A0A087XGP8_POEFO Loading...

Cilia and flagella associated protein 61

AlphaFold DB , UniProt , Accession A0A087XGP8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,201 aa.

						>A0A087XGP8_POEFO|A0A087XGP8
QESMRSTWSTEENLTVRRSRSADARWIQKLIGSSDQAVFGRINVNDLLEKANLSLTVGGQSGDVVAHASFSDLPPAAAAAVVSHDAWEAFLRSHWPAARCTPLNSLFLHLFVSEPRVAGSSLEKILRTAFSITSDLEHVLLLCPDQCPLEPVLEETFQLLQWEADSEAPCSARICRREDHCKRLHVRRARVADYDDIMMIVNKQTTECSIPLQPYALIDVIEYQHQRSHAAVLQDEGRVVGFVAATSSPNDQKLLEHFNLREFDGFYKHKVPEKEEEVEEEGEPSHQTPRKSNSFCIQHFIADEDHQTRLGPLPDTMEGTGGPAAGPATSHRDPAPQSPAESRGAPEAADCSSSCSSAQLGSNLTTQSCFKPVITKHFPMLIILGITRQKYLVLFCVFAVYSSNSSFTLGVLNVLVSLFHDLEYCLIFVPSASPESPWLQNFVLVRSRPSSLQLTSLYITHRSRFRRTVDVRHAVPEDREAVSDLLNSLNLTCSVLEDLDSFYRTHSDPDGVPLQAFVVVVERQLVGVTIIRDEQDVEYLRARYDIDSFISFGRHGYQEHAHMLHFLLKPCCYHVTRHWLKEVLRLAQRSCLYHRAYSPLLGEQTSCFHPLEFILNCSVPVRPRQQVEYPLQELGINAPSCRITEEQAPFALSLISRKLTLEPKVRVNASIVVVGASDTGLSLLEELSFSSHLRFNNLTLISTHGFPGNYDHEDVGFLSTSHVFSSRDLAQTFLLSCTRVVEGKIVRIDRKSKYVLVSDGQKVAYDFLVLCTGLQYRLPCPTGVDVSQPVTNSQLDPDWFCRRYMGPVPANLLTISDLHDGVAARRWLQENFVDLQDNAVVYGNTLDAYVTVQTLLSLGVQGSRIHLVLPPPAIRPAPFSDRAVDRAVAAAMTGAEVQVHQNCVLAQINNGEHPDPIACVSFTSDSEPLRLQCGVFLNLSSEGVDYDCFHSISGCFLPFDGRLVINSRFLTSDASIYGAGPLTRFSCSYYADEWSHANFSSRDVGRDVAAVLLEQLDPNREAPVDPPSEPEMLIPLYSRPRIRGATLPGGFHFLHVTKPSPSLQTSRRFQLVAPQDEVMVTGAAQSGDYFRLQLSALQLVESLTCLCLKPLPVGNYLSLFGRHQELLGQLLDRYRLGLVPDLYSFFTQRGCLPIFHDRFPDLHQRALQLLTHRLKVVSSLLRMMMEAFIFLLLLGLVEKEK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	Q	35	Very low	31.4	Very low	251 Å²	251	162.5 Å²	162.5	100%	1.173	82%	0.824	S	S	*	*				0	26.2	0	-161.7	167	-11.9	0	0	111.2
2	E	26.9	Very low	32.8	Very low	197 Å²	197	160.8 Å²	160.8	92%	0.921	81%	0.81	S	S	*	*			trans	-125.1	92	176.4	-68.8	175.5	121.8	0	0	107.2
3	S	24.1	Very low	35.1	Very low	120 Å²	120	157.6 Å²	157.6	84%	0.839	80%	0.797	S	S	*	*			trans	-160.4	17.8	177.8	-171.6	0	0	0	0	111.9
4	M	33.4	Very low	38.1	Very low	178 Å²	178	148.4 Å²	148.4	88%	0.877	75%	0.751	S	S	*	*			trans	-132.7	84.6	-177.1	-66.6	-175.6	81.3	0	0	109.4
5	R	28	Very low	41.1	Very low	248 Å²	248	144.5 Å²	144.5	94%	0.936	74%	0.738	S	S	*	*			trans	175.2	66.3	158.8	-97.9	159.9	-171.1	-160.4	2.3	110.5
6	S	24.5	Very low	43.9	Very low	90 Å²	90	137.9 Å²	137.9	63%	0.629	71%	0.707	S	S	*	*			trans	-115.4	97.3	152.4	58.5	0	0	0	0	107.1	W8	S6-W8 PolarHBondContact O-N 3.34Å; S6-W8 VanDerWaalsContact O-N 3.12Å
7	T	28.7	Very low	46.6	Very low	139 Å²	139	134.1 Å²	134.1	85%	0.853	68%	0.681	S	S	*	*			trans	-72.1	98.1	173.1	41.5	0	0	0	0	108.7
8	W	26.8	Very low	48.9	Very low	211 Å²	211	130.2 Å²	130.2	80%	0.799	66%	0.657	S	S	*	*			trans	-84.1	121.7	170	-72.1	43.3	0	0	0	107.7	S6 T10	S6-W8 PolarHBondContact O-N 3.34Å; S6-W8 VanDerWaalsContact O-N 3.12Å; W8-T10 HydrophobicContact CB-CG2 4.49Å; W8-T10 PolarHBondContact O-N 3.07Å; W8-T10 VanDerWaalsContact O-N 3.15Å
9	S	33.7	Very low	51	Low	93 Å²	93	124.6 Å²	124.6	65%	0.65	63%	0.631	S	S	*	*			trans	-77.3	90.3	176.2	42.7	0	0	0	0	110.4	E11	S9-E11 PolarHBondContact O-N 3.12Å
10	T	38.9	Very low	52.8	Low	116 Å²	116	126.8 Å²	126.8	71%	0.712	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	48.6	-172.4	51.9	0	0	0	0	114.4	W8	W8-T10 HydrophobicContact CB-CG2 4.49Å; W8-T10 PolarHBondContact O-N 3.07Å; W8-T10 VanDerWaalsContact O-N 3.15Å
11	E	44.9	Very low	54.2	Low	144 Å²	144	125.6 Å²	125.6	67%	0.673	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	-15.8	177	-63.7	-162.1	114.1	0	0	114	S9	S9-E11 PolarHBondContact O-N 3.12Å
12	E	48.8	Very low	56.6	Low	142 Å²	142	117 Å²	117	66%	0.664	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	126.6	-165.7	-62	-175.8	152.4	0	0	113.5	Q60	E12-Q60 PolarHBondContact O-NE2 3.44Å; E12-Q60 VanDerWaalsContact O-NE2 3.1Å
13	N	62.8	Low	59.5	Low	120 Å²	120	108 Å²	108	64%	0.642	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.7	42.9	171.5	-56	-21.5	0	0	0	117.6	Q60	N13-Q60 HydrophobicContact CB-CG 4.24Å
14	L	76.7	Confident	62.6	Low	29 Å²	29	102.4 Å²	102.4	15%	0.152	53%	0.526	C	S	.	.			trans	-85.2	121.9	153.5	-65.9	179.4	0	0	0	110.5	V57 V65 V117 K124	L14-V57 HydrophobicContact CB-CG1 3.95Å; L14-V57 HydrophobicContact CD2-CG1 4.17Å; L14-V57 HydrophobicContact CG-CG1 4.45Å; L14-V65 HydrophobicContact CD2-CG2 3.93Å; L14-V117 HydrophobicContact CD1-CB 4.2Å; L14-V117 HydrophobicContact CD1-CG1 4.31Å; L14-K124 HydrophobicContact CB-CD 4.45Å
15	T	83.4	Confident	65.3	Low	90 Å²	90	103 Å²	103	55%	0.552	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108	137.4	178.5	58.8	0	0	0	0	111.7	V57 G58	T15-V57 CarbonylContact O-C 3.58Å; T15-V57 VanDerWaalsContact O-CA 3.31Å; T15-V57 WeakPolarHBondContact O-CA 3.18Å; T15-G58 PolarHBondContact N-O 2.8Å; T15-G58 PolarHBondContact O-N 2.92Å
16	V	86.1	Confident	68.1	Low	39 Å²	39	96 Å²	96	24%	0.236	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133.5	175.4	-168.5	0	0	0	0	109.6	L55 V57 K124 I125 T128	V16-L55 HydrophobicContact CG1-CB 4.28Å; V16-L55 HydrophobicContact CG1-CD1 4.49Å; V16-L55 HydrophobicContact CG1-CD2 4.46Å; V16-V57 HydrophobicContact CG2-CG2 4.32Å; V16-K124 HydrophobicContact CG2-CB 3.72Å; V16-I125 HydrophobicContact CG1-CG1 4.47Å; V16-T128 HydrophobicContact CB-CG2 4.5Å; V16-T128 HydrophobicContact CG1-CG2 3.96Å
17	R	89.1	Confident	71.3	Confident	73 Å²	73	91.7 Å²	91.7	28%	0.275	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	168.1	174.2	58.7	170.6	179.6	76.9	-2.8	111.6	D23 L55 T56	R17-D23 IonicContact CZ-OD1 3.82Å; R17-D23 IonicContact CZ-OD2 3.73Å; R17-D23 IonicContact NH1-OD1 2.73Å; R17-D23 PolarHBondContact NH1-OD1 3.45Å; R17-D23 IonicContact NH1-OD2 3.86Å; R17-D23 PolarHBondContact NH1-OD2 3.46Å; R17-D23 IonicContact NH2-OD1 2.86Å; R17-D23 PolarHBondContact NH2-OD1 3.44Å; R17-D23 IonicContact NH2-OD2 3.01Å; R17-D23 PolarHBondContact NH2-OD2 3.38Å; R17-L55 WeakPolarHBondContact O-CA 3.4Å; R17-T56 PolarHBondContact N-O 2.72Å; R17-T56 PolarHBondContact O-N 2.99Å
18	R	87.9	Confident	74.3	Confident	63 Å²	63	91.1 Å²	91.1	24%	0.238	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	144.4	165.8	-72.8	-172.7	177.8	-121.9	-14	110.6	L55 L661 E662	R18-L55 HydrophobicContact CG-CD2 4.47Å; R18-L661 PolarHBondContact NH2-O 3.15Å; R18-E662 VanDerWaalsContact CD-OE2 3.25Å; R18-E662 WeakPolarHBondContact CD-OE2 3.17Å; R18-E662 IonicContact CZ-OE2 3Å; R18-E662 IonicContact NE-OE2 2.66Å; R18-E662 IonicContact NH1-OE2 2.68Å; R18-E662 PolarHBondContact NH1-OE2 2.84Å
19	S	89.8	Confident	77.3	Confident	24 Å²	24	87.7 Å²	87.7	17%	0.168	44%	0.44	C	S	.	.			trans	-67.4	142.8	174.8	-57.1	0	0	0	0	110.9	D23 L48 S54 L55 T56 H67	S19-D23 WeakPolarHBondContact CA-OD2 3.34Å; S19-L48 VanDerWaalsContact CB-CD2 3.46Å; S19-S54 PolarHBondContact N-O 2.99Å; S19-S54 VanDerWaalsContact OG-CB 3.32Å; S19-S54 WeakPolarHBondContact OG-CB 3.45Å; S19-S54 PolarHBondContact OG-O 3.38Å; S19-L55 PolarHBondContact OG-N 3.31Å; S19-T56 PolarHBondContact OG-OG1 3.21Å; S19-H67 PolarHBondContact OG-CE1 3.12Å; S19-H67 VanDerWaalsContact OG-CE1 3.25Å; S19-H67 PolarHBondContact OG-ND1 2.68Å
20	R	86.6	Confident	79.9	Confident	169 Å²	169	85 Å²	85	64%	0.638	42%	0.419	S	S	*	.			trans	-112.9	153.9	173.1	-64.5	176.9	176.9	173.1	-0.7	109.1	A22 D23	R20-A22 PolarHBondContact O-N 2.94Å; R20-A22 VanDerWaalsContact O-N 3.1Å; R20-D23 PolarHBondContact N-OD2 2.91Å; R20-D23 VanDerWaalsContact O-CB 3.26Å; R20-D23 WeakPolarHBondContact O-CB 3.44Å; R20-D23 PolarHBondContact O-N 3.16Å
21	S	83.2	Confident	82.3	Confident	101 Å²	101	81.1 Å²	81.1	71%	0.706	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-57	-27.3	176.1	54.4	0	0	0	0	113.4	D23 A24	S21-D23 VanDerWaalsContact C-N 3.33Å; S21-D23 PolarHBondContact O-N 3.24Å; S21-A24 WeakPolarHBondContact O-CB 3.47Å; S21-A24 PolarHBondContact O-N 3.35Å
22	A	83.8	Confident	84.2	Confident	70 Å²	70	75.6 Å²	75.6	58%	0.579	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-65.2	-29.6	172.3	0	0	0	0	0	114	R20 A24	R20-A22 PolarHBondContact O-N 2.94Å; R20-A22 VanDerWaalsContact O-N 3.1Å; A22-A24 PolarHBondContact O-N 3.48Å
23	D	88.8	Confident	85.7	Confident	9 Å²	9	73.9 Å²	73.9	5%	0.048	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-67.5	-22.5	-178.6	-58.8	-21.9	0	0	0	111.9	R17 S19 R20 S21 R25 W26 I27 T56 V64	R17-D23 IonicContact CZ-OD1 3.82Å; R17-D23 IonicContact CZ-OD2 3.73Å; R17-D23 IonicContact NH1-OD1 2.73Å; R17-D23 PolarHBondContact NH1-OD1 3.45Å; R17-D23 IonicContact NH1-OD2 3.86Å; R17-D23 PolarHBondContact NH1-OD2 3.46Å; R17-D23 IonicContact NH2-OD1 2.86Å; R17-D23 PolarHBondContact NH2-OD1 3.44Å; R17-D23 IonicContact NH2-OD2 3.01Å; R17-D23 PolarHBondContact NH2-OD2 3.38Å; S19-D23 WeakPolarHBondContact CA-OD2 3.34Å; R20-D23 PolarHBondContact N-OD2 2.91Å; R20-D23 VanDerWaalsContact O-CB 3.26Å; R20-D23 WeakPolarHBondContact O-CB 3.44Å; R20-D23 PolarHBondContact O-N 3.16Å; S21-D23 VanDerWaalsContact C-N 3.33Å; S21-D23 PolarHBondContact O-N 3.24Å; D23-R25 PolarHBondContact O-N 3.18Å; D23-R25 VanDerWaalsContact O-N 3.09Å; D23-W26 WeakPolarHBondContact O-CA 3.33Å; D23-W26 WeakPolarHBondContact O-CB 3.36Å; D23-W26 PolarHBondContact O-N 3.41Å; D23-I27 HydrophobicContact CB-CD1 3.78Å; D23-I27 HydrophobicContact CB-CG1 4.38Å; D23-I27 WeakPolarHBondContact O-CG1 3.14Å; D23-I27 PolarHBondContact O-N 3.12Å; D23-T56 PolarHBondContact OD2-OG1 2.95Å; D23-V64 HydrophobicContact CB-CG2 4.17Å
24	A	88.8	Confident	86.5	Confident	3 Å²	3	71 Å²	71	3%	0.025	37%	0.368	C	S	.	.	H	α-helix	trans	-53.1	-35.7	-176.3	0	0	0	0	0	113.4	S21 A22 W26 Q28 V44 L48	S21-A24 WeakPolarHBondContact O-CB 3.47Å; S21-A24 PolarHBondContact O-N 3.35Å; A22-A24 PolarHBondContact O-N 3.48Å; A24-W26 VanDerWaalsContact C-N 3.27Å; A24-W26 PolarHBondContact O-N 3.18Å; A24-Q28 WeakPolarHBondContact O-CB 3.48Å; A24-Q28 PolarHBondContact O-N 3.46Å; A24-V44 HydrophobicContact CB-CG1 3.95Å; A24-L48 HydrophobicContact CB-CD1 3.91Å
25	R	89.3	Confident	86.8	Confident	191 Å²	191	70.8 Å²	70.8	72%	0.721	37%	0.367	S	S	*	.	H	α-helix	trans	-69	-20.7	177.2	-75.7	-176.4	172.8	174	-0.8	114	D23 K29	D23-R25 PolarHBondContact O-N 3.18Å; D23-R25 VanDerWaalsContact O-N 3.09Å; R25-K29 WeakPolarHBondContact O-CE 3.38Å; R25-K29 WeakPolarHBondContact O-CG 3.4Å
26	W	88.6	Confident	86.8	Confident	100 Å²	100	70.9 Å²	70.9	38%	0.379	36%	0.361	S	S	.	.	H	α-helix	trans	-95.4	-45.4	177.5	-61.5	99.5	0	0	0	110.9	D23 A24 Q28 K29 L30 D63 V64	D23-W26 WeakPolarHBondContact O-CA 3.33Å; D23-W26 WeakPolarHBondContact O-CB 3.36Å; D23-W26 PolarHBondContact O-N 3.41Å; A24-W26 VanDerWaalsContact C-N 3.27Å; A24-W26 PolarHBondContact O-N 3.18Å; W26-Q28 PolarHBondContact O-N 3.23Å; W26-K29 HydrophobicContact CE3-CD 4.08Å; W26-K29 WeakPolarHBondContact O-CA 3.31Å; W26-K29 WeakPolarHBondContact O-CB 3.35Å; W26-K29 PolarHBondContact O-N 2.84Å; W26-L30 PolarHBondContact O-N 3.13Å; W26-D63 WeakPolarHBondContact CH2-OD1 3.4Å; W26-D63 WeakPolarHBondContact CZ2-OD1 3.36Å; W26-D63 WeakPolarHBondContact CZ3-OD1 3.34Å; W26-V64 HydrophobicContact CB-CB 3.72Å; W26-V64 HydrophobicContact CB-CG1 4.46Å; W26-V64 HydrophobicContact CB-CG2 4Å; W26-V64 HydrophobicContact CG-CB 4.38Å; W26-V64 HydrophobicContact CG-CG2 4.34Å
27	I	90.9	Very high	86.5	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-53.4	-42.9	172.8	-61.8	162.7	0	0	0	110.2	D23 K29 L30 I31 V44 L48 V64 H67 L110 V112	D23-I27 HydrophobicContact CB-CD1 3.78Å; D23-I27 HydrophobicContact CB-CG1 4.38Å; D23-I27 WeakPolarHBondContact O-CG1 3.14Å; D23-I27 PolarHBondContact O-N 3.12Å; I27-K29 PolarHBondContact O-N 2.66Å; I27-L30 PolarHBondContact O-N 2.91Å; I27-I31 PolarHBondContact O-N 3.2Å; I27-V44 HydrophobicContact CB-CG1 3.95Å; I27-V44 HydrophobicContact CD1-CG1 4.31Å; I27-V44 HydrophobicContact CG2-CG1 3.71Å; I27-V44 HydrophobicContact CG2-CG2 4.13Å; I27-L48 HydrophobicContact CD1-CD1 4.08Å; I27-L48 HydrophobicContact CD1-CD2 4.34Å; I27-V64 HydrophobicContact CG1-CG1 4.26Å; I27-H67 HydrophobicContact CD1-CB 4.2Å; I27-H67 WeakPolarHBondContact CD1-ND1 3.46Å; I27-H67 HydrophobicContact CG1-CB 3.83Å; I27-H67 HydrophobicContact CG2-CB 4.36Å; I27-L110 HydrophobicContact CG2-CD2 4.21Å; I27-V112 HydrophobicContact CG2-CG2 4.08Å
28	Q	91.2	Very high	86.1	Confident	126 Å²	126	68.3 Å²	68.3	59%	0.589	36%	0.359	S	S	*	.	H	α-helix	trans	-67.6	-14.8	177.3	-168.7	170.5	8	0	0	114.6	A24 W26 V44	A24-Q28 WeakPolarHBondContact O-CB 3.48Å; A24-Q28 PolarHBondContact O-N 3.46Å; W26-Q28 PolarHBondContact O-N 3.23Å; Q28-V44 HydrophobicContact CB-CG2 4.29Å
29	K	89.6	Confident	85.9	Confident	139 Å²	139	66.2 Å²	66.2	60%	0.604	35%	0.351	S	S	*	.	H	α-helix	trans	-84.1	-26.2	170	-61.3	170.8	-172.8	173.8	0	112.6	R25 W26 I27	R25-K29 WeakPolarHBondContact O-CE 3.38Å; R25-K29 WeakPolarHBondContact O-CG 3.4Å; W26-K29 HydrophobicContact CE3-CD 4.08Å; W26-K29 WeakPolarHBondContact O-CA 3.31Å; W26-K29 WeakPolarHBondContact O-CB 3.35Å; W26-K29 PolarHBondContact O-N 2.84Å; I27-K29 PolarHBondContact O-N 2.66Å
30	L	89	Confident	85.5	Confident	37 Å²	37	66.2 Å²	66.2	19%	0.194	36%	0.355	C	S	.	.	H	α-helix	trans	-81.3	-22.3	-178.2	-63.8	175.4	0	0	0	112.6	W26 I27 G32 V64 V112 E114	W26-L30 PolarHBondContact O-N 3.13Å; I27-L30 PolarHBondContact O-N 2.91Å; L30-G32 PolarHBondContact O-N 2.89Å; L30-G32 VanDerWaalsContact O-N 3.11Å; L30-V64 HydrophobicContact CD1-CG1 4.25Å; L30-V112 HydrophobicContact CB-CB 3.91Å; L30-V112 HydrophobicContact CB-CG2 3.93Å; L30-V112 HydrophobicContact CD1-CG2 4.27Å; L30-E114 HydrophobicContact CD2-CG 4.07Å
31	I	89.1	Confident	85.3	Confident	35 Å²	35	69.5 Å²	69.5	18%	0.179	37%	0.367	C	S	.	.			trans	-66	108.1	179.4	-65.1	168.3	0	0	0	110.9	I27 D35 Q36 V44 L110 V112	I27-I31 PolarHBondContact O-N 3.2Å; I31-D35 WeakPolarHBondContact CA-OD2 3.21Å; I31-Q36 HydrophobicContact CG2-CG 3.79Å; I31-V44 HydrophobicContact CD1-CG2 3.52Å; I31-L110 HydrophobicContact CD1-CD2 4.38Å; I31-V112 HydrophobicContact CB-CG1 4.44Å; I31-V112 HydrophobicContact CG1-CG1 3.72Å
32	G	84.9	Confident	85.3	Confident	27 Å²	27	67.1 Å²	67.1	28%	0.278	35%	0.346	S	S	.	.			trans	-83.3	-175	170.7	0	0	0	0	0	113.9	L30 D35 Q36	L30-G32 PolarHBondContact O-N 2.89Å; L30-G32 VanDerWaalsContact O-N 3.11Å; G32-D35 PolarHBondContact N-OD2 2.68Å; G32-Q36 PolarHBondContact O-NE2 3.33Å
33	S	80.1	Confident	85.5	Confident	107 Å²	107	66.6 Å²	66.6	75%	0.748	33%	0.334	S	S	*	.	H	α-helix	trans	-80.6	-25.6	174.4	48.5	0	0	0	0	113.4	A37	S33-A37 PolarHBondContact O-N 3.46Å
34	S	79.6	Confident	85.5	Confident	59 Å²	59	66.3 Å²	66.3	41%	0.413	33%	0.332	S	S	.	.	H	α-helix	trans	-57.2	-50.8	168.2	36.4	0	0	0	0	111.2	Q36 A37 V38	S34-Q36 VanDerWaalsContact C-N 3.29Å; S34-Q36 PolarHBondContact O-N 3.48Å; S34-A37 WeakPolarHBondContact O-CA 3.41Å; S34-A37 VanDerWaalsContact O-CB 3.3Å; S34-A37 WeakPolarHBondContact O-CB 3.38Å; S34-A37 PolarHBondContact O-N 2.91Å; S34-V38 PolarHBondContact O-N 3.1Å; S34-V38 VanDerWaalsContact O-N 3.16Å
35	D	83.5	Confident	85.5	Confident	24 Å²	24	67.8 Å²	67.8	13%	0.128	34%	0.339	C	S	.	.	H	α-helix	trans	-72.3	-31.6	-168.6	-29.5	-24.9	0	0	0	109.9	I31 G32 A37 V38 F39 V112	I31-D35 WeakPolarHBondContact CA-OD2 3.21Å; G32-D35 PolarHBondContact N-OD2 2.68Å; D35-A37 VanDerWaalsContact C-N 3.29Å; D35-A37 PolarHBondContact O-N 2.61Å; D35-V38 PolarHBondContact O-N 2.93Å; D35-F39 HydrophobicContact CB-CD2 4.31Å; D35-F39 WeakPolarHBondContact O-CB 3.45Å; D35-F39 WeakPolarHBondContact O-CD2 3.36Å; D35-F39 PolarHBondContact O-N 2.82Å; D35-V112 HydrophobicContact CB-CG1 4.39Å
36	Q	82.8	Confident	85.4	Confident	93 Å²	93	61.3 Å²	61.3	44%	0.435	32%	0.319	S	S	.	.	H	α-helix	trans	-70.3	-20.2	170.6	-69.5	-179.9	47	0	0	113.9	I31 G32 S34 G40	I31-Q36 HydrophobicContact CG2-CG 3.79Å; G32-Q36 PolarHBondContact O-NE2 3.33Å; S34-Q36 VanDerWaalsContact C-N 3.29Å; S34-Q36 PolarHBondContact O-N 3.48Å; Q36-G40 CarbonylContact O-C 3.58Å; Q36-G40 WeakPolarHBondContact O-CA 3.42Å; Q36-G40 PolarHBondContact O-N 3.07Å
37	A	79.6	Confident	85.4	Confident	49 Å²	49	57.6 Å²	57.6	41%	0.405	31%	0.307	S	S	.	.	H	α-helix	trans	-79.5	-39.4	171.3	0	0	0	0	0	111.4	S33 S34 D35	S33-A37 PolarHBondContact O-N 3.46Å; S34-A37 WeakPolarHBondContact O-CA 3.41Å; S34-A37 VanDerWaalsContact O-CB 3.3Å; S34-A37 WeakPolarHBondContact O-CB 3.38Å; S34-A37 PolarHBondContact O-N 2.91Å; D35-A37 VanDerWaalsContact C-N 3.29Å; D35-A37 PolarHBondContact O-N 2.61Å
38	V	80.4	Confident	85.4	Confident	9 Å²	9	58.7 Å²	58.7	6%	0.055	31%	0.313	C	S	.	.	H	α-helix	trans	-74.7	-52.5	179.2	176.6	0	0	0	0	112.1	S34 D35 P148 L149	S34-V38 PolarHBondContact O-N 3.1Å; S34-V38 VanDerWaalsContact O-N 3.16Å; D35-V38 PolarHBondContact O-N 2.93Å; V38-P148 WeakPolarHBondContact CG2-O 3.45Å; V38-L149 HydrophobicContact CB-CD2 4.5Å; V38-L149 HydrophobicContact CG1-CD2 3.69Å; V38-L149 HydrophobicContact CG2-CD2 3.91Å; V38-L149 HydrophobicContact CG2-CG 4.31Å
39	F	84.3	Confident	85.3	Confident	19 Å²	19	53.3 Å²	53.3	8%	0.083	29%	0.287	C	S	.	.	S	Bend	trans	-103.1	-6.8	-171.1	-56.7	-71.2	0	0	0	113.8	D35 I42 L108 H109 L110 F111 L141 L153	D35-F39 HydrophobicContact CB-CD2 4.31Å; D35-F39 WeakPolarHBondContact O-CB 3.45Å; D35-F39 WeakPolarHBondContact O-CD2 3.36Å; D35-F39 PolarHBondContact O-N 2.82Å; F39-I42 HydrophobicContact CB-CD1 3.64Å; F39-L108 HydrophobicContact CE1-CD2 4.36Å; F39-L108 HydrophobicContact CE1-CG 4.11Å; F39-L108 HydrophobicContact CZ-CD2 4.26Å; F39-L108 HydrophobicContact CZ-CG 4.39Å; F39-H109 VanDerWaalsContact CD1-O 3.23Å; F39-H109 WeakPolarHBondContact CD1-O 3.3Å; F39-L110 HydrophobicContact CB-CD1 4.46Å; F39-L110 HydrophobicContact CD2-CD1 3.94Å; F39-L110 HydrophobicContact CG-CD1 4.33Å; F39-F111 HydrophobicContact CE2-CB 4.4Å; F39-F111 HydrophobicContact CZ-CB 4.17Å; F39-L141 HydrophobicContact CE1-CD1 3.8Å; F39-L141 HydrophobicContact CZ-CD1 4.37Å; F39-L153 HydrophobicContact CZ-CD1 4.28Å
40	G	82.6	Confident	85.2	Confident	24 Å²	24	49 Å²	49	25%	0.247	27%	0.269	C	S	.	.			trans	79.5	-167	-179.4	0	0	0	0	0	114.6	Q36 I42	Q36-G40 CarbonylContact O-C 3.58Å; Q36-G40 WeakPolarHBondContact O-CA 3.42Å; Q36-G40 PolarHBondContact O-N 3.07Å; G40-I42 PolarHBondContact O-N 3.23Å
41	R	81.5	Confident	85.3	Confident	238 Å²	238	47.5 Å²	47.5	90%	0.898	26%	0.261	S	S	*	.	S	Bend	trans	-82.8	97.5	179	-72.6	-174.6	178.2	177.2	1.4	111.2
42	I	83.6	Confident	85.4	Confident	51 Å²	51	45.9 Å²	45.9	26%	0.262	25%	0.253	S	S	.	.			trans	-98.8	130.8	-177	-71	171.5	0	0	0	111.8	F39 G40 L47 H109 L110	F39-I42 HydrophobicContact CB-CD1 3.64Å; G40-I42 PolarHBondContact O-N 3.23Å; I42-L47 HydrophobicContact CG2-CB 4.12Å; I42-L47 HydrophobicContact CG2-CD2 3.98Å; I42-H109 WeakPolarHBondContact CD1-O 3.42Å; I42-L110 HydrophobicContact CD1-CB 4.24Å; I42-L110 HydrophobicContact CD1-CD1 4.19Å
43	N	87.3	Confident	85.7	Confident	59 Å²	59	44.7 Å²	44.7	32%	0.316	24%	0.24	S	C	.	.			trans	-86.4	105	159.8	176.9	7.9	0	0	0	109.3	N45 D46 L47 R554	N43-N45 PolarHBondContact O-N 3.3Å; N43-N45 WeakPolarHBondContact OD1-CB 3.42Å; N43-N45 PolarHBondContact OD1-N 3.06Å; N43-N45 VanDerWaalsContact OD1-N 3.1Å; N43-N45 PolarHBondContact OD1-ND2 2.75Å; N43-D46 HydrophobicContact CB-CB 4.38Å; N43-D46 PolarHBondContact ND2-OD1 2.9Å; N43-D46 PolarHBondContact ND2-OD2 2.86Å; N43-D46 PolarHBondContact O-N 2.73Å; N43-L47 PolarHBondContact O-N 3.2Å; N43-L47 VanDerWaalsContact O-N 3.1Å; N43-R554 PolarHBondContact ND2-NH1 3.47Å
44	V	89.4	Confident	86.4	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-50.8	-33.8	-179.5	-178.8	0	0	0	0	112.9	A24 I27 Q28 I31 L48	A24-V44 HydrophobicContact CB-CG1 3.95Å; I27-V44 HydrophobicContact CB-CG1 3.95Å; I27-V44 HydrophobicContact CD1-CG1 4.31Å; I27-V44 HydrophobicContact CG2-CG1 3.71Å; I27-V44 HydrophobicContact CG2-CG2 4.13Å; Q28-V44 HydrophobicContact CB-CG2 4.29Å; I31-V44 HydrophobicContact CD1-CG2 3.52Å; V44-L48 HydrophobicContact CG1-CD1 3.93Å; V44-L48 HydrophobicContact CG1-CG 4.23Å; V44-L48 WeakPolarHBondContact O-CB 3.45Å; V44-L48 VanDerWaalsContact O-CG 3.25Å; V44-L48 WeakPolarHBondContact O-CG 3.28Å; V44-L48 PolarHBondContact O-N 3.18Å
45	N	88.8	Confident	87.1	Confident	34 Å²	34	37.6 Å²	37.6	18%	0.182	19%	0.19	C	C	.	.	H	α-helix	trans	-70.8	-35.4	-178.9	-51.8	-94.3	0	0	0	112.4	N43 E49 K1201	N43-N45 PolarHBondContact O-N 3.3Å; N43-N45 WeakPolarHBondContact OD1-CB 3.42Å; N43-N45 PolarHBondContact OD1-N 3.06Å; N43-N45 VanDerWaalsContact OD1-N 3.1Å; N43-N45 PolarHBondContact OD1-ND2 2.75Å; N45-E49 WeakPolarHBondContact O-CB 3.5Å; N45-E49 PolarHBondContact O-N 2.88Å; N45-K1201 VanDerWaalsContact CG-NZ 3.3Å; N45-K1201 PolarHBondContact OD1-NZ 3.32Å
46	D	87.1	Confident	87.6	Confident	56 Å²	56	36.4 Å²	36.4	30%	0.299	18%	0.184	S	C	.	.	H	α-helix	trans	-78.9	-35.6	179.8	-56.2	-14.3	0	0	0	109.9	N43 E49 K50 R554	N43-D46 HydrophobicContact CB-CB 4.38Å; N43-D46 PolarHBondContact ND2-OD1 2.9Å; N43-D46 PolarHBondContact ND2-OD2 2.86Å; N43-D46 PolarHBondContact O-N 2.73Å; D46-E49 PolarHBondContact O-N 3.38Å; D46-K50 WeakPolarHBondContact O-CB 3.47Å; D46-K50 PolarHBondContact O-N 3.41Å; D46-R554 WeakPolarHBondContact OD1-CD 3.3Å; D46-R554 IonicContact OD1-CZ 3.07Å; D46-R554 IonicContact OD1-NE 2.72Å; D46-R554 PolarHBondContact OD1-NE 2.84Å; D46-R554 IonicContact OD1-NH1 3.39Å; D46-R554 PolarHBondContact OD1-NH1 2.85Å; D46-R554 IonicContact OD2-NH1 2.75Å
47	L	89	Confident	88	Confident	21 Å²	21	32 Å²	32	11%	0.11	16%	0.164	C	C	.	.	H	α-helix	trans	-60.1	-53.6	173.2	-174.9	73.9	0	0	0	111.4	I42 N43 E49 K50 A51 H109 L110	I42-L47 HydrophobicContact CG2-CB 4.12Å; I42-L47 HydrophobicContact CG2-CD2 3.98Å; N43-L47 PolarHBondContact O-N 3.2Å; N43-L47 VanDerWaalsContact O-N 3.1Å; L47-E49 PolarHBondContact O-N 3.16Å; L47-K50 PolarHBondContact O-N 2.71Å; L47-A51 WeakPolarHBondContact O-CB 3.29Å; L47-A51 PolarHBondContact O-N 3.41Å; L47-H109 HydrophobicContact CD1-CB 3.73Å; L47-L110 HydrophobicContact CD2-CB 3.71Å; L47-L110 HydrophobicContact CD2-CD2 3.74Å; L47-L110 HydrophobicContact CD2-CG 4.39Å
48	L	89.8	Confident	88.5	Confident	24 Å²	24	29.9 Å²	29.9	13%	0.126	15%	0.146	C	C	.	.	H	α-helix	trans	-63.2	-21.6	179.8	-71.9	177.8	0	0	0	113.8	S19 A24 I27 V44	S19-L48 VanDerWaalsContact CB-CD2 3.46Å; A24-L48 HydrophobicContact CB-CD1 3.91Å; I27-L48 HydrophobicContact CD1-CD1 4.08Å; I27-L48 HydrophobicContact CD1-CD2 4.34Å; V44-L48 HydrophobicContact CG1-CD1 3.93Å; V44-L48 HydrophobicContact CG1-CG 4.23Å; V44-L48 WeakPolarHBondContact O-CB 3.45Å; V44-L48 VanDerWaalsContact O-CG 3.25Å; V44-L48 WeakPolarHBondContact O-CG 3.28Å; V44-L48 PolarHBondContact O-N 3.18Å
49	E	89.3	Confident	88.5	Confident	13 Å²	13	30 Å²	30	6%	0.061	15%	0.15	C	C	.	.	H	α-helix	trans	-88.9	-36.7	178.5	-170.5	62.6	-126.3	0	0	112.6	N45 D46 L47 I550 S551 R554 H555 K658	N45-E49 WeakPolarHBondContact O-CB 3.5Å; N45-E49 PolarHBondContact O-N 2.88Å; D46-E49 PolarHBondContact O-N 3.38Å; L47-E49 PolarHBondContact O-N 3.16Å; E49-I550 WeakPolarHBondContact OE1-CA 3.48Å; E49-S551 VanDerWaalsContact CD-N 3.26Å; E49-S551 PolarHBondContact OE1-N 3.25Å; E49-S551 WeakPolarHBondContact OE2-CB 3.28Å; E49-S551 PolarHBondContact OE2-N 3.49Å; E49-S551 PolarHBondContact OE2-OG 2.84Å; E49-R554 HydrophobicContact CG-CB 4.37Å; E49-H555 VanDerWaalsContact CG-NE2 3.34Å; E49-H555 WeakPolarHBondContact CG-NE2 3.19Å; E49-H555 IonicContact OE1-NE2 3.68Å; E49-K658 IonicContact OE1-NZ 2.81Å; E49-K658 PolarHBondContact OE1-NZ 3.06Å; E49-K658 IonicContact OE2-NZ 3.24Å
50	K	88.2	Confident	87.8	Confident	49 Å²	49	36.7 Å²	36.7	21%	0.213	18%	0.181	C	C	.	.	H	α-helix	trans	-105.4	-12.2	-172.7	-59.4	-166.4	-176.2	-171.8	0	115.2	D46 L47 R554 E559	D46-K50 WeakPolarHBondContact O-CB 3.47Å; D46-K50 PolarHBondContact O-N 3.41Å; L47-K50 PolarHBondContact O-N 2.71Å; K50-R554 WeakPolarHBondContact CE-O 3.47Å; K50-R554 PolarHBondContact NZ-O 3.32Å; K50-E559 WeakPolarHBondContact CE-OE2 2.92Å; K50-E559 IonicContact NZ-OE1 3.43Å; K50-E559 PolarHBondContact NZ-OE1 3.23Å; K50-E559 IonicContact NZ-OE2 2.67Å; K50-E559 PolarHBondContact NZ-OE2 3.17Å
51	A	90.2	Very high	87.1	Confident	5 Å²	5	39.9 Å²	39.9	4%	0.041	20%	0.2	C	C	.	.			trans	-64.8	151.5	171.1	0	0	0	0	0	111.6	L47	L47-A51 WeakPolarHBondContact O-CB 3.29Å; L47-A51 PolarHBondContact O-N 3.41Å
52	N	91.3	Very high	86.5	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.183	C	C	.	.	S	Bend	trans	-81.1	-31.2	177.5	-57.9	85.8	0	0	0	111.6	F70 S71 D72 L661	N52-F70 PolarHBondContact N-O 3.42Å; N52-S71 WeakPolarHBondContact OD1-CA 3.44Å; N52-S71 PolarHBondContact OD1-OG 3.42Å; N52-D72 PolarHBondContact ND2-OD2 3.46Å; N52-D72 PolarHBondContact OD1-N 3.2Å; N52-D72 PolarHBondContact OD1-OD1 3.16Å; N52-D72 PolarHBondContact OD1-OD2 2.58Å; N52-L661 HydrophobicContact CB-CD1 3.67Å; N52-L661 HydrophobicContact CB-CG 4.23Å
53	L	92.4	Very high	86.5	Confident	3 Å²	3	31.5 Å²	31.5	2%	0.016	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	128.6	175.5	177.7	63.8	0	0	0	110.2	L55 F70 A129 I132 L661	L53-L55 HydrophobicContact CD1-CD2 4.03Å; L53-L55 HydrophobicContact CD1-CG 4.21Å; L53-L55 HydrophobicContact CD2-CD1 4.31Å; L53-L55 HydrophobicContact CD2-CG 4.45Å; L53-L55 HydrophobicContact CG-CG 4.19Å; L53-F70 HydrophobicContact CB-CB 4.45Å; L53-F70 HydrophobicContact CB-CD2 4.37Å; L53-F70 HydrophobicContact CD2-CD2 4.23Å; L53-F70 HydrophobicContact CG-CD2 4.21Å; L53-F70 PolarHBondContact N-O 2.85Å; L53-F70 PolarHBondContact O-N 3.09Å; L53-A129 HydrophobicContact CD2-CB 3.84Å; L53-I132 HydrophobicContact CD1-CD1 3.95Å; L53-I132 HydrophobicContact CD2-CD1 4.44Å; L53-L661 HydrophobicContact CB-CD1 4.16Å
54	S	93.9	Very high	86.6	Confident	15 Å²	15	29.1 Å²	29.1	11%	0.105	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	124.5	174.4	-67.3	0	0	0	0	109.9	S19 A68 S69	S19-S54 PolarHBondContact N-O 2.99Å; S19-S54 VanDerWaalsContact OG-CB 3.32Å; S19-S54 WeakPolarHBondContact OG-CB 3.45Å; S19-S54 PolarHBondContact OG-O 3.38Å; S54-A68 WeakPolarHBondContact CA-O 3.14Å; S54-S69 WeakPolarHBondContact CB-OG 3.35Å; S54-S69 PolarHBondContact OG-OG 3.29Å
55	L	94.1	Very high	86.6	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	141.5	-175.8	-66.1	179.1	0	0	0	111.1	V16 R17 R18 S19 L53 H67 A68 F70 I125 T128 A129 I132	V16-L55 HydrophobicContact CG1-CB 4.28Å; V16-L55 HydrophobicContact CG1-CD1 4.49Å; V16-L55 HydrophobicContact CG1-CD2 4.46Å; R17-L55 WeakPolarHBondContact O-CA 3.4Å; R18-L55 HydrophobicContact CG-CD2 4.47Å; S19-L55 PolarHBondContact OG-N 3.31Å; L53-L55 HydrophobicContact CD1-CD2 4.03Å; L53-L55 HydrophobicContact CD1-CG 4.21Å; L53-L55 HydrophobicContact CD2-CD1 4.31Å; L53-L55 HydrophobicContact CD2-CG 4.45Å; L53-L55 HydrophobicContact CG-CG 4.19Å; L55-H67 WeakPolarHBondContact O-CA 3.47Å; L55-H67 PolarHBondContact O-ND1 2.9Å; L55-A68 PolarHBondContact N-O 3.15Å; L55-A68 PolarHBondContact O-N 3.39Å; L55-F70 HydrophobicContact CD1-CE2 4.4Å; L55-I125 HydrophobicContact CB-CG1 4.45Å; L55-I125 HydrophobicContact CD1-CG2 4.31Å; L55-I125 WeakPolarHBondContact CD1-O 3.47Å; L55-T128 HydrophobicContact CD1-CG2 3.84Å; L55-T128 HydrophobicContact CD2-CG2 4.07Å; L55-A129 HydrophobicContact CD1-CB 4.08Å; L55-I132 HydrophobicContact CD2-CD1 4.01Å
