact O-CB 3.36Å; D1001-S1004 PolarHBondContact O-N 3.15Å; D1001-D1007 PolarHBondContact N-OD2 3.38Å
1002	P	87.9	Confident	89.9	Confident	4 Å²	4	41 Å²	41	3%	0.026	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-11.1	176.5	31	-39.5	0	0	0	114.2	C943 V944 A945 L975	C943-P1002 HydrophobicContact CB-CB 3.78Å; V944-P1002 WeakPolarHBondContact O-CG 3.31Å; A945-P1002 HydrophobicContact CB-CG 4.3Å; L975-P1002 HydrophobicContact CD2-CB 4.1Å; L975-P1002 HydrophobicContact CG-CB 4.31Å
1003	C	87.1	Confident	89.9	Confident	25 Å²	25	41 Å²	41	17%	0.169	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-17.6	171.2	-60.7	0	0	0	0	112.9	D1001	D1001-C1003 PolarHBondContact O-N 2.84Å; D1001-C1003 VanDerWaalsContact O-N 3.11Å; D1001-C1003 WeakPolarHBondContact OD1-CB 3.35Å; D1001-C1003 PolarHBondContact OD1-N 3.5Å
1004	S	90.2	Very high	89.8	Confident	35 Å²	35	41.6 Å²	41.6	25%	0.245	21%	0.211	C	C	.	.			trans	-79	124.8	-179.1	177.5	0	0	0	0	111.4	D1001 N1006 D1007 L1008	D1001-S1004 VanDerWaalsContact O-CB 3.31Å; D1001-S1004 WeakPolarHBondContact O-CB 3.36Å; D1001-S1004 PolarHBondContact O-N 3.15Å; S1004-N1006 VanDerWaalsContact C-N 3.28Å; S1004-N1006 PolarHBondContact O-N 3.23Å; S1004-D1007 WeakPolarHBondContact CB-OD2 3.29Å; S1004-D1007 PolarHBondContact O-N 3.18Å; S1004-L1008 WeakPolarHBondContact O-CG 3.24Å; S1004-L1008 PolarHBondContact O-N 3.17Å; S1004-L1008 VanDerWaalsContact O-N 3.14Å
1005	F	89.8	Confident	89.8	Confident	97 Å²	97	40.3 Å²	40.3	43%	0.425	21%	0.21	S	C	.	.	H	α-helix	trans	-60.5	-36.8	176	-71.4	-70.6	0	0	0	112.8	H1009 N1049 L1053	F1005-H1009 WeakPolarHBondContact O-CB 3.38Å; F1005-H1009 PolarHBondContact O-N 3.48Å; F1005-N1049 HydrophobicContact CE1-CB 4.4Å; F1005-N1049 HydrophobicContact CZ-CB 4.32Å; F1005-L1053 HydrophobicContact CD1-CD1 3.5Å; F1005-L1053 VanDerWaalsContact CD1-CD1 3.5Å; F1005-L1053 HydrophobicContact CD1-CD2 3.58Å; F1005-L1053 HydrophobicContact CD1-CG 3.75Å; F1005-L1053 HydrophobicContact CE1-CD1 3.77Å; F1005-L1053 HydrophobicContact CE1-CD2 3.69Å; F1005-L1053 HydrophobicContact CE1-CG 3.64Å
1006	N	91.4	Very high	89.7	Confident	131 Å²	131	40.3 Å²	40.3	70%	0.701	21%	0.211	S	C	*	.	H	α-helix	trans	-66.2	-41.3	-179.1	-69.9	-17	0	0	0	111.2	S1004 H1009 S1010	S1004-N1006 VanDerWaalsContact C-N 3.28Å; S1004-N1006 PolarHBondContact O-N 3.23Å; N1006-H1009 PolarHBondContact O-N 2.6Å; N1006-S1010 WeakPolarHBondContact O-CB 3.4Å; N1006-S1010 PolarHBondContact O-N 3.46Å
1007	D	92.2	Very high	89.6	Confident	28 Å²	28	41 Å²	41	15%	0.15	22%	0.217	C	C	.	.	H	α-helix	trans	-71	-42	-178.4	-61.6	-14.9	0	0	0	110.3	L975 D1001 S1004 H1009 S1010 V1011	L975-D1007 HydrophobicContact CD1-CB 4.22Å; L975-D1007 HydrophobicContact CD2-CB 4.45Å; D1001-D1007 PolarHBondContact N-OD2 3.38Å; S1004-D1007 WeakPolarHBondContact CB-OD2 3.29Å; S1004-D1007 PolarHBondContact O-N 3.18Å; D1007-H1009 VanDerWaalsContact C-N 3.29Å; D1007-H1009 PolarHBondContact O-N 3.25Å; D1007-S1010 WeakPolarHBondContact O-CB 3.37Å; D1007-S1010 PolarHBondContact O-N 3.49Å; D1007-S1010 VanDerWaalsContact O-N 3.16Å; D1007-S1010 PolarHBondContact O-OG 3.49Å; D1007-V1011 WeakPolarHBondContact O-CG2 3.23Å; D1007-V1011 PolarHBondContact O-N 3.15Å
1008	L	91.2	Very high	89.7	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-59.8	-38.1	172.7	-71.5	173	0	0	0	112.7	L975 S1004 L1013 I1050 L1053	L975-L1008 HydrophobicContact CD2-CD2 3.83Å; L975-L1008 HydrophobicContact CD2-CG 4.44Å; S1004-L1008 WeakPolarHBondContact O-CG 3.24Å; S1004-L1008 PolarHBondContact O-N 3.17Å; S1004-L1008 VanDerWaalsContact O-N 3.14Å; L1008-L1013 HydrophobicContact CB-CD2 4.43Å; L1008-L1013 PolarHBondContact O-N 2.81Å; L1008-I1050 HydrophobicContact CD1-CG1 3.82Å; L1008-I1050 HydrophobicContact CD2-CD1 4.31Å; L1008-I1050 HydrophobicContact CD2-CG1 4.1Å; L1008-L1053 HydrophobicContact CB-CD1 4.43Å; L1008-L1053 HydrophobicContact CD1-CD1 3.87Å
1009	H	89.9	Confident	89.9	Confident	132 Å²	132	41.1 Å²	41.1	61%	0.611	22%	0.218	S	C	*	.	H	α-helix	trans	-69.7	-38	176.2	-163.5	71.3	0	0	0	111.8	F1005 N1006 D1007 V1011 H1012	F1005-H1009 WeakPolarHBondContact O-CB 3.38Å; F1005-H1009 PolarHBondContact O-N 3.48Å; N1006-H1009 PolarHBondContact O-N 2.6Å; D1007-H1009 VanDerWaalsContact C-N 3.29Å; D1007-H1009 PolarHBondContact O-N 3.25Å; H1009-V1011 PolarHBondContact O-N 2.9Å; H1009-H1012 PolarHBondContact O-N 2.74Å
1010	S	91	Very high	90.2	Very high	11 Å²	11	38 Å²	38	8%	0.077	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-29.2	177.9	81.4	0	0	0	0	113.5	P928 A931 A932 N1006 D1007 H1012	P928-S1010 WeakPolarHBondContact O-CB 3.44Å; A931-S1010 CarbonylContact C-O 3.53Å; A932-S1010 WeakPolarHBondContact CA-O 3.35Å; A932-S1010 PolarHBondContact N-O 3.44Å; N1006-S1010 WeakPolarHBondContact O-CB 3.4Å; N1006-S1010 PolarHBondContact O-N 3.46Å; D1007-S1010 WeakPolarHBondContact O-CB 3.37Å; D1007-S1010 PolarHBondContact O-N 3.49Å; D1007-S1010 VanDerWaalsContact O-N 3.16Å; D1007-S1010 PolarHBondContact O-OG 3.49Å; S1010-H1012 VanDerWaalsContact C-N 3.35Å
1011	V	91.2	Very high	90.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-0	177.9	-173.9	0	0	0	0	112.3	H939 L941 V973 L975 V998 D1007 H1009	H939-V1011 PolarHBondContact CE1-O 2.91Å; H939-V1011 PolarHBondContact NE2-O 3.49Å; L941-V1011 HydrophobicContact CD1-CB 4.39Å; L941-V1011 HydrophobicContact CD1-CG1 3.53Å; V973-V1011 HydrophobicContact CB-CG1 3.8Å; V973-V1011 HydrophobicContact CG1-CG1 3.43Å; V973-V1011 VanDerWaalsContact CG1-CG1 3.43Å; V973-V1011 HydrophobicContact CG1-CG2 4.36Å; V973-V1011 HydrophobicContact CG2-CG1 4.27Å; L975-V1011 HydrophobicContact CD1-CG2 4.34Å; V998-V1011 HydrophobicContact CB-CG2 4.3Å; V998-V1011 HydrophobicContact CG1-CG2 4.11Å; V998-V1011 HydrophobicContact CG2-CG2 4.14Å; D1007-V1011 WeakPolarHBondContact O-CG2 3.23Å; D1007-V1011 PolarHBondContact O-N 3.15Å; H1009-V1011 PolarHBondContact O-N 2.9Å
1012	H	90.6	Very high	90.6	Very high	40 Å²	40	33.1 Å²	33.1	19%	0.185	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	51.4	-177.1	-52.1	-53.9	0	0	0	113.6	H939 H1009 S1010 C1014 Q1015 C1016	H939-H1012 PolarHBondContact CE1-O 2.82Å; H1009-H1012 PolarHBondContact O-N 2.74Å; S1010-H1012 VanDerWaalsContact C-N 3.35Å; H1012-C1014 PolarHBondContact O-N 3.12Å; H1012-Q1015 HydrophobicContact CB-CB 4.22Å; H1012-Q1015 HydrophobicContact CB-CG 4.35Å; H1012-Q1015 PolarHBondContact O-N 2.86Å; H1012-C1016 PolarHBondContact O-N 3.04Å
1013	L	89.6	Confident	90.2	Very high	3 Å²	3	33 Å²	33	2%	0.016	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-41.2	-44.1	176.5	172.9	65.8	0	0	0	113.1	L941 L1008 Q1015 C1016 C1019 I1050 L1053 L1054	L941-L1013 HydrophobicContact CD2-CB 4.44Å; L941-L1013 HydrophobicContact CD2-CD1 3.58Å; L1008-L1013 HydrophobicContact CB-CD2 4.43Å; L1008-L1013 PolarHBondContact O-N 2.81Å; L1013-Q1015 PolarHBondContact O-N 3.49Å; L1013-C1016 WeakPolarHBondContact O-CB 3.19Å; L1013-C1016 PolarHBondContact O-N 3.17Å; L1013-C1016 VanDerWaalsContact O-N 3.13Å; L1013-C1016 PolarHBondContact O-SG 2.89Å; L1013-C1019 HydrophobicContact CD1-CB 4.27Å; L1013-I1050 HydrophobicContact CD1-CG2 4.03Å; L1013-I1050 HydrophobicContact CD2-CG1 4.47Å; L1013-I1050 HydrophobicContact CD2-CG2 4.08Å; L1013-L1053 HydrophobicContact CD2-CB 4.27Å; L1013-L1053 HydrophobicContact CD2-CD1 3.97Å; L1013-L1054 HydrophobicContact CD2-CD2 4.39Å; L1013-L1054 HydrophobicContact CD2-CG 4.43Å; L1013-L1054 HydrophobicContact CG-CD2 4.1Å
1014	C	86.7	Confident	89.5	Confident	20 Å²	20	32.9 Å²	32.9	14%	0.135	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-76	-12.3	-173	-53.9	0	0	0	0	113.9	H1012 E1057	H1012-C1014 PolarHBondContact O-N 3.12Å; C1014-E1057 WeakPolarHBondContact CB-OE2 3.31Å; C1014-E1057 PolarHBondContact SG-OE1 3.34Å; C1014-E1057 VanDerWaalsContact SG-OE1 3.4Å; C1014-E1057 PolarHBondContact SG-OE2 2.89Å
1015	Q	88.2	Confident	88.2	Confident	93 Å²	93	33.5 Å²	33.5	44%	0.435	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-101	-2.1	172.6	-57.2	-173.9	11.7	0	0	113	F936 R938 H1012 L1013	F936-Q1015 PolarHBondContact O-OE1 3.33Å; R938-Q1015 WeakPolarHBondContact CA-O 3.36Å; R938-Q1015 PolarHBondContact N-O 3.27Å; H1012-Q1015 HydrophobicContact CB-CB 4.22Å; H1012-Q1015 HydrophobicContact CB-CG 4.35Å; H1012-Q1015 PolarHBondContact O-N 2.86Å; L1013-Q1015 PolarHBondContact O-N 3.49Å
1016	C	90.7	Very high	86.4	Confident	9 Å²	9	30.8 Å²	30.8	6%	0.061	17%	0.166	C	C	.	.			trans	-72.1	154.3	175.5	88.1	0	0	0	0	110.6	H939 L941 H1012 L1013 V1061	H939-C1016 WeakPolarHBondContact NE2-CB 3.4Å; H939-C1016 WeakPolarHBondContact O-CA 3.44Å; L941-C1016 HydrophobicContact CB-CB 4.24Å; H1012-C1016 PolarHBondContact O-N 3.04Å; L1013-C1016 WeakPolarHBondContact O-CB 3.19Å; L1013-C1016 PolarHBondContact O-N 3.17Å; L1013-C1016 VanDerWaalsContact O-N 3.13Å; L1013-C1016 PolarHBondContact O-SG 2.89Å; C1016-V1061 WeakPolarHBondContact SG-CG1 3.37Å
1017	N	89.5	Confident	84.5	Confident	63 Å²	63	26.8 Å²	26.8	34%	0.337	14%	0.144	S	C	.	.	S	Bend	trans	-86.7	-33.6	176.8	-173	72.7	0	0	0	112.1	C666 H939 F940 R970	C666-N1017 PolarHBondContact O-ND2 2.86Å; H939-N1017 PolarHBondContact O-N 3.29Å; F940-N1017 HydrophobicContact CD1-CB 4.41Å; F940-N1017 HydrophobicContact CE1-CB 4.26Å; R970-N1017 PolarHBondContact NH1-ND2 3.22Å
1018	A	92.9	Very high	82.4	Confident	3 Å²	3	32.6 Å²	32.6	3%	0.025	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	143.5	178.3	0	0	0	0	0	109	C666 F940 L941 H1062	C666-A1018 HydrophobicContact CB-CB 4.06Å; F940-A1018 HydrophobicContact CD1-CB 4.19Å; L941-A1018 PolarHBondContact N-O 3.31Å; A1018-H1062 WeakPolarHBondContact CA-O 3.39Å
1019	C	94.4	Very high	80.2	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.5	175.3	179.3	0	0	0	0	108.5	L941 L1013 V1061 H1062 L1063 T1064	L941-C1019 HydrophobicContact CB-CB 4.46Å; L941-C1019 CarbonylContact O-C 3.47Å; L941-C1019 WeakPolarHBondContact O-CA 3.38Å; L1013-C1019 HydrophobicContact CD1-CB 4.27Å; C1019-V1061 HydrophobicContact CB-CG1 4.09Å; C1019-H1062 PolarHBondContact N-O 3.44Å; C1019-L1063 HydrophobicContact CB-CD1 4.18Å; C1019-L1063 CarbonylContact O-C 3.59Å; C1019-L1063 WeakPolarHBondContact O-CA 3.41Å; C1019-T1064 PolarHBondContact O-N 3.43Å
1020	V	94.5	Very high	78.1	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.006	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.1	176.4	179.9	0	0	0	0	108.8	M662 C666 L941 V942 C943 F958 L1022 T1064	M662-V1020 HydrophobicContact CE-CG1 3.64Å; C666-V1020 WeakPolarHBondContact SG-CG2 3.47Å; L941-V1020 PolarHBondContact O-N 2.9Å; V942-V1020 CarbonylContact C-O 3.54Å; V942-V1020 WeakPolarHBondContact CA-O 3.45Å; C943-V1020 PolarHBondContact N-O 3.16Å; F958-V1020 HydrophobicContact CE2-CB 4.47Å; F958-V1020 HydrophobicContact CE2-CG1 4.18Å; F958-V1020 HydrophobicContact CE2-CG2 4.12Å; F958-V1020 HydrophobicContact CZ-CB 4.23Å; F958-V1020 HydrophobicContact CZ-CG1 4.41Å; F958-V1020 HydrophobicContact CZ-CG2 3.84Å; V1020-L1022 HydrophobicContact CG1-CD2 3.85Å; V1020-L1022 HydrophobicContact CG1-CG 4.23Å; V1020-T1064 CarbonylContact C-O 3.58Å; V1020-T1064 VanDerWaalsContact CA-O 3.31Å; V1020-T1064 WeakPolarHBondContact CA-O 3.38Å
1021	V	93.7	Very high	76	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	114.5	175.5	-174.9	0	0	0	0	108.1	C943 A945 T1043 C1046 I1050 L1063 T1064 T1065 E1066	C943-V1021 HydrophobicContact CB-CG2 4.28Å; C943-V1021 WeakPolarHBondContact O-CA 3.26Å; A945-V1021 HydrophobicContact CB-CG1 4.17Å; V1021-T1043 HydrophobicContact CG1-CG2 3.89Å; V1021-C1046 HydrophobicContact CG1-CB 4.34Å; V1021-I1050 HydrophobicContact CG2-CD1 3.73Å; V1021-L1063 HydrophobicContact CG2-CD1 3.7Å; V1021-T1064 PolarHBondContact N-O 3.47Å; V1021-T1065 HydrophobicContact CB-CG2 4.23Å; V1021-T1065 HydrophobicContact CG2-CG2 4.4Å; V1021-E1066 PolarHBondContact O-N 2.82Å
1022	L	90	Very high	73.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	122.4	173.7	-58.6	179.6	0	0	0	108.2	L659 M662 V942 C943 A945 L955 V1020 Y1024	L659-L1022 HydrophobicContact CD2-CD1 4.47Å; L659-L1022 HydrophobicContact CD2-CD2 4.24Å; M662-L1022 HydrophobicContact CE-CD2 3.65Å; M662-L1022 HydrophobicContact SD-CD2 4.25Å; V942-L1022 HydrophobicContact CG1-CD1 3.89Å; V942-L1022 HydrophobicContact CG1-CG 4.3Å; C943-L1022 PolarHBondContact O-N 3.42Å; A945-L1022 PolarHBondContact N-O 3.07Å; L955-L1022 HydrophobicContact CD2-CD1 3.74Å; V1020-L1022 HydrophobicContact CG1-CD2 3.85Å; V1020-L1022 HydrophobicContact CG1-CG 4.23Å; L1022-Y1024 HydrophobicContact CB-CE2 3.82Å
1023	G	79.1	Confident	71.7	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	134.1	179.1	0	0	0	0	0	111.7	T1043 H1068	G1023-T1043 WeakPolarHBondContact CA-OG1 3.44Å; G1023-H1068 PolarHBondContact O-CE1 3.21Å
1024	Y	73.6	Confident	70.2	Confident	24 Å²	24	57 Å²	57	9%	0.094	31%	0.314	C	S	.	.			trans	-128.9	117.6	168.4	-68.6	-88.1	0	0	0	109.1	V944 A945 L953 L1022 A1026	V944-Y1024 HydrophobicContact CG1-CD2 3.85Å; V944-Y1024 HydrophobicContact CG1-CE2 4Å; A945-Y1024 PolarHBondContact O-N 2.86Å; L953-Y1024 HydrophobicContact CD2-CD1 4.06Å; L953-Y1024 HydrophobicContact CD2-CD2 3.87Å; L953-Y1024 HydrophobicContact CD2-CE1 3.56Å; L953-Y1024 HydrophobicContact CD2-CE2 3.36Å; L953-Y1024 HydrophobicContact CD2-CG 4.2Å; L953-Y1024 WeakPolarHBondContact CD2-OH 3.48Å; L1022-Y1024 HydrophobicContact CB-CE2 3.82Å; Y1024-A1026 PolarHBondContact O-N 3.15Å
1025	S	62.2	Low	69.5	Low	48 Å²	48	60.9 Å²	60.9	34%	0.336	33%	0.334	S	S	.	.			trans	-77.1	111	176.3	-169.9	0	0	0	0	109.5	E1027	S1025-E1027 PolarHBondContact O-N 2.99Å
1026	A	51.5	Low	68.9	Low	39 Å²	39	60 Å²	60	32%	0.322	34%	0.336	S	S	.	.			trans	-78.7	87.8	164.5	0	0	0	0	0	107.7	K947 Y1024	K947-A1026 HydrophobicContact CB-CB 4.18Å; K947-A1026 WeakPolarHBondContact O-CB 3.48Å; Y1024-A1026 PolarHBondContact O-N 3.15Å
1027	E	52	Low	68.4	Low	48 Å²	48	62 Å²	62	22%	0.224	35%	0.35	C	S	.	.			trans	-86.3	115.1	165.6	-79.2	177.2	-142.4	0	0	108.3	K599 S1025	K599-E1027 WeakPolarHBondContact CE-OE2 3.43Å; K599-E1027 IonicContact NZ-OE2 2.64Å; K599-E1027 PolarHBondContact NZ-OE2 2.98Å; S1025-E1027 PolarHBondContact O-N 2.99Å
1028	E	49	Very low	68.2	Low	149 Å²	149	63 Å²	63	70%	0.696	36%	0.355	S	S	*	.			trans	-55.6	138.8	166.4	-70.3	177.7	178.3	0	0	108.5	H1030 S1031	E1028-H1030 PolarHBondContact O-N 3.25Å; E1028-S1031 PolarHBondContact O-N 2.92Å
1029	P	44.8	Very low	67.6	Low	109 Å²	109	65.1 Å²	65.1	71%	0.708	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-6.2	-173.9	20.1	-30.8	0	0	0	114.8
1030	H	44.3	Very low	67.1	Low	169 Å²	169	65.1 Å²	65.1	78%	0.782	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	-2.2	-173.2	-58.5	-59	0	0	0	115.9	E1028 Q1032	E1028-H1030 PolarHBondContact O-N 3.25Å; H1030-Q1032 PolarHBondContact O-N 3.01Å
1031	S	47.4	Very low	66.8	Low	52 Å²	52	72.7 Å²	72.7	36%	0.364	39%	0.393	S	S	.	.			trans	-90.7	79.9	172.8	82	0	0	0	0	111	E1028 C1033	E1028-S1031 PolarHBondContact O-N 2.92Å; S1031-C1033 PolarHBondContact O-N 3.46Å
1032	Q	42.6	Very low	66.5	Low	185 Å²	185	75.2 Å²	75.2	86%	0.864	41%	0.408	S	S	*	.			trans	-69.7	125.2	165.9	-68.7	173.9	-5.2	0	0	107.9	H1030	H1030-Q1032 PolarHBondContact O-N 3.01Å
1033	C	48.3	Very low	66.4	Low	133 Å²	133	75.4 Å²	75.4	90%	0.899	41%	0.409	S	S	*	.			trans	81.1	75.7	-170.5	-75.9	0	0	0	0	116.7	S1031	S1031-C1033 PolarHBondContact O-N 3.46Å
1034	V	58.3	Low	67	Low	52 Å²	52	76.4 Å²	76.4	32%	0.315	42%	0.415	S	S	.	.			trans	-100.6	126	152.1	-178.1	0	0	0	0	107.3	L1038	V1034-L1038 HydrophobicContact CG1-CB 3.78Å
1035	D	72.6	Confident	67.8	Low	102 Å²	102	79.8 Å²	79.8	55%	0.545	43%	0.434	S	S	.	.			trans	-53.8	138.6	174.5	-72.5	-39.7	0	0	0	110.4	S1037 L1038	D1035-S1037 PolarHBondContact O-N 3.48Å; D1035-L1038 HydrophobicContact CB-CD1 4.31Å; D1035-L1038 HydrophobicContact CB-CG 4.32Å; D1035-L1038 PolarHBondContact O-N 2.95Å
1036	P	76	Confident	69.2	Low	74 Å²	74	77.5 Å²	77.5	48%	0.481	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-58.6	-25.4	-179.3	23.3	-33.6	0	0	0	112.6	L1038 Y1069	P1036-L1038 VanDerWaalsContact C-N 3.32Å; P1036-L1038 PolarHBondContact O-N 3.23Å; P1036-Y1069 HydrophobicContact CB-CD2 4.3Å; P1036-Y1069 HydrophobicContact CB-CE2 4.43Å; P1036-Y1069 WeakPolarHBondContact O-CB 3.38Å
1037	S	80.8	Confident	71.1	Confident	51 Å²	51	75.6 Å²	75.6	36%	0.357	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-66	-30.1	173.8	54.1	0	0	0	0	113.5	D1035 N1072	D1035-S1037 PolarHBondContact O-N 3.48Å; S1037-N1072 PolarHBondContact O-ND2 3.16Å
1038	L	84	Confident	72.9	Confident	85 Å²	85	76.3 Å²	76.3	45%	0.445	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-88.4	-5.7	-176.4	-66.5	177.1	0	0	0	113.7	V1034 D1035 P1036 D1040 R1041	V1034-L1038 HydrophobicContact CG1-CB 3.78Å; D1035-L1038 HydrophobicContact CB-CD1 4.31Å; D1035-L1038 HydrophobicContact CB-CG 4.32Å; D1035-L1038 PolarHBondContact O-N 2.95Å; P1036-L1038 VanDerWaalsContact C-N 3.32Å; P1036-L1038 PolarHBondContact O-N 3.23Å; L1038-D1040 PolarHBondContact O-N 3.37Å; L1038-R1041 WeakPolarHBondContact O-CB 3.39Å; L1038-R1041 WeakPolarHBondContact O-CG 3.14Å; L1038-R1041 PolarHBondContact O-N 3.34Å
1039	Q	79.7	Confident	74.9	Confident	46 Å²	46	70.9 Å²	70.9	22%	0.215	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-34.2	-179	-166.5	174.5	17.6	0	0	112.6	H1068	Q1039-H1068 HydrophobicContact CG-CB 4.2Å
1040	D	85.6	Confident	77.2	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	10.3	-177.7	-64.3	-48.6	0	0	0	114	L1038 V1042 T1043 L1044 L1067 H1068 Y1069 N1072	L1038-D1040 PolarHBondContact O-N 3.37Å; D1040-V1042 VanDerWaalsContact C-N 3.32Å; D1040-V1042 PolarHBondContact O-N 2.8Å; D1040-V1042 VanDerWaalsContact O-N 3.16Å; D1040-T1043 PolarHBondContact O-N 2.97Å; D1040-T1043 VanDerWaalsContact O-N 3.1Å; D1040-L1044 HydrophobicContact CB-CD1 3.92Å; D1040-L1044 HydrophobicContact CB-CG 3.96Å; D1040-L1044 WeakPolarHBondContact O-CB 3.43Å; D1040-L1044 VanDerWaalsContact O-CG 3.31Å; D1040-L1044 WeakPolarHBondContact O-CG 3.27Å; D1040-L1044 PolarHBondContact O-N 3.37Å; D1040-L1067 HydrophobicContact CB-CD2 4.19Å; D1040-H1068 WeakPolarHBondContact OD1-CB 3.34Å; D1040-H1068 IonicContact OD1-CE1 3.72Å; D1040-H1068 IonicContact OD1-CG 3.05Å; D1040-H1068 PolarHBondContact OD1-N 3.27Å; D1040-H1068 IonicContact OD1-ND1 2.67Å; D1040-H1068 PolarHBondContact OD1-ND1 3.01Å; D1040-H1068 PolarHBondContact OD2-N 2.99Å; D1040-Y1069 PolarHBondContact OD2-N 3.03Å; D1040-N1072 PolarHBondContact OD2-ND2 3.14Å
1041	R	87.3	Confident	79.3	Confident	160 Å²	160	60.9 Å²	60.9	60%	0.604	32%	0.324	S	S	*	.	H	α-helix	trans	-52.3	-43.8	-170.5	67.6	-173.2	178.8	172.4	-2.5	114.4	L1038 L1045	L1038-R1041 WeakPolarHBondContact O-CB 3.39Å; L1038-R1041 WeakPolarHBondContact O-CG 3.14Å; L1038-R1041 PolarHBondContact O-N 3.34Å; R1041-L1045 WeakPolarHBondContact O-CB 3.48Å; R1041-L1045 PolarHBondContact O-N 3.15Å
1042	V	86.9	Confident	81.2	Confident	54 Å²	54	60.7 Å²	60.7	33%	0.327	32%	0.322	S	S	.	.	H	α-helix	trans	-74	-40.6	-178.1	-176.7	0	0	0	0	110.6	A945 D1040 L1045 C1046	A945-V1042 HydrophobicContact CB-CG1 4.38Å; D1040-V1042 VanDerWaalsContact C-N 3.32Å; D1040-V1042 PolarHBondContact O-N 2.8Å; D1040-V1042 VanDerWaalsContact O-N 3.16Å; V1042-L1045 PolarHBondContact O-N 3.44Å; V1042-C1046 WeakPolarHBondContact O-CB 3.43Å; V1042-C1046 PolarHBondContact O-N 3.06Å
1043	T	89.4	Confident	83.3	Confident	3 Å²	3	53.4 Å²	53.4	2%	0.018	29%	0.289	C	S	.	.	H	α-helix	trans	-65.2	-44.4	179.1	-46.4	0	0	0	0	111.4	V1021 G1023 D1040 C1046 A1047 E1066	V1021-T1043 HydrophobicContact CG1-CG2 3.89Å; G1023-T1043 WeakPolarHBondContact CA-OG1 3.44Å; D1040-T1043 PolarHBondContact O-N 2.97Å; D1040-T1043 VanDerWaalsContact O-N 3.1Å; T1043-C1046 PolarHBondContact O-N 3.28Å; T1043-A1047 VanDerWaalsContact O-CB 3.29Å; T1043-A1047 WeakPolarHBondContact O-CB 3.37Å; T1043-A1047 PolarHBondContact O-N 2.66Å; T1043-E1066 WeakPolarHBondContact CG2-O 3.28Å
1044	L	90.2	Very high	85.2	Confident	21 Å²	21	47.7 Å²	47.7	11%	0.11	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-47.3	174.1	-70.8	170	0	0	0	111	D1040 C1046 A1047 M1048 L1067 N1072 L1075 F1076	D1040-L1044 HydrophobicContact CB-CD1 3.92Å; D1040-L1044 HydrophobicContact CB-CG 3.96Å; D1040-L1044 WeakPolarHBondContact O-CB 3.43Å; D1040-L1044 VanDerWaalsContact O-CG 3.31Å; D1040-L1044 WeakPolarHBondContact O-CG 3.27Å; D1040-L1044 PolarHBondContact O-N 3.37Å; L1044-C1046 PolarHBondContact O-N 3.41Å; L1044-A1047 PolarHBondContact O-N 2.92Å; L1044-M1048 WeakPolarHBondContact O-CB 3.36Å; L1044-M1048 VanDerWaalsContact O-CG 3.25Å; L1044-M1048 WeakPolarHBondContact O-CG 3.33Å; L1044-M1048 PolarHBondContact O-N 3.33Å; L1044-L1067 HydrophobicContact CD2-CD2 3.8Å; L1044-L1067 HydrophobicContact CG-CD2 4.38Å; L1044-N1072 HydrophobicContact CD1-CB 4.17Å; L1044-L1075 HydrophobicContact CD1-CD1 3.79Å; L1044-L1075 HydrophobicContact CD2-CD1 4.27Å; L1044-F1076 HydrophobicContact CD2-CD2 4.5Å; L1044-F1076 HydrophobicContact CD2-CE2 3.54Å; L1044-F1076 HydrophobicContact CD2-CZ 3.86Å
1045	L	90.5	Very high	86.3	Confident	95 Å²	95	52.1 Å²	52.1	50%	0.497	27%	0.267	S	S	.	.	H	α-helix	trans	-58.5	-47.9	178	-178.1	65.6	0	0	0	111.8	R1041 V1042 M1048 N1049	R1041-L1045 WeakPolarHBondContact O-CB 3.48Å; R1041-L1045 PolarHBondContact O-N 3.15Å; V1042-L1045 PolarHBondContact O-N 3.44Å; L1045-M1048 PolarHBondContact O-N 3.36Å; L1045-N1049 WeakPolarHBondContact O-CB 3.45Å; L1045-N1049 VanDerWaalsContact O-CG 3.26Å; L1045-N1049 PolarHBondContact O-N 3Å
1046	C	91.7	Very high	86.7	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.4	-48.1	176.7	178.3	0	0	0	0	111.4	A945 V1021 V1042 T1043 L1044 M1048 N1049 I1050	A945-C1046 HydrophobicContact CB-CB 4.04Å; V1021-C1046 HydrophobicContact CG1-CB 4.34Å; V1042-C1046 WeakPolarHBondContact O-CB 3.43Å; V1042-C1046 PolarHBondContact O-N 3.06Å; T1043-C1046 PolarHBondContact O-N 3.28Å; L1044-C1046 PolarHBondContact O-N 3.41Å; C1046-M1048 PolarHBondContact O-N 2.89Å; C1046-N1049 PolarHBondContact O-N 3.42Å; C1046-I1050 WeakPolarHBondContact O-CG1 3.41Å; C1046-I1050 PolarHBondContact O-N 3.48Å