56	T	93.8	Very high	86.8	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	134.6	-176	-67.2	0	0	0	0	108.8	R17 S19 D23 V64 H67	R17-T56 PolarHBondContact N-O 2.72Å; R17-T56 PolarHBondContact O-N 2.99Å; S19-T56 PolarHBondContact OG-OG1 3.21Å; D23-T56 PolarHBondContact OD2-OG1 2.95Å; T56-V64 HydrophobicContact CG2-CB 4.1Å; T56-V64 HydrophobicContact CG2-CG1 3.61Å; T56-V64 HydrophobicContact CG2-CG2 3.52Å; T56-H67 PolarHBondContact OG1-ND1 2.88Å
57	V	92.6	Very high	87.2	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	123.5	173.8	-170.6	0	0	0	0	109.4	L14 T15 V16 V65 A66 I125	L14-V57 HydrophobicContact CB-CG1 3.95Å; L14-V57 HydrophobicContact CD2-CG1 4.17Å; L14-V57 HydrophobicContact CG-CG1 4.45Å; T15-V57 CarbonylContact O-C 3.58Å; T15-V57 VanDerWaalsContact O-CA 3.31Å; T15-V57 WeakPolarHBondContact O-CA 3.18Å; V16-V57 HydrophobicContact CG2-CG2 4.32Å; V57-V65 HydrophobicContact CB-CG2 4.11Å; V57-V65 HydrophobicContact CG1-CG2 3.91Å; V57-V65 PolarHBondContact O-N 3.24Å; V57-A66 HydrophobicContact CB-CB 4.05Å; V57-A66 HydrophobicContact CG2-CB 3.97Å; V57-A66 PolarHBondContact N-O 2.9Å; V57-I125 HydrophobicContact CG2-CD1 3.81Å; V57-I125 HydrophobicContact CG2-CG1 3.83Å
58	G	88.4	Confident	87.5	Confident	4 Å²	4	24.5 Å²	24.5	4%	0.041	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.5	172.9	0	0	0	0	0	111.8	T15 D63	T15-G58 PolarHBondContact N-O 2.8Å; T15-G58 PolarHBondContact O-N 2.92Å; G58-D63 WeakPolarHBondContact CA-O 3.45Å
59	G	81.5	Confident	87.7	Confident	13 Å²	13	23.4 Å²	23.4	13%	0.134	14%	0.144	C	C	.	.			trans	-80.7	176.6	164.1	0	0	0	0	0	112.3	S61 G62 D63	G59-S61 PolarHBondContact O-N 3.1Å; G59-S61 VanDerWaalsContact O-N 3.13Å; G59-G62 PolarHBondContact O-N 3.24Å; G59-D63 PolarHBondContact N-O 2.94Å
60	Q	69.5	Low	87.9	Confident	158 Å²	158	22.9 Å²	22.9	74%	0.738	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-21.3	-175.1	-63	-179.9	-0.9	0	0	114.4	E12 N13	E12-Q60 PolarHBondContact O-NE2 3.44Å; E12-Q60 VanDerWaalsContact O-NE2 3.1Å; N13-Q60 HydrophobicContact CB-CG 4.24Å
61	S	67.3	Low	88.1	Confident	92 Å²	92	20.9 Å²	20.9	64%	0.643	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-6	173.7	52.5	0	0	0	0	114.3	G59 D63	G59-S61 PolarHBondContact O-N 3.1Å; G59-S61 VanDerWaalsContact O-N 3.13Å; S61-D63 VanDerWaalsContact C-N 3.27Å; S61-D63 VanDerWaalsContact CB-OD2 3.28Å; S61-D63 WeakPolarHBondContact CB-OD2 3.48Å; S61-D63 WeakPolarHBondContact OG-CB 3.4Å; S61-D63 PolarHBondContact OG-N 3.49Å; S61-D63 PolarHBondContact OG-OD2 2.8Å
62	G	70.1	Confident	88	Confident	53 Å²	53	20.6 Å²	20.6	55%	0.546	13%	0.131	S	C	.	.	S	Bend	trans	83.1	-4.2	-168.5	0	0	0	0	0	114.6	G59	G59-G62 PolarHBondContact O-N 3.24Å
63	D	82.4	Confident	87.8	Confident	60 Å²	60	21.7 Å²	21.7	32%	0.321	14%	0.137	S	C	.	.			trans	-66.6	151.4	174.1	-65.2	-57.9	0	0	0	111.8	W26 G58 G59 S61	W26-D63 WeakPolarHBondContact CH2-OD1 3.4Å; W26-D63 WeakPolarHBondContact CZ2-OD1 3.36Å; W26-D63 WeakPolarHBondContact CZ3-OD1 3.34Å; G58-D63 WeakPolarHBondContact CA-O 3.45Å; G59-D63 PolarHBondContact N-O 2.94Å; S61-D63 VanDerWaalsContact C-N 3.27Å; S61-D63 VanDerWaalsContact CB-OD2 3.28Å; S61-D63 WeakPolarHBondContact CB-OD2 3.48Å; S61-D63 WeakPolarHBondContact OG-CB 3.4Å; S61-D63 PolarHBondContact OG-N 3.49Å; S61-D63 PolarHBondContact OG-OD2 2.8Å
64	V	88.8	Confident	87.4	Confident	8 Å²	8	21.6 Å²	21.6	5%	0.048	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	116.2	178.3	174.6	0	0	0	0	110.2	D23 W26 I27 L30 T56	D23-V64 HydrophobicContact CB-CG2 4.17Å; W26-V64 HydrophobicContact CB-CB 3.72Å; W26-V64 HydrophobicContact CB-CG1 4.46Å; W26-V64 HydrophobicContact CB-CG2 4Å; W26-V64 HydrophobicContact CG-CB 4.38Å; W26-V64 HydrophobicContact CG-CG2 4.34Å; I27-V64 HydrophobicContact CG1-CG1 4.26Å; L30-V64 HydrophobicContact CD1-CG1 4.25Å; T56-V64 HydrophobicContact CG2-CB 4.1Å; T56-V64 HydrophobicContact CG2-CG1 3.61Å; T56-V64 HydrophobicContact CG2-CG2 3.52Å
65	V	91.2	Very high	86.8	Confident	17 Å²	17	21.5 Å²	21.5	10%	0.103	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-20.4	-179.9	-60.6	0	0	0	0	113.6	L14 V57 S113 E114 V117	L14-V65 HydrophobicContact CD2-CG2 3.93Å; V57-V65 HydrophobicContact CB-CG2 4.11Å; V57-V65 HydrophobicContact CG1-CG2 3.91Å; V57-V65 PolarHBondContact O-N 3.24Å; V65-S113 CarbonylContact O-C 3.49Å; V65-S113 WeakPolarHBondContact O-CA 3.49Å; V65-E114 PolarHBondContact O-N 3.25Å; V65-V117 HydrophobicContact CB-CG2 4.27Å; V65-V117 HydrophobicContact CG2-CG2 4.25Å
66	A	92.6	Very high	85.6	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	158	173.7	0	0	0	0	0	112	V57 V112	V57-A66 HydrophobicContact CB-CB 4.05Å; V57-A66 HydrophobicContact CG2-CB 3.97Å; V57-A66 PolarHBondContact N-O 2.9Å; A66-V112 CarbonylContact C-O 3.41Å; A66-V112 VanDerWaalsContact CA-O 3.3Å; A66-V112 WeakPolarHBondContact CA-O 3.47Å
67	H	94.9	Very high	84.1	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	145.6	-179.4	169.9	78	0	0	0	112	S19 I27 L55 T56 S69 F111 V112	S19-H67 PolarHBondContact OG-CE1 3.12Å; S19-H67 VanDerWaalsContact OG-CE1 3.25Å; S19-H67 PolarHBondContact OG-ND1 2.68Å; I27-H67 HydrophobicContact CD1-CB 4.2Å; I27-H67 WeakPolarHBondContact CD1-ND1 3.46Å; I27-H67 HydrophobicContact CG1-CB 3.83Å; I27-H67 HydrophobicContact CG2-CB 4.36Å; L55-H67 WeakPolarHBondContact O-CA 3.47Å; L55-H67 PolarHBondContact O-ND1 2.9Å; T56-H67 PolarHBondContact OG1-ND1 2.88Å; H67-S69 PolarHBondContact CE1-OG 3.34Å; H67-S69 PolarHBondContact NE2-OG 2.96Å; H67-F111 WeakPolarHBondContact O-CA 3.2Å; H67-V112 HydrophobicContact CB-CG2 3.95Å; H67-V112 PolarHBondContact N-O 3.33Å; H67-V112 PolarHBondContact O-N 2.73Å
68	A	95	Very high	82.7	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	148.9	167.3	0	0	0	0	0	112.2	S54 L55 F70 L108 L110 F111 I125	S54-A68 WeakPolarHBondContact CA-O 3.14Å; L55-A68 PolarHBondContact N-O 3.15Å; L55-A68 PolarHBondContact O-N 3.39Å; A68-F70 HydrophobicContact CB-CE2 3.81Å; A68-F70 HydrophobicContact CB-CZ 3.75Å; A68-L108 HydrophobicContact CB-CD1 4.19Å; A68-L110 VanDerWaalsContact CA-O 3.23Å; A68-L110 WeakPolarHBondContact CA-O 3.37Å; A68-F111 HydrophobicContact CB-CD2 4.28Å; A68-I125 HydrophobicContact CB-CD1 4.07Å; A68-I125 HydrophobicContact CB-CG2 3.64Å
69	S	94.8	Very high	81.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	138.6	172.1	-73.1	0	0	0	0	112.1	S54 H67 H109 L110	S54-S69 WeakPolarHBondContact CB-OG 3.35Å; S54-S69 PolarHBondContact OG-OG 3.29Å; H67-S69 PolarHBondContact CE1-OG 3.34Å; H67-S69 PolarHBondContact NE2-OG 2.96Å; S69-H109 PolarHBondContact O-N 3.19Å; S69-L110 PolarHBondContact N-O 2.85Å
70	F	93.9	Very high	80.3	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.009	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142	-171.9	-51.4	-85.7	0	0	0	111.6	N52 L53 L55 A68 L106 F107 L108 I125 L126 A129 V139	N52-F70 PolarHBondContact N-O 3.42Å; L53-F70 HydrophobicContact CB-CB 4.45Å; L53-F70 HydrophobicContact CB-CD2 4.37Å; L53-F70 HydrophobicContact CD2-CD2 4.23Å; L53-F70 HydrophobicContact CG-CD2 4.21Å; L53-F70 PolarHBondContact N-O 2.85Å; L53-F70 PolarHBondContact O-N 3.09Å; L55-F70 HydrophobicContact CD1-CE2 4.4Å; A68-F70 HydrophobicContact CB-CE2 3.81Å; A68-F70 HydrophobicContact CB-CZ 3.75Å; F70-L106 HydrophobicContact CB-CB 4.37Å; F70-L106 HydrophobicContact CB-CD1 4.27Å; F70-F107 CarbonylContact C-O 3.38Å; F70-F107 VanDerWaalsContact CA-O 3.25Å; F70-F107 WeakPolarHBondContact CA-O 3.05Å; F70-L108 HydrophobicContact CD1-CB 4.48Å; F70-L108 HydrophobicContact CD1-CD1 4.05Å; F70-L108 HydrophobicContact CE1-CD1 3.67Å; F70-L108 HydrophobicContact CZ-CD1 4.24Å; F70-I125 HydrophobicContact CE2-CG2 4.06Å; F70-I125 HydrophobicContact CZ-CG2 3.77Å; F70-L126 HydrophobicContact CE1-CD2 4.4Å; F70-L126 HydrophobicContact CZ-CD2 4.44Å; F70-A129 HydrophobicContact CE2-CB 4.28Å; F70-A129 HydrophobicContact CZ-CB 4.47Å; F70-V139 HydrophobicContact CD1-CG1 3.96Å; F70-V139 HydrophobicContact CE1-CG1 3.84Å
71	S	91.3	Very high	79.9	Confident	7 Å²	7	29.5 Å²	29.5	5%	0.049	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	158	178.1	-173.1	0	0	0	0	113.3	N52 L73 L106 F107	N52-S71 WeakPolarHBondContact OD1-CA 3.44Å; N52-S71 PolarHBondContact OD1-OG 3.42Å; S71-L73 VanDerWaalsContact C-N 3.26Å; S71-L73 PolarHBondContact OG-N 3.13Å; S71-L106 WeakPolarHBondContact O-CA 3.22Å; S71-L106 WeakPolarHBondContact O-CD2 3.39Å; S71-F107 PolarHBondContact N-O 2.9Å; S71-F107 PolarHBondContact O-N 3.28Å
72	D	88.6	Confident	79.6	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	19%	0.191	C	C	.	.	S	Bend	trans	-75.9	-7.4	170.2	51.8	20.3	0	0	0	114.5	N52 W87 L106 K581	N52-D72 PolarHBondContact ND2-OD2 3.46Å; N52-D72 PolarHBondContact OD1-N 3.2Å; N52-D72 PolarHBondContact OD1-OD1 3.16Å; N52-D72 PolarHBondContact OD1-OD2 2.58Å; D72-W87 PolarHBondContact O-NE1 2.68Å; D72-L106 HydrophobicContact CB-CD2 4.31Å; D72-K581 HydrophobicContact CB-CD 3.87Å; D72-K581 HydrophobicContact CB-CG 4.43Å; D72-K581 WeakPolarHBondContact OD2-CD 3.39Å; D72-K581 WeakPolarHBondContact OD2-CG 3.49Å
73	L	86.6	Confident	79.3	Confident	22 Å²	22	26 Å²	26	12%	0.115	19%	0.187	C	C	.	.	S	Bend	trans	-110.7	150.5	176.5	-73.2	175.4	0	0	0	111.6	S71 H84 F107 H109 R585	S71-L73 VanDerWaalsContact C-N 3.26Å; S71-L73 PolarHBondContact OG-N 3.13Å; L73-H84 HydrophobicContact CD2-CB 3.72Å; L73-H84 VanDerWaalsContact CD2-O 3.31Å; L73-H84 WeakPolarHBondContact CD2-O 3.47Å; L73-F107 VanDerWaalsContact O-CD2 3.22Å; L73-F107 WeakPolarHBondContact O-CD2 3.26Å; L73-H109 PolarHBondContact O-NE2 3.22Å; L73-R585 HydrophobicContact CD2-CG 3.53Å; L73-R585 HydrophobicContact CG-CG 4.02Å
74	P	84.8	Confident	78.5	Confident	2 Å²	2	26.5 Å²	26.5	1%	0.013	19%	0.187	C	C	.	.			trans	-62.4	153.8	171.6	27.4	-35	0	0	0	111.3	A78 V82 W87 F107 L142	P74-A78 HydrophobicContact CB-CB 4.45Å; P74-V82 HydrophobicContact CG-CB 4.41Å; P74-V82 HydrophobicContact CG-CG1 4.36Å; P74-W87 HydrophobicContact CG-CB 4.46Å; P74-F107 HydrophobicContact CB-CZ 4.49Å; P74-L142 HydrophobicContact CB-CD1 3.93Å
75	P	79.8	Confident	77.3	Confident	12 Å²	12	29 Å²	29	8%	0.078	20%	0.201	C	C	.	.			trans	-58	147.1	174.8	-24.3	34.7	0	0	0	112.1	A77 A78 A79	P75-A77 PolarHBondContact O-N 2.92Å; P75-A78 CarbonylContact O-C 3.5Å; P75-A78 WeakPolarHBondContact O-CA 3.17Å; P75-A78 PolarHBondContact O-N 2.73Å; P75-A79 PolarHBondContact O-N 3.37Å
76	A	69.3	Low	76.2	Confident	84 Å²	84	30.7 Å²	30.7	69%	0.694	22%	0.216	S	C	*	.	H	α-helix	trans	-57.2	-27.7	-174.7	0	0	0	0	0	114.3	A79	A76-A79 PolarHBondContact O-N 3.05Å
77	A	63.6	Low	75.8	Confident	67 Å²	67	30.8 Å²	30.8	55%	0.554	22%	0.216	S	C	*	.	H	α-helix	trans	-67.2	-34.6	173.2	0	0	0	0	0	113.2	P75	P75-A77 PolarHBondContact O-N 2.92Å
78	A	63.3	Low	75.3	Confident	10 Å²	10	32.6 Å²	32.6	8%	0.083	23%	0.225	C	C	.	.	H	α-helix	trans	-85.3	-23.2	173.9	0	0	0	0	0	112.4	P74 P75 A80 V81 V82 L142	P74-A78 HydrophobicContact CB-CB 4.45Å; P75-A78 CarbonylContact O-C 3.5Å; P75-A78 WeakPolarHBondContact O-CA 3.17Å; P75-A78 PolarHBondContact O-N 2.73Å; A78-A80 PolarHBondContact O-N 3.27Å; A78-V81 WeakPolarHBondContact O-CA 3.4Å; A78-V81 WeakPolarHBondContact O-CB 3.36Å; A78-V81 PolarHBondContact O-N 3.39Å; A78-V82 PolarHBondContact O-N 3.07Å; A78-L142 HydrophobicContact CB-CB 4.2Å; A78-L142 HydrophobicContact CB-CD1 3.95Å
79	A	60.1	Low	74.6	Confident	19 Å²	19	35.6 Å²	35.6	16%	0.157	25%	0.25	C	C	.	.	H	α-helix	trans	-66.4	-18.8	-177.9	0	0	0	0	0	114.7	P75 A76 V81 V82 H84	P75-A79 PolarHBondContact O-N 3.37Å; A76-A79 PolarHBondContact O-N 3.05Å; A79-V81 PolarHBondContact O-N 2.84Å; A79-V82 WeakPolarHBondContact CA-O 3.33Å; A79-H84 WeakPolarHBondContact CB-NE2 3.49Å
80	A	59.3	Low	73.9	Confident	97 Å²	97	37.1 Å²	37.1	80%	0.802	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-17.4	170	0	0	0	0	0	113.2	A78	A78-A80 PolarHBondContact O-N 3.27Å
81	V	59.5	Low	73.4	Confident	68 Å²	68	37.5 Å²	37.5	41%	0.412	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-38.4	178.6	170.4	0	0	0	0	110.7	A78 A79 F90 P169	A78-V81 WeakPolarHBondContact O-CA 3.4Å; A78-V81 WeakPolarHBondContact O-CB 3.36Å; A78-V81 PolarHBondContact O-N 3.39Å; A79-V81 PolarHBondContact O-N 2.84Å; V81-F90 HydrophobicContact CG1-CE2 4.33Å; V81-F90 HydrophobicContact CG1-CZ 4.33Å; V81-P169 HydrophobicContact CG1-CB 3.55Å; V81-P169 HydrophobicContact CG1-CG 3.26Å; V81-P169 HydrophobicContact CG2-CB 4.3Å
82	V	61.2	Low	72.9	Confident	3 Å²	3	44.5 Å²	44.5	2%	0.018	28%	0.284	C	S	.	.	S	Bend	trans	-113.7	106.5	-173.6	-171.6	0	0	0	0	109.7	P74 A78 A79 H84 W87 F90	P74-V82 HydrophobicContact CG-CB 4.41Å; P74-V82 HydrophobicContact CG-CG1 4.36Å; A78-V82 PolarHBondContact O-N 3.07Å; A79-V82 WeakPolarHBondContact CA-O 3.33Å; V82-H84 PolarHBondContact O-N 2.88Å; V82-W87 HydrophobicContact CG1-CB 3.49Å; V82-W87 VanDerWaalsContact CG1-CB 3.49Å; V82-F90 HydrophobicContact CB-CD1 4.25Å; V82-F90 HydrophobicContact CB-CE1 4.48Å; V82-F90 HydrophobicContact CG1-CB 4.05Å; V82-F90 HydrophobicContact CG1-CD1 3.7Å; V82-F90 HydrophobicContact CG1-CE1 4.36Å; V82-F90 HydrophobicContact CG1-CG 3.92Å; V82-F90 HydrophobicContact CG2-CD1 3.54Å; V82-F90 HydrophobicContact CG2-CD2 4.3Å; V82-F90 HydrophobicContact CG2-CE1 3.33Å; V82-F90 HydrophobicContact CG2-CE2 4.13Å; V82-F90 HydrophobicContact CG2-CG 4.04Å; V82-F90 HydrophobicContact CG2-CZ 3.67Å
83	S	64.9	Low	72.4	Confident	67 Å²	67	48.1 Å²	48.1	47%	0.469	31%	0.309	S	S	.	.			trans	-56.2	128.5	176.5	178	0	0	0	0	111.3	D85 A86 W87	S83-D85 PolarHBondContact O-N 3.2Å; S83-D85 VanDerWaalsContact O-N 3.11Å; S83-A86 PolarHBondContact O-N 2.72Å; S83-A86 VanDerWaalsContact O-N 3.1Å; S83-W87 PolarHBondContact O-N 3.08Å; S83-W87 VanDerWaalsContact O-N 3.08Å
84	H	65.3	Low	71.9	Confident	72 Å²	72	48.6 Å²	48.6	33%	0.333	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-33.8	-178.9	-67.9	110.4	0	0	0	113.5	L73 A79 V82 R585	L73-H84 HydrophobicContact CD2-CB 3.72Å; L73-H84 VanDerWaalsContact CD2-O 3.31Å; L73-H84 WeakPolarHBondContact CD2-O 3.47Å; A79-H84 WeakPolarHBondContact CB-NE2 3.49Å; V82-H84 PolarHBondContact O-N 2.88Å; H84-R585 PolarHBondContact O-NH1 3.35Å
85	D	63.6	Low	71.7	Confident	61 Å²	61	49 Å²	49	33%	0.326	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-31.1	-175.5	-49.2	-45.1	0	0	0	111.6	S83 R585 Q588	S83-D85 PolarHBondContact O-N 3.2Å; S83-D85 VanDerWaalsContact O-N 3.11Å; D85-R585 PolarHBondContact O-NH1 3.42Å; D85-Q588 VanDerWaalsContact CG-NE2 3.34Å; D85-Q588 PolarHBondContact OD1-NE2 2.73Å; D85-Q588 PolarHBondContact OD2-NE2 2.97Å
86	A	68.9	Low	71.4	Confident	52 Å²	52	51.1 Å²	51.1	43%	0.43	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	15.8	-169.7	0	0	0	0	0	114.8	S83 E88 A89 F90	S83-A86 PolarHBondContact O-N 2.72Å; S83-A86 VanDerWaalsContact O-N 3.1Å; A86-E88 PolarHBondContact O-N 3.42Å; A86-E88 VanDerWaalsContact O-N 3.14Å; A86-A89 WeakPolarHBondContact O-CB 3.41Å; A86-A89 PolarHBondContact O-N 3.32Å; A86-F90 PolarHBondContact O-N 2.84Å
87	W	84.3	Confident	71.4	Confident	1 Å²	1	51 Å²	51	0%	0.004	33%	0.325	C	S	.	.	H	α-helix	trans	-58.1	-30.8	-175.6	70.5	-111.6	0	0	0	113.8	D72 P74 V82 S83 F90 L91 P102 F107	D72-W87 PolarHBondContact O-NE1 2.68Å; P74-W87 HydrophobicContact CG-CB 4.46Å; V82-W87 HydrophobicContact CG1-CB 3.49Å; V82-W87 VanDerWaalsContact CG1-CB 3.49Å; S83-W87 PolarHBondContact O-N 3.08Å; S83-W87 VanDerWaalsContact O-N 3.08Å; W87-F90 PolarHBondContact O-N 3.22Å; W87-L91 HydrophobicContact CE3-CD1 3.68Å; W87-L91 HydrophobicContact CE3-CG 4.23Å; W87-L91 HydrophobicContact CZ3-CD1 3.77Å; W87-L91 PolarHBondContact O-N 3.39Å; W87-P102 HydrophobicContact CH2-CB 4.39Å; W87-P102 HydrophobicContact CH2-CG 4.12Å; W87-P102 HydrophobicContact CZ2-CB 3.93Å; W87-P102 HydrophobicContact CZ2-CG 3.82Å; W87-F107 AromaticContact CD2-CE2 3.86Å; W87-F107 HydrophobicContact CD2-CE2 3.86Å; W87-F107 AromaticContact CD2-CZ 3.84Å; W87-F107 HydrophobicContact CD2-CZ 3.84Å; W87-F107 AromaticContact CE2-CE2 3.73Å; W87-F107 HydrophobicContact CE3-CE2 4.13Å; W87-F107 AromaticContact CE3-CZ 3.74Å; W87-F107 HydrophobicContact CE3-CZ 3.74Å; W87-F107 HydrophobicContact CG-CE2 4.35Å; W87-F107 HydrophobicContact CG-CZ 4.35Å; W87-F107 HydrophobicContact CH2-CE2 4.23Å; W87-F107 HydrophobicContact CH2-CZ 4.4Å; W87-F107 AromaticContact CZ2-CE2 3.92Å; W87-F107 HydrophobicContact CZ2-CE2 3.92Å; W87-F107 HydrophobicContact CZ2-CZ 4.45Å; W87-F107 HydrophobicContact CZ3-CE2 4.34Å; W87-F107 HydrophobicContact CZ3-CZ 4.07Å
88	E	83.3	Confident	71.8	Confident	39 Å²	39	48.4 Å²	48.4	18%	0.182	30%	0.303	C	S	.	.	H	α-helix	trans	-64.3	-42.9	176.4	-169.4	-172.4	177.8	0	0	111.4	A86 F90 L91 R92 P102	A86-E88 PolarHBondContact O-N 3.42Å; A86-E88 VanDerWaalsContact O-N 3.14Å; E88-F90 VanDerWaalsContact C-N 3.31Å; E88-F90 PolarHBondContact O-N 3.28Å; E88-L91 PolarHBondContact O-N 3.21Å; E88-R92 WeakPolarHBondContact O-CB 3.32Å; E88-R92 PolarHBondContact O-N 2.93Å; E88-R92 IonicContact OE1-CZ 3.8Å; E88-R92 IonicContact OE1-NE 2.79Å; E88-R92 IonicContact OE1-NH2 2.64Å; E88-R92 PolarHBondContact OE1-NH2 3.43Å; E88-R92 IonicContact OE2-NH2 3.68Å; E88-P102 HydrophobicContact CB-CG 4.39Å; E88-P102 VanDerWaalsContact OE2-CD 3.24Å; E88-P102 WeakPolarHBondContact OE2-CD 3.29Å
89	A	81.5	Confident	72.7	Confident	63 Å²	63	57.5 Å²	57.5	52%	0.521	34%	0.336	S	S	.	.	H	α-helix	trans	-63.2	-39.7	177.3	0	0	0	0	0	111.3	A86 R92 S93	A86-A89 WeakPolarHBondContact O-CB 3.41Å; A86-A89 PolarHBondContact O-N 3.32Å; A89-R92 PolarHBondContact O-N 3.03Å; A89-S93 PolarHBondContact O-N 3.13Å; A89-S93 PolarHBondContact O-OG 3.04Å
90	F	80	Confident	73.9	Confident	31 Å²	31	57.1 Å²	57.1	14%	0.136	33%	0.331	C	S	.	.	H	α-helix	trans	-63.1	-46.9	174.6	172.2	-92.5	0	0	0	112.6	V81 V82 A86 W87 E88 R92 S93 H94 W95 P169	V81-F90 HydrophobicContact CG1-CE2 4.33Å; V81-F90 HydrophobicContact CG1-CZ 4.33Å; V82-F90 HydrophobicContact CB-CD1 4.25Å; V82-F90 HydrophobicContact CB-CE1 4.48Å; V82-F90 HydrophobicContact CG1-CB 4.05Å; V82-F90 HydrophobicContact CG1-CD1 3.7Å; V82-F90 HydrophobicContact CG1-CE1 4.36Å; V82-F90 HydrophobicContact CG1-CG 3.92Å; V82-F90 HydrophobicContact CG2-CD1 3.54Å; V82-F90 HydrophobicContact CG2-CD2 4.3Å; V82-F90 HydrophobicContact CG2-CE1 3.33Å; V82-F90 HydrophobicContact CG2-CE2 4.13Å; V82-F90 HydrophobicContact CG2-CG 4.04Å; V82-F90 HydrophobicContact CG2-CZ 3.67Å; A86-F90 PolarHBondContact O-N 2.84Å; W87-F90 PolarHBondContact O-N 3.22Å; E88-F90 VanDerWaalsContact C-N 3.31Å; E88-F90 PolarHBondContact O-N 3.28Å; F90-R92 VanDerWaalsContact C-N 3.33Å; F90-R92 PolarHBondContact O-N 2.99Å; F90-S93 PolarHBondContact O-N 3.32Å; F90-S93 PolarHBondContact O-OG 2.97Å; F90-H94 AromaticContact CD2-CE1 3.38Å; F90-H94 WeakPolarHBondContact CD2-CE1 3.31Å; F90-H94 AromaticContact CD2-ND1 3.55Å; F90-H94 AromaticContact CE2-CE1 3.25Å; F90-H94 WeakPolarHBondContact CE2-CE1 3.45Å; F90-H94 AromaticContact CE2-ND1 3.53Å; F90-H94 AromaticContact CE2-NE2 3.97Å; F90-H94 AromaticContact CG-ND1 3.98Å; F90-H94 AromaticContact CZ-ND1 3.95Å; F90-H94 PolarHBondContact O-N 2.86Å; F90-H94 PolarHBondContact O-ND1 3.43Å; F90-W95 AromaticContact CE1-CZ3 3.8Å; F90-W95 HydrophobicContact CE1-CZ3 3.8Å; F90-W95 HydrophobicContact CZ-CZ3 4.3Å; F90-P169 HydrophobicContact CE2-CG 4.19Å; F90-P169 HydrophobicContact CZ-CG 4.1Å
91	L	81.6	Confident	75.2	Confident	11 Å²	11	54.4 Å²	54.4	6%	0.058	31%	0.305	C	S	.	.	H	α-helix	trans	-67.2	-36.1	176.2	-67.4	-173.4	0	0	0	111.7	W87 E88 S93 W95 C100 F107 L140	W87-L91 HydrophobicContact CE3-CD1 3.68Å; W87-L91 HydrophobicContact CE3-CG 4.23Å; W87-L91 HydrophobicContact CZ3-CD1 3.77Å; W87-L91 PolarHBondContact O-N 3.39Å; E88-L91 PolarHBondContact O-N 3.21Å; L91-S93 VanDerWaalsContact C-N 3.31Å; L91-S93 PolarHBondContact O-N 2.8Å; L91-W95 HydrophobicContact CD2-CE3 3.64Å; L91-W95 HydrophobicContact CD2-CZ3 3.76Å; L91-W95 CarbonylContact O-C 3.51Å; L91-W95 VanDerWaalsContact O-C 3.27Å; L91-W95 WeakPolarHBondContact O-CA 3.41Å; L91-W95 PolarHBondContact O-N 2.9Å; L91-C100 HydrophobicContact CD1-CB 4.12Å; L91-F107 HydrophobicContact CD1-CE1 4.38Å; L91-F107 HydrophobicContact CD1-CZ 4.2Å; L91-L140 HydrophobicContact CD1-CD1 3.55Å
92	R	81.8	Confident	76.5	Confident	154 Å²	154	51.7 Å²	51.7	58%	0.581	29%	0.289	S	S	*	.	H	α-helix	trans	-69.9	-25.4	178.4	-161.5	-171.1	-66.3	171.1	-3.3	112.6	E88 A89 F90 P96	E88-R92 WeakPolarHBondContact O-CB 3.32Å; E88-R92 PolarHBondContact O-N 2.93Å; E88-R92 IonicContact OE1-CZ 3.8Å; E88-R92 IonicContact OE1-NE 2.79Å; E88-R92 IonicContact OE1-NH2 2.64Å; E88-R92 PolarHBondContact OE1-NH2 3.43Å; E88-R92 IonicContact OE2-NH2 3.68Å; A89-R92 PolarHBondContact O-N 3.03Å; F90-R92 VanDerWaalsContact C-N 3.33Å; F90-R92 PolarHBondContact O-N 2.99Å; R92-P96 WeakPolarHBondContact O-CB 3.42Å
93	S	78.7	Confident	77.7	Confident	75 Å²	75	53.4 Å²	53.4	52%	0.524	30%	0.297	S	S	.	.	H	α-helix	trans	-84.3	-33.3	175.4	67.6	0	0	0	0	113.9	A89 F90 L91	A89-S93 PolarHBondContact O-N 3.13Å; A89-S93 PolarHBondContact O-OG 3.04Å; F90-S93 PolarHBondContact O-N 3.32Å; F90-S93 PolarHBondContact O-OG 2.97Å; L91-S93 VanDerWaalsContact C-N 3.31Å; L91-S93 PolarHBondContact O-N 2.8Å
94	H	75.9	Confident	78.8	Confident	32 Å²	32	50.9 Å²	50.9	15%	0.148	28%	0.279	C	S	.	.	H	α-helix	trans	-96.5	-29.5	-177.8	-61.5	87.6	0	0	0	113.7	F90	F90-H94 AromaticContact CD2-CE1 3.38Å; F90-H94 WeakPolarHBondContact CD2-CE1 3.31Å; F90-H94 AromaticContact CD2-ND1 3.55Å; F90-H94 AromaticContact CE2-CE1 3.25Å; F90-H94 WeakPolarHBondContact CE2-CE1 3.45Å; F90-H94 AromaticContact CE2-ND1 3.53Å; F90-H94 AromaticContact CE2-NE2 3.97Å; F90-H94 AromaticContact CG-ND1 3.98Å; F90-H94 AromaticContact CZ-ND1 3.95Å; F90-H94 PolarHBondContact O-N 2.86Å; F90-H94 PolarHBondContact O-ND1 3.43Å
95	W	80	Confident	80	Confident	10 Å²	10	47.5 Å²	47.5	4%	0.038	26%	0.263	C	S	.	.			trans	-138.3	57.3	-177.5	-60.2	-73.3	0	0	0	112.1	F90 L91 A97 A98 L160 A168 A172	F90-W95 AromaticContact CE1-CZ3 3.8Å; F90-W95 HydrophobicContact CE1-CZ3 3.8Å; F90-W95 HydrophobicContact CZ-CZ3 4.3Å; L91-W95 HydrophobicContact CD2-CE3 3.64Å; L91-W95 HydrophobicContact CD2-CZ3 3.76Å; L91-W95 CarbonylContact O-C 3.51Å; L91-W95 VanDerWaalsContact O-C 3.27Å; L91-W95 WeakPolarHBondContact O-CA 3.41Å; L91-W95 PolarHBondContact O-N 2.9Å; W95-A97 PolarHBondContact O-N 2.88Å; W95-A97 VanDerWaalsContact O-N 3.09Å; W95-A98 HydrophobicContact CB-CB 4.31Å; W95-A98 WeakPolarHBondContact O-CB 3.31Å; W95-A98 PolarHBondContact O-N 2.81Å; W95-L160 HydrophobicContact CB-CD1 4.29Å; W95-L160 HydrophobicContact CD2-CD1 4.45Å; W95-L160 HydrophobicContact CG-CB 4.06Å; W95-L160 HydrophobicContact CG-CD1 4.11Å; W95-L160 PolarHBondContact NE1-O 2.93Å; W95-A168 HydrophobicContact CZ2-CB 4.46Å; W95-A172 HydrophobicContact CD2-CB 4.24Å; W95-A172 HydrophobicContact CE3-CB 4.2Å; W95-A172 HydrophobicContact CH2-CB 3.61Å; W95-A172 HydrophobicContact CZ2-CB 3.64Å; W95-A172 HydrophobicContact CZ3-CB 3.9Å
96	P	74	Confident	81.4	Confident	57 Å²	57	44.8 Å²	44.8	37%	0.37	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-55.9	-31.3	-176.3	22.3	-33.8	0	0	0	113.7	R92 A98 R99	R92-P96 WeakPolarHBondContact O-CB 3.42Å; P96-A98 PolarHBondContact O-N 2.88Å; P96-R99 PolarHBondContact O-N 3.03Å
97	A	69.3	Low	82.5	Confident	82 Å²	82	42.4 Å²	42.4	68%	0.678	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-61.2	-24.8	176.4	0	0	0	0	0	114	W95 R99	W95-A97 PolarHBondContact O-N 2.88Å; W95-A97 VanDerWaalsContact O-N 3.09Å; A97-R99 PolarHBondContact O-N 2.83Å
98	A	71.9	Confident	83	Confident	12 Å²	12	42.3 Å²	42.3	10%	0.099	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-73.8	-23.8	-176.3	0	0	0	0	0	113.8	W95 P96 C100 L160 I174	W95-A98 HydrophobicContact CB-CB 4.31Å; W95-A98 WeakPolarHBondContact O-CB 3.31Å; W95-A98 PolarHBondContact O-N 2.81Å; P96-A98 PolarHBondContact O-N 2.88Å; A98-C100 PolarHBondContact O-N 2.88Å; A98-C100 VanDerWaalsContact O-N 3.08Å; A98-L160 HydrophobicContact CB-CD1 4.22Å; A98-L160 HydrophobicContact CB-CD2 4.05Å; A98-I174 HydrophobicContact CB-CD1 4.48Å
99	R	82	Confident	83.4	Confident	202 Å²	202	42 Å²	42	76%	0.762	23%	0.227	S	C	*	.			trans	51.2	30.3	178	-58	-178.7	-179.1	179.8	0.8	115	P96 A97	P96-R99 PolarHBondContact O-N 3.03Å; A97-R99 PolarHBondContact O-N 2.83Å
100	C	85.2	Confident	83.9	Confident	10 Å²	10	39.1 Å²	39.1	7%	0.068	20%	0.203	C	C	.	.			trans	-67.8	137.5	175.5	-61.4	0	0	0	0	111.2	L91 A98 S105 L140	L91-C100 HydrophobicContact CD1-CB 4.12Å; A98-C100 PolarHBondContact O-N 2.88Å; A98-C100 VanDerWaalsContact O-N 3.08Å; C100-S105 WeakPolarHBondContact CA-OG 3.35Å; C100-S105 VanDerWaalsContact CB-OG 3.28Å; C100-S105 WeakPolarHBondContact CB-OG 3.46Å; C100-L140 HydrophobicContact CB-CD1 4.33Å
101	T	87	Confident	84.5	Confident	41 Å²	41	37.8 Å²	37.8	25%	0.252	20%	0.197	S	C	.	.			trans	-136.5	159.7	176	65.4	0	0	0	0	109.5	L103 N104 S105	T101-L103 PolarHBondContact O-N 3.49Å; T101-L103 VanDerWaalsContact O-N 3.11Å; T101-L103 PolarHBondContact OG1-N 2.99Å; T101-N104 PolarHBondContact N-OD1 2.8Å; T101-N104 PolarHBondContact O-N 3.29Å; T101-N104 PolarHBondContact O-OD1 2.77Å; T101-N104 PolarHBondContact OG1-N 3.49Å; T101-N104 PolarHBondContact OG1-OD1 2.76Å; T101-S105 WeakPolarHBondContact O-CB 3.12Å; T101-S105 PolarHBondContact O-N 3.33Å; T101-S105 VanDerWaalsContact O-N 3.07Å
102	P	86.7	Confident	85	Confident	10 Å²	10	37.3 Å²	37.3	7%	0.065	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-14.1	173.5	-22.4	33.3	0	0	0	114.4	W87 E88 K581 E582	W87-P102 HydrophobicContact CH2-CB 4.39Å; W87-P102 HydrophobicContact CH2-CG 4.12Å; W87-P102 HydrophobicContact CZ2-CB 3.93Å; W87-P102 HydrophobicContact CZ2-CG 3.82Å; E88-P102 HydrophobicContact CB-CG 4.39Å; E88-P102 VanDerWaalsContact OE2-CD 3.24Å; E88-P102 WeakPolarHBondContact OE2-CD 3.29Å; P102-K581 PolarHBondContact O-NZ 3.49Å; P102-E582 HydrophobicContact CB-CG 4.45Å; P102-E582 VanDerWaalsContact CB-OE1 3.27Å; P102-E582 WeakPolarHBondContact CB-OE1 3.48Å; P102-E582 VanDerWaalsContact CB-OE2 3.28Å; P102-E582 WeakPolarHBondContact CB-OE2 3.24Å
103	L	85.9	Confident	85.5	Confident	39 Å²	39	30.7 Å²	30.7	20%	0.204	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-49	171.1	176.3	60.7	0	0	0	112.1	T101 D135 V469 H578	T101-L103 PolarHBondContact O-N 3.49Å; T101-L103 VanDerWaalsContact O-N 3.11Å; T101-L103 PolarHBondContact OG1-N 2.99Å; L103-D135 HydrophobicContact CD1-CB 3.98Å; L103-D135 HydrophobicContact CG-CB 4.36Å; L103-V469 HydrophobicContact CD2-CB 4.36Å; L103-V469 HydrophobicContact CD2-CG2 4.21Å; L103-H578 HydrophobicContact CD1-CB 3.85Å; L103-H578 PolarHBondContact N-CE1 2.85Å
104	N	87.7	Confident	86	Confident	14 Å²	14	31.2 Å²	31.2	8%	0.075	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	0.7	-167	79.7	-18.7	0	0	0	115.9	T101 D135 E137 H138	T101-N104 PolarHBondContact N-OD1 2.8Å; T101-N104 PolarHBondContact O-N 3.29Å; T101-N104 PolarHBondContact O-OD1 2.77Å; T101-N104 PolarHBondContact OG1-N 3.49Å; T101-N104 PolarHBondContact OG1-OD1 2.76Å; N104-D135 VanDerWaalsContact CA-O 3.26Å; N104-D135 WeakPolarHBondContact CA-O 3.48Å; N104-D135 VanDerWaalsContact CB-O 3.31Å; N104-D135 WeakPolarHBondContact CB-O 3.48Å; N104-E137 HydrophobicContact CB-CB 4.12Å; N104-E137 HydrophobicContact CB-CG 4.11Å; N104-E137 PolarHBondContact ND2-OE2 2.99Å; N104-E137 PolarHBondContact O-N 3.06Å; N104-H138 PolarHBondContact O-N 2.91Å
105	S	91.3	Very high	86.3	Confident	1 Å²	1	35 Å²	35	1%	0.007	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	146.6	-177.5	-54.6	0	0	0	0	113.7	C100 T101 H138	C100-S105 WeakPolarHBondContact CA-OG 3.35Å; C100-S105 VanDerWaalsContact CB-OG 3.28Å; C100-S105 WeakPolarHBondContact CB-OG 3.46Å; T101-S105 WeakPolarHBondContact O-CB 3.12Å; T101-S105 PolarHBondContact O-N 3.33Å; T101-S105 VanDerWaalsContact O-N 3.07Å; S105-H138 WeakPolarHBondContact CA-O 3.44Å
106	L	93	Very high	86.6	Confident	5 Å²	5	45.5 Å²	45.5	3%	0.026	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	152.3	166.2	-69.4	172.7	0	0	0	110.2	F70 S71 D72 L136 H138 V139 L140 L661	F70-L106 HydrophobicContact CB-CB 4.37Å; F70-L106 HydrophobicContact CB-CD1 4.27Å; S71-L106 WeakPolarHBondContact O-CA 3.22Å; S71-L106 WeakPolarHBondContact O-CD2 3.39Å; D72-L106 HydrophobicContact CB-CD2 4.31Å; L106-L136 HydrophobicContact CB-CD1 4Å; L106-L136 HydrophobicContact CD1-CD1 3.88Å; L106-L136 HydrophobicContact CD1-CD2 4.15Å; L106-L136 HydrophobicContact CG-CD1 3.71Å; L106-H138 PolarHBondContact N-O 3.25Å; L106-V139 CarbonylContact O-C 3.46Å; L106-V139 WeakPolarHBondContact O-CA 3.23Å; L106-L140 PolarHBondContact O-N 3.07Å; L106-L661 HydrophobicContact CD1-CD1 4.07Å
107	F	92.6	Very high	87.2	Confident	1 Å²	1	44 Å²	44	0%	0.004	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	136.1	175.9	-60	-85.1	0	0	0	111.3	F70 S71 L73 P74 W87 L91 H109 L140 L142	F70-F107 CarbonylContact C-O 3.38Å; F70-F107 VanDerWaalsContact CA-O 3.25Å; F70-F107 WeakPolarHBondContact CA-O 3.05Å; S71-F107 PolarHBondContact N-O 2.9Å; S71-F107 PolarHBondContact O-N 3.28Å; L73-F107 VanDerWaalsContact O-CD2 3.22Å; L73-F107 WeakPolarHBondContact O-CD2 3.26Å; P74-F107 HydrophobicContact CB-CZ 4.49Å; W87-F107 AromaticContact CD2-CE2 3.86Å; W87-F107 HydrophobicContact CD2-CE2 3.86Å; W87-F107 AromaticContact CD2-CZ 3.84Å; W87-F107 HydrophobicContact CD2-CZ 3.84Å; W87-F107 AromaticContact CE2-CE2 3.73Å; W87-F107 HydrophobicContact CE3-CE2 4.13Å; W87-F107 AromaticContact CE3-CZ 3.74Å; W87-F107 HydrophobicContact CE3-CZ 3.74Å; W87-F107 HydrophobicContact CG-CE2 4.35Å; W87-F107 HydrophobicContact CG-CZ 4.35Å; W87-F107 HydrophobicContact CH2-CE2 4.23Å; W87-F107 HydrophobicContact CH2-CZ 4.4Å; W87-F107 AromaticContact CZ2-CE2 3.92Å; W87-F107 HydrophobicContact CZ2-CE2 3.92Å; W87-F107 HydrophobicContact CZ2-CZ 4.45Å; W87-F107 HydrophobicContact CZ3-CE2 4.34Å; W87-F107 HydrophobicContact CZ3-CZ 4.07Å; L91-F107 HydrophobicContact CD1-CE1 4.38Å; L91-F107 HydrophobicContact CD1-CZ 4.2Å; F107-H109 PolarHBondContact O-N 3.35Å; F107-L140 CarbonylContact C-O 3.56Å; F107-L140 WeakPolarHBondContact CA-O 3.43Å; F107-L140 HydrophobicContact CD1-CB 3.68Å; F107-L140 HydrophobicContact CD1-CD1 4.17Å; F107-L140 HydrophobicContact CE1-CB 3.92Å; F107-L140 HydrophobicContact CE1-CD1 3.59Å; F107-L140 HydrophobicContact CE1-CG 4.43Å; F107-L140 HydrophobicContact CZ-CD1 3.98Å; F107-L142 HydrophobicContact CD1-CD1 3.96Å; F107-L142 HydrophobicContact CD1-CG 4.07Å; F107-L142 HydrophobicContact CE1-CD1 3.73Å; F107-L142 HydrophobicContact CE1-CG 4.1Å
108	L	93	Very high	88	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	115.3	169.4	-180	63.5	0	0	0	109.5	F39 A68 F70 L110 F111 V139 L140 L141 L153 F157	F39-L108 HydrophobicContact CE1-CD2 4.36Å; F39-L108 HydrophobicContact CE1-CG 4.11Å; F39-L108 HydrophobicContact CZ-CD2 4.26Å; F39-L108 HydrophobicContact CZ-CG 4.39Å; A68-L108 HydrophobicContact CB-CD1 4.19Å; F70-L108 HydrophobicContact CD1-CB 4.48Å; F70-L108 HydrophobicContact CD1-CD1 4.05Å; F70-L108 HydrophobicContact CE1-CD1 3.67Å; F70-L108 HydrophobicContact CZ-CD1 4.24Å; L108-L110 VanDerWaalsContact CD1-O 3.3Å; L108-L110 WeakPolarHBondContact CD1-O 3.36Å; L108-F111 HydrophobicContact CD1-CB 4.34Å; L108-F111 HydrophobicContact CD2-CB 4.18Å; L108-V139 HydrophobicContact CB-CG1 4.32Å; L108-L140 PolarHBondContact N-O 3.01Å; L108-L141 HydrophobicContact CD2-CD1 4.33Å; L108-L153 HydrophobicContact CD2-CD2 4.08Å; L108-F157 HydrophobicContact CD2-CE2 4.18Å; L108-F157 HydrophobicContact CD2-CZ 3.91Å
109	H	91.4	Very high	88.6	Confident	32 Å²	32	41.5 Å²	41.5	15%	0.148	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	-24	179.8	-85.2	-132	0	0	0	113.5	F39 I42 L47 S69 L73 F107	F39-H109 VanDerWaalsContact CD1-O 3.23Å; F39-H109 WeakPolarHBondContact CD1-O 3.3Å; I42-H109 WeakPolarHBondContact CD1-O 3.42Å; L47-H109 HydrophobicContact CD1-CB 3.73Å; S69-H109 PolarHBondContact O-N 3.19Å; L73-H109 PolarHBondContact O-NE2 3.22Å; F107-H109 PolarHBondContact O-N 3.35Å
110	L	92.5	Very high	88.8	Confident	3 Å²	3	33.4 Å²	33.4	2%	0.016	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	136.2	174.4	-177.8	61.9	0	0	0	109	I27 I31 F39 I42 L47 A68 S69 L108 V112	I27-L110 HydrophobicContact CG2-CD2 4.21Å; I31-L110 HydrophobicContact CD1-CD2 4.38Å; F39-L110 HydrophobicContact CB-CD1 4.46Å; F39-L110 HydrophobicContact CD2-CD1 3.94Å; F39-L110 HydrophobicContact CG-CD1 4.33Å; I42-L110 HydrophobicContact CD1-CB 4.24Å; I42-L110 HydrophobicContact CD1-CD1 4.19Å; L47-L110 HydrophobicContact CD2-CB 3.71Å; L47-L110 HydrophobicContact CD2-CD2 3.74Å; L47-L110 HydrophobicContact CD2-CG 4.39Å; A68-L110 VanDerWaalsContact CA-O 3.23Å; A68-L110 WeakPolarHBondContact CA-O 3.37Å; S69-L110 PolarHBondContact N-O 2.85Å; L108-L110 VanDerWaalsContact CD1-O 3.3Å; L108-L110 WeakPolarHBondContact CD1-O 3.36Å; L110-V112 HydrophobicContact CD1-CG1 3.85Å; L110-V112 HydrophobicContact CG-CG1 4.28Å
111	F	93.1	Very high	89.1	Confident	2 Å²	2	33 Å²	33	1%	0.009	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133	157.2	175.2	-106.6	0	0	0	108.4	F39 H67 A68 L108 L122 I125 E150 L153	F39-F111 HydrophobicContact CE2-CB 4.4Å; F39-F111 HydrophobicContact CZ-CB 4.17Å; H67-F111 WeakPolarHBondContact O-CA 3.2Å; A68-F111 HydrophobicContact CB-CD2 4.28Å; L108-F111 HydrophobicContact CD1-CB 4.34Å; L108-F111 HydrophobicContact CD2-CB 4.18Å; F111-L122 HydrophobicContact CD2-CD1 3.9Å; F111-L122 HydrophobicContact CE2-CB 3.93Å; F111-L122 HydrophobicContact CE2-CD1 3.86Å; F111-L122 HydrophobicContact CE2-CG 4.44Å; F111-L122 HydrophobicContact CG-CD1 4.44Å; F111-L122 HydrophobicContact CZ-CB 3.86Å; F111-L122 HydrophobicContact CZ-CD1 4.36Å; F111-I125 HydrophobicContact CE2-CD1 4.16Å; F111-E150 WeakPolarHBondContact CE1-OE2 3.08Å; F111-L153 HydrophobicContact CB-CD2 4.33Å; F111-L153 HydrophobicContact CD1-CD1 4.25Å; F111-L153 HydrophobicContact CD1-CD2 3.98Å; F111-L153 HydrophobicContact CD1-CG 4.18Å; F111-L153 HydrophobicContact CG-CD2 4.28Å
112	V	92.4	Very high	89.3	Confident	2 Å²	2	31 Å²	31	1%	0.012	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	143.6	172.7	-71	0	0	0	0	109.2	I27 L30 I31 D35 A66 H67 L110	I27-V112 HydrophobicContact CG2-CG2 4.08Å; L30-V112 HydrophobicContact CB-CB 3.91Å; L30-V112 HydrophobicContact CB-CG2 3.93Å; L30-V112 HydrophobicContact CD1-CG2 4.27Å; I31-V112 HydrophobicContact CB-CG1 4.44Å; I31-V112 HydrophobicContact CG1-CG1 3.72Å; D35-V112 HydrophobicContact CB-CG1 4.39Å; A66-V112 CarbonylContact C-O 3.41Å; A66-V112 VanDerWaalsContact CA-O 3.3Å; A66-V112 WeakPolarHBondContact CA-O 3.47Å; H67-V112 HydrophobicContact CB-CG2 3.95Å; H67-V112 PolarHBondContact N-O 3.33Å; H67-V112 PolarHBondContact O-N 2.73Å; L110-V112 HydrophobicContact CD1-CG1 3.85Å; L110-V112 HydrophobicContact CG-CG1 4.28Å
113	S	91.9	Very high	89.4	Confident	14 Å²	14	34 Å²	34	10%	0.098	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	162.1	178.2	70.6	0	0	0	0	113.1	V65 A118	V65-S113 CarbonylContact O-C 3.49Å; V65-S113 WeakPolarHBondContact O-CA 3.49Å; S113-A118 VanDerWaalsContact OG-CA 3.29Å; S113-A118 WeakPolarHBondContact OG-CA 3.34Å; S113-A118 WeakPolarHBondContact OG-CB 3.47Å
114	E	88.9	Confident	89.5	Confident	86 Å²	86	35.1 Å²	35.1	40%	0.402	18%	0.181	S	C	.	.			trans	-70.1	126	161.8	-73.5	-170.7	-157.5	0	0	110.1	L30 V65 R116 V117 A118	L30-E114 HydrophobicContact CD2-CG 4.07Å; V65-E114 PolarHBondContact O-N 3.25Å; E114-R116 PolarHBondContact O-N 3.44Å; E114-V117 HydrophobicContact CB-CG2 4.06Å; E114-V117 WeakPolarHBondContact O-CG2 3.47Å; E114-V117 PolarHBondContact O-N 3.1Å; E114-A118 PolarHBondContact O-N 2.87Å
115	P	83.4	Confident	89.7	Confident	113 Å²	113	34.4 Å²	34.4	73%	0.734	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-12.2	-173.2	-29.7	36	0	0	0	116.7
116	R	84.7	Confident	89.7	Confident	230 Å²	230	34.4 Å²	34.4	87%	0.868	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-21.5	176.2	-64.3	-179	179.8	177.8	1.2	113.8	E114	E114-R116 PolarHBondContact O-N 3.44Å
117	V	86.4	Confident	89.3	Confident	25 Å²	25	38.4 Å²	38.4	15%	0.152	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.8	6.2	-175.3	-62.7	0	0	0	0	112.7	L14 V65 E114 G119 S120 S121	L14-V117 HydrophobicContact CD1-CB 4.2Å; L14-V117 HydrophobicContact CD1-CG1 4.31Å; V65-V117 HydrophobicContact CB-CG2 4.27Å; V65-V117 HydrophobicContact CG2-CG2 4.25Å; E114-V117 HydrophobicContact CB-CG2 4.06Å; E114-V117 WeakPolarHBondContact O-CG2 3.47Å; E114-V117 PolarHBondContact O-N 3.1Å; V117-G119 PolarHBondContact O-N 3.17Å; V117-S120 PolarHBondContact O-OG 3.01Å; V117-S121 WeakPolarHBondContact O-CB 3.48Å; V117-S121 PolarHBondContact O-N 3.46Å; V117-S121 PolarHBondContact O-OG 2.95Å
118	A	86.2	Confident	89.1	Confident	4 Å²	4	40.3 Å²	40.3	3%	0.033	20%	0.204	C	C	.	.	H	α-helix	trans	-50.6	-54.8	-174.5	0	0	0	0	0	113.7	S113 E114 S121 L122 V152	S113-A118 VanDerWaalsContact OG-CA 3.29Å; S113-A118 WeakPolarHBondContact OG-CA 3.34Å; S113-A118 WeakPolarHBondContact OG-CB 3.47Å; E114-A118 PolarHBondContact O-N 2.87Å; A118-S121 PolarHBondContact O-N 3.2Å; A118-L122 WeakPolarHBondContact O-CB 3.35Å; A118-L122 PolarHBondContact O-N 3.39Å; A118-V152 HydrophobicContact CB-CB 4.49Å; A118-V152 HydrophobicContact CB-CG2 3.82Å
119	G	86.3	Confident	88.9	Confident	38 Å²	38	40.4 Å²	40.4	39%	0.392	21%	0.205	S	C	.	.	H	α-helix	trans	-60.6	-56.2	-178.8	0	0	0	0	0	113.5	V117 S121 L122 E123	V117-G119 PolarHBondContact O-N 3.17Å; G119-S121 PolarHBondContact O-N 3.48Å; G119-L122 PolarHBondContact O-N 3.27Å; G119-E123 PolarHBondContact O-N 2.68Å
120	S	86.3	Confident	88.6	Confident	32 Å²	32	38.9 Å²	38.9	22%	0.224	20%	0.198	C	C	.	.	H	α-helix	trans	-65.6	-27.1	-179.9	60.7	0	0	0	0	112.8	V117 K124	V117-S120 PolarHBondContact O-OG 3.01Å; S120-K124 VanDerWaalsContact O-CB 3.31Å; S120-K124 WeakPolarHBondContact O-CB 3.34Å; S120-K124 WeakPolarHBondContact O-CD 3.33Å; S120-K124 WeakPolarHBondContact O-CG 3.41Å; S120-K124 PolarHBondContact O-N 2.84Å
121	S	90.3	Very high	88	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-71.7	-46.1	172.1	-62.9	0	0	0	0	112.2	V117 A118 G119 K124 I125	V117-S121 WeakPolarHBondContact O-CB 3.48Å; V117-S121 PolarHBondContact O-N 3.46Å; V117-S121 PolarHBondContact O-OG 2.95Å; A118-S121 PolarHBondContact O-N 3.2Å; G119-S121 PolarHBondContact O-N 3.48Å; S121-K124 PolarHBondContact O-N 3.46Å; S121-I125 VanDerWaalsContact O-CB 3.29Å; S121-I125 WeakPolarHBondContact O-CB 3.27Å; S121-I125 VanDerWaalsContact O-CG1 3.24Å; S121-I125 WeakPolarHBondContact O-CG1 3.46Å; S121-I125 PolarHBondContact O-N 2.86Å
122	L	90.9	Very high	87.3	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-64.2	-44.3	178.3	-177.8	62.3	0	0	0	111.3	F111 A118 G119 K124 I125 L126 V152 L153 T156 F157	F111-L122 HydrophobicContact CD2-CD1 3.9Å; F111-L122 HydrophobicContact CE2-CB 3.93Å; F111-L122 HydrophobicContact CE2-CD1 3.86Å; F111-L122 HydrophobicContact CE2-CG 4.44Å; F111-L122 HydrophobicContact CG-CD1 4.44Å; F111-L122 HydrophobicContact CZ-CB 3.86Å; F111-L122 HydrophobicContact CZ-CD1 4.36Å; A118-L122 WeakPolarHBondContact O-CB 3.35Å; A118-L122 PolarHBondContact O-N 3.39Å; G119-L122 PolarHBondContact O-N 3.27Å; L122-K124 PolarHBondContact O-N 3.5Å; L122-I125 PolarHBondContact O-N 2.84Å; L122-L126 HydrophobicContact CD1-CD1 3.89Å; L122-L126 HydrophobicContact CD1-CG 4.03Å; L122-L126 HydrophobicContact CD2-CD1 4.39Å; L122-L126 HydrophobicContact CG-CD1 3.77Å; L122-L126 HydrophobicContact CG-CG 4.32Å; L122-L126 WeakPolarHBondContact O-CB 3.44Å; L122-L126 WeakPolarHBondContact O-CG 3.34Å; L122-L126 PolarHBondContact O-N 2.89Å; L122-V152 HydrophobicContact CB-CG1 4.1Å; L122-V152 HydrophobicContact CD2-CG1 3.67Å; L122-L153 HydrophobicContact CD2-CD2 3.92Å; L122-T156 HydrophobicContact CD2-CG2 3.96Å; L122-F157 HydrophobicContact CD2-CE2 4.41Å
123	E	88.6	Confident	86.7	Confident	71 Å²	71	43.3 Å²	43.3	33%	0.332	22%	0.224	S	C	.	.	H	α-helix	trans	-60.1	-46.6	177.1	-171.3	-168	-171.8	0	0	111.6	G119 L126 R127	G119-E123 PolarHBondContact O-N 2.68Å; E123-L126 PolarHBondContact O-N 2.88Å; E123-R127 VanDerWaalsContact CD-NH1 3.26Å; E123-R127 WeakPolarHBondContact O-CB 3.32Å; E123-R127 WeakPolarHBondContact O-CG 3.06Å; E123-R127 PolarHBondContact O-N 2.98Å; E123-R127 IonicContact OE1-CZ 3.2Å; E123-R127 IonicContact OE1-NH1 3.41Å; E123-R127 PolarHBondContact OE1-NH1 3.44Å; E123-R127 IonicContact OE1-NH2 2.71Å; E123-R127 PolarHBondContact OE1-NH2 2.82Å; E123-R127 IonicContact OE2-NH1 3.55Å
124	K	88	Confident	85.9	Confident	63 Å²	63	44.1 Å²	44.1	27%	0.274	23%	0.23	S	C	.	.	H	α-helix	trans	-65	-39.5	176.2	-73.6	176.6	178.2	-178.9	0	111.9	L14 V16 S120 S121 L122 T128	L14-K124 HydrophobicContact CB-CD 4.45Å; V16-K124 HydrophobicContact CG2-CB 3.72Å; S120-K124 VanDerWaalsContact O-CB 3.31Å; S120-K124 WeakPolarHBondContact O-CB 3.34Å; S120-K124 WeakPolarHBondContact O-CD 3.33Å; S120-K124 WeakPolarHBondContact O-CG 3.41Å; S120-K124 PolarHBondContact O-N 2.84Å; S121-K124 PolarHBondContact O-N 3.46Å; L122-K124 PolarHBondContact O-N 3.5Å; K124-T128 VanDerWaalsContact O-CB 3.32Å; K124-T128 WeakPolarHBondContact O-CB 3.47Å; K124-T128 PolarHBondContact O-N 2.89Å; K124-T128 PolarHBondContact O-OG1 3.24Å
125	I	91.9	Very high	85.4	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60	-49.9	173.2	-80.2	167.4	0	0	0	111	V16 L55 V57 A68 F70 F111 S121 L122 T128 A129	V16-I125 HydrophobicContact CG1-CG1 4.47Å; L55-I125 HydrophobicContact CB-CG1 4.45Å; L55-I125 HydrophobicContact CD1-CG2 4.31Å; L55-I125 WeakPolarHBondContact CD1-O 3.47Å; V57-I125 HydrophobicContact CG2-CD1 3.81Å; V57-I125 HydrophobicContact CG2-CG1 3.83Å; A68-I125 HydrophobicContact CB-CD1 4.07Å; A68-I125 HydrophobicContact CB-CG2 3.64Å; F70-I125 HydrophobicContact CE2-CG2 4.06Å; F70-I125 HydrophobicContact CZ-CG2 3.77Å; F111-I125 HydrophobicContact CE2-CD1 4.16Å; S121-I125 VanDerWaalsContact O-CB 3.29Å; S121-I125 WeakPolarHBondContact O-CB 3.27Å; S121-I125 VanDerWaalsContact O-CG1 3.24Å; S121-I125 WeakPolarHBondContact O-CG1 3.46Å; S121-I125 PolarHBondContact O-N 2.86Å; L122-I125 PolarHBondContact O-N 2.84Å; I125-T128 WeakPolarHBondContact O-CB 3.44Å; I125-T128 PolarHBondContact O-N 2.89Å; I125-A129 PolarHBondContact O-N 2.87Å
126	L	90.9	Very high	85.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-67.6	-44.8	-176.4	-71.4	169.5	0	0	0	111.4	F70 L122 E123 T128 A129 F130 V139 T156	F70-L126 HydrophobicContact CE1-CD2 4.4Å; F70-L126 HydrophobicContact CZ-CD2 4.44Å; L122-L126 HydrophobicContact CD1-CD1 3.89Å; L122-L126 HydrophobicContact CD1-CG 4.03Å; L122-L126 HydrophobicContact CD2-CD1 4.39Å; L122-L126 HydrophobicContact CG-CD1 3.77Å; L122-L126 HydrophobicContact CG-CG 4.32Å; L122-L126 WeakPolarHBondContact O-CB 3.44Å; L122-L126 WeakPolarHBondContact O-CG 3.34Å; L122-L126 PolarHBondContact O-N 2.89Å; E123-L126 PolarHBondContact O-N 2.88Å; L126-T128 VanDerWaalsContact C-N 3.26Å; L126-T128 PolarHBondContact O-N 2.88Å; L126-A129 PolarHBondContact O-N 3.18Å; L126-F130 HydrophobicContact CB-CD2 4.47Å; L126-F130 HydrophobicContact CB-CE2 4.28Å; L126-F130 WeakPolarHBondContact O-CD2 3.45Å; L126-F130 PolarHBondContact O-N 3.06Å; L126-V139 HydrophobicContact CD2-CB 4.46Å; L126-V139 HydrophobicContact CD2-CG2 4.15Å; L126-T156 HydrophobicContact CD1-CG2 3.6Å
127	R	86.4	Confident	85.7	Confident	90 Å²	90	27.7 Å²	27.7	34%	0.34	16%	0.155	S	C	.	.	H	α-helix	trans	-54.9	-42.9	170.4	-77.5	-170.5	175.7	122.1	16.8	112	E123 S131 H180	E123-R127 VanDerWaalsContact CD-NH1 3.26Å; E123-R127 WeakPolarHBondContact O-CB 3.32Å; E123-R127 WeakPolarHBondContact O-CG 3.06Å; E123-R127 PolarHBondContact O-N 2.98Å; E123-R127 IonicContact OE1-CZ 3.2Å; E123-R127 IonicContact OE1-NH1 3.41Å; E123-R127 PolarHBondContact OE1-NH1 3.44Å; E123-R127 IonicContact OE1-NH2 2.71Å; E123-R127 PolarHBondContact OE1-NH2 2.82Å; E123-R127 IonicContact OE2-NH1 3.55Å; R127-S131 WeakPolarHBondContact O-CB 3.46Å; R127-S131 PolarHBondContact O-N 3.33Å; R127-H180 HydrophobicContact CG-CB 4.1Å; R127-H180 PolarHBondContact NE-O 3.39Å
128	T	87	Confident	85.9	Confident	41 Å²	41	27.5 Å²	27.5	25%	0.252	15%	0.152	S	C	.	.	H	α-helix	trans	-65.2	-45.2	177.9	-57.1	0	0	0	0	111.6	V16 L55 K124 I125 L126 S131 I132	V16-T128 HydrophobicContact CB-CG2 4.5Å; V16-T128 HydrophobicContact CG1-CG2 3.96Å; L55-T128 HydrophobicContact CD1-CG2 3.84Å; L55-T128 HydrophobicContact CD2-CG2 4.07Å; K124-T128 VanDerWaalsContact O-CB 3.32Å; K124-T128 WeakPolarHBondContact O-CB 3.47Å; K124-T128 PolarHBondContact O-N 2.89Å; K124-T128 PolarHBondContact O-OG1 3.24Å; I125-T128 WeakPolarHBondContact O-CB 3.44Å; I125-T128 PolarHBondContact O-N 2.89Å; L126-T128 VanDerWaalsContact C-N 3.26Å; L126-T128 PolarHBondContact O-N 2.88Å; T128-S131 PolarHBondContact O-N 3.11Å; T128-I132 HydrophobicContact CG2-CD1 3.88Å; T128-I132 HydrophobicContact CG2-CG1 4.46Å; T128-I132 WeakPolarHBondContact O-CG1 3.32Å; T128-I132 PolarHBondContact O-N 3.03Å
129	A	88.9	Confident	86.3	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-62.1	-44.2	177.9	0	0	0	0	0	112.4	L53 L55 F70 I125 L126 I132 T133	L53-A129 HydrophobicContact CD2-CB 3.84Å; L55-A129 HydrophobicContact CD1-CB 4.08Å; F70-A129 HydrophobicContact CE2-CB 4.28Å; F70-A129 HydrophobicContact CZ-CB 4.47Å; I125-A129 PolarHBondContact O-N 2.87Å; L126-A129 PolarHBondContact O-N 3.18Å; A129-I132 PolarHBondContact O-N 2.75Å; A129-T133 PolarHBondContact O-N 3.16Å; A129-T133 VanDerWaalsContact O-N 3.16Å
130	F	86	Confident	86.5	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-66	-34.3	174.1	-69.1	-55.7	0	0	0	112.3	L126 T133 L136 V139 R177 H180	L126-F130 HydrophobicContact CB-CD2 4.47Å; L126-F130 HydrophobicContact CB-CE2 4.28Å; L126-F130 WeakPolarHBondContact O-CD2 3.45Å; L126-F130 PolarHBondContact O-N 3.06Å; F130-T133 CarbonylContact O-C 3.59Å; F130-L136 HydrophobicContact CD1-CB 4.25Å; F130-L136 HydrophobicContact CD1-CD2 3.79Å; F130-L136 HydrophobicContact CD1-CG 3.84Å; F130-L136 WeakPolarHBondContact CD1-O 3.29Å; F130-L136 HydrophobicContact CE1-CD2 4.03Å; F130-L136 HydrophobicContact CE1-CG 3.89Å; F130-V139 HydrophobicContact CE1-CG2 4.06Å; F130-V139 HydrophobicContact CZ-CG2 3.85Å; F130-R177 HydrophobicContact CB-CG 4.22Å; F130-R177 HydrophobicContact CD1-CB 3.83Å; F130-R177 HydrophobicContact CD1-CG 3.86Å; F130-R177 HydrophobicContact CE1-CB 3.79Å; F130-R177 HydrophobicContact CE1-CG 4.35Å; F130-R177 HydrophobicContact CG-CB 4.26Å; F130-R177 HydrophobicContact CG-CG 3.97Å; F130-R177 HydrophobicContact CZ-CB 4.2Å; F130-R177 PolarHBondContact O-NH1 2.89Å; F130-R177 PolarHBondContact O-NH2 2.75Å; F130-H180 HydrophobicContact CD2-CB 4.39Å; F130-H180 HydrophobicContact CE2-CB 4.44Å
131	S	78.8	Confident	86.7	Confident	33 Å²	33	24.1 Å²	24.1	23%	0.231	12%	0.122	C	C	.	.	H	α-helix	trans	-72	-37.1	176.7	-164.8	0	0	0	0	113.1	R127 T128 N404 S405	R127-S131 WeakPolarHBondContact O-CB 3.46Å; R127-S131 PolarHBondContact O-N 3.33Å; T128-S131 PolarHBondContact O-N 3.11Å; S131-N404 PolarHBondContact OG-OD1 2.94Å; S131-S405 PolarHBondContact O-OG 3.06Å
132	I	79.8	Confident	86.5	Confident	46 Å²	46	24.6 Å²	24.6	24%	0.236	13%	0.125	C	C	.	.	H	α-helix	trans	-63.7	-45.1	174.8	-72.1	169.1	0	0	0	111.7	L53 L55 T128 A129	L53-I132 HydrophobicContact CD1-CD1 3.95Å; L53-I132 HydrophobicContact CD2-CD1 4.44Å; L55-I132 HydrophobicContact CD2-CD1 4.01Å; T128-I132 HydrophobicContact CG2-CD1 3.88Å; T128-I132 HydrophobicContact CG2-CG1 4.46Å; T128-I132 WeakPolarHBondContact O-CG1 3.32Å; T128-I132 PolarHBondContact O-N 3.03Å; A129-I132 PolarHBondContact O-N 2.75Å
133	T	78.8	Confident	86	Confident	21 Å²	21	24.7 Å²	24.7	13%	0.129	13%	0.125	C	C	.	.			trans	-112	101.9	-177	-52.5	0	0	0	0	110.1	A129 F130 D135 L136 R177 L661	A129-T133 PolarHBondContact O-N 3.16Å; A129-T133 VanDerWaalsContact O-N 3.16Å; F130-T133 CarbonylContact O-C 3.59Å; T133-D135 PolarHBondContact O-N 2.91Å; T133-L136 HydrophobicContact CG2-CB 3.8Å; T133-L136 WeakPolarHBondContact O-CB 3.49Å; T133-L136 PolarHBondContact O-N 3.16Å; T133-R177 PolarHBondContact O-NH1 2.96Å; T133-L661 HydrophobicContact CG2-CD2 4.42Å
134	S	74.6	Confident	85.3	Confident	31 Å²	31	24 Å²	24	22%	0.217	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-38.5	178.7	36	0	0	0	0	114.2	R177	S134-R177 PolarHBondContact O-NH1 3.07Å
135	D	80	Confident	84.3	Confident	43 Å²	43	25.7 Å²	25.7	23%	0.23	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-8.1	-171.6	-58.3	-97.8	0	0	0	112.4	L103 N104 T133 E137 R464	L103-D135 HydrophobicContact CD1-CB 3.98Å; L103-D135 HydrophobicContact CG-CB 4.36Å; N104-D135 VanDerWaalsContact CA-O 3.26Å; N104-D135 WeakPolarHBondContact CA-O 3.48Å; N104-D135 VanDerWaalsContact CB-O 3.31Å; N104-D135 WeakPolarHBondContact CB-O 3.48Å; T133-D135 PolarHBondContact O-N 2.91Å; D135-E137 PolarHBondContact O-N 3.37Å; D135-R464 VanDerWaalsContact CG-NH2 3.29Å; D135-R464 IonicContact OD1-CZ 3.39Å; D135-R464 VanDerWaalsContact OD1-CZ 3.27Å; D135-R464 IonicContact OD1-NH1 3.46Å; D135-R464 PolarHBondContact OD1-NH1 3.3Å; D135-R464 IonicContact OD1-NH2 2.65Å; D135-R464 PolarHBondContact OD1-NH2 3.07Å; D135-R464 IonicContact OD2-CZ 2.73Å; D135-R464 IonicContact OD2-NH1 2.75Å; D135-R464 IonicContact OD2-NH2 3.6Å; D135-R464 PolarHBondContact OD2-NH2 3.5Å
136	L	87.2	Confident	83.1	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.016	18%	0.183	C	C	.	.			trans	-72.6	114.5	176.3	-173.5	68.9	0	0	0	109.9	L106 F130 T133 H138 V139 R177	L106-L136 HydrophobicContact CB-CD1 4Å; L106-L136 HydrophobicContact CD1-CD1 3.88Å; L106-L136 HydrophobicContact CD1-CD2 4.15Å; L106-L136 HydrophobicContact CG-CD1 3.71Å; F130-L136 HydrophobicContact CD1-CB 4.25Å; F130-L136 HydrophobicContact CD1-CD2 3.79Å; F130-L136 HydrophobicContact CD1-CG 3.84Å; F130-L136 WeakPolarHBondContact CD1-O 3.29Å; F130-L136 HydrophobicContact CE1-CD2 4.03Å; F130-L136 HydrophobicContact CE1-CG 3.89Å; T133-L136 HydrophobicContact CG2-CB 3.8Å; T133-L136 WeakPolarHBondContact O-CB 3.49Å; T133-L136 PolarHBondContact O-N 3.16Å; L136-H138 VanDerWaalsContact CD1-O 3.31Å; L136-H138 WeakPolarHBondContact CD1-O 3.46Å; L136-V139 HydrophobicContact CD2-CG2 4.29Å; L136-R177 WeakPolarHBondContact O-CD 3.46Å; L136-R177 PolarHBondContact O-NH1 3.3Å
137	E	86.9	Confident	82	Confident	39 Å²	39	36.7 Å²	36.7	18%	0.182	19%	0.193	C	C	.	.			trans	-107.2	-24.9	177	-61.7	-171.1	129.6	0	0	112	N104 D135 R177 R467	N104-E137 HydrophobicContact CB-CB 4.12Å; N104-E137 HydrophobicContact CB-CG 4.11Å; N104-E137 PolarHBondContact ND2-OE2 2.99Å; N104-E137 PolarHBondContact O-N 3.06Å; D135-E137 PolarHBondContact O-N 3.37Å; E137-R177 PolarHBondContact O-N 2.87Å; E137-R467 IonicContact OE1-CZ 3.19Å; E137-R467 IonicContact OE1-NE 2.97Å; E137-R467 PolarHBondContact OE1-NE 3.29Å; E137-R467 IonicContact OE1-NH2 2.72Å; E137-R467 PolarHBondContact OE1-NH2 3.43Å; E137-R467 IonicContact OE2-CZ 2.68Å; E137-R467 IonicContact OE2-NE 3.23Å; E137-R467 IonicContact OE2-NH2 2.73Å
138	H	91.1	Very high	81.4	Confident	20 Å²	20	36.4 Å²	36.4	9%	0.093	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	138.4	-171.8	-53.5	-41.6	0	0	0	112.2	N104 S105 L106 L136 I174 C175	N104-H138 PolarHBondContact O-N 2.91Å; S105-H138 WeakPolarHBondContact CA-O 3.44Å; L106-H138 PolarHBondContact N-O 3.25Å; L136-H138 VanDerWaalsContact CD1-O 3.31Å; L136-H138 WeakPolarHBondContact CD1-O 3.46Å; H138-I174 HydrophobicContact CB-CD1 4.04Å; H138-I174 HydrophobicContact CB-CG1 4.26Å; H138-C175 WeakPolarHBondContact CA-O 3.48Å
139	V	93	Very high	81	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	129.4	162.7	-176.5	0	0	0	0	107.9	F70 L106 L108 L126 F130 L136 F157 C175	F70-V139 HydrophobicContact CD1-CG1 3.96Å; F70-V139 HydrophobicContact CE1-CG1 3.84Å; L106-V139 CarbonylContact O-C 3.46Å; L106-V139 WeakPolarHBondContact O-CA 3.23Å; L108-V139 HydrophobicContact CB-CG1 4.32Å; L126-V139 HydrophobicContact CD2-CB 4.46Å; L126-V139 HydrophobicContact CD2-CG2 4.15Å; F130-V139 HydrophobicContact CE1-CG2 4.06Å; F130-V139 HydrophobicContact CZ-CG2 3.85Å; L136-V139 HydrophobicContact CD2-CG2 4.29Å; V139-F157 HydrophobicContact CB-CE1 4.16Å; V139-F157 HydrophobicContact CG1-CE1 3.88Å; V139-F157 HydrophobicContact CG1-CZ 4.08Å; V139-C175 HydrophobicContact CB-CB 4.37Å; V139-C175 PolarHBondContact N-O 2.95Å; V139-C175 PolarHBondContact O-N 3.39Å
140	L	91.4	Very high	80.6	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	139.5	-175.9	-64.9	172.4	0	0	0	111	L91 C100 L106 F107 L108 R173 I174	L91-L140 HydrophobicContact CD1-CD1 3.55Å; C100-L140 HydrophobicContact CB-CD1 4.33Å; L106-L140 PolarHBondContact O-N 3.07Å; F107-L140 CarbonylContact C-O 3.56Å; F107-L140 WeakPolarHBondContact CA-O 3.43Å; F107-L140 HydrophobicContact CD1-CB 3.68Å; F107-L140 HydrophobicContact CD1-CD1 4.17Å; F107-L140 HydrophobicContact CE1-CB 3.92Å; F107-L140 HydrophobicContact CE1-CD1 3.59Å; F107-L140 HydrophobicContact CE1-CG 4.43Å; F107-L140 HydrophobicContact CZ-CD1 3.98Å; L108-L140 PolarHBondContact N-O 3.01Å; L140-R173 WeakPolarHBondContact CA-O 3.45Å; L140-I174 HydrophobicContact CD2-CB 4.09Å; L140-I174 HydrophobicContact CD2-CD1 4.06Å; L140-I174 HydrophobicContact CD2-CG1 3.89Å