1047	A	92.5	Very high	86.7	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.3	-39.8	179.1	0	0	0	0	0	113	T1043 L1044 I1050 R1051 L1063 T1065 F1076	T1043-A1047 VanDerWaalsContact O-CB 3.29Å; T1043-A1047 WeakPolarHBondContact O-CB 3.37Å; T1043-A1047 PolarHBondContact O-N 2.66Å; L1044-A1047 PolarHBondContact O-N 2.92Å; A1047-I1050 PolarHBondContact O-N 2.83Å; A1047-R1051 VanDerWaalsContact O-CB 3.29Å; A1047-R1051 WeakPolarHBondContact O-CB 3.35Å; A1047-R1051 PolarHBondContact O-N 3.49Å; A1047-L1063 HydrophobicContact CB-CD2 4.37Å; A1047-T1065 HydrophobicContact CB-CG2 3.49Å; A1047-T1065 VanDerWaalsContact CB-CG2 3.49Å; A1047-F1076 HydrophobicContact CB-CE1 3.74Å; A1047-F1076 HydrophobicContact CB-CZ 3.67Å
1048	M	89.7	Confident	86.3	Confident	62 Å²	62	61.2 Å²	61.2	31%	0.305	29%	0.291	S	S	.	.	H	α-helix	trans	-67.5	-39.7	175.9	-69.8	-56.1	179.6	0	0	111.9	L1044 L1045 C1046 R1051 S1052 L1075 F1076	L1044-M1048 WeakPolarHBondContact O-CB 3.36Å; L1044-M1048 VanDerWaalsContact O-CG 3.25Å; L1044-M1048 WeakPolarHBondContact O-CG 3.33Å; L1044-M1048 PolarHBondContact O-N 3.33Å; L1045-M1048 PolarHBondContact O-N 3.36Å; C1046-M1048 PolarHBondContact O-N 2.89Å; M1048-R1051 PolarHBondContact O-N 3.41Å; M1048-S1052 VanDerWaalsContact O-CB 3.32Å; M1048-S1052 WeakPolarHBondContact O-CB 3.14Å; M1048-S1052 PolarHBondContact O-N 3.05Å; M1048-L1075 HydrophobicContact CE-CB 3.95Å; M1048-L1075 WeakPolarHBondContact CE-O 3.33Å; M1048-F1076 HydrophobicContact CE-CD1 4.07Å; M1048-F1076 HydrophobicContact CE-CE1 4.1Å; M1048-F1076 HydrophobicContact CE-CG 4.46Å; M1048-F1076 HydrophobicContact SD-CD1 4.49Å; M1048-F1076 HydrophobicContact SD-CE1 4.35Å
1049	N	91.2	Very high	85.4	Confident	35 Å²	35	61.9 Å²	61.9	19%	0.187	29%	0.292	C	S	.	.	H	α-helix	trans	-61.9	-47.2	174.8	-74.5	-7.6	0	0	0	111.3	F1005 L1045 C1046 R1051 S1052 L1053	F1005-N1049 HydrophobicContact CE1-CB 4.4Å; F1005-N1049 HydrophobicContact CZ-CB 4.32Å; L1045-N1049 WeakPolarHBondContact O-CB 3.45Å; L1045-N1049 VanDerWaalsContact O-CG 3.26Å; L1045-N1049 PolarHBondContact O-N 3Å; C1046-N1049 PolarHBondContact O-N 3.42Å; N1049-R1051 PolarHBondContact O-N 2.83Å; N1049-S1052 PolarHBondContact O-N 3.17Å; N1049-L1053 WeakPolarHBondContact O-CG 3.17Å; N1049-L1053 PolarHBondContact O-N 3.12Å; N1049-L1053 VanDerWaalsContact O-N 3.11Å
1050	I	92	Very high	85.1	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60	-47.4	176	-70.9	165.3	0	0	0	110.5	L1008 L1013 V1021 C1046 A1047 S1052 L1053 L1054 L1063	L1008-I1050 HydrophobicContact CD1-CG1 3.82Å; L1008-I1050 HydrophobicContact CD2-CD1 4.31Å; L1008-I1050 HydrophobicContact CD2-CG1 4.1Å; L1013-I1050 HydrophobicContact CD1-CG2 4.03Å; L1013-I1050 HydrophobicContact CD2-CG1 4.47Å; L1013-I1050 HydrophobicContact CD2-CG2 4.08Å; V1021-I1050 HydrophobicContact CG2-CD1 3.73Å; C1046-I1050 WeakPolarHBondContact O-CG1 3.41Å; C1046-I1050 PolarHBondContact O-N 3.48Å; A1047-I1050 PolarHBondContact O-N 2.83Å; I1050-S1052 VanDerWaalsContact C-N 3.33Å; I1050-S1052 PolarHBondContact O-N 3.13Å; I1050-L1053 PolarHBondContact O-N 2.92Å; I1050-L1054 HydrophobicContact CG2-CD1 3.76Å; I1050-L1054 HydrophobicContact CG2-CG 4.33Å; I1050-L1054 VanDerWaalsContact O-CG 3.3Å; I1050-L1054 WeakPolarHBondContact O-CG 3.39Å; I1050-L1054 PolarHBondContact O-N 2.81Å; I1050-L1063 HydrophobicContact CG2-CD1 4.05Å; I1050-L1063 HydrophobicContact CG2-CD2 4.44Å
1051	R	88	Confident	84.9	Confident	69 Å²	69	68.5 Å²	68.5	26%	0.26	33%	0.329	S	S	.	.	H	α-helix	trans	-60.3	-42.3	178.3	-178.6	177.2	170.2	160.3	-4.3	112	A1047 M1048 N1049 L1053 L1054 Q1055 L1063 F1076	A1047-R1051 VanDerWaalsContact O-CB 3.29Å; A1047-R1051 WeakPolarHBondContact O-CB 3.35Å; A1047-R1051 PolarHBondContact O-N 3.49Å; M1048-R1051 PolarHBondContact O-N 3.41Å; N1049-R1051 PolarHBondContact O-N 2.83Å; R1051-L1053 VanDerWaalsContact C-N 3.35Å; R1051-L1053 PolarHBondContact O-N 3.1Å; R1051-L1054 PolarHBondContact O-N 3.28Å; R1051-Q1055 WeakPolarHBondContact O-CB 3.32Å; R1051-Q1055 PolarHBondContact O-N 2.84Å; R1051-L1063 HydrophobicContact CB-CD2 4.46Å; R1051-F1076 PolarHBondContact NH1-O 3.11Å
1052	S	87.2	Confident	84.9	Confident	48 Å²	48	62 Å²	62	34%	0.336	31%	0.305	S	S	.	.	H	α-helix	trans	-60.6	-41.8	177.3	-177.9	0	0	0	0	112.1	M1048 N1049 I1050 K1056	M1048-S1052 VanDerWaalsContact O-CB 3.32Å; M1048-S1052 WeakPolarHBondContact O-CB 3.14Å; M1048-S1052 PolarHBondContact O-N 3.05Å; N1049-S1052 PolarHBondContact O-N 3.17Å; I1050-S1052 VanDerWaalsContact C-N 3.33Å; I1050-S1052 PolarHBondContact O-N 3.13Å; S1052-K1056 WeakPolarHBondContact O-CG 3.37Å; S1052-K1056 PolarHBondContact O-N 3.07Å; S1052-K1056 VanDerWaalsContact O-N 3.16Å
1053	L	87.8	Confident	85.2	Confident	32 Å²	32	60 Å²	60	17%	0.168	29%	0.293	C	S	.	.	H	α-helix	trans	-65.7	-49	175.2	-69.3	170.2	0	0	0	112.6	F1005 L1008 L1013 N1049 I1050 R1051 Q1055 K1056 E1057	F1005-L1053 HydrophobicContact CD1-CD1 3.5Å; F1005-L1053 VanDerWaalsContact CD1-CD1 3.5Å; F1005-L1053 HydrophobicContact CD1-CD2 3.58Å; F1005-L1053 HydrophobicContact CD1-CG 3.75Å; F1005-L1053 HydrophobicContact CE1-CD1 3.77Å; F1005-L1053 HydrophobicContact CE1-CD2 3.69Å; F1005-L1053 HydrophobicContact CE1-CG 3.64Å; L1008-L1053 HydrophobicContact CB-CD1 4.43Å; L1008-L1053 HydrophobicContact CD1-CD1 3.87Å; L1013-L1053 HydrophobicContact CD2-CB 4.27Å; L1013-L1053 HydrophobicContact CD2-CD1 3.97Å; N1049-L1053 WeakPolarHBondContact O-CG 3.17Å; N1049-L1053 PolarHBondContact O-N 3.12Å; N1049-L1053 VanDerWaalsContact O-N 3.11Å; I1050-L1053 PolarHBondContact O-N 2.92Å; R1051-L1053 VanDerWaalsContact C-N 3.35Å; R1051-L1053 PolarHBondContact O-N 3.1Å; L1053-Q1055 VanDerWaalsContact C-N 3.25Å; L1053-Q1055 PolarHBondContact O-N 3.39Å; L1053-K1056 WeakPolarHBondContact O-CB 3.05Å; L1053-K1056 PolarHBondContact O-N 2.91Å; L1053-K1056 VanDerWaalsContact O-N 3.14Å; L1053-E1057 PolarHBondContact O-N 3.28Å; L1053-E1057 VanDerWaalsContact O-N 3.08Å
1054	L	86.9	Confident	85.4	Confident	13 Å²	13	60 Å²	60	7%	0.068	29%	0.292	C	S	.	.	H	α-helix	trans	-61.3	-37.1	-179	-68.9	173	0	0	0	111.9	L1013 I1050 R1051 E1057 Q1058 H1059 V1061	L1013-L1054 HydrophobicContact CD2-CD2 4.39Å; L1013-L1054 HydrophobicContact CD2-CG 4.43Å; L1013-L1054 HydrophobicContact CG-CD2 4.1Å; I1050-L1054 HydrophobicContact CG2-CD1 3.76Å; I1050-L1054 HydrophobicContact CG2-CG 4.33Å; I1050-L1054 VanDerWaalsContact O-CG 3.3Å; I1050-L1054 WeakPolarHBondContact O-CG 3.39Å; I1050-L1054 PolarHBondContact O-N 2.81Å; R1051-L1054 PolarHBondContact O-N 3.28Å; L1054-E1057 PolarHBondContact O-N 3.32Å; L1054-Q1058 PolarHBondContact O-N 2.97Å; L1054-Q1058 VanDerWaalsContact O-N 3.13Å; L1054-H1059 PolarHBondContact O-N 2.95Å; L1054-V1061 HydrophobicContact CD1-CB 3.82Å; L1054-V1061 HydrophobicContact CD1-CG1 4.2Å; L1054-V1061 HydrophobicContact CD2-CB 3.68Å; L1054-V1061 HydrophobicContact CD2-CG1 4.45Å; L1054-V1061 HydrophobicContact CD2-CG2 3.54Å; L1054-V1061 HydrophobicContact CG-CB 4.38Å
1055	Q	83	Confident	85.6	Confident	145 Å²	145	59 Å²	59	68%	0.678	29%	0.287	S	S	*	.	H	α-helix	trans	-67.3	-40.6	176.1	-172.9	173.8	-0.7	0	0	112.1	R1051 L1053 E1057 Q1058	R1051-Q1055 WeakPolarHBondContact O-CB 3.32Å; R1051-Q1055 PolarHBondContact O-N 2.84Å; L1053-Q1055 VanDerWaalsContact C-N 3.25Å; L1053-Q1055 PolarHBondContact O-N 3.39Å; Q1055-E1057 VanDerWaalsContact C-N 3.33Å; Q1055-E1057 PolarHBondContact O-N 3.05Å; Q1055-Q1058 PolarHBondContact O-N 3.15Å
1056	K	80.9	Confident	85.6	Confident	158 Å²	158	54.5 Å²	54.5	69%	0.687	26%	0.264	S	S	*	.	H	α-helix	trans	-62.5	-39.6	176.1	-75.5	175.6	-176.8	-178.2	0	112.3	S1052 L1053	S1052-K1056 WeakPolarHBondContact O-CG 3.37Å; S1052-K1056 PolarHBondContact O-N 3.07Å; S1052-K1056 VanDerWaalsContact O-N 3.16Å; L1053-K1056 WeakPolarHBondContact O-CB 3.05Å; L1053-K1056 PolarHBondContact O-N 2.91Å; L1053-K1056 VanDerWaalsContact O-N 3.14Å
1057	E	76.1	Confident	85.5	Confident	81 Å²	81	54.5 Å²	54.5	38%	0.379	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	0.7	-178	-61.6	-168.4	-159.6	0	0	114.3	C1014 L1053 L1054 Q1055 H1059	C1014-E1057 WeakPolarHBondContact CB-OE2 3.31Å; C1014-E1057 PolarHBondContact SG-OE1 3.34Å; C1014-E1057 VanDerWaalsContact SG-OE1 3.4Å; C1014-E1057 PolarHBondContact SG-OE2 2.89Å; L1053-E1057 PolarHBondContact O-N 3.28Å; L1053-E1057 VanDerWaalsContact O-N 3.08Å; L1054-E1057 PolarHBondContact O-N 3.32Å; Q1055-E1057 VanDerWaalsContact C-N 3.33Å; Q1055-E1057 PolarHBondContact O-N 3.05Å; E1057-H1059 PolarHBondContact O-CD2 3.37Å; E1057-H1059 PolarHBondContact O-N 2.94Å; E1057-H1059 VanDerWaalsContact O-N 3.15Å; E1057-H1059 IonicContact OE2-CD2 2.65Å
1058	Q	71.5	Confident	85.2	Confident	178 Å²	178	55.2 Å²	55.2	83%	0.832	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	29.3	-179.1	-57.7	-175.3	-13.5	0	0	114.2	L1054 Q1055	L1054-Q1058 PolarHBondContact O-N 2.97Å; L1054-Q1058 VanDerWaalsContact O-N 3.13Å; Q1055-Q1058 PolarHBondContact O-N 3.15Å
1059	H	66	Low	85	Confident	99 Å²	99	55.2 Å²	55.2	46%	0.458	26%	0.264	S	S	.	.			trans	-96.2	131.2	-179.7	-83.5	-63.2	0	0	0	112.1	L1054 E1057 V1061	L1054-H1059 PolarHBondContact O-N 2.95Å; E1057-H1059 PolarHBondContact O-CD2 3.37Å; E1057-H1059 PolarHBondContact O-N 2.94Å; E1057-H1059 VanDerWaalsContact O-N 3.15Å; E1057-H1059 IonicContact OE2-CD2 2.65Å; H1059-V1061 VanDerWaalsContact C-N 3.32Å; H1059-V1061 PolarHBondContact O-N 3.1Å
1060	L	73.2	Confident	84.7	Confident	166 Å²	166	55.9 Å²	55.9	87%	0.869	27%	0.266	S	S	*	.			trans	-85.2	67.5	-179.8	-68	165.5	0	0	0	111.4
1061	V	81.6	Confident	84.4	Confident	20 Å²	20	60.8 Å²	60.8	12%	0.121	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-87	131.4	169.9	175.8	0	0	0	0	109.3	C1016 C1019 L1054 H1059 L1063	C1016-V1061 WeakPolarHBondContact SG-CG1 3.37Å; C1019-V1061 HydrophobicContact CB-CG1 4.09Å; L1054-V1061 HydrophobicContact CD1-CB 3.82Å; L1054-V1061 HydrophobicContact CD1-CG1 4.2Å; L1054-V1061 HydrophobicContact CD2-CB 3.68Å; L1054-V1061 HydrophobicContact CD2-CG1 4.45Å; L1054-V1061 HydrophobicContact CD2-CG2 3.54Å; L1054-V1061 HydrophobicContact CG-CB 4.38Å; H1059-V1061 VanDerWaalsContact C-N 3.32Å; H1059-V1061 PolarHBondContact O-N 3.1Å; V1061-L1063 PolarHBondContact O-N 3.32Å
1062	H	87.1	Confident	84.4	Confident	22 Å²	22	57.9 Å²	57.9	10%	0.102	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	120.2	172.2	-175.9	57.6	0	0	0	110	P669 A1018 C1019 T1064 G1099	P669-H1062 HydrophobicContact CB-CB 4.19Å; P669-H1062 HydrophobicContact CG-CB 3.87Å; A1018-H1062 WeakPolarHBondContact CA-O 3.39Å; C1019-H1062 PolarHBondContact N-O 3.44Å; H1062-T1064 PolarHBondContact NE2-OG1 3.07Å; H1062-G1099 PolarHBondContact CE1-O 3.26Å; H1062-G1099 VanDerWaalsContact CE1-O 3.28Å; H1062-G1099 PolarHBondContact NE2-O 2.87Å
1063	L	92.3	Very high	84.5	Confident	14 Å²	14	55.7 Å²	55.7	7%	0.073	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	127.7	174.2	179.1	63.7	0	0	0	109.1	C1019 V1021 A1047 I1050 R1051 V1061 T1065 I1100	C1019-L1063 HydrophobicContact CB-CD1 4.18Å; C1019-L1063 CarbonylContact O-C 3.59Å; C1019-L1063 WeakPolarHBondContact O-CA 3.41Å; V1021-L1063 HydrophobicContact CG2-CD1 3.7Å; A1047-L1063 HydrophobicContact CB-CD2 4.37Å; I1050-L1063 HydrophobicContact CG2-CD1 4.05Å; I1050-L1063 HydrophobicContact CG2-CD2 4.44Å; R1051-L1063 HydrophobicContact CB-CD2 4.46Å; V1061-L1063 PolarHBondContact O-N 3.32Å; L1063-T1065 HydrophobicContact CD1-CG2 4.23Å; L1063-T1065 HydrophobicContact CD2-CG2 4.13Å; L1063-T1065 HydrophobicContact CG-CG2 3.92Å; L1063-I1100 WeakPolarHBondContact O-CA 3.19Å
1064	T	94	Very high	84.4	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.8	167.1	-55.5	0	0	0	0	109.6	M662 N665 C1019 V1020 V1021 H1062 I1100	M662-T1064 HydrophobicContact CE-CG2 4.07Å; N665-T1064 PolarHBondContact ND2-OG1 2.71Å; C1019-T1064 PolarHBondContact O-N 3.43Å; V1020-T1064 CarbonylContact C-O 3.58Å; V1020-T1064 VanDerWaalsContact CA-O 3.31Å; V1020-T1064 WeakPolarHBondContact CA-O 3.38Å; V1021-T1064 PolarHBondContact N-O 3.47Å; H1062-T1064 PolarHBondContact NE2-OG1 3.07Å; T1064-I1100 CarbonylContact C-O 3.47Å; T1064-I1100 WeakPolarHBondContact CA-O 3.4Å
1065	T	94	Very high	84.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.6	-176.3	59.8	0	0	0	0	110.1	V1021 A1047 L1063 F1076 I1100 F1102	V1021-T1065 HydrophobicContact CB-CG2 4.23Å; V1021-T1065 HydrophobicContact CG2-CG2 4.4Å; A1047-T1065 HydrophobicContact CB-CG2 3.49Å; A1047-T1065 VanDerWaalsContact CB-CG2 3.49Å; L1063-T1065 HydrophobicContact CD1-CG2 4.23Å; L1063-T1065 HydrophobicContact CD2-CG2 4.13Å; L1063-T1065 HydrophobicContact CG-CG2 3.92Å; T1065-F1076 HydrophobicContact CG2-CE1 4.23Å; T1065-F1076 HydrophobicContact CG2-CZ 3.92Å; T1065-I1100 PolarHBondContact N-O 3.39Å; T1065-I1100 PolarHBondContact OG1-O 3.1Å; T1065-F1102 PolarHBondContact O-N 2.83Å
1066	E	91.4	Very high	84.6	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	133.5	166.6	-177.3	171.7	-173.3	0	0	110.1	K658 M662 V1021 T1043 F1102 N1104	K658-E1066 WeakPolarHBondContact CD-OE1 3.41Å; K658-E1066 WeakPolarHBondContact CE-OE1 3.2Å; K658-E1066 IonicContact NZ-OE1 3.4Å; K658-E1066 PolarHBondContact NZ-OE1 3.22Å; K658-E1066 IonicContact NZ-OE2 2.74Å; K658-E1066 PolarHBondContact NZ-OE2 3.06Å; M662-E1066 HydrophobicContact CE-CB 4.11Å; V1021-E1066 PolarHBondContact O-N 2.82Å; T1043-E1066 WeakPolarHBondContact CG2-O 3.28Å; E1066-F1102 WeakPolarHBondContact CA-O 3.48Å; E1066-N1104 PolarHBondContact OE1-ND2 2.81Å
1067	L	89.4	Confident	84.7	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	127.2	172.2	-67.7	178.7	0	0	0	110.4	D1040 L1044 A1073 F1076 I1101 F1102 S1103	D1040-L1067 HydrophobicContact CB-CD2 4.19Å; L1044-L1067 HydrophobicContact CD2-CD2 3.8Å; L1044-L1067 HydrophobicContact CG-CD2 4.38Å; L1067-A1073 HydrophobicContact CD1-CB 4.32Å; L1067-F1076 HydrophobicContact CD1-CE2 4.34Å; L1067-F1076 HydrophobicContact CD2-CE2 4.32Å; L1067-I1101 HydrophobicContact CD1-CB 4.05Å; L1067-I1101 HydrophobicContact CD1-CG2 3.55Å; L1067-I1101 HydrophobicContact CG-CG2 4.32Å; L1067-F1102 PolarHBondContact N-O 2.84Å; L1067-S1103 WeakPolarHBondContact O-CA 3.49Å; L1067-S1103 WeakPolarHBondContact O-CB 3.37Å; L1067-S1103 PolarHBondContact O-OG 3.42Å
1068	H	85.3	Confident	84.9	Confident	14 Å²	14	42.7 Å²	42.7	7%	0.065	21%	0.206	C	C	.	.	S	Bend	trans	-76.4	-41.3	173.3	-58.9	86.7	0	0	0	110.7	N597 G1023 Q1039 D1040	N597-H1068 VanDerWaalsContact CG-CD2 3.43Å; N597-H1068 WeakPolarHBondContact ND2-CA 3.45Å; N597-H1068 PolarHBondContact ND2-O 3.22Å; G1023-H1068 PolarHBondContact O-CE1 3.21Å; Q1039-H1068 HydrophobicContact CG-CB 4.2Å; D1040-H1068 WeakPolarHBondContact OD1-CB 3.34Å; D1040-H1068 IonicContact OD1-CE1 3.72Å; D1040-H1068 IonicContact OD1-CG 3.05Å; D1040-H1068 PolarHBondContact OD1-N 3.27Å; D1040-H1068 IonicContact OD1-ND1 2.67Å; D1040-H1068 PolarHBondContact OD1-ND1 3.01Å; D1040-H1068 PolarHBondContact OD2-N 2.99Å
1069	Y	85.5	Confident	84.8	Confident	62 Å²	62	37.3 Å²	37.3	24%	0.243	20%	0.199	C	C	.	.	S	Bend	trans	-103.8	104.3	176.3	-173.6	-123.2	0	0	0	110.7	P1036 D1040 K1071 N1072	P1036-Y1069 HydrophobicContact CB-CD2 4.3Å; P1036-Y1069 HydrophobicContact CB-CE2 4.43Å; P1036-Y1069 WeakPolarHBondContact O-CB 3.38Å; D1040-Y1069 PolarHBondContact OD2-N 3.03Å; Y1069-K1071 HydrophobicContact CD1-CB 4.1Å; Y1069-K1071 HydrophobicContact CE1-CB 3.57Å; Y1069-K1071 HydrophobicContact CE1-CD 4.36Å; Y1069-K1071 HydrophobicContact CE1-CG 4.09Å; Y1069-K1071 HydrophobicContact CE2-CB 4.49Å; Y1069-K1071 HydrophobicContact CE2-CG 4.2Å; Y1069-K1071 PolarHBondContact O-N 3.04Å; Y1069-K1071 VanDerWaalsContact O-N 3.08Å; Y1069-K1071 VanDerWaalsContact OH-CD 3.27Å; Y1069-K1071 WeakPolarHBondContact OH-CD 3.36Å; Y1069-N1072 WeakPolarHBondContact O-CB 3.49Å; Y1069-N1072 PolarHBondContact O-N 3.14Å
1070	E	85.6	Confident	84.9	Confident	50 Å²	50	40 Å²	40	23%	0.234	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-58.9	-27.2	-172.2	68.8	177.3	-160.4	0	0	114	N1072 A1073 V1090 T1105	E1070-N1072 VanDerWaalsContact C-N 3.26Å; E1070-N1072 PolarHBondContact O-N 3.05Å; E1070-A1073 WeakPolarHBondContact O-CB 3.39Å; E1070-A1073 PolarHBondContact O-N 2.68Å; E1070-V1090 HydrophobicContact CB-CG2 3.87Å; E1070-V1090 HydrophobicContact CG-CG2 3.8Å; E1070-V1090 VanDerWaalsContact O-CG2 3.32Å; E1070-V1090 WeakPolarHBondContact O-CG2 3.42Å; E1070-T1105 WeakPolarHBondContact OE2-CB 3.38Å; E1070-T1105 PolarHBondContact OE2-OG1 2.93Å
1071	K	86.2	Confident	84.9	Confident	103 Å²	103	32.2 Å²	32.2	45%	0.448	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-69.3	-24	178.4	-55.6	-163.7	-165.3	163.5	0	112.4	Y1069 A1073 Y1074	Y1069-K1071 HydrophobicContact CD1-CB 4.1Å; Y1069-K1071 HydrophobicContact CE1-CB 3.57Å; Y1069-K1071 HydrophobicContact CE1-CD 4.36Å; Y1069-K1071 HydrophobicContact CE1-CG 4.09Å; Y1069-K1071 HydrophobicContact CE2-CB 4.49Å; Y1069-K1071 HydrophobicContact CE2-CG 4.2Å; Y1069-K1071 PolarHBondContact O-N 3.04Å; Y1069-K1071 VanDerWaalsContact O-N 3.08Å; Y1069-K1071 VanDerWaalsContact OH-CD 3.27Å; Y1069-K1071 WeakPolarHBondContact OH-CD 3.36Å; K1071-A1073 PolarHBondContact O-N 3.39Å; K1071-Y1074 WeakPolarHBondContact O-CD1 3.34Å; K1071-Y1074 WeakPolarHBondContact O-CE1 3.38Å; K1071-Y1074 PolarHBondContact O-N 3.47Å
1072	N	88.6	Confident	84.4	Confident	8 Å²	8	34.4 Å²	34.4	4%	0.043	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-63.4	-8.1	175.6	-72.6	-18.3	0	0	0	113.3	S1037 D1040 L1044 Y1069 E1070 Y1074 L1075	S1037-N1072 PolarHBondContact O-ND2 3.16Å; D1040-N1072 PolarHBondContact OD2-ND2 3.14Å; L1044-N1072 HydrophobicContact CD1-CB 4.17Å; Y1069-N1072 WeakPolarHBondContact O-CB 3.49Å; Y1069-N1072 PolarHBondContact O-N 3.14Å; E1070-N1072 VanDerWaalsContact C-N 3.26Å; E1070-N1072 PolarHBondContact O-N 3.05Å; N1072-Y1074 PolarHBondContact O-N 2.86Å; N1072-L1075 HydrophobicContact CB-CD1 4.4Å; N1072-L1075 WeakPolarHBondContact O-CB 3.21Å; N1072-L1075 PolarHBondContact O-N 3.12Å
1073	A	88.7	Confident	83.6	Confident	2 Å²	2	41 Å²	41	2%	0.017	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-48.8	-42.8	174.1	0	0	0	0	0	113.4	L1067 E1070 K1071 L1075 F1076 V1090 P1095 I1101	L1067-A1073 HydrophobicContact CD1-CB 4.32Å; E1070-A1073 WeakPolarHBondContact O-CB 3.39Å; E1070-A1073 PolarHBondContact O-N 2.68Å; K1071-A1073 PolarHBondContact O-N 3.39Å; A1073-L1075 PolarHBondContact O-N 3.05Å; A1073-F1076 PolarHBondContact O-N 3.27Å; A1073-V1090 HydrophobicContact CB-CG1 4.19Å; A1073-P1095 HydrophobicContact CB-CG 4.27Å; A1073-P1095 VanDerWaalsContact O-CG 3.25Å; A1073-P1095 WeakPolarHBondContact O-CG 3.46Å; A1073-I1101 HydrophobicContact CB-CD1 3.41Å; A1073-I1101 VanDerWaalsContact CB-CD1 3.41Å
1074	Y	86.3	Confident	82.8	Confident	54 Å²	54	44.1 Å²	44.1	21%	0.212	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-58.2	-25.3	-172	73.7	-97.6	0	0	0	113	K1071 N1072 F1076 S1077 H1082 Y1086	K1071-Y1074 WeakPolarHBondContact O-CD1 3.34Å; K1071-Y1074 WeakPolarHBondContact O-CE1 3.38Å; K1071-Y1074 PolarHBondContact O-N 3.47Å; N1072-Y1074 PolarHBondContact O-N 2.86Å; Y1074-F1076 PolarHBondContact O-N 3.33Å; Y1074-F1076 VanDerWaalsContact O-N 3.17Å; Y1074-S1077 WeakPolarHBondContact CA-OG 3.17Å; Y1074-S1077 VanDerWaalsContact O-CB 3.23Å; Y1074-S1077 WeakPolarHBondContact O-CB 3.5Å; Y1074-S1077 PolarHBondContact O-N 2.81Å; Y1074-S1077 PolarHBondContact O-OG 2.8Å; Y1074-H1082 AromaticContact CD2-CD2 3.95Å; Y1074-H1082 AromaticContact CD2-CE1 3.5Å; Y1074-H1082 VanDerWaalsContact CD2-CE1 3.5Å; Y1074-H1082 WeakPolarHBondContact CD2-CE1 3.38Å; Y1074-H1082 AromaticContact CD2-NE2 3.26Å; Y1074-H1082 VanDerWaalsContact CD2-NE2 3.26Å; Y1074-H1082 WeakPolarHBondContact CD2-NE2 3.39Å; Y1074-H1082 AromaticContact CE2-CE1 3.59Å; Y1074-H1082 AromaticContact CE2-NE2 3.51Å; Y1074-H1082 PolarHBondContact O-CD2 3.11Å; Y1074-Y1086 AromaticContact CD1-CD2 3.55Å; Y1074-Y1086 HydrophobicContact CD1-CD2 3.55Å; Y1074-Y1086 HydrophobicContact CD1-CE2 4.22Å; Y1074-Y1086 HydrophobicContact CD2-CD2 4.39Å; Y1074-Y1086 AromaticContact CE1-CD2 3.57Å; Y1074-Y1086 HydrophobicContact CE1-CD2 3.57Å; Y1074-Y1086 AromaticContact CE1-CE2 3.84Å; Y1074-Y1086 HydrophobicContact CE1-CE2 3.84Å; Y1074-Y1086 HydrophobicContact CE2-CD2 4.36Å; Y1074-Y1086 HydrophobicContact CG-CD2 4.04Å; Y1074-Y1086 AromaticContact CZ-CD2 4Å
1075	L	86.5	Confident	82	Confident	62 Å²	62	44.3 Å²	44.3	33%	0.325	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-61.7	-22.6	177.7	-64.3	169.8	0	0	0	113	L1044 M1048 N1072 A1073	L1044-L1075 HydrophobicContact CD1-CD1 3.79Å; L1044-L1075 HydrophobicContact CD2-CD1 4.27Å; M1048-L1075 HydrophobicContact CE-CB 3.95Å; M1048-L1075 WeakPolarHBondContact CE-O 3.33Å; N1072-L1075 HydrophobicContact CB-CD1 4.4Å; N1072-L1075 WeakPolarHBondContact O-CB 3.21Å; N1072-L1075 PolarHBondContact O-N 3.12Å; A1073-L1075 PolarHBondContact O-N 3.05Å
1076	F	86.4	Confident	81.3	Confident	1 Å²	1	51.1 Å²	51.1	0%	0.004	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-87.6	-5.8	175.5	-69.4	-77.4	0	0	0	113.8	L1044 A1047 M1048 R1051 T1065 L1067 A1073 Y1074 P1095 I1100 I1101	L1044-F1076 HydrophobicContact CD2-CD2 4.5Å; L1044-F1076 HydrophobicContact CD2-CE2 3.54Å; L1044-F1076 HydrophobicContact CD2-CZ 3.86Å; A1047-F1076 HydrophobicContact CB-CE1 3.74Å; A1047-F1076 HydrophobicContact CB-CZ 3.67Å; M1048-F1076 HydrophobicContact CE-CD1 4.07Å; M1048-F1076 HydrophobicContact CE-CE1 4.1Å; M1048-F1076 HydrophobicContact CE-CG 4.46Å; M1048-F1076 HydrophobicContact SD-CD1 4.49Å; M1048-F1076 HydrophobicContact SD-CE1 4.35Å; R1051-F1076 PolarHBondContact NH1-O 3.11Å; T1065-F1076 HydrophobicContact CG2-CE1 4.23Å; T1065-F1076 HydrophobicContact CG2-CZ 3.92Å; L1067-F1076 HydrophobicContact CD1-CE2 4.34Å; L1067-F1076 HydrophobicContact CD2-CE2 4.32Å; A1073-F1076 PolarHBondContact O-N 3.27Å; Y1074-F1076 PolarHBondContact O-N 3.33Å; Y1074-F1076 VanDerWaalsContact O-N 3.17Å; F1076-P1095 HydrophobicContact CB-CB 3.66Å; F1076-P1095 HydrophobicContact CB-CG 4.21Å; F1076-I1100 HydrophobicContact CD1-CG2 4.3Å; F1076-I1100 HydrophobicContact CG-CG2 4.47Å; F1076-I1101 HydrophobicContact CD2-CG2 3.84Å; F1076-I1101 HydrophobicContact CE2-CG2 4.19Å
1077	S	84.2	Confident	80.6	Confident	9 Å²	9	57.7 Å²	57.7	6%	0.063	29%	0.288	C	S	.	.	S	Bend	trans	-69.8	158.1	-178.3	-40.6	0	0	0	0	111.4	Y1074 D1085	Y1074-S1077 WeakPolarHBondContact CA-OG 3.17Å; Y1074-S1077 VanDerWaalsContact O-CB 3.23Å; Y1074-S1077 WeakPolarHBondContact O-CB 3.5Å; Y1074-S1077 PolarHBondContact O-N 2.81Å; Y1074-S1077 PolarHBondContact O-OG 2.8Å; S1077-D1085 PolarHBondContact OG-OD2 3.08Å
1078	S	79.2	Confident	80.1	Confident	29 Å²	29	59 Å²	59	20%	0.203	30%	0.295	C	S	.	.			trans	-70.9	148.9	172.3	-54	0	0	0	0	110	D1080 I1081 H1082 E1094	S1078-D1080 VanDerWaalsContact C-N 3.3Å; S1078-D1080 PolarHBondContact O-N 2.7Å; S1078-D1080 VanDerWaalsContact O-N 3.17Å; S1078-I1081 PolarHBondContact O-N 3.42Å; S1078-H1082 PolarHBondContact O-N 3.34Å; S1078-H1082 VanDerWaalsContact O-N 3.14Å; S1078-E1094 VanDerWaalsContact CB-OE2 3.27Å; S1078-E1094 WeakPolarHBondContact CB-OE2 3.46Å; S1078-E1094 PolarHBondContact N-OE2 3.39Å; S1078-E1094 PolarHBondContact OG-OE1 2.88Å; S1078-E1094 PolarHBondContact OG-OE2 3.32Å
1079	G	69.6	Low	79.9	Confident	66 Å²	66	61.6 Å²	61.6	68%	0.68	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-44.2	-170.6	0	0	0	0	0	114.3	I1081 H1082	G1079-I1081 VanDerWaalsContact C-N 3.25Å; G1079-I1081 PolarHBondContact O-N 2.89Å; G1079-H1082 WeakPolarHBondContact O-CB 3.35Å; G1079-H1082 PolarHBondContact O-N 3.41Å
1080	D	68.6	Low	79.8	Confident	155 Å²	155	59.2 Å²	59.2	83%	0.829	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-20.1	-177.5	-53.5	-30.4	0	0	0	114	S1078	S1078-D1080 VanDerWaalsContact C-N 3.3Å; S1078-D1080 PolarHBondContact O-N 2.7Å; S1078-D1080 VanDerWaalsContact O-N 3.17Å
1081	I	72.8	Confident	79.8	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.015	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-16.4	-174.1	-63.1	168.9	0	0	0	111.3	S1078 G1079 E1083 N1084 D1085 E1094 F1212	S1078-I1081 PolarHBondContact O-N 3.42Å; G1079-I1081 VanDerWaalsContact C-N 3.25Å; G1079-I1081 PolarHBondContact O-N 2.89Å; I1081-E1083 PolarHBondContact O-N 3.26Å; I1081-N1084 PolarHBondContact O-N 3.38Å; I1081-N1084 VanDerWaalsContact O-N 3.1Å; I1081-D1085 HydrophobicContact CG2-CB 4.47Å; I1081-D1085 WeakPolarHBondContact CG2-OD1 3.47Å; I1081-D1085 PolarHBondContact O-N 3.4Å; I1081-E1094 HydrophobicContact CG2-CB 4.45Å; I1081-F1212 HydrophobicContact CD1-CE1 4.23Å
1082	H	70.8	Confident	79.8	Confident	65 Å²	65	54.4 Å²	54.4	30%	0.301	28%	0.283	S	S	.	.	H	α-helix	trans	-55.3	-43.2	-169.7	-175.5	-83	0	0	0	113.9	Y1074 S1078 G1079 N1084 D1085 Y1086	Y1074-H1082 AromaticContact CD2-CD2 3.95Å; Y1074-H1082 AromaticContact CD2-CE1 3.5Å; Y1074-H1082 VanDerWaalsContact CD2-CE1 3.5Å; Y1074-H1082 WeakPolarHBondContact CD2-CE1 3.38Å; Y1074-H1082 AromaticContact CD2-NE2 3.26Å; Y1074-H1082 VanDerWaalsContact CD2-NE2 3.26Å; Y1074-H1082 WeakPolarHBondContact CD2-NE2 3.39Å; Y1074-H1082 AromaticContact CE2-CE1 3.59Å; Y1074-H1082 AromaticContact CE2-NE2 3.51Å; Y1074-H1082 PolarHBondContact O-CD2 3.11Å; S1078-H1082 PolarHBondContact O-N 3.34Å; S1078-H1082 VanDerWaalsContact O-N 3.14Å; G1079-H1082 WeakPolarHBondContact O-CB 3.35Å; G1079-H1082 PolarHBondContact O-N 3.41Å; H1082-N1084 PolarHBondContact O-N 2.84Å; H1082-D1085 PolarHBondContact O-N 2.95Å; H1082-Y1086 PolarHBondContact O-N 3.19Å
1083	E	69.8	Low	79.7	Confident	160 Å²	160	54.1 Å²	54.1	75%	0.748	28%	0.281	S	S	*	.	H	α-helix	trans	-65.6	-37.6	-179.9	-66.7	-175.1	173.8	0	0	112.8	I1081	I1081-E1083 PolarHBondContact O-N 3.26Å
1084	N	75.6	Confident	79.7	Confident	81 Å²	81	54 Å²	54	43%	0.433	28%	0.281	S	S	.	.	H	α-helix	trans	-72.2	-44.8	179.4	-69.8	-30.8	0	0	0	110.5	I1081 H1082 Y1086 K1087 L1088	I1081-N1084 PolarHBondContact O-N 3.38Å; I1081-N1084 VanDerWaalsContact O-N 3.1Å; H1082-N1084 PolarHBondContact O-N 2.84Å; N1084-Y1086 VanDerWaalsContact C-N 3.29Å; N1084-Y1086 PolarHBondContact O-N 3.35Å; N1084-K1087 PolarHBondContact O-N 3.08Å; N1084-L1088 VanDerWaalsContact O-CG 3.31Å; N1084-L1088 WeakPolarHBondContact O-CG 3.35Å
1085	D	78.5	Confident	80	Confident	5 Å²	5	51.5 Å²	51.5	3%	0.027	27%	0.271	C	S	.	.	H	α-helix	trans	-65.5	-28.5	-174.6	-84.9	5.8	0	0	0	113.5	R695 S1077 I1081 H1082 K1087 L1088 E1094	R695-D1085 IonicContact CZ-OD1 3.27Å; R695-D1085 IonicContact NH1-OD1 2.63Å; R695-D1085 PolarHBondContact NH1-OD1 3.41Å; R695-D1085 IonicContact NH2-OD1 3.65Å; R695-D1085 PolarHBondContact NH2-OD1 3.11Å; S1077-D1085 PolarHBondContact OG-OD2 3.08Å; I1081-D1085 HydrophobicContact CG2-CB 4.47Å; I1081-D1085 WeakPolarHBondContact CG2-OD1 3.47Å; I1081-D1085 PolarHBondContact O-N 3.4Å; H1082-D1085 PolarHBondContact O-N 2.95Å; D1085-K1087 VanDerWaalsContact C-N 3.3Å; D1085-K1087 PolarHBondContact O-N 2.85Å; D1085-L1088 PolarHBondContact O-N 3.27Å; D1085-E1094 WeakPolarHBondContact OD2-CB 3.31Å; D1085-E1094 PolarHBondContact OD2-N 3.28Å
1086	Y	77.8	Confident	80.2	Confident	143 Å²	143	48.6 Å²	48.6	56%	0.561	26%	0.255	S	S	*	.	H	α-helix	trans	-60.6	-37.3	174.8	-179.7	-95.3	0	0	0	113.1	Y1074 H1082 N1084 L1088	Y1074-Y1086 AromaticContact CD1-CD2 3.55Å; Y1074-Y1086 HydrophobicContact CD1-CD2 3.55Å; Y1074-Y1086 HydrophobicContact CD1-CE2 4.22Å; Y1074-Y1086 HydrophobicContact CD2-CD2 4.39Å; Y1074-Y1086 AromaticContact CE1-CD2 3.57Å; Y1074-Y1086 HydrophobicContact CE1-CD2 3.57Å; Y1074-Y1086 AromaticContact CE1-CE2 3.84Å; Y1074-Y1086 HydrophobicContact CE1-CE2 3.84Å; Y1074-Y1086 HydrophobicContact CE2-CD2 4.36Å; Y1074-Y1086 HydrophobicContact CG-CD2 4.04Å; Y1074-Y1086 AromaticContact CZ-CD2 4Å; H1082-Y1086 PolarHBondContact O-N 3.19Å; N1084-Y1086 VanDerWaalsContact C-N 3.29Å; N1084-Y1086 PolarHBondContact O-N 3.35Å; Y1086-L1088 VanDerWaalsContact C-N 3.31Å
1087	K	77.9	Confident	80.5	Confident	138 Å²	138	48.5 Å²	48.5	60%	0.6	26%	0.255	S	S	*	.	H	α-helix	trans	-80.5	-15.3	-178.9	-60.4	-172.8	-173.3	-171.1	0	112.5	F97 N1084 D1085	F97-K1087 HydrophobicContact CE1-CD 4.47Å; F97-K1087 HydrophobicContact CZ-CD 4.22Å; N1084-K1087 PolarHBondContact O-N 3.08Å; D1085-K1087 VanDerWaalsContact C-N 3.3Å; D1085-K1087 PolarHBondContact O-N 2.85Å
1088	L	78.8	Confident	80.8	Confident	29 Å²	29	50.4 Å²	50.4	15%	0.152	26%	0.261	C	S	.	.	S	Bend	trans	-91.9	152.3	-171.8	-65.8	175.9	0	0	0	112.5	F689 N1084 D1085 Y1086	F689-L1088 HydrophobicContact CE1-CD1 3.69Å; F689-L1088 HydrophobicContact CE1-CD2 3.55Å; F689-L1088 HydrophobicContact CE1-CG 4.25Å; F689-L1088 HydrophobicContact CZ-CD1 3.8Å; F689-L1088 HydrophobicContact CZ-CD2 3.34Å; F689-L1088 HydrophobicContact CZ-CG 4.16Å; N1084-L1088 VanDerWaalsContact O-CG 3.31Å; N1084-L1088 WeakPolarHBondContact O-CG 3.35Å; D1085-L1088 PolarHBondContact O-N 3.27Å; Y1086-L1088 VanDerWaalsContact C-N 3.31Å
1089	P	80.1	Confident	81.4	Confident	68 Å²	68	49 Å²	49	44%	0.442	25%	0.251	S	S	.	.			trans	-57.8	141.6	165.6	-19.6	31.5	0	0	0	110.1	W1091 F1092	P1089-W1091 PolarHBondContact O-N 3.28Å; P1089-F1092 HydrophobicContact CB-CD2 4.38Å; P1089-F1092 HydrophobicContact CG-CD2 4.34Å; P1089-F1092 PolarHBondContact O-N 3.16Å
1090	V	84.3	Confident	82.4	Confident	13 Å²	13	46.7 Å²	46.7	8%	0.079	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-50.9	-33	-176.8	179.5	0	0	0	0	113	E1070 A1073 F1092 S1093 F1096 I1101	E1070-V1090 HydrophobicContact CB-CG2 3.87Å; E1070-V1090 HydrophobicContact CG-CG2 3.8Å; E1070-V1090 VanDerWaalsContact O-CG2 3.32Å; E1070-V1090 WeakPolarHBondContact O-CG2 3.42Å; A1073-V1090 HydrophobicContact CB-CG1 4.19Å; V1090-F1092 PolarHBondContact O-N 3.01Å; V1090-S1093 WeakPolarHBondContact O-CB 3.36Å; V1090-S1093 PolarHBondContact O-N 3.29Å; V1090-S1093 PolarHBondContact O-OG 2.93Å; V1090-F1096 HydrophobicContact CG1-CB 4.43Å; V1090-F1096 WeakPolarHBondContact O-CB 3.2Å; V1090-I1101 HydrophobicContact CG1-CD1 3.66Å
1091	W	85	Confident	83.6	Confident	37 Å²	37	39.4 Å²	39.4	14%	0.14	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-51.1	-36.1	173.2	-57.2	101.7	0	0	0	114.8	V676 N680 H682 Y698 F702 P1089 F1096 L1106	V676-W1091 HydrophobicContact CG1-CH2 3.67Å; V676-W1091 HydrophobicContact CG1-CZ3 3.63Å; N680-W1091 HydrophobicContact CB-CH2 4.49Å; N680-W1091 WeakPolarHBondContact ND2-CH2 3.27Å; H682-W1091 AromaticContact CE1-CD2 3.8Å; H682-W1091 AromaticContact CE1-CE2 3.99Å; H682-W1091 AromaticContact CE1-CE3 3.78Å; Y698-W1091 WeakPolarHBondContact CE1-O 3.47Å; Y698-W1091 PolarHBondContact OH-O 3.42Å; Y698-W1091 VanDerWaalsContact OH-O 3.07Å; F702-W1091 HydrophobicContact CE2-CB 3.61Å; F702-W1091 HydrophobicContact CE2-CD2 4.05Å; F702-W1091 AromaticContact CE2-CE3 3.98Å; F702-W1091 HydrophobicContact CE2-CE3 3.98Å; F702-W1091 AromaticContact CE2-CG 3.9Å; F702-W1091 HydrophobicContact CE2-CG 3.9Å; F702-W1091 HydrophobicContact CZ-CB 3.95Å; F702-W1091 HydrophobicContact CZ-CG 4.16Å; P1089-W1091 PolarHBondContact O-N 3.28Å; W1091-F1096 HydrophobicContact CE3-CD1 4.47Å; W1091-F1096 AromaticContact CE3-CE1 3.56Å; W1091-F1096 HydrophobicContact CE3-CE1 3.56Å; W1091-F1096 AromaticContact CE3-CZ 3.7Å; W1091-F1096 HydrophobicContact CE3-CZ 3.7Å; W1091-F1096 AromaticContact CZ3-CE1 3.99Å; W1091-F1096 HydrophobicContact CZ3-CE1 3.99Å; W1091-F1096 AromaticContact CZ3-CZ 3.64Å; W1091-F1096 HydrophobicContact CZ3-CZ 3.64Å; W1091-F1096 WeakPolarHBondContact O-CD1 3.4Å; W1091-L1106 HydrophobicContact CD2-CD2 4.33Å; W1091-L1106 HydrophobicContact CH2-CB 3.7Å; W1091-L1106 HydrophobicContact CH2-CD2 3.68Å; W1091-L1106 HydrophobicContact CH2-CG 4.14Å; W1091-L1106 HydrophobicContact CZ2-CB 4.09Å; W1091-L1106 HydrophobicContact CZ2-CD2 3.38Å; W1091-L1106 HydrophobicContact CZ2-CG 4.28Å; W1091-L1106 HydrophobicContact CZ3-CD2 4.31Å
1092	F	85.4	Confident	84.5	Confident	15 Å²	15	39.4 Å²	39.4	7%	0.066	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-99.1	1.3	-177.7	-67	-74.1	0	0	0	112.9	P686 F689 R695 Y698 E699 F702 P1089 V1090	P686-F1092 HydrophobicContact CG-CE2 3.93Å; P686-F1092 HydrophobicContact CG-CZ 3.92Å; F689-F1092 HydrophobicContact CE2-CD1 4.41Å; F689-F1092 HydrophobicContact CE2-CG 4.39Å; F689-F1092 HydrophobicContact CZ-CB 4.43Å; F689-F1092 HydrophobicContact CZ-CG 4.48Å; R695-F1092 PolarHBondContact NH1-O 3.2Å; Y698-F1092 HydrophobicContact CD1-CD1 4.42Å; Y698-F1092 HydrophobicContact CE1-CD1 4.47Å; E699-F1092 HydrophobicContact CB-CE1 4.33Å; E699-F1092 HydrophobicContact CG-CE1 4.16Å; F702-F1092 HydrophobicContact CD1-CE1 4.12Å; F702-F1092 AromaticContact CD1-CZ 3.77Å; F702-F1092 HydrophobicContact CD1-CZ 3.77Å; F702-F1092 HydrophobicContact CE1-CE1 4.23Å; F702-F1092 AromaticContact CE1-CE2 4Å; F702-F1092 HydrophobicContact CE1-CE2 4Å; F702-F1092 AromaticContact CE1-CZ 3.46Å; F702-F1092 HydrophobicContact CE1-CZ 3.46Å; F702-F1092 VanDerWaalsContact CE1-CZ 3.46Å; F702-F1092 HydrophobicContact CG-CZ 4.49Å; F702-F1092 HydrophobicContact CZ-CE2 4.1Å; F702-F1092 AromaticContact CZ-CZ 3.96Å; F702-F1092 HydrophobicContact CZ-CZ 3.96Å; P1089-F1092 HydrophobicContact CB-CD2 4.38Å; P1089-F1092 HydrophobicContact CG-CD2 4.34Å; P1089-F1092 PolarHBondContact O-N 3.16Å; V1090-F1092 PolarHBondContact O-N 3.01Å
1093	S	87.7	Confident	85.3	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.014	17%	0.17	C	C	.	.	S	Bend	trans	-70.1	141.8	175.6	71.2	0	0	0	0	110.8	V1090 P1095 F1096 A1097	V1090-S1093 WeakPolarHBondContact O-CB 3.36Å; V1090-S1093 PolarHBondContact O-N 3.29Å; V1090-S1093 PolarHBondContact O-OG 2.93Å; S1093-P1095 VanDerWaalsContact C-CD 3.5Å; S1093-F1096 PolarHBondContact O-N 3.19Å; S1093-F1096 WeakPolarHBondContact OG-CB 3.36Å; S1093-F1096 PolarHBondContact OG-N 3.45Å; S1093-A1097 PolarHBondContact O-N 2.81Å
1094	E	89.4	Confident	86	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-49	-51.2	172.6	-171.3	-152.4	139.3	0	0	112.6	W694 S1078 I1081 D1085 F1096 A1097 R1098 F1212	W694-E1094 HydrophobicContact CH2-CB 4.46Å; S1078-E1094 VanDerWaalsContact CB-OE2 3.27Å; S1078-E1094 WeakPolarHBondContact CB-OE2 3.46Å; S1078-E1094 PolarHBondContact N-OE2 3.39Å; S1078-E1094 PolarHBondContact OG-OE1 2.88Å; S1078-E1094 PolarHBondContact OG-OE2 3.32Å; I1081-E1094 HydrophobicContact CG2-CB 4.45Å; D1085-E1094 WeakPolarHBondContact OD2-CB 3.31Å; D1085-E1094 PolarHBondContact OD2-N 3.28Å; E1094-F1096 VanDerWaalsContact C-N 3.28Å; E1094-F1096 PolarHBondContact O-N 3.07Å; E1094-A1097 PolarHBondContact O-N 3.44Å; E1094-A1097 VanDerWaalsContact O-N 3.12Å; E1094-R1098 HydrophobicContact CG-CG 4.32Å; E1094-R1098 WeakPolarHBondContact O-CB 3.43Å; E1094-R1098 VanDerWaalsContact O-CG 3.23Å; E1094-R1098 WeakPolarHBondContact O-CG 3.35Å; E1094-R1098 PolarHBondContact O-N 3.39Å; E1094-R1098 WeakPolarHBondContact OE1-CD 3.48Å; E1094-R1098 IonicContact OE1-CZ 3.08Å; E1094-R1098 IonicContact OE1-NE 3.03Å; E1094-R1098 IonicContact OE1-NH1 3.16Å; E1094-R1098 PolarHBondContact OE1-NH1 3.03Å; E1094-F1212 HydrophobicContact CG-CD1 4.39Å; E1094-F1212 HydrophobicContact CG-CD2 4.29Å; E1094-F1212 HydrophobicContact CG-CE1 4.15Å; E1094-F1212 HydrophobicContact CG-CE2 4.05Å; E1094-F1212 HydrophobicContact CG-CG 4.46Å; E1094-F1212 HydrophobicContact CG-CZ 3.98Å
1095	P	91.3	Very high	86.4	Confident	0 Å²	0	26 Å²	26	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64.3	-31.7	-176.4	23.7	-35.2	0	0	0	113.4	A1073 F1076 S1093 G1099 I1100 I1101	A1073-P1095 HydrophobicContact CB-CG 4.27Å; A1073-P1095 VanDerWaalsContact O-CG 3.25Å; A1073-P1095 WeakPolarHBondContact O-CG 3.46Å; F1076-P1095 HydrophobicContact CB-CB 3.66Å; F1076-P1095 HydrophobicContact CB-CG 4.21Å; S1093-P1095 VanDerWaalsContact C-CD 3.5Å; P1095-G1099 PolarHBondContact O-N 3.34Å; P1095-I1100 PolarHBondContact O-N 2.75Å; P1095-I1101 HydrophobicContact CB-CG1 4.26Å; P1095-I1101 HydrophobicContact CB-CG2 4.2Å
1096	F	91.7	Very high	86.7	Confident	1 Å²	1	26 Å²	26	0%	0.004	12%	0.12	C	C	.	.	H	α-helix	trans	-71.8	-46.5	171.8	-174.2	-103.3	0	0	0	110.9	T673 N677 Y698 V1090 W1091 S1093 E1094 R1098 G1099 I1101 L1106	T673-F1096 HydrophobicContact CG2-CD2 4.22Å; T673-F1096 HydrophobicContact CG2-CE2 3.98Å; T673-F1096 HydrophobicContact CG2-CZ 4.21Å; T673-F1096 WeakPolarHBondContact CG2-O 3.47Å; N677-F1096 VanDerWaalsContact OD1-CE1 3.3Å; N677-F1096 WeakPolarHBondContact OD1-CE1 3.37Å; Y698-F1096 WeakPolarHBondContact OH-CD1 3.42Å; Y698-F1096 WeakPolarHBondContact OH-CE1 3.27Å; V1090-F1096 HydrophobicContact CG1-CB 4.43Å; V1090-F1096 WeakPolarHBondContact O-CB 3.2Å; W1091-F1096 HydrophobicContact CE3-CD1 4.47Å; W1091-F1096 AromaticContact CE3-CE1 3.56Å; W1091-F1096 HydrophobicContact CE3-CE1 3.56Å; W1091-F1096 AromaticContact CE3-CZ 3.7Å; W1091-F1096 HydrophobicContact CE3-CZ 3.7Å; W1091-F1096 AromaticContact CZ3-CE1 3.99Å; W1091-F1096 HydrophobicContact CZ3-CE1 3.99Å; W1091-F1096 AromaticContact CZ3-CZ 3.64Å; W1091-F1096 HydrophobicContact CZ3-CZ 3.64Å; W1091-F1096 WeakPolarHBondContact O-CD1 3.4Å; S1093-F1096 PolarHBondContact O-N 3.19Å; S1093-F1096 WeakPolarHBondContact OG-CB 3.36Å; S1093-F1096 PolarHBondContact OG-N 3.45Å; E1094-F1096 VanDerWaalsContact C-N 3.28Å; E1094-F1096 PolarHBondContact O-N 3.07Å; F1096-R1098 PolarHBondContact O-N 3.45Å; F1096-R1098 VanDerWaalsContact O-N 3.15Å; F1096-G1099 PolarHBondContact O-N 2.84Å; F1096-I1101 HydrophobicContact CB-CD1 3.68Å; F1096-I1101 HydrophobicContact CB-CG1 3.9Å; F1096-I1101 HydrophobicContact CD2-CD1 4.09Å; F1096-I1101 HydrophobicContact CD2-CG1 4.14Å; F1096-I1101 HydrophobicContact CG-CD1 4.36Å; F1096-L1106 HydrophobicContact CD2-CD1 3.92Å; F1096-L1106 HydrophobicContact CE2-CD1 3.41Å; F1096-L1106 VanDerWaalsContact CE2-CD1 3.41Å; F1096-L1106 HydrophobicContact CZ-CD1 4.14Å
1097	A	91.1	Very high	87.1	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60.1	-27.3	177.6	0	0	0	0	0	113.5	W694 Y698 S1093 E1094 Y1214 V1215	W694-A1097 HydrophobicContact CZ3-CB 3.91Å; Y698-A1097 HydrophobicContact CD2-CB 3.78Å; Y698-A1097 HydrophobicContact CE1-CB 4.46Å; Y698-A1097 HydrophobicContact CE2-CB 3.52Å; Y698-A1097 HydrophobicContact CG-CB 4.37Å; S1093-A1097 PolarHBondContact O-N 2.81Å; E1094-A1097 PolarHBondContact O-N 3.44Å; E1094-A1097 VanDerWaalsContact O-N 3.12Å; A1097-Y1214 WeakPolarHBondContact O-CA 3.18Å; A1097-V1215 PolarHBondContact O-N 3.37Å; A1097-V1215 VanDerWaalsContact O-N 3.1Å
1098	R	91	Very high	87.5	Confident	49 Å²	49	12.9 Å²	12.9	19%	0.185	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-18.3	174	-69.1	174.5	67.9	158.6	4.5	114.4	E1094 F1096 I1100 Y1205 F1212 R1213	E1094-R1098 HydrophobicContact CG-CG 4.32Å; E1094-R1098 WeakPolarHBondContact O-CB 3.43Å; E1094-R1098 VanDerWaalsContact O-CG 3.23Å; E1094-R1098 WeakPolarHBondContact O-CG 3.35Å; E1094-R1098 PolarHBondContact O-N 3.39Å; E1094-R1098 WeakPolarHBondContact OE1-CD 3.48Å; E1094-R1098 IonicContact OE1-CZ 3.08Å; E1094-R1098 IonicContact OE1-NE 3.03Å; E1094-R1098 IonicContact OE1-NH1 3.16Å; E1094-R1098 PolarHBondContact OE1-NH1 3.03Å; F1096-R1098 PolarHBondContact O-N 3.45Å; F1096-R1098 VanDerWaalsContact O-N 3.15Å; R1098-I1100 HydrophobicContact CB-CD1 4.09Å; R1098-I1100 HydrophobicContact CB-CG1 4.02Å; R1098-Y1205 PolarHBondContact O-OH 3.48Å; R1098-F1212 HydrophobicContact CG-CB 4.19Å; R1098-F1212 HydrophobicContact CG-CD2 3.8Å; R1098-F1212 HydrophobicContact CG-CG 4.3Å; R1098-F1212 VanDerWaalsContact CZ-CB 3.44Å; R1098-R1213 WeakPolarHBondContact CA-O 3.31Å; R1098-R1213 VanDerWaalsContact CG-O 3.3Å; R1098-R1213 WeakPolarHBondContact CG-O 3.46Å
1099	G	91.7	Very high	87.6	Confident	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.8	25.1	-172.6	0	0	0	0	0	115.7	N665 T673 H1062 P1095 F1096	N665-G1099 PolarHBondContact ND2-O 2.79Å; T673-G1099 VanDerWaalsContact CG2-CA 3.5Å; H1062-G1099 PolarHBondContact CE1-O 3.26Å; H1062-G1099 VanDerWaalsContact CE1-O 3.28Å; H1062-G1099 PolarHBondContact NE2-O 2.87Å; P1095-G1099 PolarHBondContact O-N 3.34Å; F1096-G1099 PolarHBondContact O-N 2.84Å
1100	I	92.2	Very high	87.9	Confident	16 Å²	16	8.9 Å²	8.9	8%	0.082	4%	0.042	C	C	.	.			trans	-79.7	-37.6	174.9	-64.7	173.3	0	0	0	110.2	L1063 T1064 T1065 F1076 P1095 R1098	L1063-I1100 WeakPolarHBondContact O-CA 3.19Å; T1064-I1100 CarbonylContact C-O 3.47Å; T1064-I1100 WeakPolarHBondContact CA-O 3.4Å; T1065-I1100 PolarHBondContact N-O 3.39Å; T1065-I1100 PolarHBondContact OG1-O 3.1Å; F1076-I1100 HydrophobicContact CD1-CG2 4.3Å; F1076-I1100 HydrophobicContact CG-CG2 4.47Å; P1095-I1100 PolarHBondContact O-N 2.75Å; R1098-I1100 HydrophobicContact CB-CD1 4.09Å; R1098-I1100 HydrophobicContact CB-CG1 4.02Å
1101	I	92.9	Very high	88.1	Confident	2 Å²	2	8.3 Å²	8.3	1%	0.01	4%	0.039	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	147.2	-176.2	54.8	152.4	0	0	0	112.5	L1067 A1073 F1076 V1090 P1095 F1096	L1067-I1101 HydrophobicContact CD1-CB 4.05Å; L1067-I1101 HydrophobicContact CD1-CG2 3.55Å; L1067-I1101 HydrophobicContact CG-CG2 4.32Å; A1073-I1101 HydrophobicContact CB-CD1 3.41Å; A1073-I1101 VanDerWaalsContact CB-CD1 3.41Å; F1076-I1101 HydrophobicContact CD2-CG2 3.84Å; F1076-I1101 HydrophobicContact CE2-CG2 4.19Å; V1090-I1101 HydrophobicContact CG1-CD1 3.66Å; P1095-I1101 HydrophobicContact CB-CG1 4.26Å; P1095-I1101 HydrophobicContact CB-CG2 4.2Å; F1096-I1101 HydrophobicContact CB-CD1 3.68Å; F1096-I1101 HydrophobicContact CB-CG1 3.9Å; F1096-I1101 HydrophobicContact CD2-CD1 4.09Å; F1096-I1101 HydrophobicContact CD2-CG1 4.14Å; F1096-I1101 HydrophobicContact CG-CD1 4.36Å
1102	F	91.7	Very high	87.9	Confident	3 Å²	3	6.6 Å²	6.6	1%	0.013	3%	0.032	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	131.2	167.7	-167.7	-84.7	0	0	0	109.5	K658 L661 M662 V676 T1065 E1066 L1067 L1107	K658-F1102 HydrophobicContact CB-CE1 3.93Å; K658-F1102 HydrophobicContact CG-CD1 3.9Å; K658-F1102 HydrophobicContact CG-CE1 3.59Å; L661-F1102 HydrophobicContact CB-CE2 3.99Å; L661-F1102 HydrophobicContact CB-CZ 4.31Å; L661-F1102 HydrophobicContact CD1-CE2 4.16Å; L661-F1102 HydrophobicContact CD1-CZ 4.17Å; M662-F1102 HydrophobicContact CG-CB 4.01Å; M662-F1102 HydrophobicContact CG-CD1 4.05Å; M662-F1102 HydrophobicContact CG-CD2 4.16Å; M662-F1102 HydrophobicContact CG-CG 3.79Å; M662-F1102 HydrophobicContact SD-CB 4.15Å; M662-F1102 HydrophobicContact SD-CD1 4Å; M662-F1102 HydrophobicContact SD-CG 4.16Å; V676-F1102 HydrophobicContact CG2-CE2 4.05Å; T1065-F1102 PolarHBondContact O-N 2.83Å; E1066-F1102 WeakPolarHBondContact CA-O 3.48Å; L1067-F1102 PolarHBondContact N-O 2.84Å; F1102-L1107 HydrophobicContact CE1-CD1 4.17Å; F1102-L1107 HydrophobicContact CZ-CD1 4.04Å; F1102-L1107 HydrophobicContact CZ-CD2 4.19Å; F1102-L1107 HydrophobicContact CZ-CG 4.16Å
1103	S	88.1	Confident	87.8	Confident	1 Å²	1	6.5 Å²	6.5	1%	0.007	3%	0.033	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	144	177.6	-170.2	0	0	0	0	112	L1067 T1105 L1106	L1067-S1103 WeakPolarHBondContact O-CA 3.49Å; L1067-S1103 WeakPolarHBondContact O-CB 3.37Å; L1067-S1103 PolarHBondContact O-OG 3.42Å; S1103-T1105 VanDerWaalsContact C-N 3.32Å; S1103-T1105 PolarHBondContact O-N 3.49Å; S1103-T1105 PolarHBondContact OG-OG1 3.11Å; S1103-L1106 WeakPolarHBondContact O-CB 3.45Å; S1103-L1106 PolarHBondContact O-N 3.26Å
1104	N	84.6	Confident	87.8	Confident	8 Å²	8	6.5 Å²	6.5	4%	0.043	3%	0.033	C	C	.	.	G	3₁₀ helix	trans	-69.8	-27.9	-176.9	-68.3	-23.6	0	0	0	113	P596 N597 K658 E1066 L1106 L1107 Y1108	P596-N1104 HydrophobicContact CB-CB 4.46Å; N597-N1104 PolarHBondContact OD1-ND2 2.85Å; K658-N1104 WeakPolarHBondContact CD-OD1 3.4Å; K658-N1104 WeakPolarHBondContact CG-OD1 3.44Å; E1066-N1104 PolarHBondContact OE1-ND2 2.81Å; N1104-L1106 VanDerWaalsContact C-N 3.26Å; N1104-L1106 PolarHBondContact O-N 3.23Å; N1104-L1107 PolarHBondContact O-N 2.99Å; N1104-Y1108 WeakPolarHBondContact O-CD2 3.29Å