141	L	90.1	Very high	80.5	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	114.6	172.4	175.4	57	0	0	0	107.8	F39 L108 C143 L149 L153 F157 R173	F39-L141 HydrophobicContact CE1-CD1 3.8Å; F39-L141 HydrophobicContact CZ-CD1 4.37Å; L108-L141 HydrophobicContact CD2-CD1 4.33Å; L141-C143 VanDerWaalsContact CD1-SG 3.59Å; L141-L149 HydrophobicContact CD2-CD2 4.03Å; L141-L153 HydrophobicContact CD2-CB 4.45Å; L141-F157 HydrophobicContact CB-CD1 3.78Å; L141-F157 HydrophobicContact CB-CE1 4.05Å; L141-F157 HydrophobicContact CB-CG 4.25Å; L141-F157 HydrophobicContact CD2-CB 4.47Å; L141-F157 HydrophobicContact CD2-CD2 4.34Å; L141-F157 HydrophobicContact CD2-CG 4.22Å; L141-R173 HydrophobicContact CB-CB 4.4Å; L141-R173 PolarHBondContact N-O 2.73Å; L141-R173 PolarHBondContact O-N 2.87Å
142	L	85.9	Confident	80.8	Confident	11 Å²	11	41.7 Å²	41.7	6%	0.058	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	122.9	175.3	-61	-178	0	0	0	108.5	P74 A78 F107 A172	P74-L142 HydrophobicContact CB-CD1 3.93Å; A78-L142 HydrophobicContact CB-CB 4.2Å; A78-L142 HydrophobicContact CB-CD1 3.95Å; F107-L142 HydrophobicContact CD1-CD1 3.96Å; F107-L142 HydrophobicContact CD1-CG 4.07Å; F107-L142 HydrophobicContact CE1-CD1 3.73Å; F107-L142 HydrophobicContact CE1-CG 4.1Å; L142-A172 HydrophobicContact CD2-CB 3.62Å
143	C	79.7	Confident	81.1	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.014	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	142.5	-177.9	-62.8	0	0	0	0	111.1	L141 S171	L141-C143 VanDerWaalsContact CD1-SG 3.59Å; C143-S171 PolarHBondContact N-O 3.33Å; C143-S171 PolarHBondContact O-N 3.21Å; C143-S171 PolarHBondContact O-OG 2.92Å
144	P	74.6	Confident	81.4	Confident	58 Å²	58	43.8 Å²	43.8	38%	0.377	24%	0.238	S	C	.	.			trans	-57.3	144.6	166.7	-15.9	28	0	0	0	110.5	C147	P144-C147 WeakPolarHBondContact O-CB 3.36Å; P144-C147 PolarHBondContact O-N 3.11Å; P144-C147 PolarHBondContact O-SG 3.44Å
145	D	66.6	Low	82	Confident	97 Å²	97	50 Å²	50	52%	0.519	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	143.4	-177.5	-80.2	16.4	0	0	0	112.1	C147 S171	D145-C147 PolarHBondContact O-N 3.12Å; D145-S171 PolarHBondContact OD1-N 3.34Å
146	Q	66.4	Low	82.4	Confident	200 Å²	200	49.5 Å²	49.5	94%	0.935	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	16.9	-179.6	-48	178.2	24.5	0	0	115.3
147	C	69.4	Low	82.4	Confident	31 Å²	31	49.4 Å²	49.4	21%	0.209	26%	0.262	C	S	.	.			trans	-67.5	139.3	172.7	-77.5	0	0	0	0	113.2	P144 D145 L149	P144-C147 WeakPolarHBondContact O-CB 3.36Å; P144-C147 PolarHBondContact O-N 3.11Å; P144-C147 PolarHBondContact O-SG 3.44Å; D145-C147 PolarHBondContact O-N 3.12Å; C147-L149 PolarHBondContact O-N 3.25Å
148	P	72.6	Confident	82.4	Confident	85 Å²	85	51.8 Å²	51.8	55%	0.552	27%	0.273	S	S	*	.			trans	-76.5	102.1	175.3	31.2	-33.3	0	0	0	110.6	V38	V38-P148 WeakPolarHBondContact CG2-O 3.45Å
149	L	80.1	Confident	82.2	Confident	26 Å²	26	56 Å²	56	14%	0.136	30%	0.296	C	S	.	.			trans	-83.7	150.9	175.2	-80.4	158.6	0	0	0	111.8	V38 L141 C147 L153	V38-L149 HydrophobicContact CB-CD2 4.5Å; V38-L149 HydrophobicContact CG1-CD2 3.69Å; V38-L149 HydrophobicContact CG2-CD2 3.91Å; V38-L149 HydrophobicContact CG2-CG 4.31Å; L141-L149 HydrophobicContact CD2-CD2 4.03Å; C147-L149 PolarHBondContact O-N 3.25Å; L149-L153 HydrophobicContact CD2-CB 4.29Å; L149-L153 HydrophobicContact CD2-CD1 4.01Å
150	E	80.1	Confident	81.7	Confident	51 Å²	51	57.1 Å²	57.1	24%	0.238	30%	0.302	C	S	.	.			trans	-66.5	136.9	169.7	-173.5	175.3	-156.1	0	0	109.4	F111 V152 L153 E154	F111-E150 WeakPolarHBondContact CE1-OE2 3.08Å; E150-V152 HydrophobicContact CG-CB 4.43Å; E150-V152 PolarHBondContact O-N 2.9Å; E150-L153 HydrophobicContact CB-CD1 4.37Å; E150-L153 HydrophobicContact CB-CG 4.5Å; E150-L153 WeakPolarHBondContact O-CB 3.3Å; E150-L153 PolarHBondContact O-N 3.12Å; E150-E154 PolarHBondContact O-N 3.16Å
151	P	82.9	Confident	80.7	Confident	84 Å²	84	65.7 Å²	65.7	55%	0.545	34%	0.342	S	S	.	.	H	α-helix	trans	-52.9	-36.1	-175.9	-30	36.1	0	0	0	114	L153 E154 E155	P151-L153 VanDerWaalsContact C-N 3.31Å; P151-L153 PolarHBondContact O-N 3.15Å; P151-E154 CarbonylContact O-C 3.6Å; P151-E154 PolarHBondContact O-N 3.41Å; P151-E155 WeakPolarHBondContact O-CG 3.5Å; P151-E155 PolarHBondContact O-N 3.38Å
152	V	86.1	Confident	79.7	Confident	24 Å²	24	70.6 Å²	70.6	15%	0.145	36%	0.36	C	S	.	.	H	α-helix	trans	-60.7	-37.1	177	172	0	0	0	0	112.2	A118 L122 E150 T156	A118-V152 HydrophobicContact CB-CB 4.49Å; A118-V152 HydrophobicContact CB-CG2 3.82Å; L122-V152 HydrophobicContact CB-CG1 4.1Å; L122-V152 HydrophobicContact CD2-CG1 3.67Å; E150-V152 HydrophobicContact CG-CB 4.43Å; E150-V152 PolarHBondContact O-N 2.9Å; V152-T156 VanDerWaalsContact O-CB 3.22Å; V152-T156 WeakPolarHBondContact O-CB 3.49Å; V152-T156 PolarHBondContact O-N 2.72Å; V152-T156 VanDerWaalsContact O-N 3.16Å; V152-T156 PolarHBondContact O-OG1 2.97Å
153	L	86.4	Confident	78.4	Confident	4 Å²	4	76 Å²	76	2%	0.021	39%	0.385	C	S	.	.	H	α-helix	trans	-74.3	-31.9	174.3	-66.7	173.1	0	0	0	111.6	F39 L108 F111 L122 L141 L149 E150 P151 F157	F39-L153 HydrophobicContact CZ-CD1 4.28Å; L108-L153 HydrophobicContact CD2-CD2 4.08Å; F111-L153 HydrophobicContact CB-CD2 4.33Å; F111-L153 HydrophobicContact CD1-CD1 4.25Å; F111-L153 HydrophobicContact CD1-CD2 3.98Å; F111-L153 HydrophobicContact CD1-CG 4.18Å; F111-L153 HydrophobicContact CG-CD2 4.28Å; L122-L153 HydrophobicContact CD2-CD2 3.92Å; L141-L153 HydrophobicContact CD2-CB 4.45Å; L149-L153 HydrophobicContact CD2-CB 4.29Å; L149-L153 HydrophobicContact CD2-CD1 4.01Å; E150-L153 HydrophobicContact CB-CD1 4.37Å; E150-L153 HydrophobicContact CB-CG 4.5Å; E150-L153 WeakPolarHBondContact O-CB 3.3Å; E150-L153 PolarHBondContact O-N 3.12Å; P151-L153 VanDerWaalsContact C-N 3.31Å; P151-L153 PolarHBondContact O-N 3.15Å; L153-F157 HydrophobicContact CD2-CD2 4.17Å; L153-F157 HydrophobicContact CD2-CE2 3.9Å; L153-F157 WeakPolarHBondContact O-CB 3.43Å; L153-F157 PolarHBondContact O-N 2.66Å
154	E	85.1	Confident	77.1	Confident	108 Å²	108	79.3 Å²	79.3	51%	0.505	41%	0.413	S	S	.	.	H	α-helix	trans	-73.4	-37.8	177.8	-177.8	139	-90.5	0	0	112.9	E150 P151 R173	E150-E154 PolarHBondContact O-N 3.16Å; P151-E154 CarbonylContact O-C 3.6Å; P151-E154 PolarHBondContact O-N 3.41Å; E154-R173 IonicContact OE1-CZ 2.71Å; E154-R173 IonicContact OE1-NH1 2.84Å; E154-R173 PolarHBondContact OE1-NH1 3.22Å; E154-R173 IonicContact OE1-NH2 3.97Å; E154-R173 PolarHBondContact OE1-NH2 3.42Å
155	E	86.6	Confident	75.9	Confident	162 Å²	162	84.7 Å²	84.7	76%	0.757	44%	0.438	S	S	*	.	H	α-helix	trans	-70.4	-34.7	173.1	-70.5	170.6	-176	0	0	112.3	P151	P151-E155 WeakPolarHBondContact O-CG 3.5Å; P151-E155 PolarHBondContact O-N 3.38Å
156	T	87.2	Confident	75.4	Confident	31 Å²	31	83.3 Å²	83.3	19%	0.19	44%	0.436	C	S	.	.	H	α-helix	trans	-87.4	-34.8	-174.8	-54.4	0	0	0	0	113.9	L122 L126 V152	L122-T156 HydrophobicContact CD2-CG2 3.96Å; L126-T156 HydrophobicContact CD1-CG2 3.6Å; V152-T156 VanDerWaalsContact O-CB 3.22Å; V152-T156 WeakPolarHBondContact O-CB 3.49Å; V152-T156 PolarHBondContact O-N 2.72Å; V152-T156 VanDerWaalsContact O-N 3.16Å; V152-T156 PolarHBondContact O-OG1 2.97Å
157	F	88.7	Confident	75	Confident	2 Å²	2	82.9 Å²	82.9	1%	0.009	43%	0.434	C	S	.	.	S	Bend	trans	-106.6	106.8	-176.2	-71.1	-101.4	0	0	0	111.7	L108 L122 V139 L141 L153 R173 C175	L108-F157 HydrophobicContact CD2-CE2 4.18Å; L108-F157 HydrophobicContact CD2-CZ 3.91Å; L122-F157 HydrophobicContact CD2-CE2 4.41Å; V139-F157 HydrophobicContact CB-CE1 4.16Å; V139-F157 HydrophobicContact CG1-CE1 3.88Å; V139-F157 HydrophobicContact CG1-CZ 4.08Å; L141-F157 HydrophobicContact CB-CD1 3.78Å; L141-F157 HydrophobicContact CB-CE1 4.05Å; L141-F157 HydrophobicContact CB-CG 4.25Å; L141-F157 HydrophobicContact CD2-CB 4.47Å; L141-F157 HydrophobicContact CD2-CD2 4.34Å; L141-F157 HydrophobicContact CD2-CG 4.22Å; L153-F157 HydrophobicContact CD2-CD2 4.17Å; L153-F157 HydrophobicContact CD2-CE2 3.9Å; L153-F157 WeakPolarHBondContact O-CB 3.43Å; L153-F157 PolarHBondContact O-N 2.66Å; F157-R173 HydrophobicContact CB-CB 3.69Å; F157-C175 HydrophobicContact CD1-CB 3.62Å; F157-C175 HydrophobicContact CE1-CB 3.53Å; F157-C175 HydrophobicContact CE2-CB 4.45Å; F157-C175 HydrophobicContact CG-CB 4.13Å; F157-C175 HydrophobicContact CZ-CB 3.97Å
158	Q	87.1	Confident	74.4	Confident	89 Å²	89	82.6 Å²	82.6	42%	0.416	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	130.8	179.5	-60.1	175.5	17.2	0	0	111	L160 R173 I174	Q158-L160 PolarHBondContact O-N 3.21Å; Q158-R173 CarbonylContact O-C 3.4Å; Q158-R173 VanDerWaalsContact O-CA 3.26Å; Q158-R173 WeakPolarHBondContact O-CA 3.45Å; Q158-I174 HydrophobicContact CB-CG2 4.39Å; Q158-I174 PolarHBondContact N-O 3.24Å; Q158-I174 PolarHBondContact O-N 2.92Å
159	L	85.6	Confident	74.1	Confident	108 Å²	108	81.8 Å²	81.8	57%	0.565	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	128.2	176.4	-175.9	66.5	0	0	0	111.1	Q161 R173	L159-Q161 PolarHBondContact O-N 2.93Å; L159-R173 HydrophobicContact CD1-CG 3.98Å
160	L	82.3	Confident	73.9	Confident	24 Å²	24	80.9 Å²	80.9	13%	0.126	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-76.8	116.3	175.7	-72.4	172.3	0	0	0	110.4	W95 A98 Q158 A172 I174	W95-L160 HydrophobicContact CB-CD1 4.29Å; W95-L160 HydrophobicContact CD2-CD1 4.45Å; W95-L160 HydrophobicContact CG-CB 4.06Å; W95-L160 HydrophobicContact CG-CD1 4.11Å; W95-L160 PolarHBondContact NE1-O 2.93Å; A98-L160 HydrophobicContact CB-CD1 4.22Å; A98-L160 HydrophobicContact CB-CD2 4.05Å; Q158-L160 PolarHBondContact O-N 3.21Å; L160-A172 WeakPolarHBondContact CB-O 3.49Å; L160-A172 HydrophobicContact CD1-CB 4.11Å; L160-A172 PolarHBondContact N-O 2.9Å; L160-I174 HydrophobicContact CD1-CB 4.38Å; L160-I174 HydrophobicContact CD2-CB 4.17Å; L160-I174 HydrophobicContact CD2-CG2 3.6Å; L160-I174 HydrophobicContact CG-CB 4.19Å; L160-I174 HydrophobicContact CG-CG2 3.97Å
161	Q	71.5	Confident	73.9	Confident	182 Å²	182	79.7 Å²	79.7	85%	0.85	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-68.2	137.8	171.1	-66.3	-176.4	-7.2	0	0	110.1	L159	L159-Q161 PolarHBondContact O-N 2.93Å
162	W	68.6	Low	74	Confident	104 Å²	104	75.8 Å²	75.8	39%	0.394	40%	0.396	S	S	.	.			trans	-104.1	145.5	-169.1	160.3	63.8	0	0	0	111.5	A164 S166	W162-A164 WeakPolarHBondContact CZ2-O 3.47Å; W162-S166 VanDerWaalsContact CZ2-C 3.48Å; W162-S166 VanDerWaalsContact CZ2-N 3.34Å; W162-S166 WeakPolarHBondContact CZ2-O 3.41Å
163	E	59.4	Low	74.1	Confident	124 Å²	124	76.2 Å²	76.2	58%	0.579	40%	0.395	S	S	*	.			trans	-120.2	118.8	-178.3	-63.1	-178.7	131.8	0	0	111.1
164	A	51.8	Low	74.3	Confident	72 Å²	72	76 Å²	76	60%	0.595	40%	0.395	S	S	*	.	S	Bend	trans	84.9	106.5	166.6	0	0	0	0	0	121.5	W162 S166	W162-A164 WeakPolarHBondContact CZ2-O 3.47Å; A164-S166 PolarHBondContact O-N 2.87Å
165	D	49.2	Very low	74.6	Confident	170 Å²	170	70.9 Å²	70.9	91%	0.909	37%	0.371	S	S	*	.	S	Bend	trans	57.4	-16	142.1	-63.7	4.1	0	0	0	124.2
166	S	56.2	Low	74.8	Confident	68 Å²	68	66.1 Å²	66.1	48%	0.476	35%	0.346	S	S	.	.	S	Bend	trans	-118.4	123	170.8	64.8	0	0	0	0	114.2	W162 A164 A168	W162-S166 VanDerWaalsContact CZ2-C 3.48Å; W162-S166 VanDerWaalsContact CZ2-N 3.34Å; W162-S166 WeakPolarHBondContact CZ2-O 3.41Å; A164-S166 PolarHBondContact O-N 2.87Å; S166-A168 PolarHBondContact O-N 2.86Å
167	E	57.3	Low	74.7	Confident	191 Å²	191	66 Å²	66	89%	0.893	34%	0.342	S	S	*	.			trans	-44	121.2	-178.7	-67.2	-174.7	147.5	0	0	113
168	A	57.8	Low	74.3	Confident	26 Å²	26	70.1 Å²	70.1	22%	0.215	36%	0.361	C	S	.	.			trans	-69.9	126.9	-177.7	0	0	0	0	0	110.4	W95 S166 C170	W95-A168 HydrophobicContact CZ2-CB 4.46Å; S166-A168 PolarHBondContact O-N 2.86Å; A168-C170 PolarHBondContact O-N 3.22Å
169	P	66.6	Low	74.1	Confident	67 Å²	67	69.4 Å²	69.4	44%	0.435	36%	0.36	S	S	.	.	S	Bend	trans	-76.1	-4.2	-171.6	29.5	-37.5	0	0	0	115.1	V81 F90	V81-P169 HydrophobicContact CG1-CB 3.55Å; V81-P169 HydrophobicContact CG1-CG 3.26Å; V81-P169 HydrophobicContact CG2-CB 4.3Å; F90-P169 HydrophobicContact CE2-CG 4.19Å; F90-P169 HydrophobicContact CZ-CG 4.1Å
170	C	75.5	Confident	73.7	Confident	8 Å²	8	65.3 Å²	65.3	5%	0.054	34%	0.338	C	S	.	.	S	Bend	trans	-163	153.4	169.9	60.2	0	0	0	0	111.4	A168	A168-C170 PolarHBondContact O-N 3.22Å
171	S	80	Confident	73.2	Confident	25 Å²	25	64.8 Å²	64.8	18%	0.175	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	131.6	172.1	70.1	0	0	0	0	112.1	C143 D145	C143-S171 PolarHBondContact N-O 3.33Å; C143-S171 PolarHBondContact O-N 3.21Å; C143-S171 PolarHBondContact O-OG 2.92Å; D145-S171 PolarHBondContact OD1-N 3.34Å
172	A	84.6	Confident	73	Confident	2 Å²	2	60.3 Å²	60.3	2%	0.017	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	128.2	177	0	0	0	0	0	110.9	W95 L142 L160	W95-A172 HydrophobicContact CD2-CB 4.24Å; W95-A172 HydrophobicContact CE3-CB 4.2Å; W95-A172 HydrophobicContact CH2-CB 3.61Å; W95-A172 HydrophobicContact CZ2-CB 3.64Å; W95-A172 HydrophobicContact CZ3-CB 3.9Å; L142-A172 HydrophobicContact CD2-CB 3.62Å; L160-A172 WeakPolarHBondContact CB-O 3.49Å; L160-A172 HydrophobicContact CD1-CB 4.11Å; L160-A172 PolarHBondContact N-O 2.9Å
173	R	88.9	Confident	72.9	Confident	33 Å²	33	63.2 Å²	63.2	13%	0.125	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	149.2	177.1	-48.9	-172.8	177.1	-155.2	1.3	111	L140 L141 E154 F157 Q158 L159	L140-R173 WeakPolarHBondContact CA-O 3.45Å; L141-R173 HydrophobicContact CB-CB 4.4Å; L141-R173 PolarHBondContact N-O 2.73Å; L141-R173 PolarHBondContact O-N 2.87Å; E154-R173 IonicContact OE1-CZ 2.71Å; E154-R173 IonicContact OE1-NH1 2.84Å; E154-R173 PolarHBondContact OE1-NH1 3.22Å; E154-R173 IonicContact OE1-NH2 3.97Å; E154-R173 PolarHBondContact OE1-NH2 3.42Å; F157-R173 HydrophobicContact CB-CB 3.69Å; Q158-R173 CarbonylContact O-C 3.4Å; Q158-R173 VanDerWaalsContact O-CA 3.26Å; Q158-R173 WeakPolarHBondContact O-CA 3.45Å; L159-R173 HydrophobicContact CD1-CG 3.98Å
174	I	90.5	Very high	73.3	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	134.3	-173.9	-166.4	166.8	0	0	0	111.8	A98 H138 L140 Q158 L160 R176	A98-I174 HydrophobicContact CB-CD1 4.48Å; H138-I174 HydrophobicContact CB-CD1 4.04Å; H138-I174 HydrophobicContact CB-CG1 4.26Å; L140-I174 HydrophobicContact CD2-CB 4.09Å; L140-I174 HydrophobicContact CD2-CD1 4.06Å; L140-I174 HydrophobicContact CD2-CG1 3.89Å; Q158-I174 HydrophobicContact CB-CG2 4.39Å; Q158-I174 PolarHBondContact N-O 3.24Å; Q158-I174 PolarHBondContact O-N 2.92Å; L160-I174 HydrophobicContact CD1-CB 4.38Å; L160-I174 HydrophobicContact CD2-CB 4.17Å; L160-I174 HydrophobicContact CD2-CG2 3.6Å; L160-I174 HydrophobicContact CG-CB 4.19Å; L160-I174 HydrophobicContact CG-CG2 3.97Å; I174-R176 HydrophobicContact CG1-CG 4.38Å
175	C	91.8	Very high	74.4	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	130.1	164.6	155.1	0	0	0	0	107.4	H138 V139 F157 H180	H138-C175 WeakPolarHBondContact CA-O 3.48Å; V139-C175 HydrophobicContact CB-CB 4.37Å; V139-C175 PolarHBondContact N-O 2.95Å; V139-C175 PolarHBondContact O-N 3.39Å; F157-C175 HydrophobicContact CD1-CB 3.62Å; F157-C175 HydrophobicContact CE1-CB 3.53Å; F157-C175 HydrophobicContact CE2-CB 4.45Å; F157-C175 HydrophobicContact CG-CB 4.13Å; F157-C175 HydrophobicContact CZ-CB 3.97Å; C175-H180 PolarHBondContact SG-CD2 3.34Å; C175-H180 PolarHBondContact SG-NE2 2.91Å
176	R	89.5	Confident	75.6	Confident	62 Å²	62	54 Å²	54	23%	0.234	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	149.2	178.8	-55.3	-174.9	-170.8	77.3	0.7	111.3	I174 E178 D179	I174-R176 HydrophobicContact CG1-CG 4.38Å; R176-E178 HydrophobicContact CB-CG 4.04Å; R176-E178 WeakPolarHBondContact CD-OE1 3.34Å; R176-E178 PolarHBondContact O-N 3.46Å; R176-E178 VanDerWaalsContact O-N 3.17Å; R176-D179 WeakPolarHBondContact CA-OD2 3.15Å; R176-D179 VanDerWaalsContact CB-OD2 3.29Å; R176-D179 WeakPolarHBondContact CB-OD2 3.3Å; R176-D179 PolarHBondContact N-OD2 3.01Å; R176-D179 WeakPolarHBondContact O-CB 3.41Å; R176-D179 PolarHBondContact O-N 3.42Å; R176-D179 VanDerWaalsContact O-N 3.1Å
177	R	85	Confident	76.9	Confident	29 Å²	29	52.6 Å²	52.6	11%	0.109	25%	0.25	C	S	.	.	H	α-helix	trans	-53	-37.2	175.5	-174.4	-175.4	-167.4	94	11.2	112.9	F130 T133 S134 L136 E137 D179 H180 C181	F130-R177 HydrophobicContact CB-CG 4.22Å; F130-R177 HydrophobicContact CD1-CB 3.83Å; F130-R177 HydrophobicContact CD1-CG 3.86Å; F130-R177 HydrophobicContact CE1-CB 3.79Å; F130-R177 HydrophobicContact CE1-CG 4.35Å; F130-R177 HydrophobicContact CG-CB 4.26Å; F130-R177 HydrophobicContact CG-CG 3.97Å; F130-R177 HydrophobicContact CZ-CB 4.2Å; F130-R177 PolarHBondContact O-NH1 2.89Å; F130-R177 PolarHBondContact O-NH2 2.75Å; T133-R177 PolarHBondContact O-NH1 2.96Å; S134-R177 PolarHBondContact O-NH1 3.07Å; L136-R177 WeakPolarHBondContact O-CD 3.46Å; L136-R177 PolarHBondContact O-NH1 3.3Å; E137-R177 PolarHBondContact O-N 2.87Å; R177-D179 VanDerWaalsContact C-N 3.29Å; R177-D179 PolarHBondContact O-N 3.27Å; R177-H180 PolarHBondContact O-N 2.89Å; R177-C181 HydrophobicContact CG-CB 4.29Å; R177-C181 WeakPolarHBondContact O-CB 3.49Å; R177-C181 PolarHBondContact O-N 3.02Å
178	E	81.5	Confident	77.9	Confident	88 Å²	88	50.4 Å²	50.4	41%	0.411	23%	0.234	S	C	.	.	H	α-helix	trans	-71.4	-20.3	-177.2	62.7	-149.2	166.7	0	0	114	R176 R183	R176-E178 HydrophobicContact CB-CG 4.04Å; R176-E178 WeakPolarHBondContact CD-OE1 3.34Å; R176-E178 PolarHBondContact O-N 3.46Å; R176-E178 VanDerWaalsContact O-N 3.17Å; E178-R183 IonicContact OE2-CZ 3.21Å; E178-R183 VanDerWaalsContact OE2-CZ 3.23Å; E178-R183 IonicContact OE2-NH1 3.84Å; E178-R183 PolarHBondContact OE2-NH1 2.85Å; E178-R183 IonicContact OE2-NH2 2.8Å; E178-R183 PolarHBondContact OE2-NH2 3.39Å
179	D	81.8	Confident	79.1	Confident	73 Å²	73	49.5 Å²	49.5	39%	0.39	23%	0.226	S	C	.	.	H	α-helix	trans	-71	-32.9	174.1	-52.3	-45.7	0	0	0	111.2	R176 R177	R176-D179 WeakPolarHBondContact CA-OD2 3.15Å; R176-D179 VanDerWaalsContact CB-OD2 3.29Å; R176-D179 WeakPolarHBondContact CB-OD2 3.3Å; R176-D179 PolarHBondContact N-OD2 3.01Å; R176-D179 WeakPolarHBondContact O-CB 3.41Å; R176-D179 PolarHBondContact O-N 3.42Å; R176-D179 VanDerWaalsContact O-N 3.1Å; R177-D179 VanDerWaalsContact C-N 3.29Å; R177-D179 PolarHBondContact O-N 3.27Å
180	H	79.1	Confident	80	Confident	23 Å²	23	53.6 Å²	53.6	11%	0.106	23%	0.233	C	C	.	.	H	α-helix	trans	-106.8	-22.9	-176.5	-64.5	-79	0	0	0	114.8	R127 F130 C175 R177	R127-H180 HydrophobicContact CG-CB 4.1Å; R127-H180 PolarHBondContact NE-O 3.39Å; F130-H180 HydrophobicContact CD2-CB 4.39Å; F130-H180 HydrophobicContact CE2-CB 4.44Å; C175-H180 PolarHBondContact SG-CD2 3.34Å; C175-H180 PolarHBondContact SG-NE2 2.91Å; R177-H180 PolarHBondContact O-N 2.89Å
181	C	71.2	Confident	80.2	Confident	13 Å²	13	57.2 Å²	57.2	9%	0.088	26%	0.255	C	S	.	.	S	Bend	trans	-125.9	95.9	-176.8	-60.2	0	0	0	0	110.6	R177 R183	R177-C181 HydrophobicContact CG-CB 4.29Å; R177-C181 WeakPolarHBondContact O-CB 3.49Å; R177-C181 PolarHBondContact O-N 3.02Å; C181-R183 PolarHBondContact O-N 2.86Å
182	K	67.2	Low	80.4	Confident	87 Å²	87	60.2 Å²	60.2	38%	0.378	28%	0.281	S	S	.	.			trans	-48.9	130.5	172.3	-76.5	-176.7	168.8	-175.1	0	111.1	D235 E236	K182-D235 IonicContact NZ-OD1 3.11Å; K182-D235 IonicContact NZ-OD2 2.65Å; K182-E236 IonicContact NZ-OE1 2.61Å; K182-E236 PolarHBondContact NZ-OE1 3.02Å
183	R	65.9	Low	80.3	Confident	165 Å²	165	60.5 Å²	60.5	62%	0.623	28%	0.282	S	S	*	.			trans	-83.1	114.8	169.3	-67.6	-169.7	-175.6	108.4	4.7	109.5	E178 C181	E178-R183 IonicContact OE2-CZ 3.21Å; E178-R183 VanDerWaalsContact OE2-CZ 3.23Å; E178-R183 IonicContact OE2-NH1 3.84Å; E178-R183 PolarHBondContact OE2-NH1 2.85Å; E178-R183 IonicContact OE2-NH2 2.8Å; E178-R183 PolarHBondContact OE2-NH2 3.39Å; C181-R183 PolarHBondContact O-N 2.86Å
184	L	68.8	Low	80	Confident	27 Å²	27	60.9 Å²	60.9	14%	0.141	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-62.8	142.7	175.3	-63	176.6	0	0	0	111.4	L233 D235 V240 F407	L184-L233 HydrophobicContact CB-CD2 3.69Å; L184-L233 HydrophobicContact CD1-CB 4.46Å; L184-L233 HydrophobicContact CD1-CD2 3.82Å; L184-L233 HydrophobicContact CG-CD2 4.42Å; L184-D235 HydrophobicContact CD2-CB 3.62Å; L184-V240 HydrophobicContact CD1-CG2 3.8Å; L184-V240 HydrophobicContact CD2-CG2 4.01Å; L184-V240 HydrophobicContact CG-CG2 4.5Å; L184-F407 HydrophobicContact CD1-CB 4.3Å; L184-F407 HydrophobicContact CD1-CD1 3.42Å; L184-F407 VanDerWaalsContact CD1-CD1 3.42Å; L184-F407 HydrophobicContact CD1-CD2 4.5Å; L184-F407 HydrophobicContact CD1-CE1 3.74Å; L184-F407 HydrophobicContact CD1-CG 3.85Å; L184-F407 HydrophobicContact CD1-CZ 4.39Å; L184-F407 HydrophobicContact CG-CD1 3.94Å; L184-F407 HydrophobicContact CG-CE1 4.09Å
185	H	73.9	Confident	79.5	Confident	120 Å²	120	66.4 Å²	66.4	56%	0.556	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	124.7	174.9	-176.7	71.2	0	0	0	110	Q234	H185-Q234 PolarHBondContact N-O 3.03Å; H185-Q234 PolarHBondContact O-N 3.48Å
186	V	75.6	Confident	79	Confident	27 Å²	27	70 Å²	70	16%	0.164	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.9	176.5	-171.6	0	0	0	0	109.1	A231 L233 V414	V186-A231 HydrophobicContact CG1-CB 4.07Å; V186-L233 HydrophobicContact CG2-CD2 3.83Å; V186-V414 HydrophobicContact CB-CB 4.32Å; V186-V414 HydrophobicContact CB-CG1 4.13Å; V186-V414 HydrophobicContact CB-CG2 4.12Å; V186-V414 HydrophobicContact CG1-CB 4.13Å; V186-V414 HydrophobicContact CG1-CG1 3.74Å; V186-V414 HydrophobicContact CG1-CG2 4.48Å; V186-V414 HydrophobicContact CG2-CG2 4.28Å
187	R	82	Confident	78.5	Confident	37 Å²	37	67 Å²	67	14%	0.14	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	164.5	172.7	66.5	160.6	174.8	84.1	0.7	112.1	D193 A231 V232 Q234	R187-D193 IonicContact CZ-OD1 3.31Å; R187-D193 IonicContact CZ-OD2 3.53Å; R187-D193 IonicContact NH1-OD1 2.73Å; R187-D193 PolarHBondContact NH1-OD1 3.33Å; R187-D193 IonicContact NH1-OD2 2.68Å; R187-D193 PolarHBondContact NH1-OD2 3.23Å; R187-D193 IonicContact NH2-OD1 3.17Å; R187-D193 PolarHBondContact NH2-OD1 3.23Å; R187-D193 IonicContact NH2-OD2 2.76Å; R187-A231 CarbonylContact O-C 3.54Å; R187-A231 WeakPolarHBondContact O-CA 3.39Å; R187-A231 WeakPolarHBondContact O-CB 3.31Å; R187-V232 HydrophobicContact CG-CG2 3.74Å; R187-V232 PolarHBondContact N-O 2.64Å; R187-V232 PolarHBondContact O-N 3.38Å; R187-Q234 VanDerWaalsContact NE-CD 3.26Å
188	R	79.8	Confident	78	Confident	146 Å²	146	66.6 Å²	66.6	55%	0.551	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.7	137.8	172.3	-163.2	172.3	-177	178.8	-2.9	111	Q224	R188-Q224 VanDerWaalsContact CG-OE1 3.31Å; R188-Q224 PolarHBondContact NH2-O 3.33Å; R188-Q224 VanDerWaalsContact NH2-O 3.07Å
189	A	81.9	Confident	77.8	Confident	6 Å²	6	68.7 Å²	68.7	5%	0.05	33%	0.332	C	S	.	.			trans	-71.2	149	177.5	0	0	0	0	0	111.2	D193 I221 Q224 A230 V232 F242	A189-D193 WeakPolarHBondContact CA-OD2 3.36Å; A189-I221 HydrophobicContact CB-CG2 4.47Å; A189-Q224 PolarHBondContact O-NE2 2.95Å; A189-A230 HydrophobicContact CB-CB 3.93Å; A189-A230 PolarHBondContact N-O 2.7Å; A189-V232 HydrophobicContact CB-CG1 4.08Å; A189-F242 HydrophobicContact CB-CD2 4.37Å; A189-F242 HydrophobicContact CB-CE2 3.95Å
190	R	85.8	Confident	77.3	Confident	154 Å²	154	65.5 Å²	65.5	58%	0.581	32%	0.315	S	S	*	.			trans	-129.3	154.5	-178.8	-58	171.7	-178.7	171	-0.1	108.8	A192 D193 I221	R190-A192 PolarHBondContact O-N 2.85Å; R190-D193 PolarHBondContact N-OD2 2.88Å; R190-D193 VanDerWaalsContact O-CB 3.31Å; R190-D193 WeakPolarHBondContact O-CB 3.34Å; R190-D193 PolarHBondContact O-N 3.09Å; R190-I221 VanDerWaalsContact C-CG2 3.43Å; R190-I221 WeakPolarHBondContact O-CG2 3.14Å
191	V	80.6	Confident	76.9	Confident	83 Å²	83	64.7 Å²	64.7	50%	0.503	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-57.9	-33.2	177.4	-176.2	0	0	0	0	112	D193 Y194 I221	V191-D193 PolarHBondContact O-N 2.99Å; V191-Y194 WeakPolarHBondContact O-CB 3.42Å; V191-Y194 PolarHBondContact O-N 2.83Å; V191-Y194 VanDerWaalsContact O-N 3.16Å; V191-I221 HydrophobicContact CG2-CG2 4.33Å
192	A	82.3	Confident	76.7	Confident	88 Å²	88	68.4 Å²	68.4	73%	0.727	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-66.6	-14.5	174.8	0	0	0	0	0	114.8	R190 Y194	R190-A192 PolarHBondContact O-N 2.85Å; A192-Y194 VanDerWaalsContact C-N 3.27Å
193	D	83.8	Confident	76.6	Confident	8 Å²	8	68.9 Å²	68.9	4%	0.043	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-81.7	-8.6	175.8	-51	-32	0	0	0	111.8	R187 A189 R190 V191 D195 D196 I197 V232 V239	R187-D193 IonicContact CZ-OD1 3.31Å; R187-D193 IonicContact CZ-OD2 3.53Å; R187-D193 IonicContact NH1-OD1 2.73Å; R187-D193 PolarHBondContact NH1-OD1 3.33Å; R187-D193 IonicContact NH1-OD2 2.68Å; R187-D193 PolarHBondContact NH1-OD2 3.23Å; R187-D193 IonicContact NH2-OD1 3.17Å; R187-D193 PolarHBondContact NH2-OD1 3.23Å; R187-D193 IonicContact NH2-OD2 2.76Å; A189-D193 WeakPolarHBondContact CA-OD2 3.36Å; R190-D193 PolarHBondContact N-OD2 2.88Å; R190-D193 VanDerWaalsContact O-CB 3.31Å; R190-D193 WeakPolarHBondContact O-CB 3.34Å; R190-D193 PolarHBondContact O-N 3.09Å; V191-D193 PolarHBondContact O-N 2.99Å; D193-D195 PolarHBondContact O-N 3.01Å; D193-D196 PolarHBondContact O-N 3.49Å; D193-I197 HydrophobicContact CB-CD1 3.97Å; D193-I197 WeakPolarHBondContact O-CD1 3.26Å; D193-I197 WeakPolarHBondContact O-CG1 3.44Å; D193-I197 PolarHBondContact O-N 2.9Å; D193-V232 HydrophobicContact CB-CG1 4.09Å; D193-V239 HydrophobicContact CB-CG2 4.43Å
194	Y	81.8	Confident	76.1	Confident	41 Å²	41	63 Å²	63	16%	0.161	31%	0.312	C	S	.	.	H	α-helix	trans	-58.7	-45.5	-171.7	176.3	-94.9	0	0	0	113.4	V191 A192 D196 I197 M198 P214 L217 I218	V191-Y194 WeakPolarHBondContact O-CB 3.42Å; V191-Y194 PolarHBondContact O-N 2.83Å; V191-Y194 VanDerWaalsContact O-N 3.16Å; A192-Y194 VanDerWaalsContact C-N 3.27Å; Y194-D196 PolarHBondContact O-N 3.4Å; Y194-I197 PolarHBondContact O-N 3.25Å; Y194-M198 HydrophobicContact CD1-CG 4.16Å; Y194-M198 HydrophobicContact CD2-CG 4.3Å; Y194-M198 HydrophobicContact CE1-CG 3.77Å; Y194-M198 HydrophobicContact CE2-CG 3.92Å; Y194-M198 HydrophobicContact CE2-SD 4.36Å; Y194-M198 HydrophobicContact CG-CG 4.42Å; Y194-M198 WeakPolarHBondContact O-CB 3.43Å; Y194-M198 WeakPolarHBondContact O-CG 3.24Å; Y194-M198 PolarHBondContact O-N 3.47Å; Y194-P214 WeakPolarHBondContact OH-CB 3.32Å; Y194-P214 PolarHBondContact OH-O 3.12Å; Y194-L217 HydrophobicContact CD2-CD2 4.14Å; Y194-L217 HydrophobicContact CE2-CB 4.21Å; Y194-L217 HydrophobicContact CE2-CD2 4.07Å; Y194-L217 HydrophobicContact CE2-CG 4.44Å; Y194-I218 HydrophobicContact CD2-CG1 3.75Å; Y194-I218 HydrophobicContact CE2-CD1 4.05Å; Y194-I218 HydrophobicContact CE2-CG1 3.36Å
195	D	80.3	Confident	75.2	Confident	118 Å²	118	64 Å²	64	63%	0.631	32%	0.32	S	S	*	.	H	α-helix	trans	-66.7	-38	-177.5	-65.5	-38.4	0	0	0	111.9	D193 M198 M199	D193-D195 PolarHBondContact O-N 3.01Å; D195-M198 PolarHBondContact O-N 3.38Å; D195-M199 PolarHBondContact O-N 3.36Å
196	D	82.5	Confident	73.8	Confident	74 Å²	74	64.1 Å²	64.1	40%	0.396	33%	0.329	S	S	.	.	H	α-helix	trans	-64.5	-45.2	173.9	-71.5	-18.9	0	0	0	111.2	D193 Y194 M198 M199 I200 V239	D193-D196 PolarHBondContact O-N 3.49Å; Y194-D196 PolarHBondContact O-N 3.4Å; D196-M198 VanDerWaalsContact C-N 3.33Å; D196-M198 PolarHBondContact O-N 2.93Å; D196-M199 WeakPolarHBondContact O-CB 3.33Å; D196-M199 PolarHBondContact O-N 3.4Å; D196-I200 PolarHBondContact O-N 3.16Å; D196-V239 HydrophobicContact CB-CB 3.85Å; D196-V239 HydrophobicContact CB-CG1 4.45Å; D196-V239 HydrophobicContact CB-CG2 4.23Å