1105	T	83.2	Confident	87.7	Confident	17 Å²	17	6.8 Å²	6.8	10%	0.104	3%	0.034	C	C	.	.	G	3₁₀ helix	trans	-60.7	-35.9	176.8	50.9	0	0	0	0	112	E1070 S1103 L1107 Y1108	E1070-T1105 WeakPolarHBondContact OE2-CB 3.38Å; E1070-T1105 PolarHBondContact OE2-OG1 2.93Å; S1103-T1105 VanDerWaalsContact C-N 3.32Å; S1103-T1105 PolarHBondContact O-N 3.49Å; S1103-T1105 PolarHBondContact OG-OG1 3.11Å; T1105-L1107 PolarHBondContact O-N 3.18Å; T1105-Y1108 WeakPolarHBondContact O-CB 3.21Å; T1105-Y1108 PolarHBondContact O-N 2.92Å
1106	L	84	Confident	87.4	Confident	4 Å²	4	8.8 Å²	8.8	2%	0.021	4%	0.042	C	C	.	.	G	3₁₀ helix	trans	-64.5	-20.6	-179.1	-57.1	178.1	0	0	0	113.4	V676 N680 W1091 F1096 S1103 N1104 S1109	V676-L1106 HydrophobicContact CG1-CB 4.2Å; N680-L1106 PolarHBondContact ND2-O 2.94Å; W1091-L1106 HydrophobicContact CD2-CD2 4.33Å; W1091-L1106 HydrophobicContact CH2-CB 3.7Å; W1091-L1106 HydrophobicContact CH2-CD2 3.68Å; W1091-L1106 HydrophobicContact CH2-CG 4.14Å; W1091-L1106 HydrophobicContact CZ2-CB 4.09Å; W1091-L1106 HydrophobicContact CZ2-CD2 3.38Å; W1091-L1106 HydrophobicContact CZ2-CG 4.28Å; W1091-L1106 HydrophobicContact CZ3-CD2 4.31Å; F1096-L1106 HydrophobicContact CD2-CD1 3.92Å; F1096-L1106 HydrophobicContact CE2-CD1 3.41Å; F1096-L1106 VanDerWaalsContact CE2-CD1 3.41Å; F1096-L1106 HydrophobicContact CZ-CD1 4.14Å; S1103-L1106 WeakPolarHBondContact O-CB 3.45Å; S1103-L1106 PolarHBondContact O-N 3.26Å; N1104-L1106 VanDerWaalsContact C-N 3.26Å; N1104-L1106 PolarHBondContact O-N 3.23Å; L1106-S1109 PolarHBondContact O-OG 2.93Å
1107	L	87.6	Confident	87	Confident	5 Å²	5	9.1 Å²	9.1	3%	0.026	4%	0.044	C	C	.	.	G	3₁₀ helix	trans	-82	-17.5	176.7	-67	178.9	0	0	0	113.1	M654 L657 K658 L661 V676 F1102 N1104 T1105 S1109 C1110	M654-L1107 HydrophobicContact CE-CB 3.48Å; M654-L1107 VanDerWaalsContact CE-CB 3.48Å; M654-L1107 HydrophobicContact CE-CD1 4.04Å; M654-L1107 HydrophobicContact CE-CG 4.41Å; L657-L1107 HydrophobicContact CB-CD1 4.13Å; K658-L1107 HydrophobicContact CB-CD1 4.35Å; L661-L1107 HydrophobicContact CD1-CD2 4.1Å; V676-L1107 HydrophobicContact CG2-CD2 4.3Å; F1102-L1107 HydrophobicContact CE1-CD1 4.17Å; F1102-L1107 HydrophobicContact CZ-CD1 4.04Å; F1102-L1107 HydrophobicContact CZ-CD2 4.19Å; F1102-L1107 HydrophobicContact CZ-CG 4.16Å; N1104-L1107 PolarHBondContact O-N 2.99Å; T1105-L1107 PolarHBondContact O-N 3.18Å; L1107-S1109 PolarHBondContact O-N 3.38Å; L1107-C1110 VanDerWaalsContact O-CB 3.26Å; L1107-C1110 WeakPolarHBondContact O-CB 3.18Å; L1107-C1110 PolarHBondContact O-N 3.44Å; L1107-C1110 VanDerWaalsContact O-N 3.14Å
1108	Y	85.9	Confident	86.6	Confident	1 Å²	1	10.4 Å²	10.4	0%	0.004	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-37	-179.4	-82.9	-105.5	0	0	0	112.2	A594 P596 Q627 M654 N1104 T1105 C1110 L1111	A594-Y1108 VanDerWaalsContact O-CE1 3.27Å; A594-Y1108 WeakPolarHBondContact O-CE1 3.38Å; A594-Y1108 VanDerWaalsContact O-CZ 3.27Å; A594-Y1108 PolarHBondContact O-OH 3.3Å; P596-Y1108 HydrophobicContact CB-CE2 3.84Å; P596-Y1108 VanDerWaalsContact CD-OH 3.23Å; P596-Y1108 WeakPolarHBondContact CD-OH 3.4Å; P596-Y1108 HydrophobicContact CG-CE2 4.07Å; Q627-Y1108 PolarHBondContact NE2-OH 3.18Å; Q627-Y1108 VanDerWaalsContact NE2-OH 3.12Å; M654-Y1108 HydrophobicContact CE-CD2 4.06Å; M654-Y1108 HydrophobicContact CE-CE2 3.76Å; N1104-Y1108 WeakPolarHBondContact O-CD2 3.29Å; T1105-Y1108 WeakPolarHBondContact O-CB 3.21Å; T1105-Y1108 PolarHBondContact O-N 2.92Å; Y1108-C1110 PolarHBondContact O-N 2.87Å; Y1108-L1111 WeakPolarHBondContact O-CB 3.29Å; Y1108-L1111 PolarHBondContact O-N 3.43Å
1109	S	81.6	Confident	86.4	Confident	12 Å²	12	8.4 Å²	8.4	8%	0.084	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-28.3	174.8	45.4	0	0	0	0	111.9	N680 L1106 L1107 L1111 S1112	N680-S1109 PolarHBondContact ND2-OG 2.64Å; N680-S1109 WeakPolarHBondContact OD1-CB 3.48Å; N680-S1109 PolarHBondContact OD1-OG 3.35Å; L1106-S1109 PolarHBondContact O-OG 2.93Å; L1107-S1109 PolarHBondContact O-N 3.38Å; S1109-L1111 VanDerWaalsContact C-N 3.26Å; S1109-L1111 PolarHBondContact O-N 2.97Å; S1109-S1112 WeakPolarHBondContact O-CB 3.36Å; S1109-S1112 PolarHBondContact O-N 3.34Å; S1109-S1112 PolarHBondContact O-OG 3.33Å
1110	C	85.3	Confident	86.3	Confident	1 Å²	1	8.4 Å²	8.4	1%	0.007	4%	0.044	C	C	.	.	H	α-helix	trans	-65.2	-26.9	177.8	-57.7	0	0	0	0	112.8	L679 N680 L1107 Y1108 S1112 S1113 F1114	L679-C1110 HydrophobicContact CB-CB 4.22Å; L679-C1110 VanDerWaalsContact CB-SG 3.58Å; N680-C1110 PolarHBondContact ND2-SG 3.17Å; N680-C1110 PolarHBondContact OD1-N 3.49Å; N680-C1110 PolarHBondContact OD1-SG 3.41Å; L1107-C1110 VanDerWaalsContact O-CB 3.26Å; L1107-C1110 WeakPolarHBondContact O-CB 3.18Å; L1107-C1110 PolarHBondContact O-N 3.44Å; L1107-C1110 VanDerWaalsContact O-N 3.14Å; Y1108-C1110 PolarHBondContact O-N 2.87Å; C1110-S1112 PolarHBondContact O-N 3.02Å; C1110-S1113 WeakPolarHBondContact O-CB 3.29Å; C1110-S1113 PolarHBondContact O-N 3.36Å; C1110-F1114 HydrophobicContact CB-CE2 4.26Å; C1110-F1114 HydrophobicContact CB-CZ 4.1Å; C1110-F1114 PolarHBondContact O-N 3.35Å; C1110-F1114 VanDerWaalsContact O-N 3.1Å
1111	L	88	Confident	86.2	Confident	1 Å²	1	8.2 Å²	8.2	1%	0.005	4%	0.043	C	C	.	.	H	α-helix	trans	-57.5	-32.4	177.3	-65.8	176.6	0	0	0	111.9	F525 L593 V652 Y1108 S1109 F1114 F1115	F525-L1111 HydrophobicContact CD2-CB 4.19Å; F525-L1111 HydrophobicContact CD2-CD1 4.46Å; F525-L1111 HydrophobicContact CE2-CB 4.01Å; L593-L1111 HydrophobicContact CD2-CD1 3.64Å; V652-L1111 HydrophobicContact CB-CD2 4.08Å; V652-L1111 HydrophobicContact CG1-CD2 3.89Å; V652-L1111 HydrophobicContact CG2-CD2 3.97Å; Y1108-L1111 WeakPolarHBondContact O-CB 3.29Å; Y1108-L1111 PolarHBondContact O-N 3.43Å; S1109-L1111 VanDerWaalsContact C-N 3.26Å; S1109-L1111 PolarHBondContact O-N 2.97Å; L1111-F1114 HydrophobicContact CD2-CD2 4.15Å; L1111-F1114 PolarHBondContact O-N 2.88Å; L1111-F1115 PolarHBondContact O-N 3.49Å; L1111-F1115 VanDerWaalsContact O-N 3.1Å
1112	S	82.4	Confident	85.9	Confident	0 Å²	0	11.3 Å²	11.3	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-62.9	-43.9	174.6	70.3	0	0	0	0	111.8	G528 S1109 C1110 F1114 F1115 Y1116	G528-S1112 PolarHBondContact O-OG 3.42Å; S1109-S1112 WeakPolarHBondContact O-CB 3.36Å; S1109-S1112 PolarHBondContact O-N 3.34Å; S1109-S1112 PolarHBondContact O-OG 3.33Å; C1110-S1112 PolarHBondContact O-N 3.02Å; S1112-F1114 PolarHBondContact O-N 3.37Å; S1112-F1115 WeakPolarHBondContact O-CB 3.3Å; S1112-F1115 PolarHBondContact O-N 3.21Å; S1112-Y1116 WeakPolarHBondContact O-CD2 3.25Å; S1112-Y1116 PolarHBondContact O-N 3.17Å; S1112-Y1116 VanDerWaalsContact O-N 3.12Å
1113	S	83.4	Confident	85.9	Confident	13 Å²	13	11.1 Å²	11.1	9%	0.091	5%	0.053	C	C	.	.	H	α-helix	trans	-65.9	-37.9	178.3	-68	0	0	0	0	112.2	L679 C1110 F1115 Y1116 N1117	L679-S1113 WeakPolarHBondContact O-CB 3.34Å; L679-S1113 PolarHBondContact O-OG 2.78Å; C1110-S1113 WeakPolarHBondContact O-CB 3.29Å; C1110-S1113 PolarHBondContact O-N 3.36Å; S1113-F1115 VanDerWaalsContact C-N 3.34Å; S1113-F1115 PolarHBondContact O-N 2.93Å; S1113-Y1116 PolarHBondContact O-N 3.08Å; S1113-N1117 WeakPolarHBondContact O-CB 3.37Å; S1113-N1117 PolarHBondContact O-N 3.14Å
1114	F	87.7	Confident	86.1	Confident	2 Å²	2	11.2 Å²	11.2	1%	0.009	5%	0.054	C	C	.	.	H	α-helix	trans	-64.8	-37.9	174.3	-56.9	-27.3	0	0	0	112.3	R623 M650 V652 L657 L679 C1110 L1111 S1112 Y1116 N1117 I1120 F1121 L1124	R623-F1114 PolarHBondContact NH2-O 2.9Å; M650-F1114 HydrophobicContact CE-CB 3.8Å; V652-F1114 HydrophobicContact CG1-CE2 4.22Å; V652-F1114 HydrophobicContact CG2-CD2 4.11Å; L657-F1114 HydrophobicContact CD1-CE2 4.05Å; L657-F1114 HydrophobicContact CD1-CZ 4.25Å; L679-F1114 HydrophobicContact CD2-CE1 4.06Å; C1110-F1114 HydrophobicContact CB-CE2 4.26Å; C1110-F1114 HydrophobicContact CB-CZ 4.1Å; C1110-F1114 PolarHBondContact O-N 3.35Å; C1110-F1114 VanDerWaalsContact O-N 3.1Å; L1111-F1114 HydrophobicContact CD2-CD2 4.15Å; L1111-F1114 PolarHBondContact O-N 2.88Å; S1112-F1114 PolarHBondContact O-N 3.37Å; F1114-Y1116 VanDerWaalsContact C-N 3.35Å; F1114-N1117 CarbonylContact O-C 3.54Å; F1114-I1120 HydrophobicContact CD1-CG2 4.39Å; F1114-I1120 HydrophobicContact CE1-CG2 4.25Å; F1114-F1121 HydrophobicContact CB-CB 4.25Å; F1114-F1121 HydrophobicContact CD1-CB 3.77Å; F1114-F1121 HydrophobicContact CD1-CD2 4.33Å; F1114-F1121 HydrophobicContact CD2-CD2 4.01Å; F1114-F1121 HydrophobicContact CE1-CB 4.29Å; F1114-F1121 HydrophobicContact CE1-CD2 4.33Å; F1114-F1121 HydrophobicContact CE2-CD2 4.01Å; F1114-F1121 HydrophobicContact CG-CB 3.98Å; F1114-F1121 HydrophobicContact CG-CD2 4.19Å; F1114-F1121 HydrophobicContact CG-CG 4.44Å; F1114-F1121 HydrophobicContact CZ-CD2 4.18Å; F1114-L1124 HydrophobicContact CE1-CD1 3.48Å; F1114-L1124 VanDerWaalsContact CE1-CD1 3.48Å; F1114-L1124 HydrophobicContact CZ-CD1 3.49Å; F1114-L1124 VanDerWaalsContact CZ-CD1 3.49Å
1115	F	87	Confident	86.3	Confident	6 Å²	6	12.3 Å²	12.3	3%	0.026	6%	0.057	C	C	.	.	H	α-helix	trans	-63	-41.8	175.2	170.3	-102.5	0	0	0	112.5	V511 F529 I541 A589 F591 R623 I625 L1111 S1112 S1113	V511-F1115 HydrophobicContact CG2-CE2 4.43Å; V511-F1115 HydrophobicContact CG2-CZ 4.12Å; F529-F1115 AromaticContact CE2-CD1 3.69Å; F529-F1115 HydrophobicContact CE2-CD1 3.69Å; F529-F1115 AromaticContact CE2-CE1 3.85Å; F529-F1115 HydrophobicContact CE2-CE1 3.85Å; F529-F1115 HydrophobicContact CE2-CG 4.31Å; F529-F1115 HydrophobicContact CZ-CD1 4.39Å; F529-F1115 HydrophobicContact CZ-CE1 4.1Å; I541-F1115 HydrophobicContact CD1-CE1 3.84Å; I541-F1115 HydrophobicContact CD1-CZ 4.07Å; A589-F1115 HydrophobicContact CB-CD2 4.26Å; A589-F1115 HydrophobicContact CB-CE2 3.58Å; F591-F1115 HydrophobicContact CE1-CB 4.08Å; F591-F1115 HydrophobicContact CE2-CD2 4.13Å; F591-F1115 HydrophobicContact CE2-CG 4.25Å; F591-F1115 HydrophobicContact CZ-CB 3.5Å; F591-F1115 VanDerWaalsContact CZ-CB 3.5Å; F591-F1115 HydrophobicContact CZ-CD1 4.45Å; F591-F1115 AromaticContact CZ-CD2 3.85Å; F591-F1115 HydrophobicContact CZ-CD2 3.85Å; F591-F1115 AromaticContact CZ-CG 3.67Å; F591-F1115 HydrophobicContact CZ-CG 3.67Å; R623-F1115 PolarHBondContact NH1-O 3.44Å; R623-F1115 PolarHBondContact NH2-O 3.08Å; I625-F1115 HydrophobicContact CD1-CB 3.69Å; I625-F1115 HydrophobicContact CD1-CD2 3.79Å; I625-F1115 HydrophobicContact CD1-CG 4.23Å; L1111-F1115 PolarHBondContact O-N 3.49Å; L1111-F1115 VanDerWaalsContact O-N 3.1Å; S1112-F1115 WeakPolarHBondContact O-CB 3.3Å; S1112-F1115 PolarHBondContact O-N 3.21Å; S1113-F1115 VanDerWaalsContact C-N 3.34Å; S1113-F1115 PolarHBondContact O-N 2.93Å
1116	Y	83.4	Confident	86.5	Confident	42 Å²	42	12.4 Å²	12.4	17%	0.165	6%	0.058	C	C	.	.	H	α-helix	trans	-82.6	-23.5	-178.8	-73	-63.1	0	0	0	114	F529 C533 K536 I541 S1112 S1113 F1114	F529-Y1116 HydrophobicContact CD2-CE2 4.47Å; F529-Y1116 PolarHBondContact O-OH 3.27Å; C533-Y1116 WeakPolarHBondContact CA-OH 2.9Å; C533-Y1116 VanDerWaalsContact CB-OH 3.27Å; C533-Y1116 WeakPolarHBondContact CB-OH 3.37Å; C533-Y1116 PolarHBondContact N-OH 3.48Å; K536-Y1116 HydrophobicContact CD-CD1 4.01Å; K536-Y1116 HydrophobicContact CD-CG 4.1Å; K536-Y1116 PolarHBondContact NZ-O 3.19Å; I541-Y1116 HydrophobicContact CD1-CE1 4.26Å; S1112-Y1116 WeakPolarHBondContact O-CD2 3.25Å; S1112-Y1116 PolarHBondContact O-N 3.17Å; S1112-Y1116 VanDerWaalsContact O-N 3.12Å; S1113-Y1116 PolarHBondContact O-N 3.08Å; F1114-Y1116 VanDerWaalsContact C-N 3.35Å
1117	N	83.5	Confident	86.8	Confident	8 Å²	8	12.6 Å²	12.6	4%	0.043	6%	0.059	C	C	.	.			trans	-140.5	89.4	-176.5	-62.5	-53.8	0	0	0	111.2	K536 D708 S1113 F1114 N1119 I1120	K536-N1117 VanDerWaalsContact NZ-CG 3.28Å; K536-N1117 PolarHBondContact NZ-ND2 3.13Å; K536-N1117 PolarHBondContact NZ-OD1 3.36Å; D708-N1117 HydrophobicContact CB-CB 4.35Å; S1113-N1117 WeakPolarHBondContact O-CB 3.37Å; S1113-N1117 PolarHBondContact O-N 3.14Å; F1114-N1117 CarbonylContact O-C 3.54Å; N1117-N1119 PolarHBondContact O-N 3.4Å; N1117-N1119 VanDerWaalsContact O-N 3.15Å; N1117-I1120 HydrophobicContact CB-CB 4.23Å; N1117-I1120 HydrophobicContact CB-CD1 3.33Å; N1117-I1120 HydrophobicContact CB-CG1 3.63Å; N1117-I1120 VanDerWaalsContact ND2-CD1 3.35Å; N1117-I1120 WeakPolarHBondContact ND2-CD1 3.41Å; N1117-I1120 PolarHBondContact O-N 2.92Å; N1117-I1120 VanDerWaalsContact O-N 3.12Å
1118	D	82.9	Confident	86.8	Confident	28 Å²	28	12.5 Å²	12.5	15%	0.15	6%	0.058	C	C	.	.	H	α-helix	trans	-61.8	-29	-176.2	-50.9	-0.3	0	0	0	112.6	R623 N648 I1120 F1121 R1122	R623-D1118 IonicContact CZ-OD1 2.73Å; R623-D1118 IonicContact CZ-OD2 3.67Å; R623-D1118 IonicContact NH1-OD1 3.97Å; R623-D1118 PolarHBondContact NH1-OD1 2.77Å; R623-D1118 IonicContact NH1-OD2 3.97Å; R623-D1118 IonicContact NH2-OD1 3.4Å; R623-D1118 PolarHBondContact NH2-OD1 3.25Å; R623-D1118 IonicContact NH2-OD2 3.23Å; N648-D1118 WeakPolarHBondContact CB-OD2 3.11Å; N648-D1118 VanDerWaalsContact CG-OD2 3.26Å; N648-D1118 PolarHBondContact ND2-OD2 3.36Å; D1118-I1120 VanDerWaalsContact C-N 3.33Å; D1118-I1120 PolarHBondContact O-N 3.23Å; D1118-F1121 PolarHBondContact O-N 2.87Å; D1118-R1122 PolarHBondContact O-N 3.29Å
1119	N	87.5	Confident	86.7	Confident	6 Å²	6	12.8 Å²	12.8	3%	0.032	6%	0.061	C	C	.	.	H	α-helix	trans	-74.8	-21.9	-178.4	-65.1	-32.6	0	0	0	113.2	D708 R739 I748 I767 N1117 R1122 F1123	D708-N1119 HydrophobicContact CB-CB 4.38Å; D708-N1119 VanDerWaalsContact CG-ND2 3.29Å; D708-N1119 PolarHBondContact OD1-ND2 2.92Å; D708-N1119 PolarHBondContact OD2-ND2 3.05Å; R739-N1119 WeakPolarHBondContact CD-OD1 3.26Å; R739-N1119 PolarHBondContact NE-ND2 3.34Å; I748-N1119 WeakPolarHBondContact CD1-O 3.03Å; I767-N1119 HydrophobicContact CD1-CB 4.3Å; N1117-N1119 PolarHBondContact O-N 3.4Å; N1117-N1119 VanDerWaalsContact O-N 3.15Å; N1119-R1122 PolarHBondContact O-N 3.15Å; N1119-R1122 PolarHBondContact OD1-NH1 2.85Å; N1119-R1122 VanDerWaalsContact OD1-NH1 3.11Å; N1119-F1123 WeakPolarHBondContact O-CB 3.43Å; N1119-F1123 PolarHBondContact O-N 2.79Å
1120	I	90.2	Very high	86.8	Confident	1 Å²	1	12.3 Å²	12.3	1%	0.005	6%	0.058	C	C	.	.	H	α-helix	trans	-68.5	-42.1	174.9	-64.7	177.2	0	0	0	110	L679 L706 F1114 N1117 D1118 R1122 F1123 L1124	L679-I1120 HydrophobicContact CD2-CG2 3.35Å; L706-I1120 HydrophobicContact CB-CD1 3.63Å; L706-I1120 HydrophobicContact CB-CG1 4.17Å; L706-I1120 HydrophobicContact CB-CG2 4.48Å; L706-I1120 HydrophobicContact CD1-CG2 4.17Å; L706-I1120 WeakPolarHBondContact O-CD1 3.05Å; F1114-I1120 HydrophobicContact CD1-CG2 4.39Å; F1114-I1120 HydrophobicContact CE1-CG2 4.25Å; N1117-I1120 HydrophobicContact CB-CB 4.23Å; N1117-I1120 HydrophobicContact CB-CD1 3.33Å; N1117-I1120 HydrophobicContact CB-CG1 3.63Å; N1117-I1120 VanDerWaalsContact ND2-CD1 3.35Å; N1117-I1120 WeakPolarHBondContact ND2-CD1 3.41Å; N1117-I1120 PolarHBondContact O-N 2.92Å; N1117-I1120 VanDerWaalsContact O-N 3.12Å; D1118-I1120 VanDerWaalsContact C-N 3.33Å; D1118-I1120 PolarHBondContact O-N 3.23Å; I1120-R1122 PolarHBondContact O-N 3.49Å; I1120-F1123 WeakPolarHBondContact O-CB 3.44Å; I1120-F1123 PolarHBondContact O-N 3.25Å; I1120-L1124 PolarHBondContact O-N 3.13Å
1121	F	89.1	Confident	86.5	Confident	11 Å²	11	15.5 Å²	15.5	5%	0.048	7%	0.072	C	C	.	.	H	α-helix	trans	-62.5	-44.1	176.2	178.4	-111.9	0	0	0	111.7	M650 V651 V652 F1114 D1118 F1123 L1124 R1125	M650-F1121 HydrophobicContact SD-CB 4.37Å; M650-F1121 HydrophobicContact SD-CD1 4.21Å; M650-F1121 HydrophobicContact SD-CG 4.47Å; V651-F1121 VanDerWaalsContact O-CZ 3.31Å; V651-F1121 WeakPolarHBondContact O-CZ 3.32Å; V652-F1121 HydrophobicContact CB-CE2 4.41Å; V652-F1121 HydrophobicContact CG1-CE2 4.33Å; V652-F1121 HydrophobicContact CG2-CD2 4.35Å; V652-F1121 HydrophobicContact CG2-CE2 3.92Å; V652-F1121 HydrophobicContact CG2-CZ 4.26Å; F1114-F1121 HydrophobicContact CB-CB 4.25Å; F1114-F1121 HydrophobicContact CD1-CB 3.77Å; F1114-F1121 HydrophobicContact CD1-CD2 4.33Å; F1114-F1121 HydrophobicContact CD2-CD2 4.01Å; F1114-F1121 HydrophobicContact CE1-CB 4.29Å; F1114-F1121 HydrophobicContact CE1-CD2 4.33Å; F1114-F1121 HydrophobicContact CE2-CD2 4.01Å; F1114-F1121 HydrophobicContact CG-CB 3.98Å; F1114-F1121 HydrophobicContact CG-CD2 4.19Å; F1114-F1121 HydrophobicContact CG-CG 4.44Å; F1114-F1121 HydrophobicContact CZ-CD2 4.18Å; D1118-F1121 PolarHBondContact O-N 2.87Å; F1121-F1123 VanDerWaalsContact C-N 3.32Å; F1121-F1123 PolarHBondContact O-N 3.08Å; F1121-L1124 PolarHBondContact O-N 3.02Å; F1121-R1125 VanDerWaalsContact CE1-CD 3.46Å; F1121-R1125 HydrophobicContact CE1-CG 4.24Å; F1121-R1125 HydrophobicContact CE2-CG 4.39Å; F1121-R1125 HydrophobicContact CZ-CG 4.05Å; F1121-R1125 PolarHBondContact O-N 2.97Å
1122	R	87.8	Confident	85.9	Confident	67 Å²	67	16 Å²	16	25%	0.253	8%	0.076	S	C	.	.	H	α-helix	trans	-62.4	-39	174.1	-69.9	-175.7	-179.5	129.8	-1.3	112.2	I748 D1118 N1119 I1120 L1124 R1125 V1126	I748-R1122 HydrophobicContact CD1-CB 3.28Å; I748-R1122 HydrophobicContact CD1-CG 4.47Å; I748-R1122 HydrophobicContact CG1-CB 4.46Å; D1118-R1122 PolarHBondContact O-N 3.29Å; N1119-R1122 PolarHBondContact O-N 3.15Å; N1119-R1122 PolarHBondContact OD1-NH1 2.85Å; N1119-R1122 VanDerWaalsContact OD1-NH1 3.11Å; I1120-R1122 PolarHBondContact O-N 3.49Å; R1122-L1124 VanDerWaalsContact C-N 3.34Å; R1122-R1125 PolarHBondContact O-N 2.79Å; R1122-V1126 WeakPolarHBondContact O-CG2 3.28Å; R1122-V1126 PolarHBondContact O-N 3.11Å
1123	F	91.2	Very high	85.7	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-58.7	-45.8	174.5	158.7	-98.4	0	0	0	111.4	L706 L736 A737 I748 I750 I767 N1119 I1120 F1121 R1125 V1126 L1127	L706-F1123 HydrophobicContact CD1-CE1 4.48Å; L736-F1123 HydrophobicContact CD2-CE1 3.91Å; L736-F1123 HydrophobicContact CD2-CE2 3.8Å; L736-F1123 HydrophobicContact CD2-CZ 3.47Å; L736-F1123 VanDerWaalsContact CD2-CZ 3.47Å; L736-F1123 HydrophobicContact CG-CE2 4.05Å; L736-F1123 HydrophobicContact CG-CZ 4.14Å; A737-F1123 HydrophobicContact CB-CD2 4.04Å; A737-F1123 HydrophobicContact CB-CE2 4.46Å; I748-F1123 HydrophobicContact CD1-CB 4.39Å; I748-F1123 HydrophobicContact CG2-CB 4.48Å; I750-F1123 HydrophobicContact CD1-CD2 4.05Å; I750-F1123 HydrophobicContact CD1-CE2 3.87Å; I750-F1123 HydrophobicContact CG1-CD2 4Å; I750-F1123 HydrophobicContact CG1-CE2 3.98Å; I750-F1123 HydrophobicContact CG2-CE2 4.14Å; I767-F1123 HydrophobicContact CD1-CB 3.7Å; I767-F1123 HydrophobicContact CD1-CG 4.34Å; N1119-F1123 WeakPolarHBondContact O-CB 3.43Å; N1119-F1123 PolarHBondContact O-N 2.79Å; I1120-F1123 WeakPolarHBondContact O-CB 3.44Å; I1120-F1123 PolarHBondContact O-N 3.25Å; F1121-F1123 VanDerWaalsContact C-N 3.32Å; F1121-F1123 PolarHBondContact O-N 3.08Å; F1123-R1125 PolarHBondContact O-N 3.22Å; F1123-V1126 PolarHBondContact O-N 2.88Å; F1123-L1127 HydrophobicContact CE1-CD2 4.47Å; F1123-L1127 HydrophobicContact CZ-CD2 4.23Å; F1123-L1127 WeakPolarHBondContact O-CB 3.09Å; F1123-L1127 PolarHBondContact O-N 3.15Å
1124	L	91.1	Very high	85.4	Confident	2 Å²	2	20.5 Å²	20.5	1%	0.01	10%	0.099	C	C	.	.	H	α-helix	trans	-63	-41.2	176.6	-69	176.7	0	0	0	112.5	L657 I675 L679 F1114 I1120 F1121 R1122 L1127 I1128	L657-L1124 HydrophobicContact CD2-CB 4.43Å; L657-L1124 HydrophobicContact CD2-CD1 4.36Å; I675-L1124 HydrophobicContact CG2-CD2 3.78Å; L679-L1124 HydrophobicContact CD1-CD1 3.65Å; L679-L1124 HydrophobicContact CD1-CD2 4.22Å; L679-L1124 HydrophobicContact CD2-CD1 3.84Å; L679-L1124 HydrophobicContact CD2-CG 4.39Å; L679-L1124 HydrophobicContact CG-CD1 4.39Å; F1114-L1124 HydrophobicContact CE1-CD1 3.48Å; F1114-L1124 VanDerWaalsContact CE1-CD1 3.48Å; F1114-L1124 HydrophobicContact CZ-CD1 3.49Å; F1114-L1124 VanDerWaalsContact CZ-CD1 3.49Å; I1120-L1124 PolarHBondContact O-N 3.13Å; F1121-L1124 PolarHBondContact O-N 3.02Å; R1122-L1124 VanDerWaalsContact C-N 3.34Å; L1124-L1127 WeakPolarHBondContact O-CB 3.28Å; L1124-L1127 PolarHBondContact O-N 2.67Å; L1124-I1128 WeakPolarHBondContact O-CG1 3.3Å; L1124-I1128 PolarHBondContact O-N 3.04Å
1125	R	88.7	Confident	84.8	Confident	31 Å²	31	25 Å²	25	12%	0.117	12%	0.121	C	C	.	.	H	α-helix	trans	-61.3	-44.1	175.1	-77.1	-176.1	67.4	-148.2	-9	111.7	F1121 R1122 F1123 L1127 I1128 S1129 T1133 D1134 E1137	F1121-R1125 VanDerWaalsContact CE1-CD 3.46Å; F1121-R1125 HydrophobicContact CE1-CG 4.24Å; F1121-R1125 HydrophobicContact CE2-CG 4.39Å; F1121-R1125 HydrophobicContact CZ-CG 4.05Å; F1121-R1125 PolarHBondContact O-N 2.97Å; R1122-R1125 PolarHBondContact O-N 2.79Å; F1123-R1125 PolarHBondContact O-N 3.22Å; R1125-L1127 VanDerWaalsContact C-N 3.31Å; R1125-L1127 PolarHBondContact O-N 3.37Å; R1125-I1128 PolarHBondContact O-N 2.93Å; R1125-S1129 PolarHBondContact O-N 3.14Å; R1125-T1133 HydrophobicContact CB-CG2 4.21Å; R1125-T1133 PolarHBondContact NH2-OG1 2.88Å; R1125-T1133 WeakPolarHBondContact O-CG2 3.38Å; R1125-D1134 IonicContact CZ-OD1 2.72Å; R1125-D1134 IonicContact NH1-OD1 3.14Å; R1125-D1134 IonicContact NH2-OD1 3.78Å; R1125-D1134 PolarHBondContact NH2-OD1 3.19Å; R1125-E1137 IonicContact CZ-OE1 3.92Å; R1125-E1137 VanDerWaalsContact CZ-OE1 3.24Å; R1125-E1137 IonicContact CZ-OE2 3.69Å; R1125-E1137 IonicContact NE-OE1 3.87Å; R1125-E1137 PolarHBondContact NE-OE1 3.49Å; R1125-E1137 IonicContact NH2-OE1 3.75Å; R1125-E1137 PolarHBondContact NH2-OE1 3.29Å; R1125-E1137 IonicContact NH2-OE2 3.29Å; R1125-E1137 PolarHBondContact NH2-OE2 3.32Å
1126	V	88.6	Confident	84.5	Confident	19 Å²	19	25 Å²	25	12%	0.115	12%	0.121	C	C	.	.	H	α-helix	trans	-66.3	-35.7	177.1	173.2	0	0	0	0	111.7	I748 I750 R1122 F1123 G1130 Q1131	I748-V1126 HydrophobicContact CB-CG2 4.34Å; I750-V1126 HydrophobicContact CD1-CB 4.4Å; I750-V1126 HydrophobicContact CD1-CG1 3.87Å; I750-V1126 HydrophobicContact CG1-CG1 4.21Å; R1122-V1126 WeakPolarHBondContact O-CG2 3.28Å; R1122-V1126 PolarHBondContact O-N 3.11Å; F1123-V1126 PolarHBondContact O-N 2.88Å; V1126-G1130 WeakPolarHBondContact CA-O 3.31Å; V1126-G1130 CarbonylContact O-C 3.59Å; V1126-G1130 WeakPolarHBondContact O-CA 3.34Å; V1126-G1130 PolarHBondContact O-N 3.01Å; V1126-Q1131 HydrophobicContact CG1-CG 4Å
1127	L	90.1	Very high	84.3	Confident	8 Å²	8	23.5 Å²	23.5	4%	0.042	12%	0.115	C	C	.	.	H	α-helix	trans	-61.7	-53.9	173.9	-172.9	66.3	0	0	0	110.1	Y664 F671 I750 F1123 L1124 R1125 V1162 F1234	Y664-L1127 HydrophobicContact CE2-CD2 4.34Å; Y664-L1127 HydrophobicContact CE2-CG 3.88Å; Y664-L1127 PolarHBondContact OH-O 2.89Å; F671-L1127 HydrophobicContact CE1-CD2 4.2Å; F671-L1127 HydrophobicContact CZ-CD2 4.4Å; I750-L1127 HydrophobicContact CD1-CB 4.14Å; I750-L1127 HydrophobicContact CD1-CD1 4.15Å; F1123-L1127 HydrophobicContact CE1-CD2 4.47Å; F1123-L1127 HydrophobicContact CZ-CD2 4.23Å; F1123-L1127 WeakPolarHBondContact O-CB 3.09Å; F1123-L1127 PolarHBondContact O-N 3.15Å; L1124-L1127 WeakPolarHBondContact O-CB 3.28Å; L1124-L1127 PolarHBondContact O-N 2.67Å; R1125-L1127 VanDerWaalsContact C-N 3.31Å; R1125-L1127 PolarHBondContact O-N 3.37Å; L1127-V1162 HydrophobicContact CD1-CG2 4.33Å; L1127-F1234 HydrophobicContact CD1-CZ 4.3Å
1128	I	88.4	Confident	84	Confident	3 Å²	3	25.4 Å²	25.4	2%	0.015	13%	0.132	C	C	.	.	H	α-helix	trans	-72.9	-42.7	-173.6	-64.9	168.2	0	0	0	113	L657 Y664 P961 F964 L1124 R1125	L657-I1128 HydrophobicContact CD2-CD1 3.85Å; Y664-I1128 HydrophobicContact CE2-CG1 4.49Å; P961-I1128 HydrophobicContact CG-CG2 4.02Å; F964-I1128 VanDerWaalsContact CZ-O 3.32Å; F964-I1128 WeakPolarHBondContact CZ-O 3.2Å; L1124-I1128 WeakPolarHBondContact O-CG1 3.3Å; L1124-I1128 PolarHBondContact O-N 3.04Å; R1125-I1128 PolarHBondContact O-N 2.93Å
1129	S	83.6	Confident	83.7	Confident	8 Å²	8	25.4 Å²	25.4	6%	0.056	13%	0.134	C	C	.	.	H	α-helix	trans	-115.6	0.7	-169.6	-55.5	0	0	0	0	114.6	F913 R1125	F913-S1129 WeakPolarHBondContact CZ-O 3.27Å; R1125-S1129 PolarHBondContact O-N 3.14Å
1130	G	82.4	Confident	83.2	Confident	2 Å²	2	26.6 Å²	26.6	2%	0.021	14%	0.139	C	C	.	.			trans	87.1	179.3	179.4	0	0	0	0	0	113.9	V1126 S1132 T1133	V1126-G1130 WeakPolarHBondContact CA-O 3.31Å; V1126-G1130 CarbonylContact O-C 3.59Å; V1126-G1130 WeakPolarHBondContact O-CA 3.34Å; V1126-G1130 PolarHBondContact O-N 3.01Å; G1130-S1132 VanDerWaalsContact C-N 3.32Å; G1130-S1132 PolarHBondContact O-N 3.39Å; G1130-T1133 WeakPolarHBondContact O-CG2 3.24Å
1131	Q	79.1	Confident	82.3	Confident	67 Å²	67	28.5 Å²	28.5	31%	0.313	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-24.6	-174	-64.7	-168	17	0	0	114.1	V1126 T1133 M1157 A1158	V1126-Q1131 HydrophobicContact CG1-CG 4Å; Q1131-T1133 VanDerWaalsContact C-N 3.34Å; Q1131-T1133 PolarHBondContact O-N 3.49Å; Q1131-M1157 HydrophobicContact CB-SD 4.12Å; Q1131-A1158 PolarHBondContact NE2-O 3.03Å
1132	S	75.9	Confident	81.5	Confident	11 Å²	11	33.5 Å²	33.5	8%	0.077	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	34.8	-178.3	60.3	0	0	0	0	113.4	T910 S912 G1130 D1134 E1135 L1136 M1157	T910-S1132 WeakPolarHBondContact CB-OG 3.29Å; T910-S1132 PolarHBondContact OG1-OG 3.11Å; S912-S1132 PolarHBondContact OG-OG 2.95Å; G1130-S1132 VanDerWaalsContact C-N 3.32Å; G1130-S1132 PolarHBondContact O-N 3.39Å; S1132-D1134 PolarHBondContact O-N 3.15Å; S1132-D1134 VanDerWaalsContact O-N 3.14Å; S1132-E1135 PolarHBondContact O-N 3.34Å; S1132-E1135 VanDerWaalsContact O-N 3.15Å; S1132-L1136 PolarHBondContact O-N 3.02Å; S1132-M1157 WeakPolarHBondContact OG-CE 3.42Å
1133	T	78.1	Confident	80.8	Confident	11 Å²	11	33.5 Å²	33.5	7%	0.067	21%	0.205	C	C	.	.	H	α-helix	trans	-52.7	-39.1	-175.9	57.8	0	0	0	0	113.5	R1125 G1130 Q1131 L1136 E1137	R1125-T1133 HydrophobicContact CB-CG2 4.21Å; R1125-T1133 PolarHBondContact NH2-OG1 2.88Å; R1125-T1133 WeakPolarHBondContact O-CG2 3.38Å; G1130-T1133 WeakPolarHBondContact O-CG2 3.24Å; Q1131-T1133 VanDerWaalsContact C-N 3.34Å; Q1131-T1133 PolarHBondContact O-N 3.49Å; T1133-L1136 WeakPolarHBondContact O-CB 3.35Å; T1133-L1136 PolarHBondContact O-N 3.46Å; T1133-E1137 WeakPolarHBondContact O-CB 3.3Å; T1133-E1137 WeakPolarHBondContact O-CG 3.49Å; T1133-E1137 PolarHBondContact O-N 3.5Å
1134	D	76.7	Confident	79.9	Confident	97 Å²	97	35.5 Å²	35.5	52%	0.519	22%	0.222	S	C	.	.	H	α-helix	trans	-74.3	-32.2	-174.5	-62.5	-20.1	0	0	0	112.1	R1125 S1132 A1138	R1125-D1134 IonicContact CZ-OD1 2.72Å; R1125-D1134 IonicContact NH1-OD1 3.14Å; R1125-D1134 IonicContact NH2-OD1 3.78Å; R1125-D1134 PolarHBondContact NH2-OD1 3.19Å; S1132-D1134 PolarHBondContact O-N 3.15Å; S1132-D1134 VanDerWaalsContact O-N 3.14Å; D1134-A1138 WeakPolarHBondContact O-CB 3.37Å; D1134-A1138 PolarHBondContact O-N 2.85Å
1135	E	76.4	Confident	79.2	Confident	98 Å²	98	36.3 Å²	36.3	46%	0.458	23%	0.23	S	C	.	.	H	α-helix	trans	-74.2	-37	174.9	-67.7	179	-171.3	0	0	111	K745 S1132 A1138 S1139	K745-E1135 IonicContact NZ-OE1 3.9Å; K745-E1135 PolarHBondContact NZ-OE1 3.2Å; K745-E1135 VanDerWaalsContact NZ-OE1 3.08Å; S1132-E1135 PolarHBondContact O-N 3.34Å; S1132-E1135 VanDerWaalsContact O-N 3.15Å; E1135-A1138 PolarHBondContact O-N 3.11Å; E1135-S1139 PolarHBondContact O-N 3.25Å
1136	L	80.1	Confident	78.9	Confident	5 Å²	5	35.4 Å²	35.4	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-61	-51.4	172.7	-170.7	71.6	0	0	0	110.6	F913 M960 S1132 T1133 A1138 S1139 F1140 L1146	F913-L1136 HydrophobicContact CE2-CD1 4.19Å; F913-L1136 HydrophobicContact CE2-CD2 3.84Å; F913-L1136 HydrophobicContact CZ-CD2 4.28Å; M960-L1136 HydrophobicContact SD-CD2 4.14Å; S1132-L1136 PolarHBondContact O-N 3.02Å; T1133-L1136 WeakPolarHBondContact O-CB 3.35Å; T1133-L1136 PolarHBondContact O-N 3.46Å; L1136-A1138 VanDerWaalsContact C-N 3.31Å; L1136-A1138 PolarHBondContact O-N 3.42Å; L1136-S1139 WeakPolarHBondContact O-CB 3.44Å; L1136-S1139 PolarHBondContact O-N 2.89Å; L1136-S1139 VanDerWaalsContact O-N 3.1Å; L1136-F1140 HydrophobicContact CD1-CD2 4.19Å; L1136-F1140 HydrophobicContact CD1-CE2 3.56Å; L1136-F1140 HydrophobicContact CD1-CZ 4.48Å; L1136-F1140 HydrophobicContact CD2-CE2 4.15Å; L1136-F1140 HydrophobicContact CG-CD2 3.84Å; L1136-F1140 HydrophobicContact CG-CE2 3.54Å; L1136-F1140 WeakPolarHBondContact O-CD2 3.49Å; L1136-F1140 PolarHBondContact O-N 3.44Å; L1136-L1146 HydrophobicContact CD1-CD2 3.6Å
1137	E	79.2	Confident	78.5	Confident	10 Å²	10	37.8 Å²	37.8	5%	0.047	24%	0.238	C	C	.	.	H	α-helix	trans	-59.3	-39.7	176	-83	179.9	-164.5	0	0	112.8	F631 K634 R1125 T1133 F1140 S1141	F631-E1137 HydrophobicContact CE2-CG 3.76Å; F631-E1137 HydrophobicContact CZ-CG 3.6Å; K634-E1137 VanDerWaalsContact CE-OE1 3.28Å; K634-E1137 WeakPolarHBondContact CE-OE1 3.48Å; K634-E1137 IonicContact NZ-OE1 3.65Å; K634-E1137 PolarHBondContact NZ-OE1 2.69Å; R1125-E1137 IonicContact CZ-OE1 3.92Å; R1125-E1137 VanDerWaalsContact CZ-OE1 3.24Å; R1125-E1137 IonicContact CZ-OE2 3.69Å; R1125-E1137 IonicContact NE-OE1 3.87Å; R1125-E1137 PolarHBondContact NE-OE1 3.49Å; R1125-E1137 IonicContact NH2-OE1 3.75Å; R1125-E1137 PolarHBondContact NH2-OE1 3.29Å; R1125-E1137 IonicContact NH2-OE2 3.29Å; R1125-E1137 PolarHBondContact NH2-OE2 3.32Å; T1133-E1137 WeakPolarHBondContact O-CB 3.3Å; T1133-E1137 WeakPolarHBondContact O-CG 3.49Å; T1133-E1137 PolarHBondContact O-N 3.5Å; E1137-F1140 PolarHBondContact O-N 3.39Å; E1137-S1141 WeakPolarHBondContact O-CB 3.48Å; E1137-S1141 PolarHBondContact O-N 3.41Å
1138	A	76.5	Confident	78	Confident	49 Å²	49	42.9 Å²	42.9	41%	0.405	26%	0.261	S	S	.	.	H	α-helix	trans	-62.9	-43	174.3	0	0	0	0	0	111.4	D1134 E1135 L1136 F1140 S1141 V1142	D1134-A1138 WeakPolarHBondContact O-CB 3.37Å; D1134-A1138 PolarHBondContact O-N 2.85Å; E1135-A1138 PolarHBondContact O-N 3.11Å; L1136-A1138 VanDerWaalsContact C-N 3.31Å; L1136-A1138 PolarHBondContact O-N 3.42Å; A1138-F1140 PolarHBondContact O-N 3.35Å; A1138-S1141 PolarHBondContact O-N 2.97Å; A1138-S1141 PolarHBondContact O-OG 3.38Å; A1138-V1142 WeakPolarHBondContact O-CG2 3.33Å; A1138-V1142 PolarHBondContact O-N 2.87Å
1139	S	77.6	Confident	77.3	Confident	27 Å²	27	44.4 Å²	44.4	19%	0.189	27%	0.268	C	S	.	.	H	α-helix	trans	-60.8	-45.2	175.9	-167	0	0	0	0	112	E1135 L1136 S1141 V1142 G1143 A1144 G1145	E1135-S1139 PolarHBondContact O-N 3.25Å; L1136-S1139 WeakPolarHBondContact O-CB 3.44Å; L1136-S1139 PolarHBondContact O-N 2.89Å; L1136-S1139 VanDerWaalsContact O-N 3.1Å; S1139-S1141 VanDerWaalsContact C-N 3.35Å; S1139-S1141 PolarHBondContact O-N 3.05Å; S1139-V1142 PolarHBondContact O-N 2.89Å; S1139-G1143 PolarHBondContact O-N 3.4Å; S1139-A1144 PolarHBondContact O-N 3.24Å; S1139-A1144 VanDerWaalsContact O-N 3.13Å; S1139-G1145 PolarHBondContact OG-O 3.32Å
1140	F	77.4	Confident	76.3	Confident	31 Å²	31	48.8 Å²	48.8	14%	0.136	31%	0.305	C	S	.	.	H	α-helix	trans	-65.9	-35.4	176.6	-77.7	-67.3	0	0	0	112.9	F631 E956 L1136 E1137 A1138 V1142 G1143 L1146	F631-F1140 HydrophobicContact CE1-CB 4Å; F631-F1140 HydrophobicContact CE1-CD2 4.07Å; F631-F1140 HydrophobicContact CE1-CG 4.05Å; F631-F1140 HydrophobicContact CZ-CD2 4.39Å; E956-F1140 WeakPolarHBondContact OE1-CE1 3.49Å; E956-F1140 WeakPolarHBondContact OE1-CZ 3.24Å; L1136-F1140 HydrophobicContact CD1-CD2 4.19Å; L1136-F1140 HydrophobicContact CD1-CE2 3.56Å; L1136-F1140 HydrophobicContact CD1-CZ 4.48Å; L1136-F1140 HydrophobicContact CD2-CE2 4.15Å; L1136-F1140 HydrophobicContact CG-CD2 3.84Å; L1136-F1140 HydrophobicContact CG-CE2 3.54Å; L1136-F1140 WeakPolarHBondContact O-CD2 3.49Å; L1136-F1140 PolarHBondContact O-N 3.44Å; E1137-F1140 PolarHBondContact O-N 3.39Å; A1138-F1140 PolarHBondContact O-N 3.35Å; F1140-V1142 PolarHBondContact O-N 2.96Å; F1140-G1143 PolarHBondContact O-N 3.14Å; F1140-L1146 HydrophobicContact CZ-CG 4.32Å
1141	S	71.4	Confident	75.2	Confident	42 Å²	42	52.9 Å²	52.9	29%	0.294	33%	0.329	S	S	.	.	H	α-helix	trans	-63.6	-28.2	176.7	74.9	0	0	0	0	113.3	E1137 A1138 S1139 G1143	E1137-S1141 WeakPolarHBondContact O-CB 3.48Å; E1137-S1141 PolarHBondContact O-N 3.41Å; A1138-S1141 PolarHBondContact O-N 2.97Å; A1138-S1141 PolarHBondContact O-OG 3.38Å; S1139-S1141 VanDerWaalsContact C-N 3.35Å; S1139-S1141 PolarHBondContact O-N 3.05Å; S1141-G1143 VanDerWaalsContact C-N 3.31Å
1142	V	72.4	Confident	74.2	Confident	115 Å²	115	55.5 Å²	55.5	70%	0.697	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-7.2	175.7	-179.2	0	0	0	0	111.6	A1138 S1139 F1140 A1144	A1138-V1142 WeakPolarHBondContact O-CG2 3.33Å; A1138-V1142 PolarHBondContact O-N 2.87Å; S1139-V1142 PolarHBondContact O-N 2.89Å; F1140-V1142 PolarHBondContact O-N 2.96Å; V1142-A1144 VanDerWaalsContact C-N 3.28Å
1143	G	72.5	Confident	73	Confident	68 Å²	68	63.7 Å²	63.7	70%	0.701	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	14.6	-176.7	0	0	0	0	0	113.7	S1139 F1140 S1141	S1139-G1143 PolarHBondContact O-N 3.4Å; F1140-G1143 PolarHBondContact O-N 3.14Å; S1141-G1143 VanDerWaalsContact C-N 3.31Å
1144	A	71.2	Confident	71.8	Confident	42 Å²	42	65.4 Å²	65.4	35%	0.347	40%	0.402	S	S	.	.			trans	-82.7	-14	-175.4	0	0	0	0	0	114	S1139 V1142 Q1147	S1139-A1144 PolarHBondContact O-N 3.24Å; S1139-A1144 VanDerWaalsContact O-N 3.13Å; V1142-A1144 VanDerWaalsContact C-N 3.28Å; A1144-Q1147 HydrophobicContact CB-CG 4.38Å
1145	G	77.6	Confident	71.1	Confident	19 Å²	19	65.6 Å²	65.6	20%	0.196	41%	0.406	C	S	.	.			trans	62.2	-153	-178.3	0	0	0	0	0	113.3	S1139 Q1147	S1139-G1145 PolarHBondContact OG-O 3.32Å; G1145-Q1147 PolarHBondContact O-N 2.83Å
1146	L	82.2	Confident	70.8	Confident	12 Å²	12	68.5 Å²	68.5	6%	0.063	41%	0.413	C	S	.	.	S	Bend	trans	-79.5	113.8	173.2	-69.7	173.3	0	0	0	110.4	D908 F913 W915 N991 L992 L1136 F1140	D908-L1146 HydrophobicContact CB-CD2 4.29Å; F913-L1146 HydrophobicContact CD2-CD2 4.19Å; W915-L1146 PolarHBondContact NE1-O 2.68Å; N991-L1146 HydrophobicContact CB-CB 4.29Å; L992-L1146 HydrophobicContact CD2-CD1 3.67Å; L992-L1146 HydrophobicContact CG-CD1 4.14Å; L1136-L1146 HydrophobicContact CD1-CD2 3.6Å; F1140-L1146 HydrophobicContact CZ-CG 4.32Å
1147	Q	80.6	Confident	70.4	Confident	69 Å²	69	70.2 Å²	70.2	32%	0.322	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-92.3	151.8	-179.6	-64	-172.3	-25.7	0	0	112.2	D908 R909 A1144 G1145	D908-Q1147 CarbonylContact C-O 3.07Å; D908-Q1147 WeakPolarHBondContact CA-O 3.43Å; R909-Q1147 HydrophobicContact CB-CB 4.19Å; R909-Q1147 PolarHBondContact N-O 2.87Å; A1144-Q1147 HydrophobicContact CB-CG 4.38Å; G1145-Q1147 PolarHBondContact O-N 2.83Å
1148	Q	79	Confident	69.9	Low	114 Å²	114	71.7 Å²	71.7	53%	0.533	44%	0.436	S	S	.	.	B	Isolated β-bridge	trans	-63.3	144.1	170.9	-168.2	177.3	6	0	0	111.5	W915 A1150	W915-Q1148 HydrophobicContact CD2-CB 4.35Å; W915-Q1148 HydrophobicContact CE3-CB 4.33Å; W915-Q1148 HydrophobicContact CE3-CG 4.01Å; W915-Q1148 HydrophobicContact CH2-CB 3.65Å; W915-Q1148 HydrophobicContact CH2-CG 3.71Å; W915-Q1148 HydrophobicContact CZ2-CB 3.67Å; W915-Q1148 HydrophobicContact CZ2-CG 4.23Å; W915-Q1148 HydrophobicContact CZ3-CB 3.99Å; W915-Q1148 HydrophobicContact CZ3-CG 3.59Å; Q1148-A1150 PolarHBondContact O-N 3.24Å
1149	Q	72.9	Confident	70	Confident	36 Å²	36	69.9 Å²	69.9	17%	0.168	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-62.4	125.1	169.9	-161.1	-176.3	13.9	0	0	111	T1151 S1154	Q1149-T1151 VanDerWaalsContact CG-O 3.28Å; Q1149-T1151 WeakPolarHBondContact CG-O 3.36Å; Q1149-T1151 PolarHBondContact NE2-O 3.46Å; Q1149-S1154 PolarHBondContact NE2-O 3.47Å; Q1149-S1154 PolarHBondContact NE2-OG 3.04Å
1150	A	62.9	Low	70.3	Confident	99 Å²	99	69.1 Å²	69.1	82%	0.818	42%	0.416	S	S	*	.	S	Bend	trans	-74.5	-23.2	-178.4	0	0	0	0	0	113.7	Q1148	Q1148-A1150 PolarHBondContact O-N 3.24Å
1151	T	60.4	Low	70.8	Confident	88 Å²	88	69.5 Å²	69.5	54%	0.54	42%	0.418	S	S	.	.	S	Bend	trans	-137.5	128.9	179.5	38.9	0	0	0	0	110.6	Q1149 Q1153	Q1149-T1151 VanDerWaalsContact CG-O 3.28Å; Q1149-T1151 WeakPolarHBondContact CG-O 3.36Å; Q1149-T1151 PolarHBondContact NE2-O 3.46Å; T1151-Q1153 PolarHBondContact O-N 2.95Å
1152	P	56.9	Low	71.7	Confident	123 Å²	123	67.9 Å²	67.9	80%	0.799	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	2	-175.9	26.3	-33.7	0	0	0	114.9
1153	Q	50.7	Low	72.5	Confident	183 Å²	183	62.9 Å²	62.9	86%	0.855	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	11.1	-174.2	-71.3	-176.6	-14.9	0	0	114.5	T1151	T1151-Q1153 PolarHBondContact O-N 2.95Å
1154	S	53.6	Low	73.4	Confident	47 Å²	47	61 Å²	61	33%	0.329	35%	0.35	S	S	.	.	S	Bend	trans	-74.5	134.3	170.8	101.1	0	0	0	0	110.8	Q1149 R1156	Q1149-S1154 PolarHBondContact NE2-O 3.47Å; Q1149-S1154 PolarHBondContact NE2-OG 3.04Å; S1154-R1156 PolarHBondContact O-N 3.35Å
1155	T	60.6	Low	74.3	Confident	100 Å²	100	60.2 Å²	60.2	61%	0.613	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-59	119.2	-175.5	46.1	0	0	0	0	110.6	M1157	T1155-M1157 PolarHBondContact O-N 3.3Å
1156	R	70.5	Confident	74.8	Confident	159 Å²	159	59.4 Å²	59.4	60%	0.6	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-46.5	126.6	165.7	-75.9	-178.6	-178.1	170.2	1	109	S1154	S1154-R1156 PolarHBondContact O-N 3.35Å
1157	M	72.2	Confident	74.9	Confident	41 Å²	41	59.3 Å²	59.3	20%	0.202	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-71.5	144.3	-176.6	-85.7	-159.3	-75.3	0	0	111.5	T910 G911 S912 H965 Q1131 S1132 T1155	T910-M1157 WeakPolarHBondContact O-CE 3.42Å; G911-M1157 PolarHBondContact O-N 2.82Å; S912-M1157 WeakPolarHBondContact OG-CE 3.38Å; H965-M1157 PolarHBondContact NE2-O 3.33Å; Q1131-M1157 HydrophobicContact CB-SD 4.12Å; S1132-M1157 WeakPolarHBondContact OG-CE 3.42Å; T1155-M1157 PolarHBondContact O-N 3.3Å
1158	A	69.5	Low	74.9	Confident	41 Å²	41	66.1 Å²	66.1	34%	0.339	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-65.4	148.1	172	0	0	0	0	0	110.4	Q1131	Q1131-A1158 PolarHBondContact NE2-O 3.03Å
1159	G	77.5	Confident	75.1	Confident	11 Å²	11	64.7 Å²	64.7	11%	0.113	35%	0.345	C	S	.	.			trans	-169.6	-178.9	-171.8	0	0	0	0	0	109.6	I1237	G1159-I1237 VanDerWaalsContact N-CD1 3.28Å; G1159-I1237 WeakPolarHBondContact O-CD1 3.07Å; G1159-I1237 WeakPolarHBondContact O-CG1 3.44Å
1160	V	83.9	Confident	75.2	Confident	12 Å²	12	63.3 Å²	63.3	7%	0.073	34%	0.339	C	S	.	.			trans	-128.1	133	-174.9	174.7	0	0	0	0	110	I750 N751 W966 V1162 F1234	I750-V1160 HydrophobicContact CB-CG2 3.85Å; I750-V1160 HydrophobicContact CG2-CB 4.31Å; I750-V1160 HydrophobicContact CG2-CG2 3.82Å; I750-V1160 VanDerWaalsContact O-CG2 3.29Å; I750-V1160 WeakPolarHBondContact O-CG2 3.5Å; N751-V1160 HydrophobicContact CB-CG2 3.88Å; W966-V1160 PolarHBondContact NE1-O 2.79Å; V1160-V1162 PolarHBondContact O-N 3.3Å; V1160-F1234 HydrophobicContact CG1-CB 3.33Å; V1160-F1234 HydrophobicContact CG1-CD1 3.77Å; V1160-F1234 HydrophobicContact CG1-CD2 4.03Å; V1160-F1234 HydrophobicContact CG1-CG 3.44Å; V1160-F1234 VanDerWaalsContact CG1-CG 3.44Å
1161	K	87.8	Confident	75.8	Confident	39 Å²	39	58.6 Å²	58.6	17%	0.17	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	105.7	173.3	-177.1	178.3	175.6	-175.1	0	109	S1163 M1235 D1241	K1161-S1163 PolarHBondContact O-N 3.01Å; K1161-M1235 HydrophobicContact CB-CB 4.24Å; K1161-M1235 PolarHBondContact N-O 3.17Å; K1161-M1235 PolarHBondContact O-N 3.17Å; K1161-D1241 IonicContact NZ-OD1 2.85Å; K1161-D1241 PolarHBondContact NZ-OD1 3.47Å; K1161-D1241 IonicContact NZ-OD2 2.71Å
1162	V	90.7	Very high	76.8	Confident	8 Å²	8	54.4 Å²	54.4	5%	0.048	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	125.8	170.9	-175.2	0	0	0	0	108.7	Y664 A668 F671 L1127 V1160 F1234	Y664-V1162 HydrophobicContact CD1-CB 4.02Å; Y664-V1162 HydrophobicContact CD1-CG1 4.13Å; Y664-V1162 HydrophobicContact CD1-CG2 3.96Å; Y664-V1162 HydrophobicContact CE1-CB 3.94Å; Y664-V1162 HydrophobicContact CE1-CG1 4.5Å; Y664-V1162 HydrophobicContact CE1-CG2 3.49Å; Y664-V1162 VanDerWaalsContact CE1-CG2 3.49Å; A668-V1162 HydrophobicContact CB-CG1 4.35Å; F671-V1162 HydrophobicContact CD2-CG1 3.78Å; F671-V1162 HydrophobicContact CE1-CG1 4.44Å; F671-V1162 HydrophobicContact CE2-CG1 3.58Å; F671-V1162 HydrophobicContact CG-CG1 4.29Å; F671-V1162 HydrophobicContact CZ-CG1 3.93Å; F671-V1162 HydrophobicContact CZ-CG2 4.41Å; L1127-V1162 HydrophobicContact CD1-CG2 4.33Å; V1160-V1162 PolarHBondContact O-N 3.3Å; V1162-F1234 HydrophobicContact CG1-CE1 4.4Å; V1162-F1234 HydrophobicContact CG2-CD1 4.01Å; V1162-F1234 HydrophobicContact CG2-CE1 3.68Å
1163	S	89.3	Confident	78	Confident	10 Å²	10	54.1 Å²	54.1	7%	0.07	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	154	-179.9	68.6	0	0	0	0	112.3	K1161 C1233 M1235	K1161-S1163 PolarHBondContact O-N 3.01Å; S1163-C1233 PolarHBondContact N-O 3.23Å; S1163-C1233 PolarHBondContact O-N 3.3Å; S1163-M1235 WeakPolarHBondContact OG-CG 3.34Å; S1163-M1235 PolarHBondContact OG-SD 2.88Å
1164	L	90.8	Very high	79.2	Confident	29 Å²	29	48.6 Å²	48.6	15%	0.152	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	122.4	170.3	-173.6	70.1	0	0	0	108.7	A668 P669 Y1205 M1230 F1231 Y1232	A668-L1164 HydrophobicContact CB-CB 3.99Å; P669-L1164 HydrophobicContact CG-CD2 4.45Å; L1164-Y1205 HydrophobicContact CD2-CD1 3.86Å; L1164-Y1205 HydrophobicContact CD2-CE1 4.49Å; L1164-M1230 HydrophobicContact CD1-CB 3.68Å; L1164-M1230 HydrophobicContact CD2-CB 4.16Å; L1164-M1230 HydrophobicContact CD2-CE 4.09Å; L1164-M1230 HydrophobicContact CG-CB 3.79Å; L1164-M1230 HydrophobicContact CG-CE 3.87Å; L1164-F1231 WeakPolarHBondContact CA-O 3.37Å; L1164-Y1232 HydrophobicContact CD1-CD1 3.87Å; L1164-Y1232 HydrophobicContact CD1-CE1 3.84Å; L1164-Y1232 HydrophobicContact CD1-CG 4.27Å
1165	R	89.8	Confident	80.4	Confident	25 Å²	25	46.6 Å²	46.6	9%	0.094	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	129.9	-175.9	-62.8	-65.7	-175.8	167.1	5.5	111.1	F1172 M1230 F1231 M1235 D1241	R1165-F1172 HydrophobicContact CB-CD2 3.48Å; R1165-F1172 VanDerWaalsContact CB-CD2 3.48Å; R1165-F1172 HydrophobicContact CB-CE2 3.5Å; R1165-F1172 HydrophobicContact CB-CG 4.41Å; R1165-F1172 HydrophobicContact CB-CZ 4.45Å; R1165-F1172 HydrophobicContact CG-CD2 4.15Å; R1165-F1172 HydrophobicContact CG-CE2 3.94Å; R1165-M1230 CarbonylContact O-C 3.59Å; R1165-M1230 WeakPolarHBondContact O-CA 3.26Å; R1165-F1231 PolarHBondContact N-O 3.38Å; R1165-F1231 WeakPolarHBondContact O-CD2 3.37Å; R1165-F1231 PolarHBondContact O-N 3.24Å; R1165-M1235 HydrophobicContact CG-SD 4.33Å; R1165-M1235 PolarHBondContact NE-SD 3.17Å; R1165-M1235 VanDerWaalsContact NE-SD 3.4Å; R1165-M1235 PolarHBondContact NH2-SD 2.87Å; R1165-D1241 IonicContact CZ-OD1 3.52Å; R1165-D1241 IonicContact NH1-OD1 3.59Å; R1165-D1241 IonicContact NH2-OD1 3.32Å; R1165-D1241 PolarHBondContact NH2-OD1 3.46Å; R1165-D1241 IonicContact NH2-OD2 2.82Å
1166	G	88.4	Confident	81	Confident	2 Å²	2	44.1 Å²	44.1	2%	0.021	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	178.9	167.1	0	0	0	0	0	111.9	R1168 H1169 F1172 M1230	G1166-R1168 PolarHBondContact O-N 3Å; G1166-H1169 PolarHBondContact N-CD2 3.36Å; G1166-H1169 PolarHBondContact O-N 3.49Å; G1166-F1172 WeakPolarHBondContact O-CB 3.45Å; G1166-M1230 WeakPolarHBondContact CA-SD 3.39Å; G1166-M1230 PolarHBondContact N-SD 2.96Å
1167	F	84.7	Confident	81.1	Confident	10 Å²	10	45.3 Å²	45.3	4%	0.044	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-20.6	177.4	-75	-78.4	0	0	0	114.8	H1169 K1173 L1175 T1176 L1184 I1225 Y1226 E1227 F1231	F1167-H1169 VanDerWaalsContact C-N 3.3Å; F1167-K1173 WeakPolarHBondContact O-CA 3.44Å; F1167-K1173 PolarHBondContact O-N 3.28Å; F1167-L1175 HydrophobicContact CD1-CB 4.24Å; F1167-L1175 HydrophobicContact CE1-CB 3.89Å; F1167-T1176 HydrophobicContact CB-CG2 3.66Å; F1167-T1176 HydrophobicContact CD1-CG2 3.82Å; F1167-T1176 HydrophobicContact CG-CG2 4.14Å; F1167-L1184 HydrophobicContact CE1-CD1 4.25Å; F1167-I1225 HydrophobicContact CE2-CG2 3.55Å; F1167-I1225 HydrophobicContact CZ-CB 4.36Å; F1167-I1225 HydrophobicContact CZ-CG2 3.63Å; F1167-Y1226 VanDerWaalsContact CE2-O 3.23Å; F1167-Y1226 WeakPolarHBondContact CE2-O 3.3Å; F1167-E1227 WeakPolarHBondContact CD2-O 3.4Å; F1167-F1231 HydrophobicContact CD2-CE2 4.44Å; F1167-F1231 AromaticContact CE2-CE2 3.93Å; F1167-F1231 HydrophobicContact CE2-CE2 3.93Å; F1167-F1231 HydrophobicContact CE2-CZ 4.24Å; F1167-F1231 HydrophobicContact CZ-CE2 4.09Å; F1167-F1231 HydrophobicContact CZ-CZ 4.13Å