197	I	77.4	Confident	72.1	Confident	0 Å²	0	71 Å²	71	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-63.2	-42.7	178.1	-60.8	159.5	0	0	0	110	D193 Y194 M199 I200 V201 L217 I221 V232 V239 F242 I301	D193-I197 HydrophobicContact CB-CD1 3.97Å; D193-I197 WeakPolarHBondContact O-CD1 3.26Å; D193-I197 WeakPolarHBondContact O-CG1 3.44Å; D193-I197 PolarHBondContact O-N 2.9Å; Y194-I197 PolarHBondContact O-N 3.25Å; I197-M199 VanDerWaalsContact C-N 3.32Å; I197-M199 PolarHBondContact O-N 3.29Å; I197-I200 PolarHBondContact O-N 3.11Å; I197-I200 VanDerWaalsContact O-N 3.15Å; I197-V201 WeakPolarHBondContact O-CG2 3.29Å; I197-V201 PolarHBondContact O-N 3.23Å; I197-L217 HydrophobicContact CG2-CD2 3.88Å; I197-I221 HydrophobicContact CD1-CD1 3.83Å; I197-V232 HydrophobicContact CD1-CG1 3.91Å; I197-V232 HydrophobicContact CG1-CG1 4.28Å; I197-V239 HydrophobicContact CG1-CG1 4.22Å; I197-F242 HydrophobicContact CD1-CB 4.25Å; I197-F242 HydrophobicContact CD1-CD2 3.47Å; I197-F242 VanDerWaalsContact CD1-CD2 3.47Å; I197-F242 HydrophobicContact CD1-CE2 4Å; I197-F242 HydrophobicContact CD1-CG 4.02Å; I197-F242 HydrophobicContact CG1-CB 4.08Å; I197-F242 HydrophobicContact CG1-CD2 4.24Å; I197-F242 HydrophobicContact CG1-CG 4.36Å; I197-F242 HydrophobicContact CG2-CB 3.9Å; I197-F242 HydrophobicContact CG2-CD1 4.44Å; I197-F242 HydrophobicContact CG2-CG 4.09Å; I197-I301 HydrophobicContact CG2-CD1 4.45Å
198	M	75.7	Confident	69.8	Low	21 Å²	21	72.2 Å²	72.2	10%	0.103	37%	0.373	C	S	.	.	H	α-helix	trans	-67.4	-29	176.6	-72.8	-57.5	-55.1	0	0	112.7	Y194 D195 D196 V201 N202 L217	Y194-M198 HydrophobicContact CD1-CG 4.16Å; Y194-M198 HydrophobicContact CD2-CG 4.3Å; Y194-M198 HydrophobicContact CE1-CG 3.77Å; Y194-M198 HydrophobicContact CE2-CG 3.92Å; Y194-M198 HydrophobicContact CE2-SD 4.36Å; Y194-M198 HydrophobicContact CG-CG 4.42Å; Y194-M198 WeakPolarHBondContact O-CB 3.43Å; Y194-M198 WeakPolarHBondContact O-CG 3.24Å; Y194-M198 PolarHBondContact O-N 3.47Å; D195-M198 PolarHBondContact O-N 3.38Å; D196-M198 VanDerWaalsContact C-N 3.33Å; D196-M198 PolarHBondContact O-N 2.93Å; M198-V201 HydrophobicContact CE-CG1 4.4Å; M198-N202 WeakPolarHBondContact O-CB 3.15Å; M198-N202 PolarHBondContact O-N 3.08Å; M198-N202 PolarHBondContact O-ND2 3.16Å; M198-N202 VanDerWaalsContact O-ND2 3.12Å; M198-L217 HydrophobicContact CG-CD2 4.38Å; M198-L217 HydrophobicContact SD-CD2 3.81Å
199	M	76.1	Confident	67.6	Low	131 Å²	131	69.2 Å²	69.2	65%	0.645	38%	0.375	S	S	*	.	H	α-helix	trans	-62.4	-41.6	168.5	-81.3	-151.8	178.8	0	0	112.3	D195 D196 I197 K203	D195-M199 PolarHBondContact O-N 3.36Å; D196-M199 WeakPolarHBondContact O-CB 3.33Å; D196-M199 PolarHBondContact O-N 3.4Å; I197-M199 VanDerWaalsContact C-N 3.32Å; I197-M199 PolarHBondContact O-N 3.29Å; M199-K203 WeakPolarHBondContact O-CG 3.37Å; M199-K203 PolarHBondContact O-N 2.87Å
200	I	72.3	Confident	65.6	Low	6 Å²	6	72 Å²	72	3%	0.031	39%	0.388	C	S	.	.	H	α-helix	trans	-65.4	-49.6	177.5	-57.5	170.1	0	0	0	109.9	D196 I197 N202 K203 Q204 V239 I301 D303	D196-I200 PolarHBondContact O-N 3.16Å; I197-I200 PolarHBondContact O-N 3.11Å; I197-I200 VanDerWaalsContact O-N 3.15Å; I200-N202 PolarHBondContact O-N 3.24Å; I200-K203 PolarHBondContact O-N 3.08Å; I200-Q204 PolarHBondContact O-N 3.5Å; I200-Q204 PolarHBondContact O-OE1 3.25Å; I200-V239 HydrophobicContact CD1-CG1 4.38Å; I200-I301 HydrophobicContact CB-CG2 4.28Å; I200-I301 HydrophobicContact CG2-CG2 3.62Å; I200-D303 HydrophobicContact CD1-CB 4.46Å; I200-D303 HydrophobicContact CG1-CB 4.29Å; I200-D303 HydrophobicContact CG2-CB 4.18Å
201	V	69.6	Low	63.5	Low	7 Å²	7	69.6 Å²	69.6	4%	0.042	39%	0.392	C	S	.	.	H	α-helix	trans	-56	-49.5	176.1	173.4	0	0	0	0	111.4	I197 M198 K203 Q204 T205 L212 I301	I197-V201 WeakPolarHBondContact O-CG2 3.29Å; I197-V201 PolarHBondContact O-N 3.23Å; M198-V201 HydrophobicContact CE-CG1 4.4Å; V201-K203 PolarHBondContact O-N 2.86Å; V201-Q204 CarbonylContact O-C 3.58Å; V201-Q204 PolarHBondContact O-N 2.88Å; V201-Q204 VanDerWaalsContact O-N 3.09Å; V201-T205 HydrophobicContact CG1-CG2 3.98Å; V201-T205 WeakPolarHBondContact O-CG2 3.41Å; V201-T205 PolarHBondContact O-N 3.21Å; V201-T205 PolarHBondContact O-OG1 2.95Å; V201-L212 HydrophobicContact CG1-CD1 4.34Å; V201-I301 HydrophobicContact CG2-CD1 3.71Å; V201-I301 HydrophobicContact CG2-CG2 4.34Å
202	N	67.8	Low	62	Low	91 Å²	91	67 Å²	67	49%	0.487	38%	0.375	S	S	.	.	H	α-helix	trans	-64.5	-39	-174.3	-72.3	-21.5	0	0	0	112.4	M198 I200 Q204 T205	M198-N202 WeakPolarHBondContact O-CB 3.15Å; M198-N202 PolarHBondContact O-N 3.08Å; M198-N202 PolarHBondContact O-ND2 3.16Å; M198-N202 VanDerWaalsContact O-ND2 3.12Å; I200-N202 PolarHBondContact O-N 3.24Å; N202-Q204 VanDerWaalsContact C-N 3.29Å; N202-Q204 PolarHBondContact O-N 3.01Å; N202-T205 WeakPolarHBondContact CA-OG1 3.31Å; N202-T205 PolarHBondContact O-N 3.17Å; N202-T205 PolarHBondContact O-OG1 3.08Å
203	K	64.9	Low	60.6	Low	97 Å²	97	69.9 Å²	69.9	42%	0.422	37%	0.374	S	S	.	.	H	α-helix	trans	-54.6	-47.4	171.2	-73.9	167.3	176.4	171.7	0	111.1	M199 I200 V201 T206 D303	M199-K203 WeakPolarHBondContact O-CG 3.37Å; M199-K203 PolarHBondContact O-N 2.87Å; I200-K203 PolarHBondContact O-N 3.08Å; V201-K203 PolarHBondContact O-N 2.86Å; K203-T206 PolarHBondContact O-OG1 2.96Å; K203-D303 IonicContact NZ-OD2 2.66Å; K203-D303 PolarHBondContact NZ-OD2 2.9Å
204	Q	56.1	Low	59.1	Low	40 Å²	40	72.3 Å²	72.3	19%	0.187	39%	0.39	C	S	.	.	H	α-helix	trans	-81.9	-22.7	-172.4	-68.5	169.6	-39.2	0	0	113.2	I200 V201 N202 T206 E207 A302 V400	I200-Q204 PolarHBondContact O-N 3.5Å; I200-Q204 PolarHBondContact O-OE1 3.25Å; V201-Q204 CarbonylContact O-C 3.58Å; V201-Q204 PolarHBondContact O-N 2.88Å; V201-Q204 VanDerWaalsContact O-N 3.09Å; N202-Q204 VanDerWaalsContact C-N 3.29Å; N202-Q204 PolarHBondContact O-N 3.01Å; Q204-T206 PolarHBondContact O-N 2.98Å; Q204-E207 PolarHBondContact O-N 3.19Å; Q204-A302 PolarHBondContact NE2-O 2.87Å; Q204-A302 PolarHBondContact OE1-O 3.01Å; Q204-V400 HydrophobicContact CB-CG1 3.88Å; Q204-V400 HydrophobicContact CG-CG1 4.08Å; Q204-V400 VanDerWaalsContact OE1-CG1 3.22Å
205	T	50.2	Low	57.7	Low	48 Å²	48	78.8 Å²	78.8	29%	0.294	42%	0.415	S	S	.	.	H	α-helix	trans	-65.6	-13.7	171.9	49.9	0	0	0	0	114.2	V201 N202 E207 C208	V201-T205 HydrophobicContact CG1-CG2 3.98Å; V201-T205 WeakPolarHBondContact O-CG2 3.41Å; V201-T205 PolarHBondContact O-N 3.21Å; V201-T205 PolarHBondContact O-OG1 2.95Å; N202-T205 WeakPolarHBondContact CA-OG1 3.31Å; N202-T205 PolarHBondContact O-N 3.17Å; N202-T205 PolarHBondContact O-OG1 3.08Å; T205-E207 PolarHBondContact O-N 3.3Å; T205-E207 VanDerWaalsContact O-N 3.16Å; T205-C208 PolarHBondContact O-N 2.81Å
206	T	42.6	Very low	56.8	Low	123 Å²	123	75.7 Å²	75.7	76%	0.755	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-23.5	174	-35.2	0	0	0	0	112.7	K203 Q204	K203-T206 PolarHBondContact O-OG1 2.96Å; Q204-T206 PolarHBondContact O-N 2.98Å
207	E	40.4	Very low	56.1	Low	171 Å²	171	72.3 Å²	72.3	80%	0.799	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	-6.4	179.3	-56	-168.7	141.5	0	0	113.5	Q204 T205	Q204-E207 PolarHBondContact O-N 3.19Å; T205-E207 PolarHBondContact O-N 3.3Å; T205-E207 VanDerWaalsContact O-N 3.16Å
208	C	34.7	Very low	55.7	Low	63 Å²	63	74.9 Å²	74.9	43%	0.426	40%	0.401	S	S	.	.			trans	-116.2	123.8	-167.5	-130.6	0	0	0	0	112.5	T205 I210	T205-C208 PolarHBondContact O-N 2.81Å; C208-I210 PolarHBondContact O-N 3.02Å
209	S	33	Very low	55.3	Low	84 Å²	84	78.2 Å²	78.2	59%	0.587	42%	0.419	S	S	*	.	S	Bend	trans	-73.2	5.7	-164.1	-45	0	0	0	0	116.8
210	I	39.2	Very low	55.2	Low	64 Å²	64	73 Å²	73	33%	0.328	40%	0.395	S	S	.	.	S	Bend	trans	-139	113.7	-172.9	-50.5	176.1	0	0	0	109.5	C208 L381 F398	C208-I210 PolarHBondContact O-N 3.02Å; I210-L381 HydrophobicContact CD1-CB 3.86Å; I210-L381 HydrophobicContact CD1-CD2 3.49Å; I210-L381 VanDerWaalsContact CD1-CD2 3.49Å; I210-L381 HydrophobicContact CD1-CG 4.3Å; I210-F398 HydrophobicContact CB-CE1 4.42Å; I210-F398 HydrophobicContact CB-CZ 3.92Å; I210-F398 HydrophobicContact CG2-CZ 3.88Å
211	P	41.5	Very low	55.2	Low	103 Å²	103	73 Å²	73	67%	0.669	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-72.4	134.9	172.6	29.5	-33	0	0	0	110.6	Q213	P211-Q213 PolarHBondContact O-N 2.86Å
212	L	50.1	Low	55.4	Low	28 Å²	28	78.1 Å²	78.1	15%	0.147	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-57.7	134.7	162.6	-97.9	81.8	0	0	0	108.8	V201 P214 L217 F398	V201-L212 HydrophobicContact CG1-CD1 4.34Å; L212-P214 WeakPolarHBondContact O-CD 3.37Å; L212-L217 HydrophobicContact CD2-CD1 4.5Å; L212-F398 HydrophobicContact CD1-CB 4.42Å; L212-F398 HydrophobicContact CD1-CD1 3.74Å; L212-F398 HydrophobicContact CD1-CD2 3.86Å; L212-F398 HydrophobicContact CD1-CE1 3.81Å; L212-F398 HydrophobicContact CD1-CE2 3.93Å; L212-F398 HydrophobicContact CD1-CG 3.75Å; L212-F398 HydrophobicContact CD1-CZ 3.89Å
213	Q	53.4	Low	55.4	Low	149 Å²	149	80.2 Å²	80.2	70%	0.696	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-72.6	118.5	170.9	-69.2	-160.8	-6.1	0	0	109.1	P211 Y215 A216	P211-Q213 PolarHBondContact O-N 2.86Å; Q213-Y215 PolarHBondContact O-N 3.47Å; Q213-Y215 VanDerWaalsContact O-N 3.07Å; Q213-A216 PolarHBondContact O-N 2.88Å; Q213-A216 VanDerWaalsContact O-N 3.08Å
214	P	50.7	Low	55.5	Low	59 Å²	59	76.6 Å²	76.6	38%	0.383	41%	0.405	S	S	.	.	H	α-helix	trans	-53.8	-38.1	-167.4	-31.1	37.1	0	0	0	114.5	Y194 L212 A216	Y194-P214 WeakPolarHBondContact OH-CB 3.32Å; Y194-P214 PolarHBondContact OH-O 3.12Å; L212-P214 WeakPolarHBondContact O-CD 3.37Å; P214-A216 PolarHBondContact O-N 3.27Å
215	Y	53.9	Low	56	Low	177 Å²	177	80.4 Å²	80.4	69%	0.694	42%	0.423	S	S	*	.	H	α-helix	trans	-64.5	-35.1	-177.8	-55.4	-73.2	0	0	0	114	Q213 L217 I218 D219	Q213-Y215 PolarHBondContact O-N 3.47Å; Q213-Y215 VanDerWaalsContact O-N 3.07Å; Y215-L217 VanDerWaalsContact C-N 3.29Å; Y215-L217 PolarHBondContact O-N 3.34Å; Y215-I218 PolarHBondContact O-N 2.97Å; Y215-D219 PolarHBondContact O-N 3.04Å
216	A	60.4	Low	56.6	Low	53 Å²	53	87.1 Å²	87.1	44%	0.438	45%	0.451	S	S	.	.	H	α-helix	trans	-67.8	-28.8	-174.7	0	0	0	0	0	113	Q213 P214 V220	Q213-A216 PolarHBondContact O-N 2.88Å; Q213-A216 VanDerWaalsContact O-N 3.08Å; P214-A216 PolarHBondContact O-N 3.27Å; A216-V220 WeakPolarHBondContact O-CG2 3.43Å; A216-V220 PolarHBondContact O-N 3.39Å
217	L	68.6	Low	57.8	Low	3 Å²	3	89.8 Å²	89.8	2%	0.016	45%	0.447	C	S	.	.	H	α-helix	trans	-74.7	-33	177.4	-170.6	71.8	0	0	0	111.7	Y194 I197 M198 L212 Y215 V220 I221 F242	Y194-L217 HydrophobicContact CD2-CD2 4.14Å; Y194-L217 HydrophobicContact CE2-CB 4.21Å; Y194-L217 HydrophobicContact CE2-CD2 4.07Å; Y194-L217 HydrophobicContact CE2-CG 4.44Å; I197-L217 HydrophobicContact CG2-CD2 3.88Å; M198-L217 HydrophobicContact CG-CD2 4.38Å; M198-L217 HydrophobicContact SD-CD2 3.81Å; L212-L217 HydrophobicContact CD2-CD1 4.5Å; Y215-L217 VanDerWaalsContact C-N 3.29Å; Y215-L217 PolarHBondContact O-N 3.34Å; L217-V220 PolarHBondContact O-N 2.75Å; L217-I221 HydrophobicContact CG-CD1 4.08Å; L217-I221 WeakPolarHBondContact O-CG1 3.37Å; L217-I221 PolarHBondContact O-N 3.07Å; L217-I221 VanDerWaalsContact O-N 3.13Å; L217-F242 HydrophobicContact CD1-CD1 4.3Å; L217-F242 HydrophobicContact CD1-CE1 3.62Å; L217-F242 HydrophobicContact CD1-CZ 3.96Å
218	I	68	Low	59.5	Low	54 Å²	54	82.6 Å²	82.6	28%	0.277	42%	0.416	S	S	.	.	H	α-helix	trans	-63.5	-50.1	175.2	-57	177	0	0	0	109.6	Y194 Y215 V220 I221 E222	Y194-I218 HydrophobicContact CD2-CG1 3.75Å; Y194-I218 HydrophobicContact CE2-CD1 4.05Å; Y194-I218 HydrophobicContact CE2-CG1 3.36Å; Y215-I218 PolarHBondContact O-N 2.97Å; I218-V220 PolarHBondContact O-N 2.85Å; I218-I221 PolarHBondContact O-N 2.9Å; I218-E222 WeakPolarHBondContact O-CB 3.39Å; I218-E222 PolarHBondContact O-N 3.48Å
219	D	67.8	Low	61.6	Low	91 Å²	91	81.1 Å²	81.1	49%	0.487	40%	0.402	S	S	.	.	H	α-helix	trans	-54.6	-40.5	178.2	-70.8	-29.9	0	0	0	112.2	Y215 Y223	Y215-D219 PolarHBondContact O-N 3.04Å; D219-Y223 HydrophobicContact CB-CD2 4.37Å; D219-Y223 WeakPolarHBondContact O-CB 3.25Å; D219-Y223 WeakPolarHBondContact O-CD2 3.4Å; D219-Y223 PolarHBondContact O-N 3.44Å
220	V	72.9	Confident	63.9	Low	22 Å²	22	77.1 Å²	77.1	13%	0.133	38%	0.375	C	S	.	.	H	α-helix	trans	-69.4	-34.3	178.6	169.5	0	0	0	0	112.7	A216 L217 I218 Q224 F242 A244	A216-V220 WeakPolarHBondContact O-CG2 3.43Å; A216-V220 PolarHBondContact O-N 3.39Å; L217-V220 PolarHBondContact O-N 2.75Å; I218-V220 PolarHBondContact O-N 2.85Å; V220-Q224 WeakPolarHBondContact O-CG 3.48Å; V220-F242 HydrophobicContact CG1-CZ 4.31Å; V220-A244 HydrophobicContact CG1-CB 3.48Å; V220-A244 VanDerWaalsContact CG1-CB 3.48Å
221	I	74.4	Confident	65.7	Low	6 Å²	6	74.2 Å²	74.2	3%	0.031	36%	0.36	C	S	.	.	H	α-helix	trans	-80	-33.4	178	-67.4	169.1	0	0	0	111.3	A189 R190 V191 I197 L217 I218 Q224 F242	A189-I221 HydrophobicContact CB-CG2 4.47Å; R190-I221 VanDerWaalsContact C-CG2 3.43Å; R190-I221 WeakPolarHBondContact O-CG2 3.14Å; V191-I221 HydrophobicContact CG2-CG2 4.33Å; I197-I221 HydrophobicContact CD1-CD1 3.83Å; L217-I221 HydrophobicContact CG-CD1 4.08Å; L217-I221 WeakPolarHBondContact O-CG1 3.37Å; L217-I221 PolarHBondContact O-N 3.07Å; L217-I221 VanDerWaalsContact O-N 3.13Å; I218-I221 PolarHBondContact O-N 2.9Å; I221-Q224 WeakPolarHBondContact O-CG 3.48Å; I221-Q224 PolarHBondContact O-NE2 3.5Å; I221-F242 HydrophobicContact CD1-CE2 4.02Å; I221-F242 HydrophobicContact CD1-CZ 4.31Å; I221-F242 HydrophobicContact CG1-CE2 3.78Å; I221-F242 HydrophobicContact CG1-CZ 3.93Å
222	E	72	Confident	67.6	Low	115 Å²	115	69.3 Å²	69.3	54%	0.537	33%	0.328	S	S	.	.	H	α-helix	trans	-83.7	-49.9	-177.4	-168.8	166.1	-178.3	0	0	112.5	I218 Q224	I218-E222 WeakPolarHBondContact O-CB 3.39Å; I218-E222 PolarHBondContact O-N 3.48Å; E222-Q224 PolarHBondContact O-N 2.75Å
223	Y	68.4	Low	68.9	Low	134 Å²	134	68.4 Å²	68.4	53%	0.525	32%	0.323	S	S	.	.			trans	-85.6	46.3	-175.3	-65	-76.2	0	0	0	114.2	D219 H225	D219-Y223 HydrophobicContact CB-CD2 4.37Å; D219-Y223 WeakPolarHBondContact O-CB 3.25Å; D219-Y223 WeakPolarHBondContact O-CD2 3.4Å; D219-Y223 PolarHBondContact O-N 3.44Å; Y223-H225 PolarHBondContact O-N 3.03Å; Y223-H225 VanDerWaalsContact O-N 3.16Å
224	Q	66.6	Low	70.1	Confident	21 Å²	21	62.6 Å²	62.6	10%	0.098	30%	0.297	C	S	.	.			trans	-77.8	98.2	177.4	-65	-179.8	51.8	0	0	112.2	R188 A189 V220 I221 E222 S228 A230	R188-Q224 VanDerWaalsContact CG-OE1 3.31Å; R188-Q224 PolarHBondContact NH2-O 3.33Å; R188-Q224 VanDerWaalsContact NH2-O 3.07Å; A189-Q224 PolarHBondContact O-NE2 2.95Å; V220-Q224 WeakPolarHBondContact O-CG 3.48Å; I221-Q224 WeakPolarHBondContact O-CG 3.48Å; I221-Q224 PolarHBondContact O-NE2 3.5Å; E222-Q224 PolarHBondContact O-N 2.75Å; Q224-S228 CarbonylContact C-O 3.53Å; Q224-S228 VanDerWaalsContact CA-O 3.27Å; Q224-S228 WeakPolarHBondContact CA-O 3.29Å; Q224-A230 HydrophobicContact CG-CB 4.18Å; Q224-A230 PolarHBondContact OE1-O 2.9Å
225	H	67.7	Low	71.2	Confident	121 Å²	121	60.8 Å²	60.8	56%	0.56	28%	0.283	S	S	*	.			trans	-106.8	-175.9	-179.5	-59.7	-22	0	0	0	112.8	Y223 R227 S228 H229	Y223-H225 PolarHBondContact O-N 3.03Å; Y223-H225 VanDerWaalsContact O-N 3.16Å; H225-R227 PolarHBondContact O-N 2.65Å; H225-S228 PolarHBondContact N-O 3.5Å; H225-S228 VanDerWaalsContact N-O 3.16Å; H225-S228 CarbonylContact O-C 3.56Å; H225-S228 PolarHBondContact O-N 3.17Å; H225-H229 PolarHBondContact O-CE1 3.03Å; H225-H229 PolarHBondContact O-ND1 2.93Å
226	Q	62.3	Low	72.2	Confident	188 Å²	188	59.8 Å²	59.8	88%	0.879	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-14.1	173.8	-75	-178.8	-22.2	0	0	115.1
227	R	67.1	Low	72.7	Confident	179 Å²	179	59.8 Å²	59.8	68%	0.675	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	-0.3	-179.7	-67.7	-168.8	-168	177.5	7.9	114.3	H225 T246 S247	H225-R227 PolarHBondContact O-N 2.65Å; R227-T246 CarbonylContact O-C 3.5Å; R227-T246 WeakPolarHBondContact O-CA 3.32Å; R227-T246 WeakPolarHBondContact O-CB 3.43Å; R227-S247 WeakPolarHBondContact CB-OG 3.44Å; R227-S247 WeakPolarHBondContact CD-OG 3.4Å; R227-S247 WeakPolarHBondContact CG-OG 3.44Å; R227-S247 PolarHBondContact O-N 3.2Å
228	S	76.3	Confident	73.2	Confident	21 Å²	21	67.4 Å²	67.4	15%	0.147	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	121.5	-176.6	-175.7	0	0	0	0	111	Q224 H225	Q224-S228 CarbonylContact C-O 3.53Å; Q224-S228 VanDerWaalsContact CA-O 3.27Å; Q224-S228 WeakPolarHBondContact CA-O 3.29Å; H225-S228 PolarHBondContact N-O 3.5Å; H225-S228 VanDerWaalsContact N-O 3.16Å; H225-S228 CarbonylContact O-C 3.56Å; H225-S228 PolarHBondContact O-N 3.17Å
229	H	79.1	Confident	73.8	Confident	31 Å²	31	65.6 Å²	65.6	14%	0.144	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	134.3	-176.4	-64.3	-22.6	0	0	0	110.3	H225 A245 L418 F419	H225-H229 PolarHBondContact O-CE1 3.03Å; H225-H229 PolarHBondContact O-ND1 2.93Å; H229-A245 PolarHBondContact N-O 3.16Å; H229-A245 PolarHBondContact O-N 3.32Å; H229-L418 HydrophobicContact CB-CD1 4.45Å; H229-F419 HydrophobicContact CB-CE2 4.29Å; H229-F419 HydrophobicContact CB-CZ 4.05Å; H229-F419 AromaticContact CD2-CE1 3.58Å; H229-F419 AromaticContact CD2-CE2 3.91Å; H229-F419 AromaticContact CD2-CZ 3.49Å; H229-F419 VanDerWaalsContact CD2-CZ 3.49Å; H229-F419 WeakPolarHBondContact CD2-CZ 3.25Å; H229-F419 AromaticContact CG-CZ 3.91Å; H229-F419 AromaticContact NE2-CE1 3.98Å
230	A	80.4	Confident	74.1	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.008	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	140.1	176.4	0	0	0	0	0	110.5	A189 Q224 F242 V243 A244	A189-A230 HydrophobicContact CB-CB 3.93Å; A189-A230 PolarHBondContact N-O 2.7Å; Q224-A230 HydrophobicContact CG-CB 4.18Å; Q224-A230 PolarHBondContact OE1-O 2.9Å; A230-F242 HydrophobicContact CB-CE2 3.92Å; A230-F242 HydrophobicContact CB-CZ 4.03Å; A230-V243 CarbonylContact C-O 3.49Å; A230-V243 WeakPolarHBondContact CA-O 3.25Å; A230-A244 HydrophobicContact CB-CB 4.41Å
231	A	78.7	Confident	74.3	Confident	2 Å²	2	60.6 Å²	60.6	2%	0.017	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	150.3	-176.4	0	0	0	0	0	111.3	V186 R187 F242 V243	V186-A231 HydrophobicContact CG1-CB 4.07Å; R187-A231 CarbonylContact O-C 3.54Å; R187-A231 WeakPolarHBondContact O-CA 3.39Å; R187-A231 WeakPolarHBondContact O-CB 3.31Å; A231-F242 WeakPolarHBondContact O-CA 3.36Å; A231-F242 WeakPolarHBondContact O-CD2 3.26Å; A231-V243 HydrophobicContact CB-CG1 3.94Å; A231-V243 PolarHBondContact N-O 3.26Å; A231-V243 PolarHBondContact O-N 2.87Å
232	V	80.5	Confident	74.5	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.006	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	143.8	171.9	-70.3	0	0	0	0	110.6	R187 A189 D193 I197 Q234 V239 G241 F242	R187-V232 HydrophobicContact CG-CG2 3.74Å; R187-V232 PolarHBondContact N-O 2.64Å; R187-V232 PolarHBondContact O-N 3.38Å; A189-V232 HydrophobicContact CB-CG1 4.08Å; D193-V232 HydrophobicContact CB-CG1 4.09Å; I197-V232 HydrophobicContact CD1-CG1 3.91Å; I197-V232 HydrophobicContact CG1-CG1 4.28Å; V232-Q234 HydrophobicContact CG2-CG 4.42Å; V232-V239 HydrophobicContact CB-CG1 4.08Å; V232-V239 HydrophobicContact CB-CG2 4.29Å; V232-V239 HydrophobicContact CG1-CG1 4.03Å; V232-V239 HydrophobicContact CG1-CG2 4.44Å; V232-V239 HydrophobicContact CG2-CG2 4.4Å; V232-G241 WeakPolarHBondContact CA-O 3.35Å; V232-F242 HydrophobicContact CG1-CD2 4Å
233	L	78.1	Confident	74.7	Confident	8 Å²	8	55 Å²	55	4%	0.042	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	134.6	166.3	-78.6	158.5	0	0	0	108.9	L184 V186 V239 V240 G241 V411	L184-L233 HydrophobicContact CB-CD2 3.69Å; L184-L233 HydrophobicContact CD1-CB 4.46Å; L184-L233 HydrophobicContact CD1-CD2 3.82Å; L184-L233 HydrophobicContact CG-CD2 4.42Å; V186-L233 HydrophobicContact CG2-CD2 3.83Å; L233-V239 WeakPolarHBondContact O-CA 3.38Å; L233-V240 HydrophobicContact CB-CG2 3.79Å; L233-V240 PolarHBondContact O-N 3.01Å; L233-G241 PolarHBondContact N-O 2.81Å; L233-V411 HydrophobicContact CD1-CG2 3.71Å; L233-V411 HydrophobicContact CD2-CG2 3.65Å; L233-V411 HydrophobicContact CG-CG2 3.87Å
234	Q	77.6	Confident	75.2	Confident	28 Å²	28	48.7 Å²	48.7	13%	0.131	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	140.7	173.3	-61.1	-169.3	-67.9	0	0	112.7	H185 R187 V232 G237 R238 V239	H185-Q234 PolarHBondContact N-O 3.03Å; H185-Q234 PolarHBondContact O-N 3.48Å; R187-Q234 VanDerWaalsContact NE-CD 3.26Å; V232-Q234 HydrophobicContact CG2-CG 4.42Å; Q234-G237 PolarHBondContact NE2-O 3.04Å; Q234-R238 WeakPolarHBondContact CA-O 3.41Å; Q234-R238 WeakPolarHBondContact CB-O 3.34Å; Q234-V239 HydrophobicContact CG-CG2 4.32Å
235	D	75.2	Confident	75.7	Confident	20 Å²	20	47.7 Å²	47.7	11%	0.107	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	129.5	160	-161.7	13	0	0	0	108.3	K182 L184 G237 R238 V240 H306	K182-D235 IonicContact NZ-OD1 3.11Å; K182-D235 IonicContact NZ-OD2 2.65Å; L184-D235 HydrophobicContact CD2-CB 3.62Å; D235-G237 PolarHBondContact O-N 3.17Å; D235-R238 PolarHBondContact N-O 3.48Å; D235-R238 VanDerWaalsContact N-O 3.13Å; D235-R238 PolarHBondContact O-N 3.16Å; D235-V240 HydrophobicContact CB-CG1 4.22Å; D235-H306 VanDerWaalsContact CB-NE2 3.28Å; D235-H306 WeakPolarHBondContact CB-NE2 3.44Å; D235-H306 IonicContact OD2-CD2 2.73Å; D235-H306 IonicContact OD2-CE1 3.67Å; D235-H306 IonicContact OD2-NE2 3.56Å; D235-H306 PolarHBondContact OD2-NE2 3.44Å
236	E	74.2	Confident	76.1	Confident	157 Å²	157	42.6 Å²	42.6	73%	0.734	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	43.7	34	179.7	-68.9	171.5	-160.2	0	0	114.7	K182	K182-E236 IonicContact NZ-OE1 2.61Å; K182-E236 PolarHBondContact NZ-OE1 3.02Å
237	G	71.5	Confident	76.7	Confident	52 Å²	52	35.1 Å²	35.1	54%	0.536	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.1	-17.9	178.2	0	0	0	0	0	116	Q234 D235	Q234-G237 PolarHBondContact NE2-O 3.04Å; D235-G237 PolarHBondContact O-N 3.17Å
238	R	78.4	Confident	76.5	Confident	164 Å²	164	27.6 Å²	27.6	62%	0.619	15%	0.148	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	141.5	175.3	-64.9	-177.9	178.7	174.2	1.1	110.6	Q234 D235	Q234-R238 WeakPolarHBondContact CA-O 3.41Å; Q234-R238 WeakPolarHBondContact CB-O 3.34Å; D235-R238 PolarHBondContact N-O 3.48Å; D235-R238 VanDerWaalsContact N-O 3.13Å; D235-R238 PolarHBondContact O-N 3.16Å
239	V	79.8	Confident	75.5	Confident	15 Å²	15	29.9 Å²	29.9	9%	0.091	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	129.8	170.4	176.1	0	0	0	0	109.4	D193 D196 I197 I200 V232 L233 Q234	D193-V239 HydrophobicContact CB-CG2 4.43Å; D196-V239 HydrophobicContact CB-CB 3.85Å; D196-V239 HydrophobicContact CB-CG1 4.45Å; D196-V239 HydrophobicContact CB-CG2 4.23Å; I197-V239 HydrophobicContact CG1-CG1 4.22Å; I200-V239 HydrophobicContact CD1-CG1 4.38Å; V232-V239 HydrophobicContact CB-CG1 4.08Å; V232-V239 HydrophobicContact CB-CG2 4.29Å; V232-V239 HydrophobicContact CG1-CG1 4.03Å; V232-V239 HydrophobicContact CG1-CG2 4.44Å; V232-V239 HydrophobicContact CG2-CG2 4.4Å; L233-V239 WeakPolarHBondContact O-CA 3.38Å; Q234-V239 HydrophobicContact CG-CG2 4.32Å
240	V	75.8	Confident	74.9	Confident	8 Å²	8	31.4 Å²	31.4	5%	0.048	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	2	-178.3	-55.8	0	0	0	0	112.7	L184 L233 D235 A302 D303 H306	L184-V240 HydrophobicContact CD1-CG2 3.8Å; L184-V240 HydrophobicContact CD2-CG2 4.01Å; L184-V240 HydrophobicContact CG-CG2 4.5Å; L233-V240 HydrophobicContact CB-CG2 3.79Å; L233-V240 PolarHBondContact O-N 3.01Å; D235-V240 HydrophobicContact CB-CG1 4.22Å; V240-A302 WeakPolarHBondContact O-CA 3.45Å; V240-D303 PolarHBondContact O-N 2.89Å; V240-H306 WeakPolarHBondContact CG1-ND1 3.25Å
241	G	75.8	Confident	74.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.8	167.1	176.5	0	0	0	0	0	113.3	V232 L233 I301	V232-G241 WeakPolarHBondContact CA-O 3.35Å; L233-G241 PolarHBondContact N-O 2.81Å; G241-I301 CarbonylContact C-O 3.48Å; G241-I301 WeakPolarHBondContact CA-O 3.32Å
242	F	78.1	Confident	73.8	Confident	1 Å²	1	38.3 Å²	38.3	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	145.2	-174.7	173	-98.6	0	0	0	111	A189 I197 L217 V220 I221 A230 A231 V232 A244 H299 I301	A189-F242 HydrophobicContact CB-CD2 4.37Å; A189-F242 HydrophobicContact CB-CE2 3.95Å; I197-F242 HydrophobicContact CD1-CB 4.25Å; I197-F242 HydrophobicContact CD1-CD2 3.47Å; I197-F242 VanDerWaalsContact CD1-CD2 3.47Å; I197-F242 HydrophobicContact CD1-CE2 4Å; I197-F242 HydrophobicContact CD1-CG 4.02Å; I197-F242 HydrophobicContact CG1-CB 4.08Å; I197-F242 HydrophobicContact CG1-CD2 4.24Å; I197-F242 HydrophobicContact CG1-CG 4.36Å; I197-F242 HydrophobicContact CG2-CB 3.9Å; I197-F242 HydrophobicContact CG2-CD1 4.44Å; I197-F242 HydrophobicContact CG2-CG 4.09Å; L217-F242 HydrophobicContact CD1-CD1 4.3Å; L217-F242 HydrophobicContact CD1-CE1 3.62Å; L217-F242 HydrophobicContact CD1-CZ 3.96Å; V220-F242 HydrophobicContact CG1-CZ 4.31Å; I221-F242 HydrophobicContact CD1-CE2 4.02Å; I221-F242 HydrophobicContact CD1-CZ 4.31Å; I221-F242 HydrophobicContact CG1-CE2 3.78Å; I221-F242 HydrophobicContact CG1-CZ 3.93Å; A230-F242 HydrophobicContact CB-CE2 3.92Å; A230-F242 HydrophobicContact CB-CZ 4.03Å; A231-F242 WeakPolarHBondContact O-CA 3.36Å; A231-F242 WeakPolarHBondContact O-CD2 3.26Å; V232-F242 HydrophobicContact CG1-CD2 4Å; F242-A244 HydrophobicContact CE1-CB 3.9Å; F242-A244 HydrophobicContact CZ-CB 3.97Å; F242-H299 HydrophobicContact CE1-CB 4.23Å; F242-I301 HydrophobicContact CB-CB 4.47Å; F242-I301 HydrophobicContact CD1-CD1 4.16Å; F242-I301 PolarHBondContact N-O 3.25Å; F242-I301 PolarHBondContact O-N 3.03Å
243	V	78	Confident	73.4	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.024	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	140.8	172.6	67.4	0	0	0	0	111.1	A230 A231 I297 H299 F300 V411 L415	A230-V243 CarbonylContact C-O 3.49Å; A230-V243 WeakPolarHBondContact CA-O 3.25Å; A231-V243 HydrophobicContact CB-CG1 3.94Å; A231-V243 PolarHBondContact N-O 3.26Å; A231-V243 PolarHBondContact O-N 2.87Å; V243-I297 HydrophobicContact CG2-CG2 3.94Å; V243-H299 WeakPolarHBondContact CA-O 3.34Å; V243-H299 WeakPolarHBondContact CG2-O 3.48Å; V243-F300 HydrophobicContact CB-CD2 4.08Å; V243-F300 HydrophobicContact CG2-CD2 3.9Å; V243-V411 HydrophobicContact CB-CG1 4.22Å; V243-V411 HydrophobicContact CG1-CG1 3.72Å; V243-V411 HydrophobicContact CG2-CG1 4.38Å; V243-L415 HydrophobicContact CG1-CD1 4.15Å; V243-L415 HydrophobicContact CG1-CD2 4.06Å; V243-L415 HydrophobicContact CG1-CG 4.37Å; V243-L415 HydrophobicContact CG2-CD1 3.75Å