1168	R	80.8	Confident	81.2	Confident	212 Å²	212	46.9 Å²	46.9	80%	0.8	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-18.7	175.7	-62.2	-177	-177	-178.9	1.2	113.3	G1166	G1166-R1168 PolarHBondContact O-N 3Å
1169	H	83.2	Confident	81.4	Confident	84 Å²	84	46.4 Å²	46.4	39%	0.389	21%	0.212	S	C	.	.	S	Bend	trans	-98.8	146.4	-175	-58.4	-77.5	0	0	0	111.2	G1166 F1167 F1172 K1173	G1166-H1169 PolarHBondContact N-CD2 3.36Å; G1166-H1169 PolarHBondContact O-N 3.49Å; F1167-H1169 VanDerWaalsContact C-N 3.3Å; H1169-F1172 CarbonylContact O-C 3.54Å; H1169-F1172 PolarHBondContact O-N 3.13Å; H1169-K1173 PolarHBondContact O-N 3.22Å
1170	A	74.5	Confident	81	Confident	7 Å²	7	52.6 Å²	52.6	6%	0.058	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	143.2	168.8	0	0	0	0	0	110.4	N1243 W1246	A1170-N1243 WeakPolarHBondContact CB-OD1 3.48Å; A1170-W1246 HydrophobicContact CB-CG 4.45Å
1171	P	76.2	Confident	80.5	Confident	0 Å²	0	63 Å²	63	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	cis	-87.9	-5.5	-2.1	34.7	-36.6	0	0	0	115.2	K1173 F1174 W1197 I1199 W1246	P1171-K1173 PolarHBondContact O-N 3.32Å; P1171-F1174 VanDerWaalsContact O-CD2 3.25Å; P1171-F1174 WeakPolarHBondContact O-CD2 3.36Å; P1171-F1174 PolarHBondContact O-N 3.09Å; P1171-W1197 HydrophobicContact CB-CD2 3.58Å; P1171-W1197 VanDerWaalsContact CB-CE2 3.45Å; P1171-W1197 HydrophobicContact CB-CE3 3.83Å; P1171-W1197 HydrophobicContact CB-CG 4.17Å; P1171-W1197 HydrophobicContact CB-CH2 3.91Å; P1171-W1197 HydrophobicContact CB-CZ2 3.65Å; P1171-W1197 HydrophobicContact CB-CZ3 4Å; P1171-W1197 HydrophobicContact CG-CD2 3.43Å; P1171-W1197 VanDerWaalsContact CG-CD2 3.43Å; P1171-W1197 HydrophobicContact CG-CE3 3.35Å; P1171-W1197 HydrophobicContact CG-CG 3.94Å; P1171-W1197 HydrophobicContact CG-CH2 4.23Å; P1171-W1197 HydrophobicContact CG-CZ2 4.29Å; P1171-W1197 HydrophobicContact CG-CZ3 3.78Å; P1171-I1199 HydrophobicContact CG-CD1 3.61Å; P1171-W1246 HydrophobicContact CB-CB 4.38Å; P1171-W1246 HydrophobicContact CB-CD2 3.77Å; P1171-W1246 HydrophobicContact CB-CE3 3.55Å; P1171-W1246 HydrophobicContact CB-CG 4.16Å; P1171-W1246 HydrophobicContact CB-CZ3 3.99Å; P1171-W1246 HydrophobicContact CG-CD2 4.24Å; P1171-W1246 HydrophobicContact CG-CE3 3.79Å; P1171-W1246 HydrophobicContact CG-CH2 3.97Å; P1171-W1246 HydrophobicContact CG-CZ2 4.49Å; P1171-W1246 HydrophobicContact CG-CZ3 3.66Å
1172	F	82.2	Confident	80.1	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-21.3	-177.5	-65.2	-93.4	0	0	0	113.9	R1165 G1166 H1169 F1174 L1175 V1189 C1193 F1231 C1233	R1165-F1172 HydrophobicContact CB-CD2 3.48Å; R1165-F1172 VanDerWaalsContact CB-CD2 3.48Å; R1165-F1172 HydrophobicContact CB-CE2 3.5Å; R1165-F1172 HydrophobicContact CB-CG 4.41Å; R1165-F1172 HydrophobicContact CB-CZ 4.45Å; R1165-F1172 HydrophobicContact CG-CD2 4.15Å; R1165-F1172 HydrophobicContact CG-CE2 3.94Å; G1166-F1172 WeakPolarHBondContact O-CB 3.45Å; H1169-F1172 CarbonylContact O-C 3.54Å; H1169-F1172 PolarHBondContact O-N 3.13Å; F1172-F1174 PolarHBondContact O-N 2.11Å; F1172-F1174 VanDerWaalsContact O-N 3.15Å; F1172-L1175 HydrophobicContact CB-CD1 4.43Å; F1172-L1175 HydrophobicContact CD1-CD1 3.64Å; F1172-L1175 HydrophobicContact CE1-CD1 4.31Å; F1172-L1175 HydrophobicContact CG-CD1 4.39Å; F1172-L1175 VanDerWaalsContact O-CB 3.31Å; F1172-L1175 WeakPolarHBondContact O-CB 3.45Å; F1172-L1175 PolarHBondContact O-N 3.29Å; F1172-V1189 HydrophobicContact CD1-CG1 4.35Å; F1172-V1189 HydrophobicContact CE1-CG1 3.92Å; F1172-C1193 VanDerWaalsContact CE1-SG 3.55Å; F1172-F1231 AromaticContact CD1-CD2 3.67Å; F1172-F1231 HydrophobicContact CD1-CD2 3.67Å; F1172-F1231 AromaticContact CD1-CE2 3.76Å; F1172-F1231 HydrophobicContact CD1-CE2 3.76Å; F1172-F1231 HydrophobicContact CD1-CG 4.29Å; F1172-F1231 HydrophobicContact CD1-CZ 4.41Å; F1172-F1231 HydrophobicContact CE1-CB 4.16Å; F1172-F1231 HydrophobicContact CE1-CD1 4.31Å; F1172-F1231 AromaticContact CE1-CD2 3.67Å; F1172-F1231 HydrophobicContact CE1-CD2 3.67Å; F1172-F1231 HydrophobicContact CE1-CE2 4.04Å; F1172-F1231 AromaticContact CE1-CG 3.8Å; F1172-F1231 HydrophobicContact CE1-CG 3.8Å; F1172-F1231 HydrophobicContact CE1-CZ 4.47Å; F1172-F1231 HydrophobicContact CG-CD2 4.41Å; F1172-F1231 HydrophobicContact CZ-CB 4.18Å; F1172-F1231 HydrophobicContact CZ-CD2 4.39Å; F1172-F1231 HydrophobicContact CZ-CG 4.33Å; F1172-C1233 VanDerWaalsContact CZ-SG 3.53Å
1173	K	80.6	Confident	79.7	Confident	116 Å²	116	71.2 Å²	71.2	50%	0.504	32%	0.323	S	S	.	.	H	α-helix	trans	-51.7	-33.6	169.9	-167.5	176.2	-178.6	178.1	0	113.2	F1167 H1169 P1171 L1175 T1176	F1167-K1173 WeakPolarHBondContact O-CA 3.44Å; F1167-K1173 PolarHBondContact O-N 3.28Å; H1169-K1173 PolarHBondContact O-N 3.22Å; P1171-K1173 PolarHBondContact O-N 3.32Å; K1173-L1175 VanDerWaalsContact C-N 3.3Å; K1173-L1175 PolarHBondContact O-N 3.3Å; K1173-T1176 WeakPolarHBondContact O-CB 3.37Å; K1173-T1176 PolarHBondContact O-N 3.06Å; K1173-T1176 PolarHBondContact O-OG1 2.88Å
1174	F	76.5	Confident	79.6	Confident	68 Å²	68	71.2 Å²	71.2	30%	0.298	32%	0.322	S	S	.	.	H	α-helix	trans	-70.1	-26.8	176.7	-64.7	-72	0	0	0	113.4	P1171 F1172 T1176 R1177 W1197 W1246	P1171-F1174 VanDerWaalsContact O-CD2 3.25Å; P1171-F1174 WeakPolarHBondContact O-CD2 3.36Å; P1171-F1174 PolarHBondContact O-N 3.09Å; F1172-F1174 PolarHBondContact O-N 2.11Å; F1172-F1174 VanDerWaalsContact O-N 3.15Å; F1174-T1176 VanDerWaalsContact C-N 3.28Å; F1174-T1176 PolarHBondContact O-N 2.99Å; F1174-R1177 PolarHBondContact O-N 3.46Å; F1174-W1197 HydrophobicContact CD2-CZ2 4.49Å; F1174-W1246 HydrophobicContact CE2-CB 3.86Å; F1174-W1246 WeakPolarHBondContact CE2-O 3.23Å; F1174-W1246 WeakPolarHBondContact CZ-O 3.41Å
1175	L	79.2	Confident	79.6	Confident	4 Å²	4	71.3 Å²	71.3	2%	0.021	32%	0.324	C	S	.	.	H	α-helix	trans	-70.8	-25.1	178	-59	171.1	0	0	0	111.9	F1167 F1172 K1173 R1177 I1178 S1179 L1184 V1189 R1192 W1197	F1167-L1175 HydrophobicContact CD1-CB 4.24Å; F1167-L1175 HydrophobicContact CE1-CB 3.89Å; F1172-L1175 HydrophobicContact CB-CD1 4.43Å; F1172-L1175 HydrophobicContact CD1-CD1 3.64Å; F1172-L1175 HydrophobicContact CE1-CD1 4.31Å; F1172-L1175 HydrophobicContact CG-CD1 4.39Å; F1172-L1175 VanDerWaalsContact O-CB 3.31Å; F1172-L1175 WeakPolarHBondContact O-CB 3.45Å; F1172-L1175 PolarHBondContact O-N 3.29Å; K1173-L1175 VanDerWaalsContact C-N 3.3Å; K1173-L1175 PolarHBondContact O-N 3.3Å; L1175-R1177 PolarHBondContact O-N 3.25Å; L1175-I1178 HydrophobicContact CD2-CD1 4.3Å; L1175-I1178 PolarHBondContact O-N 2.92Å; L1175-S1179 PolarHBondContact O-N 3.37Å; L1175-L1184 HydrophobicContact CB-CD1 4.06Å; L1175-L1184 WeakPolarHBondContact O-CD1 3.43Å; L1175-V1189 HydrophobicContact CD1-CB 4.44Å; L1175-V1189 HydrophobicContact CD1-CG1 3.79Å; L1175-V1189 HydrophobicContact CD1-CG2 4Å; L1175-R1192 HydrophobicContact CD2-CG 4.27Å; L1175-W1197 HydrophobicContact CD1-CH2 4.3Å; L1175-W1197 HydrophobicContact CD1-CZ3 4.19Å; L1175-W1197 HydrophobicContact CD2-CH2 4.12Å; L1175-W1197 HydrophobicContact CG-CH2 3.99Å; L1175-W1197 HydrophobicContact CG-CZ3 4.39Å
1176	T	73.3	Confident	79.8	Confident	49 Å²	49	70.1 Å²	70.1	30%	0.301	32%	0.319	S	S	.	.	H	α-helix	trans	-55.3	-40.5	175.7	61.1	0	0	0	0	112.4	F1167 K1173 F1174 I1178 S1179 L1180	F1167-T1176 HydrophobicContact CB-CG2 3.66Å; F1167-T1176 HydrophobicContact CD1-CG2 3.82Å; F1167-T1176 HydrophobicContact CG-CG2 4.14Å; K1173-T1176 WeakPolarHBondContact O-CB 3.37Å; K1173-T1176 PolarHBondContact O-N 3.06Å; K1173-T1176 PolarHBondContact O-OG1 2.88Å; F1174-T1176 VanDerWaalsContact C-N 3.28Å; F1174-T1176 PolarHBondContact O-N 2.99Å; T1176-I1178 VanDerWaalsContact C-N 3.26Å; T1176-I1178 PolarHBondContact O-N 2.88Å; T1176-S1179 WeakPolarHBondContact O-CB 3.26Å; T1176-S1179 PolarHBondContact O-N 3.17Å; T1176-L1180 WeakPolarHBondContact O-CG 3.25Å; T1176-L1180 PolarHBondContact O-N 2.8Å; T1176-L1180 VanDerWaalsContact O-N 3.17Å
1177	R	71.9	Confident	79.9	Confident	183 Å²	183	72.9 Å²	72.9	69%	0.691	33%	0.331	S	S	*	.	H	α-helix	trans	-64.9	-31.3	178	-68.6	-175.8	-178.4	171.1	-0.8	112.8	F1174 L1175	F1174-R1177 PolarHBondContact O-N 3.46Å; L1175-R1177 PolarHBondContact O-N 3.25Å
1178	I	74.8	Confident	80.2	Confident	74 Å²	74	75.3 Å²	75.3	38%	0.379	34%	0.344	S	S	.	.	H	α-helix	trans	-79.6	-40.8	178.6	-56.4	174.8	0	0	0	109.4	L1175 T1176 L1180 R1181 K1182 L1184	L1175-I1178 HydrophobicContact CD2-CD1 4.3Å; L1175-I1178 PolarHBondContact O-N 2.92Å; T1176-I1178 VanDerWaalsContact C-N 3.26Å; T1176-I1178 PolarHBondContact O-N 2.88Å; I1178-L1180 PolarHBondContact O-N 3.22Å; I1178-R1181 PolarHBondContact O-N 3.25Å; I1178-K1182 PolarHBondContact O-N 3.01Å; I1178-K1182 VanDerWaalsContact O-N 3.16Å; I1178-L1184 HydrophobicContact CB-CD2 4.44Å; I1178-L1184 HydrophobicContact CG2-CD2 3.86Å
1179	S	73	Confident	80.6	Confident	32 Å²	32	65.2 Å²	65.2	22%	0.224	31%	0.306	C	S	.	.	H	α-helix	trans	-56.1	-34	176.4	-156.3	0	0	0	0	112.8	L1175 T1176 R1181 K1182	L1175-S1179 PolarHBondContact O-N 3.37Å; T1176-S1179 WeakPolarHBondContact O-CB 3.26Å; T1176-S1179 PolarHBondContact O-N 3.17Å; S1179-R1181 PolarHBondContact O-N 3.27Å; S1179-K1182 WeakPolarHBondContact CA-O 3.45Å
1180	L	69.2	Low	81	Confident	140 Å²	140	61.2 Å²	61.2	73%	0.733	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-21.6	175.8	-73.5	167.6	0	0	0	113.7	T1176 I1178	T1176-L1180 WeakPolarHBondContact O-CG 3.25Å; T1176-L1180 PolarHBondContact O-N 2.8Å; T1176-L1180 VanDerWaalsContact O-N 3.17Å; I1178-L1180 PolarHBondContact O-N 3.22Å
1181	R	73.8	Confident	81.8	Confident	231 Å²	231	62.6 Å²	62.6	87%	0.872	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-33.2	-178.3	-66.3	-176.4	177.7	175.8	-2	113.1	I1178 S1179	I1178-R1181 PolarHBondContact O-N 3.25Å; S1179-R1181 PolarHBondContact O-N 3.27Å
1182	K	79.6	Confident	82.4	Confident	135 Å²	135	67.2 Å²	67.2	59%	0.587	31%	0.311	S	S	*	.	S	Bend	trans	-149.7	139.9	-177.1	-173.3	-175.7	175.4	-170.4	0	109.4	I1178 S1179 L1184	I1178-K1182 PolarHBondContact O-N 3.01Å; I1178-K1182 VanDerWaalsContact O-N 3.16Å; S1179-K1182 WeakPolarHBondContact CA-O 3.45Å; K1182-L1184 PolarHBondContact O-N 3.07Å; K1182-L1184 VanDerWaalsContact O-N 3.13Å
1183	P	81.9	Confident	82.7	Confident	84 Å²	84	67.2 Å²	67.2	55%	0.545	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-57.3	120.4	170.4	24.9	-34.1	0	0	0	109.3
1184	L	87.7	Confident	83.1	Confident	11 Å²	11	61.7 Å²	61.7	6%	0.058	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-77.2	131.7	177	-76.2	166.2	0	0	0	109.4	F1167 L1175 I1178 K1182 D1188 V1189 I1225	F1167-L1184 HydrophobicContact CE1-CD1 4.25Å; L1175-L1184 HydrophobicContact CB-CD1 4.06Å; L1175-L1184 WeakPolarHBondContact O-CD1 3.43Å; I1178-L1184 HydrophobicContact CB-CD2 4.44Å; I1178-L1184 HydrophobicContact CG2-CD2 3.86Å; K1182-L1184 PolarHBondContact O-N 3.07Å; K1182-L1184 VanDerWaalsContact O-N 3.13Å; L1184-D1188 HydrophobicContact CD2-CB 4.14Å; L1184-V1189 HydrophobicContact CB-CG2 4.37Å; L1184-V1189 HydrophobicContact CD1-CG2 4.45Å; L1184-I1225 HydrophobicContact CB-CD1 4.39Å; L1184-I1225 PolarHBondContact O-N 3.49Å; L1184-I1225 VanDerWaalsContact O-N 3.1Å
1185	T	91.4	Very high	83.6	Confident	30 Å²	30	61.3 Å²	61.3	18%	0.184	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-91.5	156.6	168.8	65.1	0	0	0	0	110.2	K1187 D1188 V1189 P1221 T1223	T1185-K1187 PolarHBondContact O-N 3.4Å; T1185-D1188 PolarHBondContact N-OD2 2.84Å; T1185-D1188 VanDerWaalsContact N-OD2 3.15Å; T1185-D1188 WeakPolarHBondContact O-CB 3.07Å; T1185-D1188 PolarHBondContact O-N 3.23Å; T1185-D1188 VanDerWaalsContact O-N 3.09Å; T1185-D1188 PolarHBondContact OG1-N 2.94Å; T1185-D1188 PolarHBondContact OG1-OD2 3.39Å; T1185-V1189 PolarHBondContact O-N 2.95Å; T1185-P1221 WeakPolarHBondContact CB-O 3.34Å; T1185-T1223 CarbonylContact C-O 3.44Å; T1185-T1223 WeakPolarHBondContact CA-O 3.47Å
1186	F	92.1	Very high	83.8	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-56.9	-35.7	175	-174	-99.8	0	0	0	111.9	Y728 D1188 V1189 Y1190 C1201 L1204 P1219 T1223 F1231	Y728-F1186 VanDerWaalsContact OH-CD1 3.26Å; Y728-F1186 WeakPolarHBondContact OH-CD1 3.33Å; F1186-D1188 PolarHBondContact O-N 3.27Å; F1186-V1189 PolarHBondContact O-N 2.98Å; F1186-Y1190 HydrophobicContact CE1-CD2 4.36Å; F1186-Y1190 VanDerWaalsContact O-CB 3.31Å; F1186-Y1190 WeakPolarHBondContact O-CB 3.49Å; F1186-Y1190 PolarHBondContact O-N 2.97Å; F1186-C1201 HydrophobicContact CZ-CB 4.23Å; F1186-L1204 HydrophobicContact CD2-CD1 4.21Å; F1186-L1204 HydrophobicContact CD2-CD2 3.96Å; F1186-L1204 HydrophobicContact CD2-CG 4.06Å; F1186-L1204 HydrophobicContact CE2-CD2 3.97Å; F1186-L1204 HydrophobicContact CE2-CG 4.08Å; F1186-P1219 HydrophobicContact CB-CG 4.15Å; F1186-P1219 HydrophobicContact CD1-CG 3.58Å; F1186-P1219 HydrophobicContact CD2-CG 3.57Å; F1186-P1219 HydrophobicContact CE1-CG 3.77Å; F1186-P1219 HydrophobicContact CE2-CG 3.74Å; F1186-P1219 HydrophobicContact CG-CG 3.48Å; F1186-P1219 VanDerWaalsContact CG-CG 3.48Å; F1186-P1219 HydrophobicContact CZ-CG 3.84Å; F1186-T1223 PolarHBondContact N-O 3.38Å; F1186-F1231 HydrophobicContact CD2-CD1 4.49Å; F1186-F1231 HydrophobicContact CD2-CE1 4.17Å; F1186-F1231 HydrophobicContact CE2-CD1 4.12Å; F1186-F1231 HydrophobicContact CE2-CE1 4.25Å
1187	K	92	Very high	84.2	Confident	61 Å²	61	60.7 Å²	60.7	27%	0.265	29%	0.287	S	S	.	.	H	α-helix	trans	-56.7	-48.6	172.9	-178.4	-179	179.4	-175.3	0	112.7	Y728 E729 T1185 V1189 Y1190 I1191 P1221	Y728-K1187 HydrophobicContact CE1-CB 4.25Å; Y728-K1187 HydrophobicContact CE1-CG 4.07Å; E729-K1187 VanDerWaalsContact OE1-CE 3.23Å; E729-K1187 WeakPolarHBondContact OE1-CE 3.47Å; E729-K1187 IonicContact OE1-NZ 3.17Å; E729-K1187 PolarHBondContact OE1-NZ 3.44Å; T1185-K1187 PolarHBondContact O-N 3.4Å; K1187-V1189 VanDerWaalsContact C-N 3.28Å; K1187-V1189 PolarHBondContact O-N 3.48Å; K1187-Y1190 PolarHBondContact O-N 2.92Å; K1187-I1191 HydrophobicContact CD-CD1 4.38Å; K1187-I1191 HydrophobicContact CG-CD1 3.75Å; K1187-I1191 HydrophobicContact CG-CG1 4.44Å; K1187-I1191 WeakPolarHBondContact O-CG1 3.5Å; K1187-I1191 PolarHBondContact O-N 3.34Å; K1187-P1221 HydrophobicContact CB-CB 3.96Å; K1187-P1221 VanDerWaalsContact CB-O 3.32Å; K1187-P1221 WeakPolarHBondContact CB-O 3.4Å; K1187-P1221 HydrophobicContact CD-CB 4.36Å; K1187-P1221 PolarHBondContact N-O 3.44Å
1188	D	90.3	Very high	84.9	Confident	60 Å²	60	54.4 Å²	54.4	32%	0.321	27%	0.266	S	S	.	.	H	α-helix	trans	-60.3	-41.5	-178.9	-62	-42.3	0	0	0	111.1	L1184 T1185 F1186 R1192	L1184-D1188 HydrophobicContact CD2-CB 4.14Å; T1185-D1188 PolarHBondContact N-OD2 2.84Å; T1185-D1188 VanDerWaalsContact N-OD2 3.15Å; T1185-D1188 WeakPolarHBondContact O-CB 3.07Å; T1185-D1188 PolarHBondContact O-N 3.23Å; T1185-D1188 VanDerWaalsContact O-N 3.09Å; T1185-D1188 PolarHBondContact OG1-N 2.94Å; T1185-D1188 PolarHBondContact OG1-OD2 3.39Å; F1186-D1188 PolarHBondContact O-N 3.27Å; D1188-R1192 VanDerWaalsContact O-CB 3.3Å; D1188-R1192 WeakPolarHBondContact O-CB 3.16Å; D1188-R1192 PolarHBondContact O-N 3.49Å
1189	V	90.1	Very high	85.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-70.6	-46	178.3	175.3	0	0	0	0	111.5	F1172 L1175 L1184 T1185 F1186 K1187 I1191 R1192 C1193 I1225 F1231	F1172-V1189 HydrophobicContact CD1-CG1 4.35Å; F1172-V1189 HydrophobicContact CE1-CG1 3.92Å; L1175-V1189 HydrophobicContact CD1-CB 4.44Å; L1175-V1189 HydrophobicContact CD1-CG1 3.79Å; L1175-V1189 HydrophobicContact CD1-CG2 4Å; L1184-V1189 HydrophobicContact CB-CG2 4.37Å; L1184-V1189 HydrophobicContact CD1-CG2 4.45Å; T1185-V1189 PolarHBondContact O-N 2.95Å; F1186-V1189 PolarHBondContact O-N 2.98Å; K1187-V1189 VanDerWaalsContact C-N 3.28Å; K1187-V1189 PolarHBondContact O-N 3.48Å; V1189-I1191 PolarHBondContact O-N 2.79Å; V1189-R1192 PolarHBondContact O-N 2.73Å; V1189-C1193 VanDerWaalsContact O-CB 3.32Å; V1189-C1193 WeakPolarHBondContact O-CB 3.46Å; V1189-C1193 PolarHBondContact O-N 3.01Å; V1189-C1193 PolarHBondContact O-SG 2.55Å; V1189-I1225 HydrophobicContact CB-CD1 3.82Å; V1189-I1225 HydrophobicContact CG2-CD1 3.24Å; V1189-F1231 HydrophobicContact CB-CE1 4.35Å; V1189-F1231 HydrophobicContact CG1-CD1 4.36Å; V1189-F1231 HydrophobicContact CG1-CE1 3.72Å; V1189-F1231 HydrophobicContact CG1-CZ 3.89Å; V1189-F1231 HydrophobicContact CG2-CZ 4.45Å
1190	Y	91.8	Very high	86.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-57.2	-51.3	179.6	-179.7	-92.3	0	0	0	111.7	Y728 I734 F1186 K1187 R1192 C1193 I1194 L1200 C1201	Y728-Y1190 AromaticContact CD1-CD1 3.29Å; Y728-Y1190 HydrophobicContact CD1-CD1 3.29Å; Y728-Y1190 AromaticContact CD1-CE1 3.55Å; Y728-Y1190 HydrophobicContact CD1-CE1 3.55Å; Y728-Y1190 HydrophobicContact CD1-CG 4.13Å; Y728-Y1190 AromaticContact CD2-CD1 4Å; Y728-Y1190 HydrophobicContact CD2-CD1 4Å; Y728-Y1190 AromaticContact CD2-CE1 3.68Å; Y728-Y1190 HydrophobicContact CD2-CE1 3.68Å; Y728-Y1190 HydrophobicContact CD2-CE2 4.43Å; Y728-Y1190 HydrophobicContact CD2-CG 4.49Å; Y728-Y1190 AromaticContact CD2-CZ 3.92Å; Y728-Y1190 AromaticContact CE1-CD1 3.55Å; Y728-Y1190 HydrophobicContact CE1-CD1 3.55Å; Y728-Y1190 HydrophobicContact CE1-CE1 4.18Å; Y728-Y1190 AromaticContact CE1-CG 3.93Å; Y728-Y1190 HydrophobicContact CE1-CG 3.93Å; Y728-Y1190 HydrophobicContact CE2-CD1 4.23Å; Y728-Y1190 HydrophobicContact CE2-CE1 4.31Å; Y728-Y1190 HydrophobicContact CE2-CG 4.33Å; Y728-Y1190 AromaticContact CG-CD1 3.54Å; Y728-Y1190 HydrophobicContact CG-CD1 3.54Å; Y728-Y1190 AromaticContact CG-CE1 3.26Å; Y728-Y1190 HydrophobicContact CG-CE1 3.26Å; Y728-Y1190 HydrophobicContact CG-CG 4.41Å; Y728-Y1190 AromaticContact CG-CZ 3.97Å; I734-Y1190 HydrophobicContact CD1-CE2 4.3Å; I734-Y1190 HydrophobicContact CG1-CE2 4.09Å; I734-Y1190 HydrophobicContact CG2-CE2 4.2Å; F1186-Y1190 HydrophobicContact CE1-CD2 4.36Å; F1186-Y1190 VanDerWaalsContact O-CB 3.31Å; F1186-Y1190 WeakPolarHBondContact O-CB 3.49Å; F1186-Y1190 PolarHBondContact O-N 2.97Å; K1187-Y1190 PolarHBondContact O-N 2.92Å; Y1190-R1192 VanDerWaalsContact C-N 3.35Å; Y1190-R1192 PolarHBondContact O-N 3.35Å; Y1190-C1193 PolarHBondContact O-N 3.25Å; Y1190-I1194 HydrophobicContact CD1-CD1 3.92Å; Y1190-I1194 HydrophobicContact CD2-CD1 4.45Å; Y1190-I1194 HydrophobicContact CE1-CD1 3.29Å; Y1190-I1194 HydrophobicContact CE1-CG1 4.5Å; Y1190-I1194 HydrophobicContact CE2-CD1 3.89Å; Y1190-I1194 HydrophobicContact CG-CD1 4.46Å; Y1190-I1194 WeakPolarHBondContact O-CG1 3.36Å; Y1190-I1194 PolarHBondContact O-N 3.15Å; Y1190-I1194 VanDerWaalsContact O-N 3.12Å; Y1190-I1194 WeakPolarHBondContact OH-CD1 3.26Å; Y1190-L1200 HydrophobicContact CE2-CD1 3.97Å; Y1190-C1201 HydrophobicContact CD2-CB 4.13Å; Y1190-C1201 WeakPolarHBondContact CE2-O 3.33Å
1191	I	90.6	Very high	87.6	Confident	37 Å²	37	42.7 Å²	42.7	19%	0.19	20%	0.202	C	C	.	.	H	α-helix	trans	-61.2	-46	179.5	-65.5	172.8	0	0	0	109.9	E729 K1187 V1189 C1193 I1194 T1195	E729-I1191 HydrophobicContact CG-CD1 3.94Å; E729-I1191 WeakPolarHBondContact OE1-CD1 3.32Å; K1187-I1191 HydrophobicContact CD-CD1 4.38Å; K1187-I1191 HydrophobicContact CG-CD1 3.75Å; K1187-I1191 HydrophobicContact CG-CG1 4.44Å; K1187-I1191 WeakPolarHBondContact O-CG1 3.5Å; K1187-I1191 PolarHBondContact O-N 3.34Å; V1189-I1191 PolarHBondContact O-N 2.79Å; I1191-C1193 PolarHBondContact O-N 2.63Å; I1191-I1194 PolarHBondContact O-N 2.81Å; I1191-T1195 HydrophobicContact CG2-CG2 4.13Å; I1191-T1195 WeakPolarHBondContact O-CG2 3.48Å; I1191-T1195 PolarHBondContact O-N 3.35Å; I1191-T1195 PolarHBondContact O-OG1 3.46Å; I1191-T1195 VanDerWaalsContact O-OG1 3.05Å
1192	R	88.6	Confident	88.5	Confident	96 Å²	96	31.9 Å²	31.9	36%	0.362	16%	0.162	S	C	.	.	H	α-helix	trans	-63.9	-41.9	-178.9	-164.8	65.8	171.9	173.2	-2	112.6	L1175 D1188 V1189 Y1190 I1194 T1195 C1196 F1248	L1175-R1192 HydrophobicContact CD2-CG 4.27Å; D1188-R1192 VanDerWaalsContact O-CB 3.3Å; D1188-R1192 WeakPolarHBondContact O-CB 3.16Å; D1188-R1192 PolarHBondContact O-N 3.49Å; V1189-R1192 PolarHBondContact O-N 2.73Å; Y1190-R1192 VanDerWaalsContact C-N 3.35Å; Y1190-R1192 PolarHBondContact O-N 3.35Å; R1192-I1194 VanDerWaalsContact C-N 3.33Å; R1192-I1194 PolarHBondContact O-N 3.3Å; R1192-T1195 PolarHBondContact O-N 2.81Å; R1192-T1195 PolarHBondContact O-OG1 3.38Å; R1192-C1196 VanDerWaalsContact CD-SG 3.56Å; R1192-C1196 PolarHBondContact NE-SG 3.02Å; R1192-C1196 VanDerWaalsContact NE-SG 3.39Å; R1192-C1196 VanDerWaalsContact O-CB 3.29Å; R1192-C1196 WeakPolarHBondContact O-CB 3.46Å; R1192-C1196 PolarHBondContact O-N 3.47Å; R1192-F1248 VanDerWaalsContact NH2-CZ 3.25Å
1193	C	89	Confident	89.2	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.7	-41.8	177.5	-77.2	0	0	0	0	112	F1172 V1189 Y1190 I1191 W1197 Q1198 I1199	F1172-C1193 VanDerWaalsContact CE1-SG 3.55Å; V1189-C1193 VanDerWaalsContact O-CB 3.32Å; V1189-C1193 WeakPolarHBondContact O-CB 3.46Å; V1189-C1193 PolarHBondContact O-N 3.01Å; V1189-C1193 PolarHBondContact O-SG 2.55Å; Y1190-C1193 PolarHBondContact O-N 3.25Å; I1191-C1193 PolarHBondContact O-N 2.63Å; C1193-W1197 HydrophobicContact CB-CE3 4.27Å; C1193-W1197 CarbonylContact O-C 3.54Å; C1193-W1197 WeakPolarHBondContact O-CA 3.37Å; C1193-W1197 WeakPolarHBondContact O-CB 2.93Å; C1193-W1197 PolarHBondContact O-N 2.97Å; C1193-W1197 VanDerWaalsContact O-N 3.11Å; C1193-Q1198 PolarHBondContact O-N 3.04Å; C1193-I1199 CarbonylContact C-O 3.53Å; C1193-I1199 HydrophobicContact CB-CB 4.23Å; C1193-I1199 PolarHBondContact O-N 3.27Å
1194	I	88	Confident	89.8	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-71.4	-47.8	177.8	-69.8	-179.6	0	0	0	111.4	R721 I725 I753 Y1190 I1191 R1192 Q1198 I1199 L1200	R721-I1194 HydrophobicContact CG-CG2 3.75Å; I725-I1194 HydrophobicContact CD1-CG2 4.06Å; I725-I1194 HydrophobicContact CG1-CG2 3.89Å; I753-I1194 HydrophobicContact CD1-CD1 4.02Å; I753-I1194 HydrophobicContact CD1-CG1 3.96Å; I753-I1194 HydrophobicContact CD1-CG2 3.98Å; I753-I1194 HydrophobicContact CG2-CG2 4.33Å; Y1190-I1194 HydrophobicContact CD1-CD1 3.92Å; Y1190-I1194 HydrophobicContact CD2-CD1 4.45Å; Y1190-I1194 HydrophobicContact CE1-CD1 3.29Å; Y1190-I1194 HydrophobicContact CE1-CG1 4.5Å; Y1190-I1194 HydrophobicContact CE2-CD1 3.89Å; Y1190-I1194 HydrophobicContact CG-CD1 4.46Å; Y1190-I1194 WeakPolarHBondContact O-CG1 3.36Å; Y1190-I1194 PolarHBondContact O-N 3.15Å; Y1190-I1194 VanDerWaalsContact O-N 3.12Å; Y1190-I1194 WeakPolarHBondContact OH-CD1 3.26Å; I1191-I1194 PolarHBondContact O-N 2.81Å; R1192-I1194 VanDerWaalsContact C-N 3.33Å; R1192-I1194 PolarHBondContact O-N 3.3Å; I1194-Q1198 PolarHBondContact O-N 3.44Å; I1194-I1199 WeakPolarHBondContact CG1-O 3.21Å; I1194-L1200 HydrophobicContact CD1-CD1 4.15Å
1195	T	86.6	Confident	90.1	Very high	61 Å²	61	21.9 Å²	21.9	37%	0.374	11%	0.108	S	C	.	.	H	α-helix	trans	-68.5	-40	-175.1	55.8	0	0	0	0	112.9	I725 I1191 R1192	I725-T1195 HydrophobicContact CD1-CG2 3.57Å; I1191-T1195 HydrophobicContact CG2-CG2 4.13Å; I1191-T1195 WeakPolarHBondContact O-CG2 3.48Å; I1191-T1195 PolarHBondContact O-N 3.35Å; I1191-T1195 PolarHBondContact O-OG1 3.46Å; I1191-T1195 VanDerWaalsContact O-OG1 3.05Å; R1192-T1195 PolarHBondContact O-N 2.81Å; R1192-T1195 PolarHBondContact O-OG1 3.38Å
1196	C	84.1	Confident	90.2	Very high	32 Å²	32	20.7 Å²	20.7	22%	0.216	10%	0.101	C	C	.	.	H	α-helix	trans	-98.4	-30.6	-170.5	-62.6	0	0	0	0	113.4	R1192 F1248	R1192-C1196 VanDerWaalsContact CD-SG 3.56Å; R1192-C1196 PolarHBondContact NE-SG 3.02Å; R1192-C1196 VanDerWaalsContact NE-SG 3.39Å; R1192-C1196 VanDerWaalsContact O-CB 3.29Å; R1192-C1196 WeakPolarHBondContact O-CB 3.46Å; R1192-C1196 PolarHBondContact O-N 3.47Å; C1196-F1248 HydrophobicContact CB-CD1 4.46Å; C1196-F1248 HydrophobicContact CB-CE1 4.15Å
1197	W	82	Confident	90.1	Very high	8 Å²	8	25.4 Å²	25.4	3%	0.03	12%	0.119	C	C	.	.	H	α-helix	trans	-125.1	-8	-168	-59.5	-36.1	0	0	0	113.6	P1171 F1174 L1175 C1193 I1199 Q1239 W1246	P1171-W1197 HydrophobicContact CB-CD2 3.58Å; P1171-W1197 VanDerWaalsContact CB-CE2 3.45Å; P1171-W1197 HydrophobicContact CB-CE3 3.83Å; P1171-W1197 HydrophobicContact CB-CG 4.17Å; P1171-W1197 HydrophobicContact CB-CH2 3.91Å; P1171-W1197 HydrophobicContact CB-CZ2 3.65Å; P1171-W1197 HydrophobicContact CB-CZ3 4Å; P1171-W1197 HydrophobicContact CG-CD2 3.43Å; P1171-W1197 VanDerWaalsContact CG-CD2 3.43Å; P1171-W1197 HydrophobicContact CG-CE3 3.35Å; P1171-W1197 HydrophobicContact CG-CG 3.94Å; P1171-W1197 HydrophobicContact CG-CH2 4.23Å; P1171-W1197 HydrophobicContact CG-CZ2 4.29Å; P1171-W1197 HydrophobicContact CG-CZ3 3.78Å; F1174-W1197 HydrophobicContact CD2-CZ2 4.49Å; L1175-W1197 HydrophobicContact CD1-CH2 4.3Å; L1175-W1197 HydrophobicContact CD1-CZ3 4.19Å; L1175-W1197 HydrophobicContact CD2-CH2 4.12Å; L1175-W1197 HydrophobicContact CG-CH2 3.99Å; L1175-W1197 HydrophobicContact CG-CZ3 4.39Å; C1193-W1197 HydrophobicContact CB-CE3 4.27Å; C1193-W1197 CarbonylContact O-C 3.54Å; C1193-W1197 WeakPolarHBondContact O-CA 3.37Å; C1193-W1197 WeakPolarHBondContact O-CB 2.93Å; C1193-W1197 PolarHBondContact O-N 2.97Å; C1193-W1197 VanDerWaalsContact O-N 3.11Å; W1197-I1199 HydrophobicContact CB-CB 4.39Å; W1197-I1199 HydrophobicContact CB-CD1 3.73Å; W1197-I1199 HydrophobicContact CB-CG1 3.78Å; W1197-I1199 HydrophobicContact CE3-CD1 4.39Å; W1197-I1199 HydrophobicContact CG-CD1 4.42Å; W1197-I1199 PolarHBondContact O-N 3.33Å; W1197-Q1239 PolarHBondContact O-NE2 3.19Å; W1197-Q1239 PolarHBondContact O-OE1 3.33Å; W1197-W1246 HydrophobicContact CB-CE3 4.45Å; W1197-W1246 HydrophobicContact CB-CZ3 3.84Å; W1197-W1246 AromaticContact CD1-CE3 3.63Å; W1197-W1246 AromaticContact CD1-CZ3 3.9Å; W1197-W1246 AromaticContact CG-CE3 3.99Å; W1197-W1246 HydrophobicContact CG-CE3 3.99Å; W1197-W1246 AromaticContact CG-CZ3 3.84Å; W1197-W1246 HydrophobicContact CG-CZ3 3.84Å
1198	Q	86.2	Confident	89.9	Confident	51 Å²	51	24 Å²	24	24%	0.238	11%	0.113	C	C	.	.			trans	56.7	27.4	-173.2	-55.9	174.5	-58.5	0	0	112.8	N751 I753 C1193 I1194	N751-Q1198 PolarHBondContact ND2-O 2.9Å; N751-Q1198 VanDerWaalsContact ND2-O 3.13Å; I753-Q1198 HydrophobicContact CG2-CB 3.8Å; I753-Q1198 HydrophobicContact CG2-CG 3.93Å; I753-Q1198 PolarHBondContact O-NE2 3.44Å; C1193-Q1198 PolarHBondContact O-N 3.04Å; I1194-Q1198 PolarHBondContact O-N 3.44Å
1199	I	89	Confident	89.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.138	C	C	.	.			trans	-92.1	127.6	177.8	-63.3	172.9	0	0	0	108.7	P1171 C1193 I1194 W1197 C1233 M1235 W1246	P1171-I1199 HydrophobicContact CG-CD1 3.61Å; C1193-I1199 CarbonylContact C-O 3.53Å; C1193-I1199 HydrophobicContact CB-CB 4.23Å; C1193-I1199 PolarHBondContact O-N 3.27Å; I1194-I1199 WeakPolarHBondContact CG1-O 3.21Å; W1197-I1199 HydrophobicContact CB-CB 4.39Å; W1197-I1199 HydrophobicContact CB-CD1 3.73Å; W1197-I1199 HydrophobicContact CB-CG1 3.78Å; W1197-I1199 HydrophobicContact CE3-CD1 4.39Å; W1197-I1199 HydrophobicContact CG-CD1 4.42Å; W1197-I1199 PolarHBondContact O-N 3.33Å; I1199-C1233 HydrophobicContact CG2-CB 3.69Å; I1199-M1235 HydrophobicContact CD1-CE 4.12Å; I1199-M1235 HydrophobicContact CD1-CG 4.32Å; I1199-M1235 HydrophobicContact CG1-CG 4.27Å; I1199-M1235 HydrophobicContact CG2-CG 4.38Å; I1199-W1246 HydrophobicContact CD1-CH2 3.83Å; I1199-W1246 HydrophobicContact CD1-CZ3 3.96Å
1200	L	91.7	Very high	88.6	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	113.4	173.4	-179.4	73.6	0	0	0	109.9	I734 L736 I753 Y1190 I1194 L1202 C1233 F1234	I734-L1200 HydrophobicContact CG2-CD1 3.86Å; I734-L1200 HydrophobicContact CG2-CD2 4.49Å; I734-L1200 HydrophobicContact CG2-CG 4.38Å; L736-L1200 HydrophobicContact CD1-CD2 3.99Å; I753-L1200 HydrophobicContact CD1-CB 4.46Å; I753-L1200 HydrophobicContact CD1-CD1 4.27Å; Y1190-L1200 HydrophobicContact CE2-CD1 3.97Å; I1194-L1200 HydrophobicContact CD1-CD1 4.15Å; L1200-L1202 HydrophobicContact CD2-CD2 3.98Å; L1200-L1202 HydrophobicContact CG-CD2 4.23Å; L1200-C1233 WeakPolarHBondContact O-CA 3.43Å; L1200-F1234 HydrophobicContact CB-CB 4.16Å; L1200-F1234 HydrophobicContact CD2-CD2 4.1Å; L1200-F1234 PolarHBondContact N-O 2.65Å; L1200-F1234 VanDerWaalsContact N-O 3.1Å; L1200-F1234 PolarHBondContact O-N 2.93Å
1201	C	93.1	Very high	88	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	126.2	173.5	-61.6	0	0	0	0	110.4	F1186 Y1190 Y1232	F1186-C1201 HydrophobicContact CZ-CB 4.23Å; Y1190-C1201 HydrophobicContact CD2-CB 4.13Å; Y1190-C1201 WeakPolarHBondContact CE2-O 3.33Å; C1201-Y1232 CarbonylContact C-O 3.57Å; C1201-Y1232 WeakPolarHBondContact CA-O 3.42Å
1202	L	93.1	Very high	87.8	Confident	4 Å²	4	34 Å²	34	2%	0.021	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-29	-177.5	-57.3	177.8	0	0	0	113.2	F671 L674 L736 I769 L1200 N1218 Y1232 F1234	F671-L1202 HydrophobicContact CE2-CD1 4.07Å; L674-L1202 HydrophobicContact CD2-CB 4.17Å; L674-L1202 HydrophobicContact CD2-CD1 4.21Å; L736-L1202 HydrophobicContact CD1-CD2 3.3Å; I769-L1202 HydrophobicContact CD1-CD2 4.41Å; L1200-L1202 HydrophobicContact CD2-CD2 3.98Å; L1200-L1202 HydrophobicContact CG-CD2 4.23Å; L1202-N1218 PolarHBondContact O-N 2.88Å; L1202-Y1232 PolarHBondContact N-O 2.68Å; L1202-F1234 HydrophobicContact CD1-CD1 3.96Å; L1202-F1234 HydrophobicContact CD1-CD2 4.42Å; L1202-F1234 HydrophobicContact CD1-CE1 3.62Å; L1202-F1234 HydrophobicContact CD1-CE2 4.12Å; L1202-F1234 HydrophobicContact CD1-CG 4.35Å; L1202-F1234 HydrophobicContact CD1-CZ 3.71Å; L1202-F1234 HydrophobicContact CD2-CD2 4.34Å; L1202-F1234 HydrophobicContact CD2-CE2 4.32Å
1203	G	93.8	Very high	87.9	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.6	-172.4	-171.2	0	0	0	0	0	112.8	I1216 Y1232	G1203-I1216 CarbonylContact C-O 3.59Å; G1203-I1216 WeakPolarHBondContact CA-O 3.48Å; G1203-Y1232 PolarHBondContact O-N 3.04Å
1204	L	94.7	Very high	88.1	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	151.6	-177	-61.9	173.3	0	0	0	111.3	F1186 I1216 P1219 T1223 M1230 F1231	F1186-L1204 HydrophobicContact CD2-CD1 4.21Å; F1186-L1204 HydrophobicContact CD2-CD2 3.96Å; F1186-L1204 HydrophobicContact CD2-CG 4.06Å; F1186-L1204 HydrophobicContact CE2-CD2 3.97Å; F1186-L1204 HydrophobicContact CE2-CG 4.08Å; L1204-I1216 HydrophobicContact CB-CB 4.39Å; L1204-I1216 PolarHBondContact N-O 3.34Å; L1204-I1216 PolarHBondContact O-N 3.44Å; L1204-P1219 HydrophobicContact CD1-CB 4.32Å; L1204-P1219 HydrophobicContact CD1-CG 3.92Å; L1204-P1219 HydrophobicContact CG-CG 4.08Å; L1204-T1223 HydrophobicContact CD1-CG2 4.49Å; L1204-M1230 CarbonylContact C-O 3.59Å; L1204-M1230 WeakPolarHBondContact CA-O 3.39Å; L1204-F1231 HydrophobicContact CD2-CD1 3.34Å; L1204-F1231 HydrophobicContact CD2-CE1 3.41Å; L1204-F1231 VanDerWaalsContact CD2-CE1 3.41Å; L1204-F1231 HydrophobicContact CD2-CG 4.08Å; L1204-F1231 HydrophobicContact CD2-CZ 4.18Å
1205	Y	94.4	Very high	88.4	Confident	19 Å²	19	32.1 Å²	32.1	8%	0.075	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	84.1	166.5	-169.9	-133.4	0	0	0	108.1	P669 R1098 L1164 R1213 Y1214 V1215 M1230 Y1232	P669-Y1205 HydrophobicContact CB-CE1 4.05Å; R1098-Y1205 PolarHBondContact O-OH 3.48Å; L1164-Y1205 HydrophobicContact CD2-CD1 3.86Å; L1164-Y1205 HydrophobicContact CD2-CE1 4.49Å; Y1205-R1213 HydrophobicContact CD1-CB 3.84Å; Y1205-R1213 VanDerWaalsContact CD1-CD 3.44Å; Y1205-R1213 HydrophobicContact CD1-CG 4.26Å; Y1205-R1213 HydrophobicContact CD2-CB 3.89Å; Y1205-R1213 HydrophobicContact CE1-CB 3.44Å; Y1205-R1213 VanDerWaalsContact CE1-CB 3.44Å; Y1205-R1213 HydrophobicContact CE1-CG 4.01Å; Y1205-R1213 HydrophobicContact CE2-CB 3.48Å; Y1205-R1213 VanDerWaalsContact CE2-CB 3.48Å; Y1205-R1213 WeakPolarHBondContact CE2-O 3.45Å; Y1205-R1213 HydrophobicContact CG-CB 4.06Å; Y1205-R1213 PolarHBondContact O-NH1 3.2Å; Y1205-Y1214 CarbonylContact C-O 3.57Å; Y1205-Y1214 WeakPolarHBondContact CA-O 3.2Å; Y1205-Y1214 WeakPolarHBondContact CD2-O 3.37Å; Y1205-V1215 HydrophobicContact CD2-CG2 3.93Å; Y1205-V1215 HydrophobicContact CE2-CG2 4.15Å; Y1205-M1230 PolarHBondContact N-O 3.31Å; Y1205-M1230 PolarHBondContact O-N 3.01Å; Y1205-Y1232 VanDerWaalsContact CD2-OH 3.3Å; Y1205-Y1232 WeakPolarHBondContact CD2-OH 3.49Å; Y1205-Y1232 HydrophobicContact CG-CE2 4.44Å
1206	R	93.4	Very high	88.7	Confident	6 Å²	6	29.4 Å²	29.4	2%	0.023	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	140.5	-166.1	173.7	156.9	-72.9	176.9	-3.4	111.1	E697 R1213 Y1214 I1216 Q1224 D1229	E697-R1206 IonicContact OE1-NH1 2.7Å; E697-R1206 WeakPolarHBondContact OE2-CD 3.41Å; E697-R1206 IonicContact OE2-CZ 3.97Å; E697-R1206 IonicContact OE2-NE 3.34Å; E697-R1206 IonicContact OE2-NH1 3.92Å; E697-R1206 PolarHBondContact OE2-NH1 2.75Å; R1206-R1213 CarbonylContact O-C 3.52Å; R1206-R1213 WeakPolarHBondContact O-CA 3.49Å; R1206-R1213 WeakPolarHBondContact O-CB 3.37Å; R1206-Y1214 HydrophobicContact CB-CE1 4.06Å; R1206-Y1214 HydrophobicContact CB-CE2 4.38Å; R1206-Y1214 VanDerWaalsContact CD-OH 3.29Å; R1206-Y1214 WeakPolarHBondContact CD-OH 3.42Å; R1206-Y1214 HydrophobicContact CG-CE1 3.91Å; R1206-Y1214 PolarHBondContact N-O 3.07Å; R1206-Y1214 PolarHBondContact O-N 2.92Å; R1206-I1216 HydrophobicContact CB-CD1 3.98Å; R1206-Q1224 PolarHBondContact NH2-O 3.27Å; R1206-D1229 WeakPolarHBondContact CA-OD1 3.46Å; R1206-D1229 WeakPolarHBondContact CG-OD1 3.41Å; R1206-D1229 IonicContact CZ-OD2 2.75Å; R1206-D1229 IonicContact NE-OD1 3.24Å; R1206-D1229 PolarHBondContact NE-OD1 2.77Å; R1206-D1229 IonicContact NE-OD2 2.74Å; R1206-D1229 PolarHBondContact NE-OD2 3.24Å; R1206-D1229 IonicContact NH2-OD2 3.83Å; R1206-D1229 PolarHBondContact NH2-OD2 2.91Å
1207	W	90.2	Very high	89.1	Confident	99 Å²	99	28 Å²	28	38%	0.375	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	132.4	174.2	-175.3	-91.8	0	0	0	110.7	G1211 R1213 N1228	W1207-G1211 WeakPolarHBondContact CH2-O 3.27Å; W1207-R1213 HydrophobicContact CB-CG 4.43Å; W1207-R1213 HydrophobicContact CD2-CG 4.36Å; W1207-R1213 HydrophobicContact CE3-CG 3.41Å; W1207-R1213 VanDerWaalsContact CE3-CG 3.41Å; W1207-R1213 HydrophobicContact CZ3-CG 4Å; W1207-N1228 HydrophobicContact CB-CB 4.03Å
1208	Q	86.3	Confident	89.7	Confident	30 Å²	30	27.7 Å²	27.7	14%	0.14	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-102.5	146.5	173.8	-172.7	59	15.8	0	0	110.1	W694 N1210 G1211 F1212 Y1214	W694-Q1208 HydrophobicContact CB-CG 4.4Å; W694-Q1208 HydrophobicContact CG-CG 4.38Å; Q1208-N1210 HydrophobicContact CG-CB 4.37Å; Q1208-N1210 PolarHBondContact O-N 2.89Å; Q1208-N1210 VanDerWaalsContact O-N 3.14Å; Q1208-G1211 PolarHBondContact O-N 3.23Å; Q1208-F1212 HydrophobicContact CB-CD1 4.4Å; Q1208-F1212 HydrophobicContact CB-CD2 4.27Å; Q1208-F1212 HydrophobicContact CB-CE1 4.22Å; Q1208-F1212 HydrophobicContact CB-CE2 4.07Å; Q1208-F1212 HydrophobicContact CB-CG 4.42Å; Q1208-F1212 HydrophobicContact CB-CZ 4.04Å; Q1208-F1212 WeakPolarHBondContact CB-O 3.43Å; Q1208-F1212 HydrophobicContact CG-CE1 3.96Å; Q1208-F1212 HydrophobicContact CG-CE2 4.32Å; Q1208-F1212 HydrophobicContact CG-CZ 3.82Å; Q1208-F1212 PolarHBondContact N-O 3.2Å; Q1208-Y1214 HydrophobicContact CB-CD1 4.18Å; Q1208-Y1214 HydrophobicContact CB-CE1 4.05Å
1209	E	79.9	Confident	90	Very high	183 Å²	183	25.3 Å²	25.3	86%	0.855	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-31	-179.7	-66.5	178.3	178.7	0	0	113	G1211	E1209-G1211 PolarHBondContact O-N 2.89Å
1210	N	74.8	Confident	90.1	Very high	84 Å²	84	30 Å²	30	45%	0.449	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	7.8	177.4	-59.5	9.9	0	0	0	114.1	Q1208 F1212	Q1208-N1210 HydrophobicContact CG-CB 4.37Å; Q1208-N1210 PolarHBondContact O-N 2.89Å; Q1208-N1210 VanDerWaalsContact O-N 3.14Å; N1210-F1212 HydrophobicContact CB-CD1 3.94Å; N1210-F1212 HydrophobicContact CB-CE1 3.75Å
1211	G	78.8	Confident	90	Very high	40 Å²	40	31.4 Å²	31.4	41%	0.412	16%	0.158	S	C	.	.	S	Bend	trans	88.7	15.4	171	0	0	0	0	0	115.7	W1207 Q1208 E1209	W1207-G1211 WeakPolarHBondContact CH2-O 3.27Å; Q1208-G1211 PolarHBondContact O-N 3.23Å; E1209-G1211 PolarHBondContact O-N 2.89Å
1212	F	85.4	Confident	89.9	Confident	1 Å²	1	37.5 Å²	37.5	0%	0.004	19%	0.19	C	C	.	.			trans	-126	166.8	177.1	69.1	-94.6	0	0	0	112.7	W694 I1081 E1094 R1098 Q1208 N1210 Y1214	W694-F1212 HydrophobicContact CD2-CE2 4.31Å; W694-F1212 HydrophobicContact CD2-CZ 4.07Å; W694-F1212 AromaticContact CE2-CZ 3.86Å; W694-F1212 HydrophobicContact CE3-CE2 4.39Å; W694-F1212 HydrophobicContact CG-CZ 4.42Å; W694-F1212 HydrophobicContact CZ2-CZ 4.18Å; I1081-F1212 HydrophobicContact CD1-CE1 4.23Å; E1094-F1212 HydrophobicContact CG-CD1 4.39Å; E1094-F1212 HydrophobicContact CG-CD2 4.29Å; E1094-F1212 HydrophobicContact CG-CE1 4.15Å; E1094-F1212 HydrophobicContact CG-CE2 4.05Å; E1094-F1212 HydrophobicContact CG-CG 4.46Å; E1094-F1212 HydrophobicContact CG-CZ 3.98Å; R1098-F1212 HydrophobicContact CG-CB 4.19Å; R1098-F1212 HydrophobicContact CG-CD2 3.8Å; R1098-F1212 HydrophobicContact CG-CG 4.3Å; R1098-F1212 VanDerWaalsContact CZ-CB 3.44Å; Q1208-F1212 HydrophobicContact CB-CD1 4.4Å; Q1208-F1212 HydrophobicContact CB-CD2 4.27Å; Q1208-F1212 HydrophobicContact CB-CE1 4.22Å; Q1208-F1212 HydrophobicContact CB-CE2 4.07Å; Q1208-F1212 HydrophobicContact CB-CG 4.42Å; Q1208-F1212 HydrophobicContact CB-CZ 4.04Å; Q1208-F1212 WeakPolarHBondContact CB-O 3.43Å; Q1208-F1212 HydrophobicContact CG-CE1 3.96Å; Q1208-F1212 HydrophobicContact CG-CE2 4.32Å; Q1208-F1212 HydrophobicContact CG-CZ 3.82Å; Q1208-F1212 PolarHBondContact N-O 3.2Å; N1210-F1212 HydrophobicContact CB-CD1 3.94Å; N1210-F1212 HydrophobicContact CB-CE1 3.75Å; F1212-Y1214 HydrophobicContact CE2-CD1 4.13Å
1213	R	90.9	Very high	89.8	Confident	52 Å²	52	38.8 Å²	38.8	20%	0.196	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	143.8	174.1	-68.3	177.5	174.6	-96.2	-1.3	110.7	R1098 Y1205 R1206 W1207 N1228	R1098-R1213 WeakPolarHBondContact CA-O 3.31Å; R1098-R1213 VanDerWaalsContact CG-O 3.3Å; R1098-R1213 WeakPolarHBondContact CG-O 3.46Å; Y1205-R1213 HydrophobicContact CD1-CB 3.84Å; Y1205-R1213 VanDerWaalsContact CD1-CD 3.44Å; Y1205-R1213 HydrophobicContact CD1-CG 4.26Å; Y1205-R1213 HydrophobicContact CD2-CB 3.89Å; Y1205-R1213 HydrophobicContact CE1-CB 3.44Å; Y1205-R1213 VanDerWaalsContact CE1-CB 3.44Å; Y1205-R1213 HydrophobicContact CE1-CG 4.01Å; Y1205-R1213 HydrophobicContact CE2-CB 3.48Å; Y1205-R1213 VanDerWaalsContact CE2-CB 3.48Å; Y1205-R1213 WeakPolarHBondContact CE2-O 3.45Å; Y1205-R1213 HydrophobicContact CG-CB 4.06Å; Y1205-R1213 PolarHBondContact O-NH1 3.2Å; R1206-R1213 CarbonylContact O-C 3.52Å; R1206-R1213 WeakPolarHBondContact O-CA 3.49Å; R1206-R1213 WeakPolarHBondContact O-CB 3.37Å; W1207-R1213 HydrophobicContact CB-CG 4.43Å; W1207-R1213 HydrophobicContact CD2-CG 4.36Å; W1207-R1213 HydrophobicContact CE3-CG 3.41Å; W1207-R1213 VanDerWaalsContact CE3-CG 3.41Å; W1207-R1213 HydrophobicContact CZ3-CG 4Å; R1213-N1228 VanDerWaalsContact CZ-O 3.28Å; R1213-N1228 PolarHBondContact NH1-O 2.79Å; R1213-N1228 PolarHBondContact NH2-O 2.97Å
1214	Y	92.8	Very high	89.7	Confident	2 Å²	2	44 Å²	44	1%	0.008	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	157.3	179.3	63.5	-83.8	0	0	0	111.8	W694 E697 A1097 Y1205 R1206 Q1208 F1212 I1216	W694-Y1214 HydrophobicContact CB-CD1 4.18Å; W694-Y1214 HydrophobicContact CB-CE1 3.61Å; W694-Y1214 HydrophobicContact CB-CE2 4.17Å; W694-Y1214 HydrophobicContact CE3-CD2 4.39Å; W694-Y1214 HydrophobicContact CE3-CG 4.22Å; E697-Y1214 HydrophobicContact CB-CE2 4.22Å; E697-Y1214 PolarHBondContact OE2-OH 2.86Å; E697-Y1214 VanDerWaalsContact OE2-OH 3.06Å; A1097-Y1214 WeakPolarHBondContact O-CA 3.18Å; Y1205-Y1214 CarbonylContact C-O 3.57Å; Y1205-Y1214 WeakPolarHBondContact CA-O 3.2Å; Y1205-Y1214 WeakPolarHBondContact CD2-O 3.37Å; R1206-Y1214 HydrophobicContact CB-CE1 4.06Å; R1206-Y1214 HydrophobicContact CB-CE2 4.38Å; R1206-Y1214 VanDerWaalsContact CD-OH 3.29Å; R1206-Y1214 WeakPolarHBondContact CD-OH 3.42Å; R1206-Y1214 HydrophobicContact CG-CE1 3.91Å; R1206-Y1214 PolarHBondContact N-O 3.07Å; R1206-Y1214 PolarHBondContact O-N 2.92Å; Q1208-Y1214 HydrophobicContact CB-CD1 4.18Å; Q1208-Y1214 HydrophobicContact CB-CE1 4.05Å; F1212-Y1214 HydrophobicContact CE2-CD1 4.13Å; Y1214-I1216 HydrophobicContact CD2-CD1 4.34Å; Y1214-I1216 HydrophobicContact CD2-CG1 3.9Å; Y1214-I1216 HydrophobicContact CE2-CD1 3.57Å; Y1214-I1216 HydrophobicContact CE2-CG1 3.59Å
1215	V	94.5	Very high	89.4	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.018	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	132.8	-173.4	178.9	0	0	0	0	112	T673 L674 Y698 A1097 Y1205 Y1232	T673-V1215 WeakPolarHBondContact OG1-CG2 3.44Å; L674-V1215 HydrophobicContact CB-CG1 3.74Å; L674-V1215 HydrophobicContact CD1-CG1 3.44Å; L674-V1215 VanDerWaalsContact CD1-CG1 3.44Å; L674-V1215 HydrophobicContact CG-CG1 4.22Å; Y698-V1215 WeakPolarHBondContact CD2-O 3.43Å; A1097-V1215 PolarHBondContact O-N 3.37Å; A1097-V1215 VanDerWaalsContact O-N 3.1Å; Y1205-V1215 HydrophobicContact CD2-CG2 3.93Å; Y1205-V1215 HydrophobicContact CE2-CG2 4.15Å; V1215-Y1232 HydrophobicContact CG1-CE2 4.01Å; V1215-Y1232 HydrophobicContact CG2-CE2 4.25Å; V1215-Y1232 WeakPolarHBondContact CG2-OH 3.5Å
1216	I	94.3	Very high	89.1	Confident	4 Å²	4	48.1 Å²	48.1	2%	0.021	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	111.4	172.2	-52.3	170.7	0	0	0	108.7	E697 G1203 L1204 R1206 Y1214 P1219	E697-I1216 HydrophobicContact CB-CD1 4.08Å; G1203-I1216 CarbonylContact C-O 3.59Å; G1203-I1216 WeakPolarHBondContact CA-O 3.48Å; L1204-I1216 HydrophobicContact CB-CB 4.39Å; L1204-I1216 PolarHBondContact N-O 3.34Å; L1204-I1216 PolarHBondContact O-N 3.44Å; R1206-I1216 HydrophobicContact CB-CD1 3.98Å; Y1214-I1216 HydrophobicContact CD2-CD1 4.34Å; Y1214-I1216 HydrophobicContact CD2-CG1 3.9Å; Y1214-I1216 HydrophobicContact CE2-CD1 3.57Å; Y1214-I1216 HydrophobicContact CE2-CG1 3.59Å; I1216-P1219 HydrophobicContact CG2-CB 3.96Å
1217	A	92.8	Very high	88.7	Confident	3 Å²	3	54.5 Å²	54.5	3%	0.025	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	134.7	173.6	0	0	0	0	0	111	L674 L678 G701 M704	L674-A1217 HydrophobicContact CD1-CB 3.62Å; L678-A1217 HydrophobicContact CD2-CB 4.06Å; L678-A1217 HydrophobicContact CG-CB 4.34Å; G701-A1217 VanDerWaalsContact CA-O 3.28Å; G701-A1217 WeakPolarHBondContact CA-O 3.39Å; M704-A1217 HydrophobicContact CB-CB 4.36Å
1218	N	93.1	Very high	88.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.273	C	S	.	.	S	Bend	trans	38.3	64	176.6	-172.2	27.5	0	0	0	113.9	Y700 M704 N732 I734 I769 L1202	Y700-N1218 WeakPolarHBondContact CE1-O 3.49Å; M704-N1218 HydrophobicContact CE-CB 4.32Å; M704-N1218 WeakPolarHBondContact CE-O 3.29Å; M704-N1218 HydrophobicContact CG-CB 4.05Å; M704-N1218 HydrophobicContact SD-CB 4.05Å; N732-N1218 PolarHBondContact O-ND2 3.21Å; I734-N1218 HydrophobicContact CD1-CB 3.74Å; I734-N1218 WeakPolarHBondContact CD1-OD1 3.46Å; I734-N1218 HydrophobicContact CG1-CB 4.47Å; I734-N1218 WeakPolarHBondContact CG1-OD1 3.33Å; I769-N1218 HydrophobicContact CG2-CB 3.97Å; L1202-N1218 PolarHBondContact O-N 2.88Å
1219	P	93	Very high	88.7	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.013	27%	0.266	C	S	.	.			trans	-56.8	159.2	179	27.9	-37.1	0	0	0	111.3	F1186 L1204 I1216 T1223	F1186-P1219 HydrophobicContact CB-CG 4.15Å; F1186-P1219 HydrophobicContact CD1-CG 3.58Å; F1186-P1219 HydrophobicContact CD2-CG 3.57Å; F1186-P1219 HydrophobicContact CE1-CG 3.77Å; F1186-P1219 HydrophobicContact CE2-CG 3.74Å; F1186-P1219 HydrophobicContact CG-CG 3.48Å; F1186-P1219 VanDerWaalsContact CG-CG 3.48Å; F1186-P1219 HydrophobicContact CZ-CG 3.84Å; L1204-P1219 HydrophobicContact CD1-CB 4.32Å; L1204-P1219 HydrophobicContact CD1-CG 3.92Å; L1204-P1219 HydrophobicContact CG-CG 4.08Å; I1216-P1219 HydrophobicContact CG2-CB 3.96Å; P1219-T1223 HydrophobicContact CB-CG2 4.22Å