244	A	77.9	Confident	73.2	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.008	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	136.8	173.5	0	0	0	0	0	110.6	V220 A230 F242 Q298 H299	V220-A244 HydrophobicContact CG1-CB 3.48Å; V220-A244 VanDerWaalsContact CG1-CB 3.48Å; A230-A244 HydrophobicContact CB-CB 4.41Å; F242-A244 HydrophobicContact CE1-CB 3.9Å; F242-A244 HydrophobicContact CZ-CB 3.97Å; A244-Q298 PolarHBondContact O-N 2.82Å; A244-H299 HydrophobicContact CB-CB 4.28Å; A244-H299 PolarHBondContact N-O 3.31Å; A244-H299 PolarHBondContact O-N 3.07Å
245	A	77.6	Confident	73.1	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	147.6	-177	0	0	0	0	0	112.3	H229 F295 C296 I297 L415 F419	H229-A245 PolarHBondContact N-O 3.16Å; H229-A245 PolarHBondContact O-N 3.32Å; A245-F295 HydrophobicContact CB-CD2 4.14Å; A245-C296 CarbonylContact C-O 3.55Å; A245-C296 VanDerWaalsContact CA-O 3.29Å; A245-C296 WeakPolarHBondContact CA-O 3.48Å; A245-I297 HydrophobicContact CB-CG1 4.26Å; A245-L415 HydrophobicContact CB-CD2 4.22Å; A245-F419 HydrophobicContact CB-CE2 3.87Å; A245-F419 HydrophobicContact CB-CZ 4.46Å
246	T	76.9	Confident	73.2	Confident	14 Å²	14	47 Å²	47	9%	0.086	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	146.8	-175.9	58	0	0	0	0	112.3	R227 S248 F295 C296 Q298	R227-T246 CarbonylContact O-C 3.5Å; R227-T246 WeakPolarHBondContact O-CA 3.32Å; R227-T246 WeakPolarHBondContact O-CB 3.43Å; T246-S248 PolarHBondContact O-N 3.08Å; T246-F295 CarbonylContact O-C 3.54Å; T246-F295 WeakPolarHBondContact O-CA 2.95Å; T246-F295 WeakPolarHBondContact O-CB 3.2Å; T246-C296 PolarHBondContact N-O 3.49Å; T246-C296 PolarHBondContact O-N 3.44Å; T246-Q298 HydrophobicContact CG2-CG 4.27Å; T246-Q298 PolarHBondContact OG1-NE2 3.45Å
247	S	73.5	Confident	73.4	Confident	30 Å²	30	41.1 Å²	41.1	21%	0.21	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	137.7	165.5	63.4	0	0	0	0	110.1	R227	R227-S247 WeakPolarHBondContact CB-OG 3.44Å; R227-S247 WeakPolarHBondContact CD-OG 3.4Å; R227-S247 WeakPolarHBondContact CG-OG 3.44Å; R227-S247 PolarHBondContact O-N 3.2Å
248	S	63.3	Low	73.9	Confident	21 Å²	21	38.7 Å²	38.7	15%	0.147	19%	0.192	C	C	.	.			trans	-56.5	133.4	-170.9	69	0	0	0	0	112.4	T246 D251 S292 S294	T246-S248 PolarHBondContact O-N 3.08Å; S248-D251 PolarHBondContact OG-OD1 3.26Å; S248-S292 PolarHBondContact OG-OG 2.98Å; S248-S294 WeakPolarHBondContact CB-OG 3.37Å; S248-S294 PolarHBondContact N-O 3.25Å; S248-S294 VanDerWaalsContact N-O 3.13Å; S248-S294 PolarHBondContact OG-OG 2.95Å
249	P	55.6	Low	73.9	Confident	70 Å²	70	33 Å²	33	46%	0.455	17%	0.174	S	C	.	.	S	Bend	trans	-97.4	-6.1	-171.4	36	-36.4	0	0	0	114.9	F395	P249-F395 HydrophobicContact CG-CE1 4.16Å; P249-F395 HydrophobicContact CG-CZ 3.68Å
250	N	65.8	Low	73.8	Confident	62 Å²	62	32.5 Å²	32.5	33%	0.332	17%	0.17	S	C	.	.			trans	-158	92.9	179.8	-163.2	-47	0	0	0	113.5	Q252 K253	N250-Q252 VanDerWaalsContact C-N 3.3Å; N250-Q252 PolarHBondContact O-N 3.32Å; N250-Q252 PolarHBondContact OD1-N 3.09Å; N250-Q252 VanDerWaalsContact OD1-N 3.16Å; N250-K253 PolarHBondContact OD1-N 2.89Å
251	D	68.6	Low	73.7	Confident	22 Å²	22	42.4 Å²	42.4	12%	0.118	21%	0.207	C	C	.	.	H	α-helix	trans	-67.2	-27.3	177.3	-65.7	-45.7	0	0	0	113.7	S248 L254 L255 Y267 K291 S292	S248-D251 PolarHBondContact OG-OD1 3.26Å; D251-L254 PolarHBondContact O-N 2.97Å; D251-L255 WeakPolarHBondContact O-CG 3.21Å; D251-L255 PolarHBondContact O-N 2.81Å; D251-L255 VanDerWaalsContact O-N 3.13Å; D251-Y267 HydrophobicContact CB-CE1 4.28Å; D251-K291 VanDerWaalsContact OD2-CA 3.31Å; D251-K291 WeakPolarHBondContact OD2-CA 3.2Å; D251-S292 WeakPolarHBondContact OD1-CB 3.23Å; D251-S292 PolarHBondContact OD1-N 3.14Å; D251-S292 PolarHBondContact OD1-OG 3.24Å; D251-S292 PolarHBondContact OD2-N 2.84Å
252	Q	68.7	Low	73.4	Confident	126 Å²	126	45 Å²	45	59%	0.589	22%	0.219	S	C	*	.	H	α-helix	trans	-68.5	-46	-178.8	-171.5	-176.1	-34.1	0	0	111.2	N250 L254 L255 E256	N250-Q252 VanDerWaalsContact C-N 3.3Å; N250-Q252 PolarHBondContact O-N 3.32Å; N250-Q252 PolarHBondContact OD1-N 3.09Å; N250-Q252 VanDerWaalsContact OD1-N 3.16Å; Q252-L254 VanDerWaalsContact C-N 3.31Å; Q252-L254 PolarHBondContact O-N 3.48Å; Q252-L255 CarbonylContact O-C 3.59Å; Q252-L255 WeakPolarHBondContact O-CB 3.43Å; Q252-L255 PolarHBondContact O-N 2.83Å; Q252-L255 VanDerWaalsContact O-N 3.1Å; Q252-E256 WeakPolarHBondContact CG-OE1 3.44Å; Q252-E256 PolarHBondContact NE2-OE1 3.25Å; Q252-E256 WeakPolarHBondContact O-CG 3.38Å; Q252-E256 PolarHBondContact O-N 2.8Å
253	K	70.2	Confident	73.2	Confident	77 Å²	77	45.6 Å²	45.6	34%	0.335	22%	0.222	S	C	.	.	H	α-helix	trans	-63.9	-34.9	176.6	-71.6	-174.6	177.2	-171.5	0	112.7	N250 L255 E256 H257	N250-K253 PolarHBondContact OD1-N 2.89Å; K253-L255 VanDerWaalsContact C-N 3.33Å; K253-E256 PolarHBondContact O-N 2.86Å; K253-H257 PolarHBondContact O-CD2 3.19Å; K253-H257 VanDerWaalsContact O-CD2 3.29Å; K253-H257 PolarHBondContact O-N 2.85Å; K253-H257 VanDerWaalsContact O-N 3.16Å
254	L	74.9	Confident	72.7	Confident	8 Å²	8	49.8 Å²	49.8	4%	0.042	24%	0.244	C	C	.	.	H	α-helix	trans	-59.6	-44.2	171.8	-81.9	167.9	0	0	0	111.3	D251 Q252 F258 L260 L426 F428 L457	D251-L254 PolarHBondContact O-N 2.97Å; Q252-L254 VanDerWaalsContact C-N 3.31Å; Q252-L254 PolarHBondContact O-N 3.48Å; L254-F258 HydrophobicContact CD2-CD2 4.49Å; L254-F258 PolarHBondContact O-N 2.77Å; L254-L260 HydrophobicContact CB-CD1 3.9Å; L254-L260 HydrophobicContact CD2-CD1 4.33Å; L254-L426 HydrophobicContact CD1-CD1 3.93Å; L254-L426 HydrophobicContact CD2-CD1 4.33Å; L254-F428 HydrophobicContact CD2-CE1 4.36Å; L254-F428 HydrophobicContact CD2-CZ 3.75Å; L254-L457 HydrophobicContact CD2-CD2 3.74Å
255	L	74.7	Confident	72.1	Confident	68 Å²	68	51.9 Å²	51.9	36%	0.356	27%	0.266	S	S	.	.	H	α-helix	trans	-71	-27.9	175.8	-71.4	170.1	0	0	0	114	D251 Q252 K253 Y267 R448	D251-L255 WeakPolarHBondContact O-CG 3.21Å; D251-L255 PolarHBondContact O-N 2.81Å; D251-L255 VanDerWaalsContact O-N 3.13Å; Q252-L255 CarbonylContact O-C 3.59Å; Q252-L255 WeakPolarHBondContact O-CB 3.43Å; Q252-L255 PolarHBondContact O-N 2.83Å; Q252-L255 VanDerWaalsContact O-N 3.1Å; K253-L255 VanDerWaalsContact C-N 3.33Å; L255-Y267 HydrophobicContact CD1-CE1 4.41Å; L255-Y267 HydrophobicContact CD2-CE2 3.84Å; L255-Y267 WeakPolarHBondContact CD2-OH 3.15Å; L255-Y267 WeakPolarHBondContact CG-OH 3.21Å; L255-R448 PolarHBondContact O-NE 2.8Å; L255-R448 PolarHBondContact O-NH1 2.88Å; L255-R448 PolarHBondContact O-NH2 3.1Å
256	E	78.1	Confident	71.8	Confident	86 Å²	86	52 Å²	52	40%	0.402	27%	0.266	S	S	.	.	H	α-helix	trans	-72	-33.6	176.3	-73.8	163.2	178.7	0	0	112.2	Q252 K253 R448	Q252-E256 WeakPolarHBondContact CG-OE1 3.44Å; Q252-E256 PolarHBondContact NE2-OE1 3.25Å; Q252-E256 WeakPolarHBondContact O-CG 3.38Å; Q252-E256 PolarHBondContact O-N 2.8Å; K253-E256 PolarHBondContact O-N 2.86Å; E256-R448 WeakPolarHBondContact O-CD 3.5Å
257	H	79.1	Confident	71.5	Confident	35 Å²	35	52.8 Å²	52.8	16%	0.162	27%	0.268	C	S	.	.	H	α-helix	trans	-106.6	-24	-170.8	-70.6	-70.5	0	0	0	116.1	K253 R448 S451 Q453	K253-H257 PolarHBondContact O-CD2 3.19Å; K253-H257 VanDerWaalsContact O-CD2 3.29Å; K253-H257 PolarHBondContact O-N 2.85Å; K253-H257 VanDerWaalsContact O-N 3.16Å; H257-R448 PolarHBondContact O-N 2.87Å; H257-S451 PolarHBondContact ND1-OG 2.86Å; H257-Q453 VanDerWaalsContact CD2-CD 3.47Å; H257-Q453 PolarHBondContact CD2-NE2 2.89Å; H257-Q453 VanDerWaalsContact CD2-NE2 3.32Å; H257-Q453 PolarHBondContact NE2-NE2 3.1Å; H257-Q453 VanDerWaalsContact NE2-NE2 3.16Å
258	F	82	Confident	70.9	Confident	1 Å²	1	56.2 Å²	56.2	0%	0.004	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-129.6	156.5	-172.1	-60.7	-81.7	0	0	0	113.7	L254 L260 F428 V445 S447 R448 L457	L254-F258 HydrophobicContact CD2-CD2 4.49Å; L254-F258 PolarHBondContact O-N 2.77Å; F258-L260 HydrophobicContact CB-CG 4.31Å; F258-F428 AromaticContact CE2-CE1 3.92Å; F258-F428 HydrophobicContact CE2-CE1 3.92Å; F258-F428 HydrophobicContact CZ-CE1 4.35Å; F258-V445 HydrophobicContact CB-CG1 3.99Å; F258-V445 HydrophobicContact CD1-CG1 4.31Å; F258-S447 WeakPolarHBondContact CE1-OG 3.45Å; F258-R448 PolarHBondContact O-NE 2.7Å; F258-L457 HydrophobicContact CB-CD2 4.03Å; F258-L457 HydrophobicContact CD1-CB 3.66Å; F258-L457 HydrophobicContact CD1-CD2 4.04Å; F258-L457 HydrophobicContact CD1-CG 4.5Å; F258-L457 HydrophobicContact CD2-CB 4.27Å; F258-L457 HydrophobicContact CD2-CD2 3.75Å; F258-L457 HydrophobicContact CE1-CB 3.44Å; F258-L457 VanDerWaalsContact CE1-CB 3.44Å; F258-L457 HydrophobicContact CE2-CB 4.08Å; F258-L457 HydrophobicContact CE2-CD2 4.27Å; F258-L457 HydrophobicContact CG-CB 4.09Å; F258-L457 HydrophobicContact CG-CD2 3.63Å; F258-L457 HydrophobicContact CZ-CB 3.67Å
259	N	77	Confident	70.1	Confident	44 Å²	44	62.3 Å²	62.3	24%	0.235	31%	0.305	C	S	.	.			trans	-90.2	108.5	167.7	-168.9	24.7	0	0	0	110.7	R261 E262 V445 R446	N259-R261 PolarHBondContact OD1-N 2.96Å; N259-E262 PolarHBondContact ND2-OE1 2.9Å; N259-V445 VanDerWaalsContact O-CG1 3.31Å; N259-V445 WeakPolarHBondContact O-CG1 3.36Å; N259-R446 PolarHBondContact N-O 3.46Å
260	L	78.4	Confident	69.3	Low	4 Å²	4	67.3 Å²	67.3	2%	0.021	32%	0.32	C	S	.	.			trans	-112.3	10.5	-179.5	-62.6	170.7	0	0	0	112.7	L254 F258 E262 F263 F266 Y267 V445 L457 I459	L254-L260 HydrophobicContact CB-CD1 3.9Å; L254-L260 HydrophobicContact CD2-CD1 4.33Å; F258-L260 HydrophobicContact CB-CG 4.31Å; L260-E262 VanDerWaalsContact C-N 3.28Å; L260-E262 PolarHBondContact O-N 3.22Å; L260-F263 HydrophobicContact CD2-CD2 4.29Å; L260-F263 HydrophobicContact CD2-CE2 4.47Å; L260-F266 HydrophobicContact CD1-CD1 4.49Å; L260-F266 HydrophobicContact CD1-CE1 3.88Å; L260-F266 HydrophobicContact CD1-CZ 4.19Å; L260-Y267 HydrophobicContact CB-CE2 4.37Å; L260-Y267 WeakPolarHBondContact CD1-OH 3.42Å; L260-V445 HydrophobicContact CD2-CG1 3.96Å; L260-V445 HydrophobicContact CD2-CG2 4.42Å; L260-L457 HydrophobicContact CD2-CD2 4.17Å; L260-I459 HydrophobicContact CD2-CD1 3.48Å; L260-I459 VanDerWaalsContact CD2-CD1 3.48Å
261	R	72.9	Confident	67.6	Low	216 Å²	216	70 Å²	70	82%	0.815	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-25.4	178.3	-67.8	-179.6	174.1	-179.9	-1.9	113.2	N259 F263	N259-R261 PolarHBondContact OD1-N 2.96Å; R261-F263 PolarHBondContact O-N 2.94Å
262	E	69.9	Low	66	Low	56 Å²	56	74.6 Å²	74.6	26%	0.262	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-0.7	-177.4	-65.2	167.1	-135.9	0	0	113.2	N259 L260 P570	N259-E262 PolarHBondContact ND2-OE1 2.9Å; L260-E262 VanDerWaalsContact C-N 3.28Å; L260-E262 PolarHBondContact O-N 3.22Å; E262-P570 HydrophobicContact CB-CG 4.23Å; E262-P570 WeakPolarHBondContact O-CG 3.35Å
263	F	74.2	Confident	64.4	Low	13 Å²	13	76.4 Å²	76.4	6%	0.057	38%	0.377	C	S	.	.	S	Bend	trans	-113.7	96.2	-178	-64.2	-83.4	0	0	0	111.3	L260 R261 G265 F266 Y424 V443 V445 I459 P570	L260-F263 HydrophobicContact CD2-CD2 4.29Å; L260-F263 HydrophobicContact CD2-CE2 4.47Å; R261-F263 PolarHBondContact O-N 2.94Å; F263-G265 PolarHBondContact O-N 3.27Å; F263-F266 HydrophobicContact CB-CB 4.02Å; F263-F266 HydrophobicContact CB-CD2 4.44Å; F263-F266 VanDerWaalsContact O-CB 3.27Å; F263-F266 WeakPolarHBondContact O-CB 3.47Å; F263-F266 PolarHBondContact O-N 3.02Å; F263-Y424 HydrophobicContact CB-CE1 4.32Å; F263-Y424 AromaticContact CD1-CE1 3.97Å; F263-Y424 HydrophobicContact CD1-CE1 3.97Å; F263-V443 HydrophobicContact CE1-CG2 4.22Å; F263-V443 HydrophobicContact CZ-CB 4.31Å; F263-V443 HydrophobicContact CZ-CG1 4.01Å; F263-V443 HydrophobicContact CZ-CG2 4.48Å; F263-V445 HydrophobicContact CE2-CG1 4.48Å; F263-V445 HydrophobicContact CE2-CG2 3.99Å; F263-V445 HydrophobicContact CZ-CG2 4.08Å; F263-I459 HydrophobicContact CD1-CG2 4.43Å; F263-I459 HydrophobicContact CE1-CG2 4.18Å; F263-I459 HydrophobicContact CE2-CD1 4.48Å; F263-I459 HydrophobicContact CZ-CB 4.49Å; F263-P570 HydrophobicContact CE1-CB 4.31Å
264	D	67.1	Low	62.8	Low	91 Å²	91	82.6 Å²	82.6	49%	0.487	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.5	136	174.4	-75.6	-25.9	0	0	0	111.4	F266 Y424 K569	D264-F266 PolarHBondContact O-N 3.2Å; D264-F266 VanDerWaalsContact O-N 3.12Å; D264-Y424 PolarHBondContact O-OH 3.5Å; D264-K569 IonicContact OD2-NZ 2.95Å; D264-K569 PolarHBondContact OD2-NZ 3.47Å
265	G	64.8	Low	60.9	Low	46 Å²	46	90.8 Å²	90.8	47%	0.474	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	3.6	176.5	0	0	0	0	0	116.4	F263 Y267 N293	F263-G265 PolarHBondContact O-N 3.27Å; G265-Y267 VanDerWaalsContact C-N 3.27Å; G265-Y267 PolarHBondContact O-N 3.48Å; G265-N293 WeakPolarHBondContact O-CB 3.34Å; G265-N293 PolarHBondContact O-ND2 2.81Å; G265-N293 VanDerWaalsContact O-ND2 3.17Å
266	F	72.3	Confident	59	Low	2 Å²	2	96.4 Å²	96.4	1%	0.009	47%	0.467	C	S	.	.	S	Bend	trans	-61.9	-32.9	-178.9	-170.9	-86.1	0	0	0	113.2	L260 F263 D264 S292 N293 Y424 L426 I459	L260-F266 HydrophobicContact CD1-CD1 4.49Å; L260-F266 HydrophobicContact CD1-CE1 3.88Å; L260-F266 HydrophobicContact CD1-CZ 4.19Å; F263-F266 HydrophobicContact CB-CB 4.02Å; F263-F266 HydrophobicContact CB-CD2 4.44Å; F263-F266 VanDerWaalsContact O-CB 3.27Å; F263-F266 WeakPolarHBondContact O-CB 3.47Å; F263-F266 PolarHBondContact O-N 3.02Å; D264-F266 PolarHBondContact O-N 3.2Å; D264-F266 VanDerWaalsContact O-N 3.12Å; F266-S292 VanDerWaalsContact CE1-CB 3.43Å; F266-S292 CarbonylContact O-C 3.57Å; F266-S292 VanDerWaalsContact O-CA 3.3Å; F266-S292 WeakPolarHBondContact O-CA 3.43Å; F266-N293 WeakPolarHBondContact O-CB 3.36Å; F266-N293 PolarHBondContact O-N 2.75Å; F266-Y424 HydrophobicContact CB-CD2 4.41Å; F266-Y424 HydrophobicContact CB-CE2 4.11Å; F266-Y424 HydrophobicContact CD2-CD1 4.17Å; F266-Y424 AromaticContact CD2-CD2 3.66Å; F266-Y424 HydrophobicContact CD2-CD2 3.66Å; F266-Y424 HydrophobicContact CD2-CE2 4.06Å; F266-Y424 AromaticContact CD2-CG 3.71Å; F266-Y424 HydrophobicContact CD2-CG 3.71Å; F266-Y424 HydrophobicContact CE2-CD2 4.37Å; F266-Y424 HydrophobicContact CE2-CG 4.07Å; F266-Y424 HydrophobicContact CG-CD2 4.41Å; F266-L426 HydrophobicContact CE2-CD2 3.88Å; F266-L426 HydrophobicContact CZ-CD2 4.03Å; F266-I459 HydrophobicContact CE2-CD1 3.96Å
267	Y	70.7	Confident	56.7	Low	31 Å²	31	101.9 Å²	101.9	12%	0.122	49%	0.493	C	S	.	.	B	Isolated β-bridge	trans	-107.3	122.2	170.3	-66.5	-73.5	0	0	0	109.6	D251 L255 L260 G265 H269 R290	D251-Y267 HydrophobicContact CB-CE1 4.28Å; L255-Y267 HydrophobicContact CD1-CE1 4.41Å; L255-Y267 HydrophobicContact CD2-CE2 3.84Å; L255-Y267 WeakPolarHBondContact CD2-OH 3.15Å; L255-Y267 WeakPolarHBondContact CG-OH 3.21Å; L260-Y267 HydrophobicContact CB-CE2 4.37Å; L260-Y267 WeakPolarHBondContact CD1-OH 3.42Å; G265-Y267 VanDerWaalsContact C-N 3.27Å; G265-Y267 PolarHBondContact O-N 3.48Å; Y267-H269 PolarHBondContact O-N 3.04Å; Y267-H269 VanDerWaalsContact O-N 3.16Å; Y267-R290 HydrophobicContact CD1-CB 3.94Å; Y267-R290 WeakPolarHBondContact CD1-O 3.44Å; Y267-R290 HydrophobicContact CG-CB 4.39Å
268	K	59.9	Low	54.5	Low	102 Å²	102	106.6 Å²	106.6	44%	0.443	52%	0.523	S	S	.	.			trans	-69.6	115.2	175.5	-60.5	-165.9	-179	-173.8	0	108.7	K270 K291 N293 D421	K268-K270 PolarHBondContact O-N 3.2Å; K268-K291 PolarHBondContact N-O 3.13Å; K268-N293 WeakPolarHBondContact CE-OD1 3.33Å; K268-N293 HydrophobicContact CG-CB 4.12Å; K268-N293 PolarHBondContact NZ-OD1 2.85Å; K268-D421 PolarHBondContact NZ-O 3.25Å
269	H	47	Very low	52.2	Low	148 Å²	148	115.7 Å²	115.7	69%	0.685	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-61.8	134.6	169.2	-74.8	-91.6	0	0	0	108.9	Y267 V271	Y267-H269 PolarHBondContact O-N 3.04Å; Y267-H269 VanDerWaalsContact O-N 3.16Å; H269-V271 PolarHBondContact O-N 3.01Å
270	K	38.5	Very low	49.9	Very low	175 Å²	175	122.7 Å²	122.7	76%	0.761	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-60.9	122.4	162	-84.7	-173.7	169.7	-173.9	0	107.1	K268	K268-K270 PolarHBondContact O-N 3.2Å
271	V	31.6	Very low	47.7	Very low	119 Å²	119	132 Å²	132	72%	0.721	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-59.8	133.8	157	179.1	0	0	0	0	106.4	H269 E273	H269-V271 PolarHBondContact O-N 3.01Å; V271-E273 VanDerWaalsContact C-N 3.32Å; V271-E273 PolarHBondContact O-N 3.41Å
272	P	34.8	Very low	45.8	Very low	118 Å²	118	125.4 Å²	125.4	77%	0.766	64%	0.64	S	S	*	*			trans	-69.5	95.9	168.2	28.8	-32	0	0	0	108.1
273	E	34.7	Very low	43.7	Very low	164 Å²	164	131.3 Å²	131.3	77%	0.766	67%	0.667	S	S	*	*			trans	-60.9	141.2	161	-67.7	-178.1	145.6	0	0	108	V271 E275	V271-E273 VanDerWaalsContact C-N 3.32Å; V271-E273 PolarHBondContact O-N 3.41Å; E273-E275 VanDerWaalsContact C-N 3.33Å; E273-E275 PolarHBondContact O-N 3.31Å
274	K	36.4	Very low	41.4	Very low	207 Å²	207	136 Å²	136	90%	0.9	70%	0.699	S	S	*	*			trans	-77.7	85.8	-178	-68.9	-176.6	177.2	-175	0	109.5
275	E	34.7	Very low	39.5	Very low	180 Å²	180	137 Å²	137	84%	0.841	71%	0.713	S	S	*	*			trans	-82.2	139.6	163.5	-63.6	-176	138.5	0	0	108.8	E273	E273-E275 VanDerWaalsContact C-N 3.33Å; E273-E275 PolarHBondContact O-N 3.31Å
276	E	34.4	Very low	37.9	Very low	186 Å²	186	143.4 Å²	143.4	87%	0.869	73%	0.73	S	S	*	*			trans	-81	158.2	-171	-62.5	179.9	134.4	0	0	112	V278	E276-V278 PolarHBondContact O-N 3.1Å
277	E	30.7	Very low	36.1	Very low	202 Å²	202	151.8 Å²	151.8	94%	0.944	77%	0.77	S	S	*	*			trans	-65.9	113.2	-175.5	-64.6	174.5	154.2	0	0	112
278	V	32.2	Very low	34.3	Very low	133 Å²	133	154.8 Å²	154.8	81%	0.806	79%	0.791	S	S	*	*			trans	-134.4	118.3	161.8	-176.6	0	0	0	0	108.4	E276	E276-V278 PolarHBondContact O-N 3.1Å
279	E	33.8	Very low	33.5	Very low	192 Å²	192	154.9 Å²	154.9	90%	0.897	80%	0.802	S	S	*	*			trans	-83.8	116.4	175.7	-61.8	179.8	131.4	0	0	110.6
280	E	30	Very low	34	Very low	192 Å²	192	155.3 Å²	155.3	90%	0.897	80%	0.798	S	S	*	*			trans	-134.5	137.5	154.1	-75	-161.2	144.2	0	0	109.6
281	E	31.5	Very low	35.2	Very low	199 Å²	199	154.7 Å²	154.7	93%	0.93	80%	0.795	S	S	*	*			trans	-91.1	139	-172	-62	-173.8	120.3	0	0	113.1
282	G	32.9	Very low	37	Very low	77 Å²	77	149.5 Å²	149.5	79%	0.794	76%	0.764	S	S	*	*			trans	97.1	48.8	135.4	0	0	0	0	0	120.4
283	E	26.1	Very low	39.2	Very low	181 Å²	181	144.1 Å²	144.1	85%	0.846	73%	0.729	S	S	*	*			trans	-122.4	148.7	153	-80.3	-152.8	154.5	0	0	112.4	S285	E283-S285 PolarHBondContact O-N 3.39Å
284	P	26.3	Very low	41.3	Very low	112 Å²	112	136.3 Å²	136.3	73%	0.727	69%	0.692	S	S	*	*			trans	-66.4	126.9	-179.3	27.5	-34.5	0	0	0	111	H286	P284-H286 PolarHBondContact O-N 3.45Å
285	S	27.4	Very low	43.4	Very low	110 Å²	110	126.5 Å²	126.5	77%	0.769	65%	0.65	S	S	*	*			trans	-67.2	97.1	-170.5	49.7	0	0	0	0	113.2	E283 Q287	E283-S285 PolarHBondContact O-N 3.39Å; S285-Q287 PolarHBondContact O-N 3.34Å
286	H	30.6	Very low	45.6	Very low	182 Å²	182	118 Å²	118	84%	0.843	61%	0.61	S	S	*	*			trans	-58.2	97.2	165.2	-89.9	-72.1	0	0	0	109.9	P284 T288	P284-H286 PolarHBondContact O-N 3.45Å; H286-T288 PolarHBondContact O-N 3.46Å
287	Q	33.2	Very low	47.6	Very low	178 Å²	178	109.2 Å²	109.2	83%	0.832	57%	0.569	S	S	*	*			trans	-60.7	103.8	177.5	-65.5	-172.2	10.1	0	0	110	S285	S285-Q287 PolarHBondContact O-N 3.34Å
288	T	33.8	Very low	49.6	Very low	94 Å²	94	102 Å²	102	58%	0.577	54%	0.535	S	S	*	.			trans	-57.4	127	175.3	58.1	0	0	0	0	109.1	H286 R290	H286-T288 PolarHBondContact O-N 3.46Å; T288-R290 PolarHBondContact O-N 3.46Å
289	P	43.6	Very low	51.5	Low	103 Å²	103	97.1 Å²	97.1	67%	0.669	50%	0.504	S	S	*	.			trans	-59.5	128.7	-170.5	21.1	-32.6	0	0	0	111.5	K291	P289-K291 PolarHBondContact O-N 3.43Å; P289-K291 VanDerWaalsContact O-N 3.11Å
290	R	56.3	Low	53.4	Low	157 Å²	157	88.2 Å²	88.2	59%	0.592	46%	0.462	S	S	*	.			trans	-66.1	108.4	173.7	-66.8	-177.5	-178.2	-177.7	0.3	108.4	Y267 T288 S292	Y267-R290 HydrophobicContact CD1-CB 3.94Å; Y267-R290 WeakPolarHBondContact CD1-O 3.44Å; Y267-R290 HydrophobicContact CG-CB 4.39Å; T288-R290 PolarHBondContact O-N 3.46Å; R290-S292 PolarHBondContact O-N 2.79Å
291	K	64.1	Low	55.4	Low	162 Å²	162	79.1 Å²	79.1	70%	0.704	42%	0.419	S	S	*	.			trans	-56.9	124.4	175	-66.8	176.8	-177.5	169.4	0	109.9	D251 K268 P289	D251-K291 VanDerWaalsContact OD2-CA 3.31Å; D251-K291 WeakPolarHBondContact OD2-CA 3.2Å; K268-K291 PolarHBondContact N-O 3.13Å; P289-K291 PolarHBondContact O-N 3.43Å; P289-K291 VanDerWaalsContact O-N 3.11Å
292	S	69.9	Low	57.1	Low	10 Å²	10	69.9 Å²	69.9	7%	0.07	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-70.8	155.6	170.4	62.3	0	0	0	0	112.1	S248 D251 F266 R290 S294	S248-S292 PolarHBondContact OG-OG 2.98Å; D251-S292 WeakPolarHBondContact OD1-CB 3.23Å; D251-S292 PolarHBondContact OD1-N 3.14Å; D251-S292 PolarHBondContact OD1-OG 3.24Å; D251-S292 PolarHBondContact OD2-N 2.84Å; F266-S292 VanDerWaalsContact CE1-CB 3.43Å; F266-S292 CarbonylContact O-C 3.57Å; F266-S292 VanDerWaalsContact O-CA 3.3Å; F266-S292 WeakPolarHBondContact O-CA 3.43Å; R290-S292 PolarHBondContact O-N 2.79Å; S292-S294 PolarHBondContact O-N 2.79Å; S292-S294 PolarHBondContact OG-OG 3.13Å
293	N	80.1	Confident	58.8	Low	5 Å²	5	67.1 Å²	67.1	3%	0.027	34%	0.344	C	S	.	.	S	Bend	trans	-87.9	39.7	179.5	-164.4	2	0	0	0	110.9	G265 F266 K268 E423 Y424	G265-N293 WeakPolarHBondContact O-CB 3.34Å; G265-N293 PolarHBondContact O-ND2 2.81Å; G265-N293 VanDerWaalsContact O-ND2 3.17Å; F266-N293 WeakPolarHBondContact O-CB 3.36Å; F266-N293 PolarHBondContact O-N 2.75Å; K268-N293 WeakPolarHBondContact CE-OD1 3.33Å; K268-N293 HydrophobicContact CG-CB 4.12Å; K268-N293 PolarHBondContact NZ-OD1 2.85Å; N293-E423 PolarHBondContact ND2-OE2 3.4Å; N293-E423 PolarHBondContact O-N 3.15Å; N293-E423 PolarHBondContact OD1-N 2.96Å; N293-Y424 HydrophobicContact CB-CD2 4.47Å; N293-Y424 PolarHBondContact O-N 3.18Å
294	S	80.5	Confident	60.4	Low	1 Å²	1	62.3 Å²	62.3	1%	0.007	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	149.3	-162.5	77	0	0	0	0	115.9	S248 S292 Y424	S248-S294 WeakPolarHBondContact CB-OG 3.37Å; S248-S294 PolarHBondContact N-O 3.25Å; S248-S294 VanDerWaalsContact N-O 3.13Å; S248-S294 PolarHBondContact OG-OG 2.95Å; S292-S294 PolarHBondContact O-N 2.79Å; S292-S294 PolarHBondContact OG-OG 3.13Å; S294-Y424 WeakPolarHBondContact CA-O 3.25Å
295	F	80.1	Confident	61.8	Low	1 Å²	1	60.7 Å²	60.7	0%	0.004	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	154.8	164.4	67.6	-90.2	0	0	0	110.4	A245 T246 L415 V416 F419 L422 Y424 C425 L426	A245-F295 HydrophobicContact CB-CD2 4.14Å; T246-F295 CarbonylContact O-C 3.54Å; T246-F295 WeakPolarHBondContact O-CA 2.95Å; T246-F295 WeakPolarHBondContact O-CB 3.2Å; F295-L415 HydrophobicContact CE2-CB 4.26Å; F295-L415 HydrophobicContact CZ-CB 4.35Å; F295-V416 HydrophobicContact CE1-CG2 4.2Å; F295-V416 HydrophobicContact CZ-CG2 3.84Å; F295-F419 HydrophobicContact CB-CD1 4.46Å; F295-F419 HydrophobicContact CB-CD2 4.13Å; F295-F419 HydrophobicContact CB-CE2 4.26Å; F295-F419 HydrophobicContact CB-CG 4.25Å; F295-F419 HydrophobicContact CB-CZ 4.48Å; F295-F419 HydrophobicContact CD1-CB 3.78Å; F295-F419 AromaticContact CD1-CD2 3.82Å; F295-F419 HydrophobicContact CD1-CD2 3.82Å; F295-F419 AromaticContact CD1-CG 3.9Å; F295-F419 HydrophobicContact CD1-CG 3.9Å; F295-F419 AromaticContact CD2-CD2 3.76Å; F295-F419 HydrophobicContact CD2-CD2 3.76Å; F295-F419 AromaticContact CD2-CE2 3.93Å; F295-F419 HydrophobicContact CD2-CE2 3.93Å; F295-F419 HydrophobicContact CE1-CB 3.98Å; F295-F419 HydrophobicContact CE1-CD2 4.08Å; F295-F419 HydrophobicContact CE1-CG 4.35Å; F295-F419 HydrophobicContact CE2-CD2 4.01Å; F295-F419 HydrophobicContact CE2-CE2 4.4Å; F295-F419 HydrophobicContact CG-CB 4.4Å; F295-F419 AromaticContact CG-CD2 3.64Å; F295-F419 HydrophobicContact CG-CD2 3.64Å; F295-F419 HydrophobicContact CG-CE2 4.06Å; F295-F419 HydrophobicContact CG-CG 4.01Å; F295-F419 HydrophobicContact CZ-CD2 4.16Å; F295-L422 HydrophobicContact CB-CD1 3.9Å; F295-L422 HydrophobicContact CD1-CB 4.12Å; F295-L422 HydrophobicContact CD1-CD1 4.34Å; F295-Y424 PolarHBondContact N-O 2.66Å; F295-C425 HydrophobicContact CD2-CB 4.49Å; F295-C425 HydrophobicContact CE1-CB 4.06Å; F295-C425 HydrophobicContact CE2-CB 3.84Å; F295-C425 WeakPolarHBondContact CE2-SG 3.38Å; F295-C425 HydrophobicContact CZ-CB 3.6Å; F295-C425 CarbonylContact O-C 3.56Å; F295-C425 WeakPolarHBondContact O-CA 3.39Å; F295-L426 PolarHBondContact O-N 2.8Å
296	C	80.5	Confident	63.2	Low	1 Å²	1	57 Å²	57	1%	0.007	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.1	179.9	-174.2	0	0	0	0	110.4	A245 T246 L426	A245-C296 CarbonylContact C-O 3.55Å; A245-C296 VanDerWaalsContact CA-O 3.29Å; A245-C296 WeakPolarHBondContact CA-O 3.48Å; T246-C296 PolarHBondContact N-O 3.49Å; T246-C296 PolarHBondContact O-N 3.44Å; C296-L426 WeakPolarHBondContact CA-O 3.38Å; C296-L426 HydrophobicContact CB-CB 4.05Å
297	I	77.1	Confident	64.1	Low	1 Å²	1	51 Å²	51	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	128.3	168	-61.5	177.3	0	0	0	108.1	V243 A245 F300 V397 L412 L415 L426 I427	V243-I297 HydrophobicContact CG2-CG2 3.94Å; A245-I297 HydrophobicContact CB-CG1 4.26Å; I297-F300 HydrophobicContact CG2-CB 4.4Å; I297-V397 WeakPolarHBondContact O-CG2 3.24Å; I297-L412 HydrophobicContact CD1-CD2 3.67Å; I297-L415 HydrophobicContact CD1-CD1 3.96Å; I297-L415 HydrophobicContact CG1-CD1 4.3Å; I297-L426 PolarHBondContact N-O 2.97Å; I297-I427 HydrophobicContact CB-CG1 4.29Å; I297-I427 HydrophobicContact CD1-CD1 4.19Å; I297-I427 HydrophobicContact CD1-CG1 4.16Å; I297-I427 HydrophobicContact CG1-CG1 4.48Å
298	Q	72.5	Confident	64.4	Low	51 Å²	51	48 Å²	48	24%	0.238	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-35	179.7	-63.8	-166.8	-11.5	0	0	112.6	A244 T246 V397	A244-Q298 PolarHBondContact O-N 2.82Å; T246-Q298 HydrophobicContact CG2-CG 4.27Å; T246-Q298 PolarHBondContact OG1-NE2 3.45Å; Q298-V397 WeakPolarHBondContact O-CA 3.48Å
299	H	72	Confident	64.8	Low	31 Å²	31	49.7 Å²	49.7	14%	0.144	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	138.8	-179.7	-59.8	-66.1	0	0	0	109.7	F242 V243 A244	F242-H299 HydrophobicContact CE1-CB 4.23Å; V243-H299 WeakPolarHBondContact CA-O 3.34Å; V243-H299 WeakPolarHBondContact CG2-O 3.48Å; A244-H299 HydrophobicContact CB-CB 4.28Å; A244-H299 PolarHBondContact N-O 3.31Å; A244-H299 PolarHBondContact O-N 3.07Å
300	F	72.7	Confident	64.3	Low	5 Å²	5	49.4 Å²	49.4	2%	0.022	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	121.7	171.2	-178.9	-91.7	0	0	0	109.9	V243 I297 F398 A399 V400 T408 V411 W438	V243-F300 HydrophobicContact CB-CD2 4.08Å; V243-F300 HydrophobicContact CG2-CD2 3.9Å; I297-F300 HydrophobicContact CG2-CB 4.4Å; F300-F398 PolarHBondContact N-O 3Å; F300-A399 WeakPolarHBondContact O-CA 3.33Å; F300-V400 PolarHBondContact O-N 3.16Å; F300-T408 HydrophobicContact CE1-CG2 4.21Å; F300-T408 HydrophobicContact CE2-CG2 4.38Å; F300-T408 HydrophobicContact CZ-CG2 3.69Å; F300-V411 HydrophobicContact CE2-CG1 4.26Å; F300-V411 HydrophobicContact CE2-CG2 4.35Å; F300-W438 HydrophobicContact CD1-CH2 4.44Å; F300-W438 AromaticContact CD1-CZ2 3.75Å; F300-W438 HydrophobicContact CD1-CZ2 3.75Å; F300-W438 HydrophobicContact CE1-CZ2 4.21Å; F300-W438 HydrophobicContact CG-CH2 4.39Å; F300-W438 HydrophobicContact CG-CZ2 4.11Å