1220	M	90.9	Very high	89.3	Confident	97 Å²	97	45.1 Å²	45.1	48%	0.478	23%	0.233	S	C	.	.			trans	-54.4	146.5	176.4	-73.8	-168.7	-179.4	0	0	111.2	Y700 D1222 T1223	Y700-M1220 HydrophobicContact CD1-CG 4.39Å; Y700-M1220 HydrophobicContact CD2-CE 3.73Å; Y700-M1220 HydrophobicContact CD2-CG 4.46Å; Y700-M1220 HydrophobicContact CE1-CB 4.46Å; Y700-M1220 HydrophobicContact CE1-CG 3.67Å; Y700-M1220 HydrophobicContact CE2-CE 3.27Å; Y700-M1220 HydrophobicContact CE2-CG 3.78Å; Y700-M1220 HydrophobicContact CE2-SD 4.39Å; Y700-M1220 WeakPolarHBondContact OH-CG 3.46Å; M1220-D1222 PolarHBondContact O-N 3.41Å; M1220-D1222 VanDerWaalsContact O-N 3.13Å; M1220-T1223 PolarHBondContact N-OG1 3.02Å; M1220-T1223 VanDerWaalsContact O-CB 3.25Å; M1220-T1223 WeakPolarHBondContact O-CB 3.32Å; M1220-T1223 PolarHBondContact O-N 3.09Å; M1220-T1223 PolarHBondContact O-OG1 2.99Å; M1220-T1223 VanDerWaalsContact O-OG1 3.08Å
1221	P	89.8	Confident	90.3	Very high	30 Å²	30	41.1 Å²	41.1	20%	0.195	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-37.7	179.8	-29.2	36.5	0	0	0	113.2	N732 T1185 K1187 T1223	N732-P1221 HydrophobicContact CB-CG 4.19Å; T1185-P1221 WeakPolarHBondContact CB-O 3.34Å; K1187-P1221 HydrophobicContact CB-CB 3.96Å; K1187-P1221 VanDerWaalsContact CB-O 3.32Å; K1187-P1221 WeakPolarHBondContact CB-O 3.4Å; K1187-P1221 HydrophobicContact CD-CB 4.36Å; K1187-P1221 PolarHBondContact N-O 3.44Å; P1221-T1223 VanDerWaalsContact C-N 3.31Å; P1221-T1223 PolarHBondContact O-N 3.5Å
1222	D	91.2	Very high	91	Very high	128 Å²	128	39.2 Å²	39.2	68%	0.684	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	0.9	-176.8	-56.2	-30.6	0	0	0	113.7	M1220 Q1224	M1220-D1222 PolarHBondContact O-N 3.41Å; M1220-D1222 VanDerWaalsContact O-N 3.13Å; D1222-Q1224 PolarHBondContact O-N 3.29Å; D1222-Q1224 VanDerWaalsContact O-N 3.14Å
1223	T	91.1	Very high	91.3	Very high	31 Å²	31	39.3 Å²	39.3	19%	0.19	19%	0.193	C	C	.	.			trans	-61.1	119.3	178.9	-65.4	0	0	0	0	110	T1185 F1186 L1204 P1219 M1220 P1221	T1185-T1223 CarbonylContact C-O 3.44Å; T1185-T1223 WeakPolarHBondContact CA-O 3.47Å; F1186-T1223 PolarHBondContact N-O 3.38Å; L1204-T1223 HydrophobicContact CD1-CG2 4.49Å; P1219-T1223 HydrophobicContact CB-CG2 4.22Å; M1220-T1223 PolarHBondContact N-OG1 3.02Å; M1220-T1223 VanDerWaalsContact O-CB 3.25Å; M1220-T1223 WeakPolarHBondContact O-CB 3.32Å; M1220-T1223 PolarHBondContact O-N 3.09Å; M1220-T1223 PolarHBondContact O-OG1 2.99Å; M1220-T1223 VanDerWaalsContact O-OG1 3.08Å; P1221-T1223 VanDerWaalsContact C-N 3.31Å; P1221-T1223 PolarHBondContact O-N 3.5Å
1224	Q	90.2	Very high	91.4	Very high	110 Å²	110	36.8 Å²	36.8	51%	0.514	18%	0.183	S	C	.	.	B	Isolated β-bridge	trans	-68.1	140.9	175.1	-64.3	-177.7	1.3	0	0	110.5	R1206 D1222	R1206-Q1224 PolarHBondContact NH2-O 3.27Å; D1222-Q1224 PolarHBondContact O-N 3.29Å; D1222-Q1224 VanDerWaalsContact O-N 3.14Å
1225	I	90.2	Very high	91.1	Very high	13 Å²	13	36.8 Å²	36.8	7%	0.067	18%	0.183	C	C	.	.			trans	-105.2	134.6	-177.9	-47.2	174.8	0	0	0	110.1	F1167 L1184 V1189 D1229 F1231	F1167-I1225 HydrophobicContact CE2-CG2 3.55Å; F1167-I1225 HydrophobicContact CZ-CB 4.36Å; F1167-I1225 HydrophobicContact CZ-CG2 3.63Å; L1184-I1225 HydrophobicContact CB-CD1 4.39Å; L1184-I1225 PolarHBondContact O-N 3.49Å; L1184-I1225 VanDerWaalsContact O-N 3.1Å; V1189-I1225 HydrophobicContact CB-CD1 3.82Å; V1189-I1225 HydrophobicContact CG2-CD1 3.24Å; I1225-D1229 HydrophobicContact CG2-CB 3.91Å; I1225-F1231 HydrophobicContact CD1-CE1 3.9Å; I1225-F1231 HydrophobicContact CD1-CZ 3.77Å; I1225-F1231 HydrophobicContact CG2-CE1 4.31Å; I1225-F1231 HydrophobicContact CG2-CE2 4.35Å; I1225-F1231 HydrophobicContact CG2-CZ 3.62Å
1226	Y	87.8	Confident	90.4	Very high	92 Å²	92	36.8 Å²	36.8	36%	0.361	18%	0.183	S	C	.	.			trans	-100	155.6	176.8	-53.9	-70.7	0	0	0	112.2	R693 F1167 N1228 D1229	R693-Y1226 PolarHBondContact NH2-OH 3.45Å; F1167-Y1226 VanDerWaalsContact CE2-O 3.23Å; F1167-Y1226 WeakPolarHBondContact CE2-O 3.3Å; Y1226-N1228 PolarHBondContact O-N 3.13Å; Y1226-N1228 VanDerWaalsContact O-N 3.09Å; Y1226-D1229 PolarHBondContact N-OD2 3.45Å; Y1226-D1229 VanDerWaalsContact O-CB 3.27Å; Y1226-D1229 WeakPolarHBondContact O-CB 2.9Å; Y1226-D1229 PolarHBondContact O-N 2.7Å
1227	E	84.1	Confident	89.5	Confident	140 Å²	140	38.4 Å²	38.4	65%	0.654	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-26.7	-177.2	-61.7	-170.5	163.4	0	0	114.3	F1167	F1167-E1227 WeakPolarHBondContact CD2-O 3.4Å
1228	N	87.5	Confident	88.1	Confident	82 Å²	82	44.7 Å²	44.7	44%	0.439	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-9.3	179.1	-68.3	-25.5	0	0	0	113.2	W1207 R1213 Y1226	W1207-N1228 HydrophobicContact CB-CB 4.03Å; R1213-N1228 VanDerWaalsContact CZ-O 3.28Å; R1213-N1228 PolarHBondContact NH1-O 2.79Å; R1213-N1228 PolarHBondContact NH2-O 2.97Å; Y1226-N1228 PolarHBondContact O-N 3.13Å; Y1226-N1228 VanDerWaalsContact O-N 3.09Å
1229	D	90.5	Very high	86.5	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.011	23%	0.233	C	C	.	.			trans	-65.9	141.4	179.3	-72.5	-19.4	0	0	0	110.7	R1206 I1225 Y1226	R1206-D1229 WeakPolarHBondContact CA-OD1 3.46Å; R1206-D1229 WeakPolarHBondContact CG-OD1 3.41Å; R1206-D1229 IonicContact CZ-OD2 2.75Å; R1206-D1229 IonicContact NE-OD1 3.24Å; R1206-D1229 PolarHBondContact NE-OD1 2.77Å; R1206-D1229 IonicContact NE-OD2 2.74Å; R1206-D1229 PolarHBondContact NE-OD2 3.24Å; R1206-D1229 IonicContact NH2-OD2 3.83Å; R1206-D1229 PolarHBondContact NH2-OD2 2.91Å; I1225-D1229 HydrophobicContact CG2-CB 3.91Å; Y1226-D1229 PolarHBondContact N-OD2 3.45Å; Y1226-D1229 VanDerWaalsContact O-CB 3.27Å; Y1226-D1229 WeakPolarHBondContact O-CB 2.9Å; Y1226-D1229 PolarHBondContact O-N 2.7Å
1230	M	92.5	Very high	84.8	Confident	31 Å²	31	51.5 Å²	51.5	15%	0.153	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	144.4	173	-56.2	-83.3	-63.7	0	0	108.7	L1164 R1165 G1166 L1204 Y1205	L1164-M1230 HydrophobicContact CD1-CB 3.68Å; L1164-M1230 HydrophobicContact CD2-CB 4.16Å; L1164-M1230 HydrophobicContact CD2-CE 4.09Å; L1164-M1230 HydrophobicContact CG-CB 3.79Å; L1164-M1230 HydrophobicContact CG-CE 3.87Å; R1165-M1230 CarbonylContact O-C 3.59Å; R1165-M1230 WeakPolarHBondContact O-CA 3.26Å; G1166-M1230 WeakPolarHBondContact CA-SD 3.39Å; G1166-M1230 PolarHBondContact N-SD 2.96Å; L1204-M1230 CarbonylContact C-O 3.59Å; L1204-M1230 WeakPolarHBondContact CA-O 3.39Å; Y1205-M1230 PolarHBondContact N-O 3.31Å; Y1205-M1230 PolarHBondContact O-N 3.01Å
1231	F	93.9	Very high	83.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.6	-174.8	-61	-94.2	0	0	0	110.3	L1164 R1165 F1167 F1172 F1186 V1189 L1204 I1225 C1233	L1164-F1231 WeakPolarHBondContact CA-O 3.37Å; R1165-F1231 PolarHBondContact N-O 3.38Å; R1165-F1231 WeakPolarHBondContact O-CD2 3.37Å; R1165-F1231 PolarHBondContact O-N 3.24Å; F1167-F1231 HydrophobicContact CD2-CE2 4.44Å; F1167-F1231 AromaticContact CE2-CE2 3.93Å; F1167-F1231 HydrophobicContact CE2-CE2 3.93Å; F1167-F1231 HydrophobicContact CE2-CZ 4.24Å; F1167-F1231 HydrophobicContact CZ-CE2 4.09Å; F1167-F1231 HydrophobicContact CZ-CZ 4.13Å; F1172-F1231 AromaticContact CD1-CD2 3.67Å; F1172-F1231 HydrophobicContact CD1-CD2 3.67Å; F1172-F1231 AromaticContact CD1-CE2 3.76Å; F1172-F1231 HydrophobicContact CD1-CE2 3.76Å; F1172-F1231 HydrophobicContact CD1-CG 4.29Å; F1172-F1231 HydrophobicContact CD1-CZ 4.41Å; F1172-F1231 HydrophobicContact CE1-CB 4.16Å; F1172-F1231 HydrophobicContact CE1-CD1 4.31Å; F1172-F1231 AromaticContact CE1-CD2 3.67Å; F1172-F1231 HydrophobicContact CE1-CD2 3.67Å; F1172-F1231 HydrophobicContact CE1-CE2 4.04Å; F1172-F1231 AromaticContact CE1-CG 3.8Å; F1172-F1231 HydrophobicContact CE1-CG 3.8Å; F1172-F1231 HydrophobicContact CE1-CZ 4.47Å; F1172-F1231 HydrophobicContact CG-CD2 4.41Å; F1172-F1231 HydrophobicContact CZ-CB 4.18Å; F1172-F1231 HydrophobicContact CZ-CD2 4.39Å; F1172-F1231 HydrophobicContact CZ-CG 4.33Å; F1186-F1231 HydrophobicContact CD2-CD1 4.49Å; F1186-F1231 HydrophobicContact CD2-CE1 4.17Å; F1186-F1231 HydrophobicContact CE2-CD1 4.12Å; F1186-F1231 HydrophobicContact CE2-CE1 4.25Å; V1189-F1231 HydrophobicContact CB-CE1 4.35Å; V1189-F1231 HydrophobicContact CG1-CD1 4.36Å; V1189-F1231 HydrophobicContact CG1-CE1 3.72Å; V1189-F1231 HydrophobicContact CG1-CZ 3.89Å; V1189-F1231 HydrophobicContact CG2-CZ 4.45Å; L1204-F1231 HydrophobicContact CD2-CD1 3.34Å; L1204-F1231 HydrophobicContact CD2-CE1 3.41Å; L1204-F1231 VanDerWaalsContact CD2-CE1 3.41Å; L1204-F1231 HydrophobicContact CD2-CG 4.08Å; L1204-F1231 HydrophobicContact CD2-CZ 4.18Å; I1225-F1231 HydrophobicContact CD1-CE1 3.9Å; I1225-F1231 HydrophobicContact CD1-CZ 3.77Å; I1225-F1231 HydrophobicContact CG2-CE1 4.31Å; I1225-F1231 HydrophobicContact CG2-CE2 4.35Å; I1225-F1231 HydrophobicContact CG2-CZ 3.62Å; F1231-C1233 VanDerWaalsContact CB-SG 3.55Å; F1231-C1233 PolarHBondContact O-N 3.11Å; F1231-C1233 PolarHBondContact O-SG 2.91Å; F1231-C1233 VanDerWaalsContact O-SG 3.39Å
1232	Y	95	Very high	81.5	Confident	1 Å²	1	51.9 Å²	51.9	0%	0.004	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	118.3	166.3	-69.1	-72.1	0	0	0	108.9	A668 P669 F671 L674 L1164 C1201 L1202 G1203 Y1205 V1215	A668-Y1232 HydrophobicContact CB-CD1 4.21Å; A668-Y1232 HydrophobicContact CB-CE1 4.16Å; P669-Y1232 VanDerWaalsContact O-CE1 3.31Å; P669-Y1232 WeakPolarHBondContact O-CE1 3.37Å; P669-Y1232 PolarHBondContact O-OH 2.9Å; F671-Y1232 HydrophobicContact CB-CE1 4.24Å; F671-Y1232 HydrophobicContact CD2-CD1 4.04Å; L674-Y1232 HydrophobicContact CD1-CD2 4.31Å; L674-Y1232 HydrophobicContact CD2-CD2 4.22Å; L674-Y1232 HydrophobicContact CD2-CG 4.11Å; L1164-Y1232 HydrophobicContact CD1-CD1 3.87Å; L1164-Y1232 HydrophobicContact CD1-CE1 3.84Å; L1164-Y1232 HydrophobicContact CD1-CG 4.27Å; C1201-Y1232 CarbonylContact C-O 3.57Å; C1201-Y1232 WeakPolarHBondContact CA-O 3.42Å; L1202-Y1232 PolarHBondContact N-O 2.68Å; G1203-Y1232 PolarHBondContact O-N 3.04Å; Y1205-Y1232 VanDerWaalsContact CD2-OH 3.3Å; Y1205-Y1232 WeakPolarHBondContact CD2-OH 3.49Å; Y1205-Y1232 HydrophobicContact CG-CE2 4.44Å; V1215-Y1232 HydrophobicContact CG1-CE2 4.01Å; V1215-Y1232 HydrophobicContact CG2-CE2 4.25Å; V1215-Y1232 WeakPolarHBondContact CG2-OH 3.5Å
1233	C	92	Very high	79.7	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.014	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	138	-171.5	-61.4	0	0	0	0	112	S1163 F1172 I1199 L1200 F1231 M1235	S1163-C1233 PolarHBondContact N-O 3.23Å; S1163-C1233 PolarHBondContact O-N 3.3Å; F1172-C1233 VanDerWaalsContact CZ-SG 3.53Å; I1199-C1233 HydrophobicContact CG2-CB 3.69Å; L1200-C1233 WeakPolarHBondContact O-CA 3.43Å; F1231-C1233 VanDerWaalsContact CB-SG 3.55Å; F1231-C1233 PolarHBondContact O-N 3.11Å; F1231-C1233 PolarHBondContact O-SG 2.91Å; F1231-C1233 VanDerWaalsContact O-SG 3.39Å; C1233-M1235 HydrophobicContact CB-CG 4.33Å
1234	F	91.5	Very high	77.8	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	107.8	161.7	-77.4	-3.8	0	0	0	108.4	F671 L736 I750 N751 L1127 V1160 V1162 L1200 L1202	F671-F1234 AromaticContact CE2-CE1 3.99Å; F671-F1234 HydrophobicContact CE2-CE1 3.99Å; F671-F1234 AromaticContact CZ-CE1 3.91Å; F671-F1234 HydrophobicContact CZ-CE1 3.91Å; F671-F1234 HydrophobicContact CZ-CZ 4.27Å; L736-F1234 HydrophobicContact CD1-CD2 4.04Å; L736-F1234 HydrophobicContact CD1-CE2 3.44Å; L736-F1234 VanDerWaalsContact CD1-CE2 3.44Å; L736-F1234 HydrophobicContact CD1-CZ 4.28Å; L736-F1234 HydrophobicContact CG-CE2 4.33Å; I750-F1234 HydrophobicContact CG2-CD2 3.72Å; I750-F1234 HydrophobicContact CG2-CE2 3.49Å; I750-F1234 VanDerWaalsContact CG2-CE2 3.49Å; I750-F1234 HydrophobicContact CG2-CZ 4.34Å; N751-F1234 HydrophobicContact CB-CB 4.34Å; L1127-F1234 HydrophobicContact CD1-CZ 4.3Å; V1160-F1234 HydrophobicContact CG1-CB 3.33Å; V1160-F1234 HydrophobicContact CG1-CD1 3.77Å; V1160-F1234 HydrophobicContact CG1-CD2 4.03Å; V1160-F1234 HydrophobicContact CG1-CG 3.44Å; V1160-F1234 VanDerWaalsContact CG1-CG 3.44Å; V1162-F1234 HydrophobicContact CG1-CE1 4.4Å; V1162-F1234 HydrophobicContact CG2-CD1 4.01Å; V1162-F1234 HydrophobicContact CG2-CE1 3.68Å; L1200-F1234 HydrophobicContact CB-CB 4.16Å; L1200-F1234 HydrophobicContact CD2-CD2 4.1Å; L1200-F1234 PolarHBondContact N-O 2.65Å; L1200-F1234 VanDerWaalsContact N-O 3.1Å; L1200-F1234 PolarHBondContact O-N 2.93Å; L1202-F1234 HydrophobicContact CD1-CD1 3.96Å; L1202-F1234 HydrophobicContact CD1-CD2 4.42Å; L1202-F1234 HydrophobicContact CD1-CE1 3.62Å; L1202-F1234 HydrophobicContact CD1-CE2 4.12Å; L1202-F1234 HydrophobicContact CD1-CG 4.35Å; L1202-F1234 HydrophobicContact CD1-CZ 3.71Å; L1202-F1234 HydrophobicContact CD2-CD2 4.34Å; L1202-F1234 HydrophobicContact CD2-CE2 4.32Å
1235	M	86.8	Confident	76.1	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	146.5	179.7	-62.6	-177.4	73.7	0	0	110.8	K1161 S1163 R1165 I1199 C1233 W1246	K1161-M1235 HydrophobicContact CB-CB 4.24Å; K1161-M1235 PolarHBondContact N-O 3.17Å; K1161-M1235 PolarHBondContact O-N 3.17Å; S1163-M1235 WeakPolarHBondContact OG-CG 3.34Å; S1163-M1235 PolarHBondContact OG-SD 2.88Å; R1165-M1235 HydrophobicContact CG-SD 4.33Å; R1165-M1235 PolarHBondContact NE-SD 3.17Å; R1165-M1235 VanDerWaalsContact NE-SD 3.4Å; R1165-M1235 PolarHBondContact NH2-SD 2.87Å; I1199-M1235 HydrophobicContact CD1-CE 4.12Å; I1199-M1235 HydrophobicContact CD1-CG 4.32Å; I1199-M1235 HydrophobicContact CG1-CG 4.27Å; I1199-M1235 HydrophobicContact CG2-CG 4.38Å; C1233-M1235 HydrophobicContact CB-CG 4.33Å; M1235-W1246 HydrophobicContact CE-CH2 3.47Å; M1235-W1246 VanDerWaalsContact CE-CH2 3.47Å; M1235-W1246 HydrophobicContact CE-CZ2 3.52Å
1236	P	81.2	Confident	74.6	Confident	4 Å²	4	56.6 Å²	56.6	3%	0.026	29%	0.285	C	S	.	.			trans	-69.1	162.4	172.3	31.6	-36.2	0	0	0	111.6	E754 Q1239	E754-P1236 HydrophobicContact CG-CB 4.26Å; P1236-Q1239 HydrophobicContact CG-CB 4.38Å; P1236-Q1239 HydrophobicContact CG-CG 3.92Å
1237	I	73.4	Confident	72.8	Confident	38 Å²	38	60.7 Å²	60.7	20%	0.195	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-42.2	-169.8	-67.2	172.1	0	0	0	112.3	W966 G1159 Q1239	W966-I1237 HydrophobicContact CB-CB 4.24Å; W966-I1237 HydrophobicContact CB-CD1 4.09Å; W966-I1237 HydrophobicContact CB-CG1 3.74Å; W966-I1237 HydrophobicContact CB-CG2 3.66Å; W966-I1237 HydrophobicContact CD2-CD1 4.1Å; W966-I1237 HydrophobicContact CD2-CG1 4.37Å; W966-I1237 HydrophobicContact CE3-CD1 3.79Å; W966-I1237 HydrophobicContact CG-CD1 4.23Å; W966-I1237 HydrophobicContact CG-CG1 4.03Å; G1159-I1237 VanDerWaalsContact N-CD1 3.28Å; G1159-I1237 WeakPolarHBondContact O-CD1 3.07Å; G1159-I1237 WeakPolarHBondContact O-CG1 3.44Å; I1237-Q1239 PolarHBondContact O-N 3.46Å
1238	D	64.8	Low	71.2	Confident	135 Å²	135	58.8 Å²	58.8	72%	0.722	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-1.3	-166.7	-66.4	-25.8	0	0	0	114.4	D1240	D1238-D1240 PolarHBondContact O-N 3.49Å
1239	Q	59.2	Low	69	Low	38 Å²	38	58.9 Å²	58.9	18%	0.178	30%	0.301	C	S	.	.			trans	-91.7	92.2	-178	-71.8	175.1	-5.8	0	0	110.9	W1197 P1236 I1237 W1246	W1197-Q1239 PolarHBondContact O-NE2 3.19Å; W1197-Q1239 PolarHBondContact O-OE1 3.33Å; P1236-Q1239 HydrophobicContact CG-CB 4.38Å; P1236-Q1239 HydrophobicContact CG-CG 3.92Å; I1237-Q1239 PolarHBondContact O-N 3.46Å; Q1239-W1246 HydrophobicContact CB-CH2 3.69Å; Q1239-W1246 HydrophobicContact CB-CZ2 3.67Å; Q1239-W1246 HydrophobicContact CB-CZ3 4.41Å; Q1239-W1246 VanDerWaalsContact CD-CH2 3.44Å; Q1239-W1246 VanDerWaalsContact CD-CZ3 3.44Å; Q1239-W1246 HydrophobicContact CG-CH2 4Å; Q1239-W1246 HydrophobicContact CG-CZ2 4.34Å; Q1239-W1246 HydrophobicContact CG-CZ3 4.24Å
1240	D	56.1	Low	66.1	Low	107 Å²	107	67.9 Å²	67.9	57%	0.572	34%	0.344	S	S	*	.			trans	-57.2	143.7	170.3	-85.3	-29.7	0	0	0	111.8	D1238 S1242 W1246	D1238-D1240 PolarHBondContact O-N 3.49Å; D1240-S1242 PolarHBondContact O-N 3.03Å; D1240-W1246 PolarHBondContact O-NE1 3.4Å; D1240-W1246 VanDerWaalsContact O-NE1 3.16Å
1241	D	56.5	Low	63.2	Low	80 Å²	80	73.1 Å²	73.1	43%	0.428	37%	0.371	S	S	.	.	S	Bend	trans	-63.6	-2.6	177.5	-64.3	-18.6	0	0	0	113	K1161 R1165	K1161-D1241 IonicContact NZ-OD1 2.85Å; K1161-D1241 PolarHBondContact NZ-OD1 3.47Å; K1161-D1241 IonicContact NZ-OD2 2.71Å; R1165-D1241 IonicContact CZ-OD1 3.52Å; R1165-D1241 IonicContact NH1-OD1 3.59Å; R1165-D1241 IonicContact NH2-OD1 3.32Å; R1165-D1241 PolarHBondContact NH2-OD1 3.46Å; R1165-D1241 IonicContact NH2-OD2 2.82Å
1242	S	55.9	Low	60.2	Low	55 Å²	55	80.3 Å²	80.3	39%	0.385	41%	0.407	S	S	.	.	S	Bend	trans	-72.3	132.7	178.4	84.2	0	0	0	0	110.8	D1240 K1244 N1245 W1246	D1240-S1242 PolarHBondContact O-N 3.03Å; S1242-K1244 PolarHBondContact O-N 2.85Å; S1242-N1245 PolarHBondContact O-N 3.15Å; S1242-W1246 VanDerWaalsContact O-CD1 3.24Å
1243	N	53.1	Low	56.9	Low	100 Å²	100	88.6 Å²	88.6	54%	0.535	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-16.8	-179.6	-72.5	-23.7	0	0	0	114	A1170	A1170-N1243 WeakPolarHBondContact CB-OD1 3.48Å
1244	K	51.5	Low	53.9	Low	178 Å²	178	94 Å²	94	77%	0.774	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-28.3	-171.8	-69.5	-174	178.5	-178.6	0	113.5	S1242	S1242-K1244 PolarHBondContact O-N 2.85Å
1245	N	55.5	Low	51.1	Low	94 Å²	94	103.3 Å²	103.3	50%	0.503	53%	0.525	S	S	.	.	S	Bend	trans	-86.3	-13.4	-173.8	-67	-1	0	0	0	113.2	S1242 K1247	S1242-N1245 PolarHBondContact O-N 3.15Å; N1245-K1247 PolarHBondContact O-N 3.33Å
1246	W	57.8	Low	48.6	Very low	9 Å²	9	109.8 Å²	109.8	3%	0.034	56%	0.56	C	S	.	*			trans	-95	65.1	-175.9	-55.2	94.9	0	0	0	110.7	A1170 P1171 F1174 W1197 I1199 M1235 Q1239 D1240 S1242	A1170-W1246 HydrophobicContact CB-CG 4.45Å; P1171-W1246 HydrophobicContact CB-CB 4.38Å; P1171-W1246 HydrophobicContact CB-CD2 3.77Å; P1171-W1246 HydrophobicContact CB-CE3 3.55Å; P1171-W1246 HydrophobicContact CB-CG 4.16Å; P1171-W1246 HydrophobicContact CB-CZ3 3.99Å; P1171-W1246 HydrophobicContact CG-CD2 4.24Å; P1171-W1246 HydrophobicContact CG-CE3 3.79Å; P1171-W1246 HydrophobicContact CG-CH2 3.97Å; P1171-W1246 HydrophobicContact CG-CZ2 4.49Å; P1171-W1246 HydrophobicContact CG-CZ3 3.66Å; F1174-W1246 HydrophobicContact CE2-CB 3.86Å; F1174-W1246 WeakPolarHBondContact CE2-O 3.23Å; F1174-W1246 WeakPolarHBondContact CZ-O 3.41Å; W1197-W1246 HydrophobicContact CB-CE3 4.45Å; W1197-W1246 HydrophobicContact CB-CZ3 3.84Å; W1197-W1246 AromaticContact CD1-CE3 3.63Å; W1197-W1246 AromaticContact CD1-CZ3 3.9Å; W1197-W1246 AromaticContact CG-CE3 3.99Å; W1197-W1246 HydrophobicContact CG-CE3 3.99Å; W1197-W1246 AromaticContact CG-CZ3 3.84Å; W1197-W1246 HydrophobicContact CG-CZ3 3.84Å; I1199-W1246 HydrophobicContact CD1-CH2 3.83Å; I1199-W1246 HydrophobicContact CD1-CZ3 3.96Å; M1235-W1246 HydrophobicContact CE-CH2 3.47Å; M1235-W1246 VanDerWaalsContact CE-CH2 3.47Å; M1235-W1246 HydrophobicContact CE-CZ2 3.52Å; Q1239-W1246 HydrophobicContact CB-CH2 3.69Å; Q1239-W1246 HydrophobicContact CB-CZ2 3.67Å; Q1239-W1246 HydrophobicContact CB-CZ3 4.41Å; Q1239-W1246 VanDerWaalsContact CD-CH2 3.44Å; Q1239-W1246 VanDerWaalsContact CD-CZ3 3.44Å; Q1239-W1246 HydrophobicContact CG-CH2 4Å; Q1239-W1246 HydrophobicContact CG-CZ2 4.34Å; Q1239-W1246 HydrophobicContact CG-CZ3 4.24Å; D1240-W1246 PolarHBondContact O-NE1 3.4Å; D1240-W1246 VanDerWaalsContact O-NE1 3.16Å; S1242-W1246 VanDerWaalsContact O-CD1 3.24Å
1247	K	51	Low	46.2	Very low	178 Å²	178	119.5 Å²	119.5	77%	0.774	61%	0.605	S	S	*	*			trans	-100.8	142.6	167.3	-72.8	-174.3	177.3	-177.3	0	109.1	N1245 S1249	N1245-K1247 PolarHBondContact O-N 3.33Å; K1247-S1249 PolarHBondContact O-N 3.34Å; K1247-S1249 VanDerWaalsContact O-N 3.14Å
1248	F	49.3	Very low	44.1	Very low	100 Å²	100	122.1 Å²	122.1	44%	0.439	63%	0.627	S	S	.	*			trans	-57.4	118.8	169.5	-79.8	-69.5	0	0	0	108.4	R1192 C1196 E1250	R1192-F1248 VanDerWaalsContact NH2-CZ 3.25Å; C1196-F1248 HydrophobicContact CB-CD1 4.46Å; C1196-F1248 HydrophobicContact CB-CE1 4.15Å; F1248-E1250 PolarHBondContact O-N 3.11Å
1249	S	41.1	Very low	42.5	Very low	83 Å²	83	125.9 Å²	125.9	58%	0.58	66%	0.655	S	S	*	*			trans	-65.8	111.5	162.6	41.3	0	0	0	0	107.6	K1247 I1251	K1247-S1249 PolarHBondContact O-N 3.34Å; K1247-S1249 VanDerWaalsContact O-N 3.14Å; S1249-I1251 PolarHBondContact O-N 2.79Å
1250	E	29.8	Very low	41.7	Very low	192 Å²	192	130.3 Å²	130.3	90%	0.897	68%	0.679	S	S	*	*			trans	-68.9	71.2	165.9	-74	178.2	156.6	0	0	109.3	F1248	F1248-E1250 PolarHBondContact O-N 3.11Å
1251	I	31.5	Very low	40.9	Very low	140 Å²	140	131.5 Å²	131.5	72%	0.718	68%	0.684	S	S	*	*			trans	-151.7	101	173.1	-46.1	175.4	0	0	0	104	S1249	S1249-I1251 PolarHBondContact O-N 2.79Å
1252	I	31.5	Very low	40	Very low	151 Å²	151	134.4 Å²	134.4	77%	0.774	70%	0.698	S	S	*	*				-145.4	110.2	60.9	-64.2	157	0	0	0	107.4
1253	Q	26.3	Very low	39.1	Very low	175 Å²	175	139.1 Å²	139.1	82%	0.818	72%	0.717	S	S	*	*			trans	-72.9	135.7	152.5	-82.5	-178.7	-17.2	0	0	107	Q1255	Q1253-Q1255 PolarHBondContact O-N 3.34Å; Q1253-Q1255 VanDerWaalsContact O-N 3.14Å
1254	P	29	Very low	38.2	Very low	117 Å²	117	141.5 Å²	141.5	76%	0.76	73%	0.728	S	S	*	*			trans	-58.6	121	171.1	25.2	-30.6	0	0	0	107.6	N1256	P1254-N1256 PolarHBondContact O-N 3.01Å
1255	Q	32.2	Very low	37.4	Very low	194 Å²	194	139.1 Å²	139.1	91%	0.907	73%	0.725	S	S	*	*			trans	-60.8	111.4	169.5	-79	-169	-29.8	0	0	107.8	Q1253	Q1253-Q1255 PolarHBondContact O-N 3.34Å; Q1253-Q1255 VanDerWaalsContact O-N 3.14Å
1256	N	33	Very low	36.1	Very low	138 Å²	138	142.3 Å²	142.3	74%	0.738	74%	0.741	S	S	*	*			trans	19.4	98.5	159.8	-66.8	-10.4	0	0	0	116.6	P1254 S1258	P1254-N1256 PolarHBondContact O-N 3.01Å; N1256-S1258 PolarHBondContact O-N 3.03Å; N1256-S1258 VanDerWaalsContact O-N 3.08Å
1257	E	30.7	Very low	34.4	Very low	207 Å²	207	152.5 Å²	152.5	97%	0.967	80%	0.796	S	S	*	*			trans	-67.2	93	141.4	-76.6	179.2	165.6	0	0	107.7
1258	S	31.2	Very low	33	Very low	94 Å²	94	150.4 Å²	150.4	66%	0.657	80%	0.797	S	S	*	*			trans	-142.8	62.3	160	68	0	0	0	0	108.9	N1256	N1256-S1258 PolarHBondContact O-N 3.03Å; N1256-S1258 VanDerWaalsContact O-N 3.08Å
1259	T	30.4	Very low	31.5	Very low	214 Å²	214	155 Å²	155	100%	1.313	83%	0.83	S	S	*	*			trans	-162.7	0	149	43.7	0	0	0	0	109.1

Retrieved 1,259 of 1,259 residues in 505.7 ms (Link to these results)

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