301	I	71.7	Confident	62.9	Low	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	139.7	-171.9	-59.6	160.8	0	0	0	108.6	I197 I200 V201 G241 F242 V400	I197-I301 HydrophobicContact CG2-CD1 4.45Å; I200-I301 HydrophobicContact CB-CG2 4.28Å; I200-I301 HydrophobicContact CG2-CG2 3.62Å; V201-I301 HydrophobicContact CG2-CD1 3.71Å; V201-I301 HydrophobicContact CG2-CG2 4.34Å; G241-I301 CarbonylContact C-O 3.48Å; G241-I301 WeakPolarHBondContact CA-O 3.32Å; F242-I301 HydrophobicContact CB-CB 4.47Å; F242-I301 HydrophobicContact CD1-CD1 4.16Å; F242-I301 PolarHBondContact N-O 3.25Å; F242-I301 PolarHBondContact O-N 3.03Å; I301-V400 HydrophobicContact CG1-CG2 3.95Å
302	A	68.6	Low	61.1	Low	6 Å²	6	43 Å²	43	5%	0.05	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	149.9	174.5	0	0	0	0	0	111.4	Q204 V240	Q204-A302 PolarHBondContact NE2-O 2.87Å; Q204-A302 PolarHBondContact OE1-O 3.01Å; V240-A302 WeakPolarHBondContact O-CA 3.45Å
303	D	68.3	Low	59	Low	19 Å²	19	48.3 Å²	48.3	10%	0.102	26%	0.263	C	S	.	.			trans	-84.1	113	172.3	-168.9	-29.2	0	0	0	109.6	I200 K203 V240 D305 H306 R309	I200-D303 HydrophobicContact CD1-CB 4.46Å; I200-D303 HydrophobicContact CG1-CB 4.29Å; I200-D303 HydrophobicContact CG2-CB 4.18Å; K203-D303 IonicContact NZ-OD2 2.66Å; K203-D303 PolarHBondContact NZ-OD2 2.9Å; V240-D303 PolarHBondContact O-N 2.89Å; D303-D305 VanDerWaalsContact C-N 3.34Å; D303-D305 PolarHBondContact O-N 2.8Å; D303-D305 WeakPolarHBondContact OD1-CB 3.37Å; D303-D305 PolarHBondContact OD1-N 2.94Å; D303-D305 VanDerWaalsContact OD1-N 3.1Å; D303-H306 PolarHBondContact O-N 3.04Å; D303-R309 IonicContact OD1-NH1 3.33Å; D303-R309 PolarHBondContact OD1-NH1 3.38Å; D303-R309 IonicContact OD2-NH1 2.73Å; D303-R309 PolarHBondContact OD2-NH1 3.41Å
304	E	58.9	Low	56.5	Low	80 Å²	80	53.6 Å²	53.6	37%	0.374	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-69.7	-29.5	-177.6	-63.8	-147.4	86.8	0	0	113.3	H306 Y401 S402 S403	E304-H306 PolarHBondContact O-N 3.09Å; E304-Y401 WeakPolarHBondContact CG-O 3.26Å; E304-Y401 WeakPolarHBondContact OE2-CB 3.31Å; E304-S402 WeakPolarHBondContact OE1-CA 3.27Å; E304-S403 WeakPolarHBondContact OE1-CB 3.39Å; E304-S403 PolarHBondContact OE1-N 2.76Å; E304-S403 PolarHBondContact OE1-OG 2.91Å
305	D	55.6	Low	53.9	Low	77 Å²	77	60.9 Å²	60.9	41%	0.412	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-76.6	-1.8	-179.3	-68.9	-38.5	0	0	0	113	D303 Q307 T308 R309	D303-D305 VanDerWaalsContact C-N 3.34Å; D303-D305 PolarHBondContact O-N 2.8Å; D303-D305 WeakPolarHBondContact OD1-CB 3.37Å; D303-D305 PolarHBondContact OD1-N 2.94Å; D303-D305 VanDerWaalsContact OD1-N 3.1Å; D305-Q307 VanDerWaalsContact C-N 3.3Å; D305-Q307 PolarHBondContact O-N 3.42Å; D305-T308 PolarHBondContact O-N 3.08Å; D305-T308 PolarHBondContact O-OG1 3.26Å; D305-R309 VanDerWaalsContact CB-NH1 3.26Å; D305-R309 VanDerWaalsContact CG-NH2 3.33Å; D305-R309 WeakPolarHBondContact O-CG 3.2Å; D305-R309 PolarHBondContact O-N 2.96Å; D305-R309 IonicContact OD2-CZ 3.57Å; D305-R309 IonicContact OD2-NH1 3.95Å; D305-R309 IonicContact OD2-NH2 2.68Å; D305-R309 PolarHBondContact OD2-NH2 2.98Å
306	H	57.2	Low	51.6	Low	32 Å²	32	67.5 Å²	67.5	15%	0.148	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-61.3	-37.2	-169.4	-176	62.9	0	0	0	113.2	D235 V240 D303 E304	D235-H306 VanDerWaalsContact CB-NE2 3.28Å; D235-H306 WeakPolarHBondContact CB-NE2 3.44Å; D235-H306 IonicContact OD2-CD2 2.73Å; D235-H306 IonicContact OD2-CE1 3.67Å; D235-H306 IonicContact OD2-NE2 3.56Å; D235-H306 PolarHBondContact OD2-NE2 3.44Å; V240-H306 WeakPolarHBondContact CG1-ND1 3.25Å; D303-H306 PolarHBondContact O-N 3.04Å; E304-H306 PolarHBondContact O-N 3.09Å
307	Q	48.8	Very low	49.1	Very low	58 Å²	58	76.3 Å²	76.3	27%	0.271	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-22.6	178.9	-78.6	-173.6	-15.9	0	0	114.6	D305 R309 N404 F407	D305-Q307 VanDerWaalsContact C-N 3.3Å; D305-Q307 PolarHBondContact O-N 3.42Å; Q307-R309 VanDerWaalsContact C-N 3.26Å; Q307-R309 PolarHBondContact O-N 2.81Å; Q307-N404 PolarHBondContact OE1-ND2 3.05Å; Q307-F407 HydrophobicContact CG-CZ 4.06Å
308	T	41.2	Very low	46.7	Very low	115 Å²	115	85.1 Å²	85.1	71%	0.706	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-13.7	177.5	52.1	0	0	0	0	112.7	D305	D305-T308 PolarHBondContact O-N 3.08Å; D305-T308 PolarHBondContact O-OG1 3.26Å
309	R	41.1	Very low	44.6	Very low	129 Å²	129	86.5 Å²	86.5	49%	0.487	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	7	179.7	-66.7	177.7	-178.4	124.4	10.2	114.9	D303 D305 Q307 G311	D303-R309 IonicContact OD1-NH1 3.33Å; D303-R309 PolarHBondContact OD1-NH1 3.38Å; D303-R309 IonicContact OD2-NH1 2.73Å; D303-R309 PolarHBondContact OD2-NH1 3.41Å; D305-R309 VanDerWaalsContact CB-NH1 3.26Å; D305-R309 VanDerWaalsContact CG-NH2 3.33Å; D305-R309 WeakPolarHBondContact O-CG 3.2Å; D305-R309 PolarHBondContact O-N 2.96Å; D305-R309 IonicContact OD2-CZ 3.57Å; D305-R309 IonicContact OD2-NH1 3.95Å; D305-R309 IonicContact OD2-NH2 2.68Å; D305-R309 PolarHBondContact OD2-NH2 2.98Å; Q307-R309 VanDerWaalsContact C-N 3.26Å; Q307-R309 PolarHBondContact O-N 2.81Å; R309-G311 PolarHBondContact O-N 2.55Å
310	L	32.7	Very low	42.4	Very low	97 Å²	97	91.9 Å²	91.9	51%	0.508	53%	0.525	S	S	.	.			trans	-77.4	46.7	179.3	-74.9	167.1	0	0	0	113.6
311	G	28.1	Very low	40.2	Very low	48 Å²	48	95.4 Å²	95.4	50%	0.495	56%	0.563	S	S	.	*	S	Bend	trans	-88.1	164.3	160	0	0	0	0	0	111	R309 L313	R309-G311 PolarHBondContact O-N 2.55Å; G311-L313 PolarHBondContact O-N 3Å
312	P	25.6	Very low	37.8	Very low	136 Å²	136	99 Å²	99	88%	0.883	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-62.2	130.7	179.4	25.5	-33.6	0	0	0	111.6
313	L	25.1	Very low	36.3	Very low	121 Å²	121	104.7 Å²	104.7	63%	0.634	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-66.9	145.6	172	-74.6	164.6	0	0	0	110.3	G311 D315	G311-L313 PolarHBondContact O-N 3Å; L313-D315 PolarHBondContact O-N 3.19Å
314	P	28.2	Very low	34.2	Very low	117 Å²	117	108.5 Å²	108.5	76%	0.76	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-69.1	129.2	173.5	28.9	-33.5	0	0	0	110.5	T316	P314-T316 PolarHBondContact O-N 2.99Å
315	D	26.8	Very low	32.6	Very low	154 Å²	154	109.8 Å²	109.8	82%	0.824	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-58.1	132.3	-177.6	-72.4	-56	0	0	0	113	L313 M317	L313-D315 PolarHBondContact O-N 3.19Å; D315-M317 PolarHBondContact O-N 2.91Å; D315-M317 VanDerWaalsContact O-N 3.07Å
316	T	30.2	Very low	31	Very low	140 Å²	140	109.4 Å²	109.4	86%	0.859	71%	0.709	S	S	*	*			trans	-65.4	104.4	166.3	22.3	0	0	0	0	110.4	P314 E318	P314-T316 PolarHBondContact O-N 2.99Å; T316-E318 PolarHBondContact O-N 2.92Å; T316-E318 VanDerWaalsContact O-N 3.12Å
317	M	28.8	Very low	30.2	Very low	186 Å²	186	114.2 Å²	114.2	92%	0.916	74%	0.743	S	S	*	*			trans	-61.4	107.5	171.4	-79.9	-86.6	177.3	0	0	111.3	D315 G319	D315-M317 PolarHBondContact O-N 2.91Å; D315-M317 VanDerWaalsContact O-N 3.07Å; M317-G319 PolarHBondContact O-N 3.06Å
318	E	26.3	Very low	29	Very low	186 Å²	186	116.2 Å²	116.2	87%	0.869	77%	0.769	S	S	*	*			trans	-68.2	117.3	166	-69.5	-165.2	130.6	0	0	110.6	T316	T316-E318 PolarHBondContact O-N 2.92Å; T316-E318 VanDerWaalsContact O-N 3.12Å
319	G	28.4	Very low	28.3	Very low	80 Å²	80	117.5 Å²	117.5	83%	0.825	78%	0.777	S	S	*	*			trans	-108.3	95.3	173.7	0	0	0	0	0	111.6	M317	M317-G319 PolarHBondContact O-N 3.06Å
320	T	26.1	Very low	27.5	Very low	144 Å²	144	117.3 Å²	117.3	88%	0.883	80%	0.796	S	S	*	*			trans	-85.9	134.4	174.1	41.5	0	0	0	0	111.5
321	G	25.7	Very low	27.2	Very low	79 Å²	79	121.2 Å²	121.2	81%	0.814	81%	0.811	S	S	*	*			trans	145.2	90	169.5	0	0	0	0	0	116.3
322	G	22.8	Very low	27	Very low	75 Å²	75	130.3 Å²	130.3	77%	0.773	83%	0.83	S	S	*	*			trans	-86	-177	145.8	0	0	0	0	0	110.7
323	P	36.5	Very low	27.1	Very low	126 Å²	126	130.6 Å²	130.6	82%	0.818	83%	0.825	S	S	*	*			cis	-136.1	170	16.3	41.8	-25.4	0	0	0	116.7
324	A	24.9	Very low	27.6	Very low	99 Å²	99	130.6 Å²	130.6	82%	0.818	83%	0.831	S	S	*	*			trans	40.7	116.1	145.2	0	0	0	0	0	121.4
325	A	23.6	Very low	27.4	Very low	106 Å²	106	129 Å²	129	88%	0.876	83%	0.828	S	S	*	*				-176.3	142.4	112.1	0	0	0	0	0	112.7
326	G	23.5	Very low	27.9	Very low	70 Å²	70	127.4 Å²	127.4	72%	0.722	83%	0.826	S	S	*	*			trans	-112.9	-174.1	147.8	0	0	0	0	0	109.1
327	P	40.4	Very low	27.7	Very low	133 Å²	133	129.7 Å²	129.7	86%	0.864	83%	0.827	S	S	*	*			cis	-135.8	-147.8	10.9	43.8	-25.5	0	0	0	112.4
328	A	22.2	Very low	27.7	Very low	99 Å²	99	125.8 Å²	125.8	82%	0.818	82%	0.818	S	S	*	*			trans	104.3	134.3	157	0	0	0	0	0	118
329	T	27	Very low	28.4	Very low	143 Å²	143	123.1 Å²	123.1	88%	0.877	82%	0.817	S	S	*	*			trans	-101.1	148.5	179.7	44	0	0	0	0	111.5
330	S	24.8	Very low	28.4	Very low	125 Å²	125	123.9 Å²	123.9	87%	0.874	82%	0.815	S	S	*	*			trans	-162.1	152.7	152.4	54.3	0	0	0	0	111.4
331	H	26	Very low	28.4	Very low	179 Å²	179	126.2 Å²	126.2	83%	0.829	82%	0.816	S	S	*	*			trans	-93.9	149.1	178	-63.6	-101.1	0	0	0	111.6
332	R	24	Very low	28.5	Very low	238 Å²	238	126.4 Å²	126.4	90%	0.898	81%	0.805	S	S	*	*				174.3	136.8	107.6	-96.7	174.7	174.8	178	-1.7	114
333	D	27.1	Very low	28.7	Very low	143 Å²	143	134.4 Å²	134.4	77%	0.765	81%	0.812	S	S	*	*			trans	-75.1	177.4	164.3	-42	-90.2	0	0	0	111.5
334	P	37.1	Very low	28	Very low	120 Å²	120	132.2 Å²	132.2	78%	0.779	81%	0.812	S	S	*	*				-152	140.5	89.7	37.5	-19.3	0	0	0	118.1
335	A	23.8	Very low	28.1	Very low	83 Å²	83	132.1 Å²	132.1	69%	0.686	81%	0.812	S	S	*	*			trans	56.1	168.8	131.5	0	0	0	0	0	120.9
336	P	35.8	Very low	28.7	Very low	121 Å²	121	133.3 Å²	133.3	79%	0.786	81%	0.81	S	S	*	*			cis	-104.9	149.1	-5.2	37.9	-27.3	0	0	0	113.1
337	Q	26.6	Very low	28.7	Very low	188 Å²	188	138.7 Å²	138.7	88%	0.879	82%	0.817	S	S	*	*				87	139.2	52.2	-83.5	-165.5	-10.4	0	0	116.1
338	S	28.2	Very low	28	Very low	104 Å²	104	137 Å²	137	73%	0.727	81%	0.813	S	S	*	*			trans	-93.7	-164.6	-171.1	54.1	0	0	0	0	113
339	P	41.6	Very low	28	Very low	130 Å²	130	137 Å²	137	84%	0.844	81%	0.814	S	S	*	*				-138.6	172.3	107.7	39.5	-29.6	0	0	0	114.6
340	A	28.1	Very low	27.8	Very low	96 Å²	96	137 Å²	137	79%	0.793	81%	0.809	S	S	*	*			trans	-154.7	150.3	171.6	0	0	0	0	0	112
341	E	26.2	Very low	27.7	Very low	193 Å²	193	136.5 Å²	136.5	90%	0.902	80%	0.804	S	S	*	*			trans	-149.9	166.4	171.2	-65.4	-168.6	142.2	0	0	110.1
342	S	27.4	Very low	27.5	Very low	83 Å²	83	133.2 Å²	133.2	58%	0.58	80%	0.801	S	S	*	*				-164.7	154.1	-51.1	73.7	0	0	0	0	110
343	R	27	Very low	27.6	Very low	244 Å²	244	126.7 Å²	126.7	92%	0.921	79%	0.792	S	S	*	*			trans	65.4	162.2	166.9	-56.4	166	178.1	176.9	-0.1	115.3
344	G	22.2	Very low	27.3	Very low	79 Å²	79	124.4 Å²	124.4	81%	0.814	79%	0.787	S	S	*	*			cis	175.3	161.9	-6.5	0	0	0	0	0	110.2
345	A	27	Very low	26.6	Very low	98 Å²	98	124.8 Å²	124.8	81%	0.81	79%	0.791	S	S	*	*			trans	-124.3	157.6	-177.3	0	0	0	0	0	113
346	P	36.4	Very low	26.5	Very low	130 Å²	130	125.7 Å²	125.7	84%	0.844	79%	0.792	S	S	*	*			trans	-142	-170	131.9	39.3	-24.3	0	0	0	114.5
347	E	24.5	Very low	25.8	Very low	184 Å²	184	124.9 Å²	124.9	86%	0.86	79%	0.789	S	S	*	*			trans	-91.1	166.8	-163.6	-51.7	146.7	118.2	0	0	115.2
348	A	24.8	Very low	25.6	Very low	96 Å²	96	120.2 Å²	120.2	79%	0.793	78%	0.783	S	S	*	*				159.9	137.7	105.6	0	0	0	0	0	116.2
349	A	23.5	Very low	25.4	Very low	101 Å²	101	123.7 Å²	123.7	84%	0.835	79%	0.788	S	S	*	*			trans	63	166.5	147.8	0	0	0	0	0	122
350	D	21.7	Very low	24.5	Very low	142 Å²	142	125.5 Å²	125.5	76%	0.759	79%	0.79	S	S	*	*				-168	154.6	-53.3	-148.5	-37.7	0	0	0	109.6
351	C	22.4	Very low	24.2	Very low	114 Å²	114	124 Å²	124	77%	0.77	78%	0.783	S	S	*	*			trans	60.5	147	165.2	-72.9	0	0	0	0	117.9
352	S	23.1	Very low	24	Very low	111 Å²	111	120 Å²	120	78%	0.776	78%	0.777	S	S	*	*			cis	-163.1	-171	-4.5	57.9	0	0	0	0	107.7
353	S	24.3	Very low	23.7	Very low	101 Å²	101	123.5 Å²	123.5	71%	0.706	79%	0.789	S	S	*	*			cis	-158.7	167.3	13.7	55.7	0	0	0	0	113.5
354	S	22	Very low	23.6	Very low	95 Å²	95	120.2 Å²	120.2	66%	0.664	79%	0.788	S	S	*	*			trans	5.2	133.4	154.6	61.1	0	0	0	0	124
355	C	21.1	Very low	23.5	Very low	127 Å²	127	121.7 Å²	121.7	86%	0.858	78%	0.782	S	S	*	*				59.5	146.3	125.5	-62.6	0	0	0	0	121.4
356	S	22.2	Very low	23.3	Very low	102 Å²	102	122.2 Å²	122.2	71%	0.713	78%	0.775	S	S	*	*			cis	-160.8	167.3	1.6	49.6	0	0	0	0	113.3
357	S	22	Very low	22.6	Very low	104 Å²	104	124.9 Å²	124.9	73%	0.727	78%	0.776	S	S	*	*			trans	60.9	106.8	145.3	59.7	0	0	0	0	121.9
358	A	22.5	Very low	22.5	Very low	90 Å²	90	121.8 Å²	121.8	74%	0.744	78%	0.775	S	S	*	*				86.4	126.6	117.7	0	0	0	0	0	123
359	Q	22.7	Very low	22.4	Very low	177 Å²	177	122.2 Å²	122.2	83%	0.827	77%	0.771	S	S	*	*			trans	77.4	128.4	140.7	-74.7	-179.9	-12.3	0	0	122.3
360	L	22.7	Very low	22.3	Very low	169 Å²	169	127.1 Å²	127.1	89%	0.885	77%	0.774	S	S	*	*			trans	48.9	134.8	153	-78.3	69.4	0	0	0	119.4
361	G	21.9	Very low	22.2	Very low	63 Å²	63	129.2 Å²	129.2	65%	0.649	78%	0.776	S	S	*	*			cis	157.9	160.3	-5.7	0	0	0	0	0	113.7
362	S	22.6	Very low	22.2	Very low	111 Å²	111	129.1 Å²	129.1	78%	0.776	78%	0.775	S	S	*	*			trans	78.4	141	169.7	81.2	0	0	0	0	120
363	N	22	Very low	22.1	Very low	156 Å²	156	130 Å²	130	83%	0.834	78%	0.775	S	S	*	*			trans	66.9	96.8	150.1	-57.2	-9.2	0	0	0	120.1
364	L	24.2	Very low	22	Very low	174 Å²	174	133 Å²	133	91%	0.911	78%	0.781	S	S	*	*			trans	-108.1	145.7	160.1	-116.5	158.6	0	0	0	109.8
365	T	20.8	Very low	22	Very low	111 Å²	111	132.7 Å²	132.7	68%	0.681	78%	0.776	S	S	*	*			trans	-101.3	-177.7	-174	53.8	0	0	0	0	113.1
366	T	21.9	Very low	22.1	Very low	108 Å²	108	135.7 Å²	135.7	66%	0.663	77%	0.774	S	S	*	*			trans	68.3	103.3	151.4	39.3	0	0	0	0	119.4
367	Q	22.3	Very low	22.3	Very low	186 Å²	186	138.7 Å²	138.7	87%	0.869	78%	0.776	S	S	*	*				41.6	121.2	122.6	-63.4	174.7	-28	0	0	119.6
368	S	20.9	Very low	22.5	Very low	119 Å²	119	140.2 Å²	140.2	83%	0.832	77%	0.77	S	S	*	*				-156.9	151.1	110.6	63.7	0	0	0	0	113.9
369	C	24.1	Very low	22.6	Very low	106 Å²	106	140.9 Å²	140.9	72%	0.716	77%	0.767	S	S	*	*			trans	-26.7	124.3	178.4	-161.8	0	0	0	0	119
370	F	21.8	Very low	22.6	Very low	204 Å²	204	140.9 Å²	140.9	90%	0.895	77%	0.769	S	S	*	*			trans	-125.8	134.3	143	-94.8	-93.3	0	0	0	108.7
371	K	19.1	Very low	22.7	Very low	185 Å²	185	137.8 Å²	137.8	80%	0.804	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-83.4	121.5	172.2	-69.6	-178	176.6	-176.9	0	109.1
372	P	21.2	Very low	22.9	Very low	113 Å²	113	140 Å²	140	73%	0.734	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-73.6	127.9	167.2	30.2	-31.4	0	0	0	109.4
373	V	21.5	Very low	22.9	Very low	129 Å²	129	141 Å²	141	78%	0.782	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-75	126.9	159.9	175.4	0	0	0	0	106.6	T375	V373-T375 PolarHBondContact O-N 2.97Å
374	I	22.4	Very low	23	Very low	164 Å²	164	140.5 Å²	140.5	84%	0.841	74%	0.74	S	S	*	*			trans	-79.9	86.9	-175.7	-55.2	176.4	0	0	0	109.2
375	T	21.6	Very low	22.9	Very low	89 Å²	89	135.1 Å²	135.1	55%	0.546	73%	0.727	S	S	.	*			trans	-78.5	149.2	162.8	42	0	0	0	0	110.4	V373 H377	V373-T375 PolarHBondContact O-N 2.97Å; T375-H377 PolarHBondContact O-N 3.29Å
376	K	24.6	Very low	23	Very low	189 Å²	189	137.3 Å²	137.3	82%	0.822	73%	0.733	S	S	*	*			trans	-64.4	102.1	-179.3	-68	176.8	179.1	176.7	0	110.2	F378	K376-F378 PolarHBondContact O-N 2.91Å
377	H	25.2	Very low	23	Very low	165 Å²	165	138.2 Å²	138.2	76%	0.764	74%	0.739	S	S	*	*			trans	-88.9	105.3	175.5	-79.9	-61.4	0	0	0	111.6	T375	T375-H377 PolarHBondContact O-N 3.29Å
378	F	25.7	Very low	23.2	Very low	137 Å²	137	141.1 Å²	141.1	60%	0.601	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-57.2	151.5	156.9	-68.5	-82.1	0	0	0	110.3	K376 M380	K376-F378 PolarHBondContact O-N 2.91Å; F378-M380 PolarHBondContact O-N 2.89Å
379	P	25.7	Very low	23.4	Very low	104 Å²	104	144 Å²	144	68%	0.675	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-59.4	126.1	-178.1	23.3	-33.6	0	0	0	111.5	L381	P379-L381 PolarHBondContact O-N 3.07Å
380	M	21.9	Very low	23.6	Very low	176 Å²	176	147.9 Å²	147.9	87%	0.867	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-59.4	116.3	-175.2	-172	-167.2	-58.2	0	0	111.4	F378 I382	F378-M380 PolarHBondContact O-N 2.89Å; M380-I382 PolarHBondContact O-N 3.21Å
381	L	26.4	Very low	24.1	Very low	105 Å²	105	148.5 Å²	148.5	55%	0.55	74%	0.744	S	S	.	*			trans	-67.7	115.6	177	-165.3	78.2	0	0	0	110	I210 P379 I383	I210-L381 HydrophobicContact CD1-CB 3.86Å; I210-L381 HydrophobicContact CD1-CD2 3.49Å; I210-L381 VanDerWaalsContact CD1-CD2 3.49Å; I210-L381 HydrophobicContact CD1-CG 4.3Å; P379-L381 PolarHBondContact O-N 3.07Å; L381-I383 PolarHBondContact O-N 2.75Å; L381-I383 VanDerWaalsContact O-N 3.08Å
382	I	24.6	Very low	24.4	Very low	108 Å²	108	145.6 Å²	145.6	55%	0.554	74%	0.737	S	S	*	*			trans	-73.6	103.9	-178.4	-60.8	177	0	0	0	109.7	M380 L384 K751	M380-I382 PolarHBondContact O-N 3.21Å; I382-L384 PolarHBondContact O-N 3.13Å; I382-L384 VanDerWaalsContact O-N 3.16Å; I382-K751 WeakPolarHBondContact CD1-O 3.49Å
383	I	23.9	Very low	24.8	Very low	134 Å²	134	143.6 Å²	143.6	69%	0.687	72%	0.723	S	S	*	*			trans	-67.5	108.9	167.3	-58.3	176.6	0	0	0	108.3	L381 G385	L381-I383 PolarHBondContact O-N 2.75Å; L381-I383 VanDerWaalsContact O-N 3.08Å; I383-G385 PolarHBondContact O-N 2.79Å
384	L	22.9	Very low	25.2	Very low	144 Å²	144	143.4 Å²	143.4	75%	0.754	72%	0.717	S	S	*	*			trans	-65.2	117	162.8	-88	163.6	0	0	0	108.4	I382 I386	I382-L384 PolarHBondContact O-N 3.13Å; I382-L384 VanDerWaalsContact O-N 3.16Å; L384-I386 PolarHBondContact O-N 2.91Å
385	G	21.7	Very low	25.8	Very low	62 Å²	62	139 Å²	139	64%	0.639	69%	0.691	S	S	*	*			trans	-61.3	133.3	-166.7	0	0	0	0	0	114.2	I383 T387	I383-G385 PolarHBondContact O-N 2.79Å; G385-T387 PolarHBondContact O-N 3.11Å; G385-T387 VanDerWaalsContact O-N 3.11Å
386	I	23.4	Very low	26.4	Very low	157 Å²	157	137.1 Å²	137.1	81%	0.805	68%	0.681	S	S	*	*			trans	-74.8	99.4	180	-57.2	170.2	0	0	0	109.9	L384	L384-I386 PolarHBondContact O-N 2.91Å
387	T	21.5	Very low	26.9	Very low	126 Å²	126	128.8 Å²	128.8	77%	0.773	65%	0.647	S	S	*	*			trans	-81.6	137.9	159.2	47.1	0	0	0	0	109.7	G385 Q389	G385-T387 PolarHBondContact O-N 3.11Å; G385-T387 VanDerWaalsContact O-N 3.11Å; T387-Q389 VanDerWaalsContact C-N 3.34Å; T387-Q389 PolarHBondContact O-N 2.72Å
388	R	28	Very low	27.6	Very low	248 Å²	248	123 Å²	123	94%	0.936	62%	0.619	S	S	*	*	S	Bend	trans	-72.7	78.1	-177.2	-80.3	-178.3	164.2	179.9	-4.7	112.4
389	Q	24.6	Very low	28.2	Very low	179 Å²	179	117.7 Å²	117.7	84%	0.836	60%	0.6	S	S	*	*	S	Bend	trans	-157.6	114.4	159.5	-111.2	162.9	38.3	0	0	112.9	T387	T387-Q389 VanDerWaalsContact C-N 3.34Å; T387-Q389 PolarHBondContact O-N 2.72Å
390	K	28.2	Very low	28.9	Very low	187 Å²	187	113.9 Å²	113.9	81%	0.813	58%	0.575	S	S	*	*	S	Bend	trans	46.1	100.1	160.4	-64.6	-176.6	178.3	-179.3	0	118.7
391	Y	31.7	Very low	30.1	Very low	217 Å²	217	110.5 Å²	110.5	85%	0.851	55%	0.553	S	S	*	*			trans	55.4	61.2	147.4	-58	-74.2	0	0	0	118.6
392	L	25	Very low	30.7	Very low	125 Å²	125	105.7 Å²	105.7	65%	0.654	53%	0.529	S	S	*	.			trans	-93.1	95.4	151.8	-162.7	75.7	0	0	0	109.3	L394	L392-L394 PolarHBondContact O-N 3.18Å
393	V	30.7	Very low	31.6	Very low	70 Å²	70	104.1 Å²	104.1	42%	0.424	53%	0.527	S	S	.	.			trans	-68.7	114.1	171.9	177.6	0	0	0	0	108.5	F395	V393-F395 HydrophobicContact CB-CE2 4.45Å; V393-F395 HydrophobicContact CG1-CD2 4.31Å; V393-F395 HydrophobicContact CG1-CE2 4.15Å; V393-F395 HydrophobicContact CG1-CZ 4.35Å; V393-F395 PolarHBondContact O-N 3.13Å
394	L	29.6	Very low	32.8	Very low	126 Å²	126	99 Å²	99	66%	0.66	50%	0.502	S	S	*	.			trans	-85	104.8	177.3	-161.6	77.5	0	0	0	108.6	L392 C396	L392-L394 PolarHBondContact O-N 3.18Å; L394-C396 VanDerWaalsContact CD2-SG 3.58Å; L394-C396 PolarHBondContact O-N 3.32Å
395	F	35.7	Very low	34.1	Very low	70 Å²	70	92.8 Å²	92.8	31%	0.307	47%	0.47	S	S	.	.			trans	-76.2	61.6	178.6	-73.3	-89.3	0	0	0	111.8	P249 V393 V397 F428	P249-F395 HydrophobicContact CG-CE1 4.16Å; P249-F395 HydrophobicContact CG-CZ 3.68Å; V393-F395 HydrophobicContact CB-CE2 4.45Å; V393-F395 HydrophobicContact CG1-CD2 4.31Å; V393-F395 HydrophobicContact CG1-CE2 4.15Å; V393-F395 HydrophobicContact CG1-CZ 4.35Å; V393-F395 PolarHBondContact O-N 3.13Å; F395-V397 PolarHBondContact O-N 3.14Å; F395-F428 AromaticContact CD1-CD2 3.83Å; F395-F428 HydrophobicContact CD1-CD2 3.83Å; F395-F428 AromaticContact CD1-CE2 3.84Å; F395-F428 HydrophobicContact CD1-CE2 3.84Å; F395-F428 HydrophobicContact CE1-CD2 4.34Å; F395-F428 AromaticContact CE1-CE2 3.9Å; F395-F428 HydrophobicContact CE1-CE2 3.9Å; F395-F428 HydrophobicContact CG-CD2 4.39Å; F395-F428 HydrophobicContact CG-CE2 4.47Å
396	C	33.5	Very low	35.5	Very low	50 Å²	50	91 Å²	91	34%	0.338	45%	0.448	S	S	.	.			trans	-89	81.3	172.6	-75.2	0	0	0	0	110.4	L394 F398	L394-C396 VanDerWaalsContact CD2-SG 3.58Å; L394-C396 PolarHBondContact O-N 3.32Å; C396-F398 PolarHBondContact O-N 2.81Å
397	V	35.9	Very low	37.1	Very low	15 Å²	15	85 Å²	85	9%	0.091	42%	0.416	C	S	.	.			trans	-71.4	101.9	168.7	-172.8	0	0	0	0	108.9	I297 Q298 F395 A399 I427 F428	I297-V397 WeakPolarHBondContact O-CG2 3.24Å; Q298-V397 WeakPolarHBondContact O-CA 3.48Å; F395-V397 PolarHBondContact O-N 3.14Å; V397-A399 VanDerWaalsContact C-N 3.31Å; V397-A399 HydrophobicContact CG1-CB 4.36Å; V397-A399 PolarHBondContact O-N 2.71Å; V397-A399 VanDerWaalsContact O-N 3.07Å; V397-I427 HydrophobicContact CG1-CG2 4.29Å; V397-F428 VanDerWaalsContact CB-O 3.26Å; V397-F428 WeakPolarHBondContact CB-O 3.46Å; V397-F428 HydrophobicContact CG2-CB 4.29Å; V397-F428 WeakPolarHBondContact CG2-O 3.32Å
398	F	39.2	Very low	38.9	Very low	44 Å²	44	79 Å²	79	19%	0.193	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	97.4	156.2	-76.8	-101.6	0	0	0	107	I210 L212 F300 C396 V400	I210-F398 HydrophobicContact CB-CE1 4.42Å; I210-F398 HydrophobicContact CB-CZ 3.92Å; I210-F398 HydrophobicContact CG2-CZ 3.88Å; L212-F398 HydrophobicContact CD1-CB 4.42Å; L212-F398 HydrophobicContact CD1-CD1 3.74Å; L212-F398 HydrophobicContact CD1-CD2 3.86Å; L212-F398 HydrophobicContact CD1-CE1 3.81Å; L212-F398 HydrophobicContact CD1-CE2 3.93Å; L212-F398 HydrophobicContact CD1-CG 3.75Å; L212-F398 HydrophobicContact CD1-CZ 3.89Å; F300-F398 PolarHBondContact N-O 3Å; C396-F398 PolarHBondContact O-N 2.81Å; F398-V400 HydrophobicContact CB-CG2 4.31Å
399	A	37.7	Very low	40.5	Very low	24 Å²	24	68.7 Å²	68.7	20%	0.198	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	91.5	160.5	0	0	0	0	0	106.5	F300 V397 W438	F300-A399 WeakPolarHBondContact O-CA 3.33Å; V397-A399 VanDerWaalsContact C-N 3.31Å; V397-A399 HydrophobicContact CG1-CB 4.36Å; V397-A399 PolarHBondContact O-N 2.71Å; V397-A399 VanDerWaalsContact O-N 3.07Å; A399-W438 HydrophobicContact CB-CZ2 4.49Å
400	V	40.4	Very low	42.4	Very low	25 Å²	25	62 Å²	62	15%	0.152	32%	0.322	C	S	.	.			trans	-79.7	141.7	177.1	-161.8	0	0	0	0	108.5	Q204 F300 I301 F398	Q204-V400 HydrophobicContact CB-CG1 3.88Å; Q204-V400 HydrophobicContact CG-CG1 4.08Å; Q204-V400 VanDerWaalsContact OE1-CG1 3.22Å; F300-V400 PolarHBondContact O-N 3.16Å; I301-V400 HydrophobicContact CG1-CG2 3.95Å; F398-V400 HydrophobicContact CB-CG2 4.31Å
401	Y	46.8	Very low	44.1	Very low	104 Å²	104	53.2 Å²	53.2	41%	0.408	28%	0.284	S	S	.	.			trans	-60.6	142.2	-161.8	-60.6	-80.5	0	0	0	113.1	E304 P434	E304-Y401 WeakPolarHBondContact CG-O 3.26Å; E304-Y401 WeakPolarHBondContact OE2-CB 3.31Å; Y401-P434 HydrophobicContact CE1-CG 4.34Å
402	S	40.6	Very low	45.8	Very low	4 Å²	4	43.1 Å²	43.1	3%	0.028	24%	0.244	C	C	.	.			trans	-141.9	106.5	162.1	71.5	0	0	0	0	108.7	E304 N404	E304-S402 WeakPolarHBondContact OE1-CA 3.27Å; S402-N404 PolarHBondContact O-N 3.21Å; S402-N404 VanDerWaalsContact O-N 3.12Å
403	S	42.3	Very low	47.9	Very low	75 Å²	75	41.2 Å²	41.2	52%	0.524	24%	0.235	S	C	.	.	S	Bend	trans	-59.8	-12.6	174.9	40.2	0	0	0	0	114.1	E304	E304-S403 WeakPolarHBondContact OE1-CB 3.39Å; E304-S403 PolarHBondContact OE1-N 2.76Å; E304-S403 PolarHBondContact OE1-OG 2.91Å
404	N	49.4	Very low	49.7	Very low	28 Å²	28	40.1 Å²	40.1	15%	0.15	23%	0.228	C	C	.	.			trans	-99	106.3	178.7	-106.4	-58	0	0	0	113.2	S131 Q307 S402 S406 F407	S131-N404 PolarHBondContact OG-OD1 2.94Å; Q307-N404 PolarHBondContact OE1-ND2 3.05Å; S402-N404 PolarHBondContact O-N 3.21Å; S402-N404 VanDerWaalsContact O-N 3.12Å; N404-S406 PolarHBondContact O-N 2.97Å; N404-S406 VanDerWaalsContact O-N 3.16Å; N404-S406 PolarHBondContact OD1-OG 3.17Å; N404-F407 HydrophobicContact CB-CD2 3.56Å; N404-F407 HydrophobicContact CB-CE2 3.43Å; N404-F407 VanDerWaalsContact CB-CE2 3.43Å; N404-F407 HydrophobicContact CB-CG 4.36Å; N404-F407 HydrophobicContact CB-CZ 4.13Å
405	S	49.7	Very low	51.4	Low	12 Å²	12	34.2 Å²	34.2	8%	0.084	20%	0.197	C	C	.	.	H	α-helix	trans	-61.1	-17.9	173	66.9	0	0	0	0	114.5	S131 T408	S131-S405 PolarHBondContact O-OG 3.06Å; S405-T408 PolarHBondContact O-OG1 2.94Å
406	S	51	Low	53	Low	25 Å²	25	31.2 Å²	31.2	18%	0.175	19%	0.185	C	C	.	.	H	α-helix	trans	-74.3	-38.4	-170.9	57	0	0	0	0	113.2	N404	N404-S406 PolarHBondContact O-N 2.97Å; N404-S406 VanDerWaalsContact O-N 3.16Å; N404-S406 PolarHBondContact OD1-OG 3.17Å
407	F	58.2	Low	54.7	Low	30 Å²	30	31.6 Å²	31.6	13%	0.132	19%	0.188	C	C	.	.	H	α-helix	trans	-69.5	-40.9	-178.5	-54.9	-43.1	0	0	0	112	L184 Q307 N404 L409 G410 V411	L184-F407 HydrophobicContact CD1-CB 4.3Å; L184-F407 HydrophobicContact CD1-CD1 3.42Å; L184-F407 VanDerWaalsContact CD1-CD1 3.42Å; L184-F407 HydrophobicContact CD1-CD2 4.5Å; L184-F407 HydrophobicContact CD1-CE1 3.74Å; L184-F407 HydrophobicContact CD1-CG 3.85Å; L184-F407 HydrophobicContact CD1-CZ 4.39Å; L184-F407 HydrophobicContact CG-CD1 3.94Å; L184-F407 HydrophobicContact CG-CE1 4.09Å; Q307-F407 HydrophobicContact CG-CZ 4.06Å; N404-F407 HydrophobicContact CB-CD2 3.56Å; N404-F407 HydrophobicContact CB-CE2 3.43Å; N404-F407 VanDerWaalsContact CB-CE2 3.43Å; N404-F407 HydrophobicContact CB-CG 4.36Å; N404-F407 HydrophobicContact CB-CZ 4.13Å; F407-L409 PolarHBondContact O-N 3.17Å; F407-G410 PolarHBondContact O-N 3.02Å; F407-G410 VanDerWaalsContact O-N 3.15Å; F407-V411 PolarHBondContact O-N 3.37Å; F407-V411 VanDerWaalsContact O-N 3.12Å
408	T	59.1	Low	56.3	Low	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-68.9	-33.6	-168.5	53.3	0	0	0	0	113.3	F300 S405 G410 V411 L412 W438	F300-T408 HydrophobicContact CE1-CG2 4.21Å; F300-T408 HydrophobicContact CE2-CG2 4.38Å; F300-T408 HydrophobicContact CZ-CG2 3.69Å; S405-T408 PolarHBondContact O-OG1 2.94Å; T408-G410 VanDerWaalsContact C-N 3.32Å; T408-G410 PolarHBondContact O-N 3.47Å; T408-V411 PolarHBondContact O-N 3.48Å; T408-L412 VanDerWaalsContact O-CB 3.31Å; T408-L412 WeakPolarHBondContact O-CB 3.49Å; T408-L412 WeakPolarHBondContact O-CD1 3.45Å; T408-L412 WeakPolarHBondContact O-CG 3.43Å; T408-L412 PolarHBondContact O-N 3.33Å; T408-W438 HydrophobicContact CG2-CB 3.64Å; T408-W438 HydrophobicContact CG2-CD2 3.82Å; T408-W438 HydrophobicContact CG2-CE3 4.19Å; T408-W438 HydrophobicContact CG2-CG 3.61Å; T408-W438 VanDerWaalsContact OG1-CB 3.25Å; T408-W438 WeakPolarHBondContact OG1-CB 3.27Å
409	L	62.2	Low	57.9	Low	33 Å²	33	32.5 Å²	32.5	17%	0.173	19%	0.193	C	C	.	.	H	α-helix	trans	-65.8	-35.2	174.1	-85.7	156.2	0	0	0	112.3	F407 N413 F465	F407-L409 PolarHBondContact O-N 3.17Å; L409-N413 VanDerWaalsContact O-CB 3.32Å; L409-N413 WeakPolarHBondContact O-CB 3.31Å; L409-N413 PolarHBondContact O-N 3.47Å; L409-F465 HydrophobicContact CD2-CD1 4.31Å; L409-F465 HydrophobicContact CD2-CE1 3.89Å
410	G	63.4	Low	59.4	Low	39 Å²	39	37.5 Å²	37.5	40%	0.402	21%	0.212	S	C	.	.	H	α-helix	trans	-63.7	-48.3	171.5	0	0	0	0	0	112.1	F407 T408 V414	F407-G410 PolarHBondContact O-N 3.02Å; F407-G410 VanDerWaalsContact O-N 3.15Å; T408-G410 VanDerWaalsContact C-N 3.32Å; T408-G410 PolarHBondContact O-N 3.47Å; G410-V414 WeakPolarHBondContact O-CG2 3.22Å; G410-V414 PolarHBondContact O-N 3.2Å
411	V	64.3	Low	60.9	Low	2 Å²	2	42.5 Å²	42.5	1%	0.012	24%	0.238	C	C	.	.	H	α-helix	trans	-57.4	-51.8	175.6	177.2	0	0	0	0	111.6	L233 V243 F300 F407 T408 N413 V414 L415	L233-V411 HydrophobicContact CD1-CG2 3.71Å; L233-V411 HydrophobicContact CD2-CG2 3.65Å; L233-V411 HydrophobicContact CG-CG2 3.87Å; V243-V411 HydrophobicContact CB-CG1 4.22Å; V243-V411 HydrophobicContact CG1-CG1 3.72Å; V243-V411 HydrophobicContact CG2-CG1 4.38Å; F300-V411 HydrophobicContact CE2-CG1 4.26Å; F300-V411 HydrophobicContact CE2-CG2 4.35Å; F407-V411 PolarHBondContact O-N 3.37Å; F407-V411 VanDerWaalsContact O-N 3.12Å; T408-V411 PolarHBondContact O-N 3.48Å; V411-N413 PolarHBondContact O-N 3.1Å; V411-V414 PolarHBondContact O-N 2.88Å; V411-V414 VanDerWaalsContact O-N 3.11Å; V411-L415 HydrophobicContact CG1-CD1 3.92Å; V411-L415 HydrophobicContact CG1-CG 4.32Å; V411-L415 PolarHBondContact O-N 2.97Å
412	L	68.2	Low	62.3	Low	4 Å²	4	38.9 Å²	38.9	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-65.4	-38.4	-174.3	-70.5	165.4	0	0	0	111.8	I297 T408 V414 L415 V416 F442 F465	I297-L412 HydrophobicContact CD1-CD2 3.67Å; T408-L412 VanDerWaalsContact O-CB 3.31Å; T408-L412 WeakPolarHBondContact O-CB 3.49Å; T408-L412 WeakPolarHBondContact O-CD1 3.45Å; T408-L412 WeakPolarHBondContact O-CG 3.43Å; T408-L412 PolarHBondContact O-N 3.33Å; L412-V414 VanDerWaalsContact C-N 3.28Å; L412-V414 PolarHBondContact O-N 3.11Å; L412-L415 HydrophobicContact CD2-CD1 4.42Å; L412-L415 PolarHBondContact O-N 3.31Å; L412-V416 WeakPolarHBondContact O-CB 3.28Å; L412-V416 VanDerWaalsContact O-CG2 3.24Å; L412-V416 WeakPolarHBondContact O-CG2 3.43Å; L412-V416 PolarHBondContact O-N 2.9Å; L412-F442 HydrophobicContact CD1-CE2 3.73Å; L412-F442 HydrophobicContact CD1-CZ 3.94Å; L412-F442 HydrophobicContact CD2-CE2 4.42Å; L412-F442 HydrophobicContact CD2-CZ 3.84Å; L412-F465 HydrophobicContact CB-CE1 3.6Å; L412-F465 HydrophobicContact CB-CZ 3.55Å
413	N	68.2	Low	64.1	Low	85 Å²	85	42.6 Å²	42.6	46%	0.455	24%	0.243	S	C	.	.	H	α-helix	trans	-62.3	-36	174.4	-165.9	22.3	0	0	0	111.8	L409 V411 S417 F465	L409-N413 VanDerWaalsContact O-CB 3.32Å; L409-N413 WeakPolarHBondContact O-CB 3.31Å; L409-N413 PolarHBondContact O-N 3.47Å; V411-N413 PolarHBondContact O-N 3.1Å; N413-S417 WeakPolarHBondContact O-CB 3.17Å; N413-S417 PolarHBondContact O-N 2.82Å; N413-S417 PolarHBondContact O-OG 3.32Å; N413-F465 HydrophobicContact CB-CD1 3.81Å; N413-F465 HydrophobicContact CB-CE1 4.32Å; N413-F465 HydrophobicContact CB-CG 4.48Å
414	V	67.5	Low	66	Low	47 Å²	47	39.2 Å²	39.2	29%	0.285	22%	0.218	S	C	.	.	H	α-helix	trans	-74.3	-36.1	175.1	175.4	0	0	0	0	112.3	V186 G410 V411 L412 S417 L418	V186-V414 HydrophobicContact CB-CB 4.32Å; V186-V414 HydrophobicContact CB-CG1 4.13Å; V186-V414 HydrophobicContact CB-CG2 4.12Å; V186-V414 HydrophobicContact CG1-CB 4.13Å; V186-V414 HydrophobicContact CG1-CG1 3.74Å; V186-V414 HydrophobicContact CG1-CG2 4.48Å; V186-V414 HydrophobicContact CG2-CG2 4.28Å; G410-V414 WeakPolarHBondContact O-CG2 3.22Å; G410-V414 PolarHBondContact O-N 3.2Å; V411-V414 PolarHBondContact O-N 2.88Å; V411-V414 VanDerWaalsContact O-N 3.11Å; L412-V414 VanDerWaalsContact C-N 3.28Å; L412-V414 PolarHBondContact O-N 3.11Å; V414-S417 WeakPolarHBondContact CA-OG 3.21Å; V414-S417 PolarHBondContact O-N 2.95Å; V414-S417 PolarHBondContact O-OG 3.07Å; V414-L418 WeakPolarHBondContact O-CG 3.49Å; V414-L418 PolarHBondContact O-N 2.75Å
415	L	67.2	Low	67.5	Low	2 Å²	2	38 Å²	38	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-64.9	-42.3	172.4	-70.7	171.6	0	0	0	112	V243 A245 F295 I297 V411 L412 S417 L418 F419	V243-L415 HydrophobicContact CG1-CD1 4.15Å; V243-L415 HydrophobicContact CG1-CD2 4.06Å; V243-L415 HydrophobicContact CG1-CG 4.37Å; V243-L415 HydrophobicContact CG2-CD1 3.75Å; A245-L415 HydrophobicContact CB-CD2 4.22Å; F295-L415 HydrophobicContact CE2-CB 4.26Å; F295-L415 HydrophobicContact CZ-CB 4.35Å; I297-L415 HydrophobicContact CD1-CD1 3.96Å; I297-L415 HydrophobicContact CG1-CD1 4.3Å; V411-L415 HydrophobicContact CG1-CD1 3.92Å; V411-L415 HydrophobicContact CG1-CG 4.32Å; V411-L415 PolarHBondContact O-N 2.97Å; L412-L415 HydrophobicContact CD2-CD1 4.42Å; L412-L415 PolarHBondContact O-N 3.31Å; L415-S417 VanDerWaalsContact C-N 3.29Å; L415-S417 PolarHBondContact O-N 3.01Å; L415-L418 PolarHBondContact O-N 3.5Å; L415-F419 WeakPolarHBondContact O-CD2 3.41Å; L415-F419 PolarHBondContact O-N 3.19Å; L415-F419 VanDerWaalsContact O-N 3.08Å
416	V	68.9	Low	69.2	Low	8 Å²	8	37.4 Å²	37.4	5%	0.048	21%	0.208	C	C	.	.	H	α-helix	trans	-68.6	-27	176.3	169.8	0	0	0	0	112	F295 L412 R462 F465	F295-V416 HydrophobicContact CE1-CG2 4.2Å; F295-V416 HydrophobicContact CZ-CG2 3.84Å; L412-V416 WeakPolarHBondContact O-CB 3.28Å; L412-V416 VanDerWaalsContact O-CG2 3.24Å; L412-V416 WeakPolarHBondContact O-CG2 3.43Å; L412-V416 PolarHBondContact O-N 2.9Å; V416-R462 HydrophobicContact CG1-CB 4.17Å; V416-R462 HydrophobicContact CG1-CG 3.56Å; V416-F465 HydrophobicContact CG1-CD2 4.45Å; V416-F465 HydrophobicContact CG2-CD2 4.33Å; V416-F465 HydrophobicContact CG2-CE2 3.92Å; V416-F465 HydrophobicContact CG2-CZ 4.48Å
417	S	69	Low	70.6	Confident	57 Å²	57	36.3 Å²	36.3	40%	0.399	20%	0.2	S	C	.	.	H	α-helix	trans	-81.9	-18.5	171.3	75.8	0	0	0	0	113.8	N413 V414 L415 H420	N413-S417 WeakPolarHBondContact O-CB 3.17Å; N413-S417 PolarHBondContact O-N 2.82Å; N413-S417 PolarHBondContact O-OG 3.32Å; V414-S417 WeakPolarHBondContact CA-OG 3.21Å; V414-S417 PolarHBondContact O-N 2.95Å; V414-S417 PolarHBondContact O-OG 3.07Å; L415-S417 VanDerWaalsContact C-N 3.29Å; L415-S417 PolarHBondContact O-N 3.01Å; S417-H420 PolarHBondContact O-CE1 2.68Å; S417-H420 PolarHBondContact O-ND1 3.43Å; S417-H420 VanDerWaalsContact O-ND1 3.12Å
418	L	70.1	Confident	71.6	Confident	70 Å²	70	35.6 Å²	35.6	37%	0.366	20%	0.197	S	C	.	.	H	α-helix	trans	-75.2	-50	168.4	-70.6	166.7	0	0	0	111	H229 V414 L415 H420	H229-L418 HydrophobicContact CB-CD1 4.45Å; V414-L418 WeakPolarHBondContact O-CG 3.49Å; V414-L418 PolarHBondContact O-N 2.75Å; L415-L418 PolarHBondContact O-N 3.5Å; L418-H420 VanDerWaalsContact C-N 3.3Å; L418-H420 PolarHBondContact O-N 3.28Å; L418-H420 PolarHBondContact O-ND1 3.19Å
419	F	71.3	Confident	72.6	Confident	9 Å²	9	36 Å²	36	4%	0.039	20%	0.2	C	C	.	.			trans	-81.9	67.3	-180	-69.2	-70.2	0	0	0	113	H229 A245 F295 L415 D421 L422	H229-F419 HydrophobicContact CB-CE2 4.29Å; H229-F419 HydrophobicContact CB-CZ 4.05Å; H229-F419 AromaticContact CD2-CE1 3.58Å; H229-F419 AromaticContact CD2-CE2 3.91Å; H229-F419 AromaticContact CD2-CZ 3.49Å; H229-F419 VanDerWaalsContact CD2-CZ 3.49Å; H229-F419 WeakPolarHBondContact CD2-CZ 3.25Å; H229-F419 AromaticContact CG-CZ 3.91Å; H229-F419 AromaticContact NE2-CE1 3.98Å; A245-F419 HydrophobicContact CB-CE2 3.87Å; A245-F419 HydrophobicContact CB-CZ 4.46Å; F295-F419 HydrophobicContact CB-CD1 4.46Å; F295-F419 HydrophobicContact CB-CD2 4.13Å; F295-F419 HydrophobicContact CB-CE2 4.26Å; F295-F419 HydrophobicContact CB-CG 4.25Å; F295-F419 HydrophobicContact CB-CZ 4.48Å; F295-F419 HydrophobicContact CD1-CB 3.78Å; F295-F419 AromaticContact CD1-CD2 3.82Å; F295-F419 HydrophobicContact CD1-CD2 3.82Å; F295-F419 AromaticContact CD1-CG 3.9Å; F295-F419 HydrophobicContact CD1-CG 3.9Å; F295-F419 AromaticContact CD2-CD2 3.76Å; F295-F419 HydrophobicContact CD2-CD2 3.76Å; F295-F419 AromaticContact CD2-CE2 3.93Å; F295-F419 HydrophobicContact CD2-CE2 3.93Å; F295-F419 HydrophobicContact CE1-CB 3.98Å; F295-F419 HydrophobicContact CE1-CD2 4.08Å; F295-F419 HydrophobicContact CE1-CG 4.35Å; F295-F419 HydrophobicContact CE2-CD2 4.01Å; F295-F419 HydrophobicContact CE2-CE2 4.4Å; F295-F419 HydrophobicContact CG-CB 4.4Å; F295-F419 AromaticContact CG-CD2 3.64Å; F295-F419 HydrophobicContact CG-CD2 3.64Å; F295-F419 HydrophobicContact CG-CE2 4.06Å; F295-F419 HydrophobicContact CG-CG 4.01Å; F295-F419 HydrophobicContact CZ-CD2 4.16Å; L415-F419 WeakPolarHBondContact O-CD2 3.41Å; L415-F419 PolarHBondContact O-N 3.19Å; L415-F419 VanDerWaalsContact O-N 3.08Å; F419-D421 VanDerWaalsContact C-N 3.26Å; F419-D421 PolarHBondContact O-N 2.82Å; F419-D421 VanDerWaalsContact O-N 3.13Å; F419-L422 HydrophobicContact CB-CB 4.35Å; F419-L422 HydrophobicContact CB-CD1 4.28Å; F419-L422 HydrophobicContact CD1-CD1 3.98Å; F419-L422 HydrophobicContact CG-CD1 4.35Å; F419-L422 PolarHBondContact O-N 3.31Å
420	H	69.4	Low	73.5	Confident	129 Å²	129	37.5 Å²	37.5	60%	0.597	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-36.7	-175.4	-71.3	75.1	0	0	0	115.1	S417 L418 R462	S417-H420 PolarHBondContact O-CE1 2.68Å; S417-H420 PolarHBondContact O-ND1 3.43Å; S417-H420 VanDerWaalsContact O-ND1 3.12Å; L418-H420 VanDerWaalsContact C-N 3.3Å; L418-H420 PolarHBondContact O-N 3.28Å; L418-H420 PolarHBondContact O-ND1 3.19Å; H420-R462 PolarHBondContact O-NH1 2.86Å
421	D	71.6	Confident	74.3	Confident	130 Å²	130	35.9 Å²	35.9	70%	0.695	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.7	2.8	-171.3	-54.4	-39.3	0	0	0	114.4	K268 F419	K268-D421 PolarHBondContact NZ-O 3.25Å; F419-D421 VanDerWaalsContact C-N 3.26Å; F419-D421 PolarHBondContact O-N 2.82Å; F419-D421 VanDerWaalsContact O-N 3.13Å
422	L	77.7	Confident	75	Confident	28 Å²	28	38.2 Å²	38.2	15%	0.147	21%	0.213	C	C	.	.			trans	-121.9	143.7	-173.8	-56.5	174.4	0	0	0	110.5	F295 F419	F295-L422 HydrophobicContact CB-CD1 3.9Å; F295-L422 HydrophobicContact CD1-CB 4.12Å; F295-L422 HydrophobicContact CD1-CD1 4.34Å; F419-L422 HydrophobicContact CB-CB 4.35Å; F419-L422 HydrophobicContact CB-CD1 4.28Å; F419-L422 HydrophobicContact CD1-CD1 3.98Å; F419-L422 HydrophobicContact CG-CD1 4.35Å; F419-L422 PolarHBondContact O-N 3.31Å
423	E	77.3	Confident	75.3	Confident	81 Å²	81	39.6 Å²	39.6	38%	0.379	22%	0.223	S	C	.	.			trans	-114.1	-19.8	-170	-66.2	-178.1	132.1	0	0	113.4	N293 H461 R462	N293-E423 PolarHBondContact ND2-OE2 3.4Å; N293-E423 PolarHBondContact O-N 3.15Å; N293-E423 PolarHBondContact OD1-N 2.96Å; E423-H461 CarbonylContact O-C 3.57Å; E423-H461 WeakPolarHBondContact O-CA 3.1Å; E423-H461 PolarHBondContact O-CD2 2.72Å; E423-R462 WeakPolarHBondContact O-CB 3.32Å; E423-R462 PolarHBondContact O-N 3.07Å
424	Y	81.8	Confident	75.5	Confident	4 Å²	4	39 Å²	39	2%	0.016	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.4	180	-70.5	-81	0	0	0	112.8	F263 D264 F266 N293 S294 F295 I459 H461	F263-Y424 HydrophobicContact CB-CE1 4.32Å; F263-Y424 AromaticContact CD1-CE1 3.97Å; F263-Y424 HydrophobicContact CD1-CE1 3.97Å; D264-Y424 PolarHBondContact O-OH 3.5Å; F266-Y424 HydrophobicContact CB-CD2 4.41Å; F266-Y424 HydrophobicContact CB-CE2 4.11Å; F266-Y424 HydrophobicContact CD2-CD1 4.17Å; F266-Y424 AromaticContact CD2-CD2 3.66Å; F266-Y424 HydrophobicContact CD2-CD2 3.66Å; F266-Y424 HydrophobicContact CD2-CE2 4.06Å; F266-Y424 AromaticContact CD2-CG 3.71Å; F266-Y424 HydrophobicContact CD2-CG 3.71Å; F266-Y424 HydrophobicContact CE2-CD2 4.37Å; F266-Y424 HydrophobicContact CE2-CG 4.07Å; F266-Y424 HydrophobicContact CG-CD2 4.41Å; N293-Y424 HydrophobicContact CB-CD2 4.47Å; N293-Y424 PolarHBondContact O-N 3.18Å; S294-Y424 WeakPolarHBondContact CA-O 3.25Å; F295-Y424 PolarHBondContact N-O 2.66Å; Y424-I459 HydrophobicContact CD1-CG2 3.58Å; Y424-I459 HydrophobicContact CE1-CG2 4.23Å; Y424-I459 HydrophobicContact CG-CG2 4.49Å; Y424-H461 HydrophobicContact CD1-CB 4.06Å; Y424-H461 HydrophobicContact CE1-CB 3.82Å; Y424-H461 AromaticContact CE1-CD2 3.69Å; Y424-H461 AromaticContact CE2-CD2 3.98Å; Y424-H461 AromaticContact CZ-CD2 3.69Å
425	C	82.2	Confident	75.8	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.014	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	127.2	172	176.8	0	0	0	0	109.6	F295 F442 I459 T460	F295-C425 HydrophobicContact CD2-CB 4.49Å; F295-C425 HydrophobicContact CE1-CB 4.06Å; F295-C425 HydrophobicContact CE2-CB 3.84Å; F295-C425 WeakPolarHBondContact CE2-SG 3.38Å; F295-C425 HydrophobicContact CZ-CB 3.6Å; F295-C425 CarbonylContact O-C 3.56Å; F295-C425 WeakPolarHBondContact O-CA 3.39Å; C425-F442 HydrophobicContact CB-CE1 4.43Å; C425-I459 WeakPolarHBondContact O-CA 3.36Å; C425-T460 HydrophobicContact CB-CG2 4.1Å; C425-T460 PolarHBondContact N-O 3.16Å; C425-T460 PolarHBondContact O-N 2.84Å
426	L	83.9	Confident	76	Confident	1 Å²	1	38 Å²	38	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	143	-179	-46.8	-177.1	0	0	0	111.4	L254 F266 F295 C296 I297 L457 Y458 I459	L254-L426 HydrophobicContact CD1-CD1 3.93Å; L254-L426 HydrophobicContact CD2-CD1 4.33Å; F266-L426 HydrophobicContact CE2-CD2 3.88Å; F266-L426 HydrophobicContact CZ-CD2 4.03Å; F295-L426 PolarHBondContact O-N 2.8Å; C296-L426 WeakPolarHBondContact CA-O 3.38Å; C296-L426 HydrophobicContact CB-CB 4.05Å; I297-L426 PolarHBondContact N-O 2.97Å; L426-L457 HydrophobicContact CB-CD1 4.14Å; L426-L457 HydrophobicContact CD2-CD1 4.47Å; L426-Y458 CarbonylContact C-O 3.57Å; L426-Y458 WeakPolarHBondContact CA-O 3.48Å; L426-I459 HydrophobicContact CD2-CD1 3.61Å; L426-I459 HydrophobicContact CD2-CG1 3.59Å
427	I	81.3	Confident	76	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	135.6	166.7	-49.6	172.6	0	0	0	108.6	I297 V397 V429 W438 L439 F442 Y458	I297-I427 HydrophobicContact CB-CG1 4.29Å; I297-I427 HydrophobicContact CD1-CD1 4.19Å; I297-I427 HydrophobicContact CD1-CG1 4.16Å; I297-I427 HydrophobicContact CG1-CG1 4.48Å; V397-I427 HydrophobicContact CG1-CG2 4.29Å; I427-V429 HydrophobicContact CG2-CG2 3.98Å; I427-W438 HydrophobicContact CD1-CH2 3.53Å; I427-W438 HydrophobicContact CD1-CZ3 3.45Å; I427-W438 VanDerWaalsContact CD1-CZ3 3.45Å; I427-L439 HydrophobicContact CD1-CD2 3.81Å; I427-F442 HydrophobicContact CD1-CD1 4.05Å; I427-F442 HydrophobicContact CD1-CD2 4.18Å; I427-F442 HydrophobicContact CD1-CE1 3.49Å; I427-F442 VanDerWaalsContact CD1-CE1 3.49Å; I427-F442 HydrophobicContact CD1-CE2 3.66Å; I427-F442 HydrophobicContact CD1-CG 4.41Å; I427-F442 HydrophobicContact CD1-CZ 3.3Å; I427-F442 HydrophobicContact CG1-CD1 4.35Å; I427-F442 HydrophobicContact CG1-CE1 3.79Å; I427-F442 HydrophobicContact CG1-CZ 4.06Å; I427-Y458 PolarHBondContact N-O 3.25Å; I427-Y458 PolarHBondContact O-N 3.05Å
428	F	79.7	Confident	76.2	Confident	16 Å²	16	37.8 Å²	37.8	7%	0.07	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	137.5	167.4	-65.1	-89.1	0	0	0	109.5	L254 F258 F395 V397 S456 L457	L254-F428 HydrophobicContact CD2-CE1 4.36Å; L254-F428 HydrophobicContact CD2-CZ 3.75Å; F258-F428 AromaticContact CE2-CE1 3.92Å; F258-F428 HydrophobicContact CE2-CE1 3.92Å; F258-F428 HydrophobicContact CZ-CE1 4.35Å; F395-F428 AromaticContact CD1-CD2 3.83Å; F395-F428 HydrophobicContact CD1-CD2 3.83Å; F395-F428 AromaticContact CD1-CE2 3.84Å; F395-F428 HydrophobicContact CD1-CE2 3.84Å; F395-F428 HydrophobicContact CE1-CD2 4.34Å; F395-F428 AromaticContact CE1-CE2 3.9Å; F395-F428 HydrophobicContact CE1-CE2 3.9Å; F395-F428 HydrophobicContact CG-CD2 4.39Å; F395-F428 HydrophobicContact CG-CE2 4.47Å; V397-F428 VanDerWaalsContact CB-O 3.26Å; V397-F428 WeakPolarHBondContact CB-O 3.46Å; V397-F428 HydrophobicContact CG2-CB 4.29Å; V397-F428 WeakPolarHBondContact CG2-O 3.32Å; F428-S456 CarbonylContact C-O 3.52Å; F428-S456 WeakPolarHBondContact CA-O 3.49Å; F428-L457 HydrophobicContact CD1-CB 4.41Å; F428-L457 HydrophobicContact CD1-CD1 4.2Å; F428-L457 HydrophobicContact CE1-CB 4.33Å; F428-L457 HydrophobicContact CE1-CD1 3.9Å; F428-L457 HydrophobicContact CE2-CD1 4.33Å; F428-L457 HydrophobicContact CZ-CD1 3.99Å
429	V	79.1	Confident	76.5	Confident	9 Å²	9	34.6 Å²	34.6	6%	0.055	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	137.4	178.7	-177.9	0	0	0	0	108.4	I427 S431 S433 L439 T455 S456 Y458	I427-V429 HydrophobicContact CG2-CG2 3.98Å; V429-S431 PolarHBondContact O-N 3.2Å; V429-S433 WeakPolarHBondContact CG1-OG 3.26Å; V429-L439 HydrophobicContact CG2-CD1 4.06Å; V429-T455 CarbonylContact O-C 3.49Å; V429-T455 WeakPolarHBondContact O-CA 3.39Å; V429-S456 PolarHBondContact N-O 2.93Å; V429-S456 PolarHBondContact O-N 2.93Å; V429-Y458 HydrophobicContact CB-CD2 4.27Å; V429-Y458 HydrophobicContact CB-CE2 3.96Å; V429-Y458 HydrophobicContact CG2-CD2 3.78Å; V429-Y458 HydrophobicContact CG2-CE2 3.78Å
430	P	80.8	Confident	76.5	Confident	64 Å²	64	36.7 Å²	36.7	42%	0.416	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	132.7	174.4	-23.6	34.2	0	0	0	111.5	A432 S433	P430-A432 VanDerWaalsContact C-N 3.29Å; P430-A432 PolarHBondContact O-N 3.45Å; P430-S433 PolarHBondContact O-N 3.38Å; P430-S433 VanDerWaalsContact O-N 3.08Å; P430-S433 PolarHBondContact O-OG 2.82Å
431	S	80.6	Confident	76.8	Confident	5 Å²	5	31 Å²	31	4%	0.035	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-36.1	-173.1	47	0	0	0	0	113.3	V429 S433 L454 N668 A669 D766	V429-S431 PolarHBondContact O-N 3.2Å; S431-S433 VanDerWaalsContact C-N 3.33Å; S431-S433 PolarHBondContact O-N 2.96Å; S431-L454 PolarHBondContact N-O 3.31Å; S431-L454 VanDerWaalsContact N-O 3.07Å; S431-L454 WeakPolarHBondContact OG-CA 3.42Å; S431-L454 WeakPolarHBondContact OG-CB 3.46Å; S431-L454 PolarHBondContact OG-O 3.16Å; S431-N668 WeakPolarHBondContact CB-O 3.44Å; S431-N668 CarbonylContact O-C 3.27Å; S431-A669 WeakPolarHBondContact O-CA 3.31Å; S431-A669 PolarHBondContact O-N 3.03Å; S431-D766 VanDerWaalsContact CB-OD2 3.27Å; S431-D766 WeakPolarHBondContact CB-OD2 3.34Å; S431-D766 PolarHBondContact OG-OD1 3.2Å; S431-D766 PolarHBondContact OG-OD2 3.38Å
432	A	78.3	Confident	77.2	Confident	50 Å²	50	24.8 Å²	24.8	41%	0.413	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-6.5	178	0	0	0	0	0	115.6	P430 D766	P430-A432 VanDerWaalsContact C-N 3.29Å; P430-A432 PolarHBondContact O-N 3.45Å; A432-D766 HydrophobicContact CB-CB 4.29Å
433	S	75.8	Confident	77.5	Confident	34 Å²	34	24.1 Å²	24.1	24%	0.238	15%	0.145	C	C	.	.	S	Bend	trans	-86.5	141.8	179.9	60.3	0	0	0	0	112.1	V429 P430 S431	V429-S433 WeakPolarHBondContact CG1-OG 3.26Å; P430-S433 PolarHBondContact O-N 3.38Å; P430-S433 VanDerWaalsContact O-N 3.08Å; P430-S433 PolarHBondContact O-OG 2.82Å; S431-S433 VanDerWaalsContact C-N 3.33Å; S431-S433 PolarHBondContact O-N 2.96Å
434	P	72.8	Confident	77.9	Confident	72 Å²	72	21.3 Å²	21.3	47%	0.468	13%	0.132	S	C	.	.	P	Polyproline II helix	trans	-65.9	139.3	179.9	27.6	-34.4	0	0	0	111.1	Y401 S436	Y401-P434 HydrophobicContact CE1-CG 4.34Å; P434-S436 PolarHBondContact O-N 2.99Å
435	E	73.3	Confident	78	Confident	22 Å²	22	21.3 Å²	21.3	10%	0.103	13%	0.133	C	C	.	.	P	Polyproline II helix	trans	-69.5	123.2	-177.1	-172.8	-179.9	117.8	0	0	111.8	L439 Y458 R666	E435-L439 HydrophobicContact CG-CB 3.69Å; E435-L439 HydrophobicContact CG-CD1 3.82Å; E435-L439 HydrophobicContact CG-CG 4.38Å; E435-Y458 WeakPolarHBondContact OE2-CE1 3.39Å; E435-Y458 PolarHBondContact OE2-OH 2.85Å; E435-R666 IonicContact OE1-CZ 2.77Å; E435-R666 IonicContact OE1-NE 3.16Å; E435-R666 PolarHBondContact OE1-NE 3.39Å; E435-R666 IonicContact OE1-NH2 3.67Å; E435-R666 PolarHBondContact OE1-NH2 3.37Å; E435-R666 WeakPolarHBondContact OE2-CB 3.38Å; E435-R666 IonicContact OE2-CZ 2.68Å; E435-R666 VanDerWaalsContact OE2-CZ 3.24Å; E435-R666 IonicContact OE2-NE 3.13Å; E435-R666 PolarHBondContact OE2-NE 3.18Å; E435-R666 IonicContact OE2-NH2 3.18Å; E435-R666 PolarHBondContact OE2-NH2 2.88Å; E435-R666 VanDerWaalsContact OE2-NH2 3.07Å
436	S	71.6	Confident	77.8	Confident	6 Å²	6	26.6 Å²	26.6	4%	0.042	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-64.6	133.7	170.2	-64	0	0	0	0	111.1	P434 W438 L439	P434-S436 PolarHBondContact O-N 2.99Å; S436-W438 VanDerWaalsContact CB-CD1 3.47Å; S436-W438 VanDerWaalsContact CB-NE1 3.32Å; S436-W438 PolarHBondContact O-N 2.77Å; S436-L439 WeakPolarHBondContact O-CB 3.16Å; S436-L439 PolarHBondContact O-N 3.1Å
437	P	69.4	Low	77.7	Confident	59 Å²	59	28.5 Å²	28.5	38%	0.383	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-54	-26.6	-170.7	-30.4	35.6	0	0	0	116.2	L439 Q440	P437-L439 VanDerWaalsContact C-N 3.35Å; P437-L439 PolarHBondContact O-N 3.05Å; P437-Q440 WeakPolarHBondContact O-CB 3.49Å; P437-Q440 VanDerWaalsContact O-CG 3.29Å; P437-Q440 WeakPolarHBondContact O-CG 3.09Å; P437-Q440 PolarHBondContact O-NE2 3.31Å
438	W	71.7	Confident	77.6	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.008	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-71.6	-23	179.1	64.3	-93.9	0	0	0	114.8	F300 A399 T408 I427 S436 Q440 N441 F442	F300-W438 HydrophobicContact CD1-CH2 4.44Å; F300-W438 AromaticContact CD1-CZ2 3.75Å; F300-W438 HydrophobicContact CD1-CZ2 3.75Å; F300-W438 HydrophobicContact CE1-CZ2 4.21Å; F300-W438 HydrophobicContact CG-CH2 4.39Å; F300-W438 HydrophobicContact CG-CZ2 4.11Å; A399-W438 HydrophobicContact CB-CZ2 4.49Å; T408-W438 HydrophobicContact CG2-CB 3.64Å; T408-W438 HydrophobicContact CG2-CD2 3.82Å; T408-W438 HydrophobicContact CG2-CE3 4.19Å; T408-W438 HydrophobicContact CG2-CG 3.61Å; T408-W438 VanDerWaalsContact OG1-CB 3.25Å; T408-W438 WeakPolarHBondContact OG1-CB 3.27Å; I427-W438 HydrophobicContact CD1-CH2 3.53Å; I427-W438 HydrophobicContact CD1-CZ3 3.45Å; I427-W438 VanDerWaalsContact CD1-CZ3 3.45Å; S436-W438 VanDerWaalsContact CB-CD1 3.47Å; S436-W438 VanDerWaalsContact CB-NE1 3.32Å; S436-W438 PolarHBondContact O-N 2.77Å; W438-Q440 PolarHBondContact O-N 3.43Å; W438-Q440 VanDerWaalsContact O-N 3.13Å; W438-N441 WeakPolarHBondContact O-CB 3.31Å; W438-N441 PolarHBondContact O-N 2.93Å; W438-N441 PolarHBondContact O-ND2 2.88Å; W438-N441 VanDerWaalsContact O-ND2 3.14Å; W438-F442 HydrophobicContact CE3-CE2 4.1Å; W438-F442 AromaticContact CZ3-CE2 3.81Å; W438-F442 HydrophobicContact CZ3-CE2 3.81Å; W438-F442 HydrophobicContact CZ3-CZ 4.38Å
439	L	76.4	Confident	77.2	Confident	2 Å²	2	35 Å²	35	1%	0.01	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-66.3	-10.6	177.9	-70.8	168.4	0	0	0	112.7	I427 V429 E435 S436 P437 N441 F442 Y458 R666	I427-L439 HydrophobicContact CD1-CD2 3.81Å; V429-L439 HydrophobicContact CG2-CD1 4.06Å; E435-L439 HydrophobicContact CG-CB 3.69Å; E435-L439 HydrophobicContact CG-CD1 3.82Å; E435-L439 HydrophobicContact CG-CG 4.38Å; S436-L439 WeakPolarHBondContact O-CB 3.16Å; S436-L439 PolarHBondContact O-N 3.1Å; P437-L439 VanDerWaalsContact C-N 3.35Å; P437-L439 PolarHBondContact O-N 3.05Å; L439-N441 PolarHBondContact O-N 3.1Å; L439-N441 VanDerWaalsContact O-N 3.11Å; L439-F442 HydrophobicContact CD2-CD2 4.29Å; L439-F442 WeakPolarHBondContact O-CB 3.22Å; L439-F442 PolarHBondContact O-N 2.98Å; L439-Y458 HydrophobicContact CB-CE1 4.22Å; L439-Y458 HydrophobicContact CD1-CE2 4.34Å; L439-Y458 HydrophobicContact CD2-CG 4.37Å; L439-R666 PolarHBondContact O-NH2 3.03Å
440	Q	72.5	Confident	76.9	Confident	54 Å²	54	38.6 Å²	38.6	25%	0.252	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-56.1	-20	164.5	-64.9	-177.7	50.6	0	0	113.1	P437 W438 F442	P437-Q440 WeakPolarHBondContact O-CB 3.49Å; P437-Q440 VanDerWaalsContact O-CG 3.29Å; P437-Q440 WeakPolarHBondContact O-CG 3.09Å; P437-Q440 PolarHBondContact O-NE2 3.31Å; W438-Q440 PolarHBondContact O-N 3.43Å; W438-Q440 VanDerWaalsContact O-N 3.13Å; Q440-F442 PolarHBondContact O-N 2.83Å
441	N	74.4	Confident	76.8	Confident	8 Å²	8	36.3 Å²	36.3	4%	0.043	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-82.5	20	170	-65.5	-78.3	0	0	0	113.9	W438 L439 T460 R464 Y573	W438-N441 WeakPolarHBondContact O-CB 3.31Å; W438-N441 PolarHBondContact O-N 2.93Å; W438-N441 PolarHBondContact O-ND2 2.88Å; W438-N441 VanDerWaalsContact O-ND2 3.14Å; L439-N441 PolarHBondContact O-N 3.1Å; L439-N441 VanDerWaalsContact O-N 3.11Å; N441-T460 VanDerWaalsContact O-CB 3.24Å; N441-T460 WeakPolarHBondContact O-CB 3.4Å; N441-T460 PolarHBondContact O-OG1 3.32Å; N441-R464 PolarHBondContact OD1-NE 2.73Å; N441-R464 PolarHBondContact OD1-NH2 2.95Å; N441-Y573 PolarHBondContact O-OH 3.22Å
442	F	80.7	Confident	76.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.227	C	C	.	.	S	Bend	trans	-138.2	143.6	174.2	-66.6	-106.8	0	0	0	112.2	L412 C425 I427 W438 L439 Q440 Y458 I459 T460 Y573 R666	L412-F442 HydrophobicContact CD1-CE2 3.73Å; L412-F442 HydrophobicContact CD1-CZ 3.94Å; L412-F442 HydrophobicContact CD2-CE2 4.42Å; L412-F442 HydrophobicContact CD2-CZ 3.84Å; C425-F442 HydrophobicContact CB-CE1 4.43Å; I427-F442 HydrophobicContact CD1-CD1 4.05Å; I427-F442 HydrophobicContact CD1-CD2 4.18Å; I427-F442 HydrophobicContact CD1-CE1 3.49Å; I427-F442 VanDerWaalsContact CD1-CE1 3.49Å; I427-F442 HydrophobicContact CD1-CE2 3.66Å; I427-F442 HydrophobicContact CD1-CG 4.41Å; I427-F442 HydrophobicContact CD1-CZ 3.3Å; I427-F442 HydrophobicContact CG1-CD1 4.35Å; I427-F442 HydrophobicContact CG1-CE1 3.79Å; I427-F442 HydrophobicContact CG1-CZ 4.06Å; W438-F442 HydrophobicContact CE3-CE2 4.1Å; W438-F442 AromaticContact CZ3-CE2 3.81Å; W438-F442 HydrophobicContact CZ3-CE2 3.81Å; W438-F442 HydrophobicContact CZ3-CZ 4.38Å; L439-F442 HydrophobicContact CD2-CD2 4.29Å; L439-F442 WeakPolarHBondContact O-CB 3.22Å; L439-F442 PolarHBondContact O-N 2.98Å; Q440-F442 PolarHBondContact O-N 2.83Å; F442-Y458 HydrophobicContact CB-CD1 3.75Å; F442-Y458 HydrophobicContact CB-CG 4.22Å; F442-I459 WeakPolarHBondContact CA-O 3.41Å; F442-T460 HydrophobicContact CD1-CG2 3.88Å; F442-T460 HydrophobicContact CE1-CG2 3.46Å; F442-T460 VanDerWaalsContact CE1-CG2 3.46Å; F442-T460 HydrophobicContact CE2-CG2 4.33Å; F442-T460 HydrophobicContact CG-CG2 4.44Å; F442-T460 HydrophobicContact CZ-CG2 3.69Å; F442-Y573 WeakPolarHBondContact CA-OH 3.48Å; F442-Y573 PolarHBondContact N-OH 3.34Å; F442-Y573 VanDerWaalsContact N-OH 3.13Å; F442-R666 PolarHBondContact O-NH1 3.38Å
443	V	84.6	Confident	76.7	Confident	14 Å²	14	40.7 Å²	40.7	9%	0.085	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	135.8	161.3	-169.6	0	0	0	0	108.3	F263 Y458 I459 Y573	F263-V443 HydrophobicContact CE1-CG2 4.22Å; F263-V443 HydrophobicContact CZ-CB 4.31Å; F263-V443 HydrophobicContact CZ-CG1 4.01Å; F263-V443 HydrophobicContact CZ-CG2 4.48Å; V443-Y458 CarbonylContact O-C 3.42Å; V443-Y458 VanDerWaalsContact O-CA 3.24Å; V443-Y458 WeakPolarHBondContact O-CA 3.5Å; V443-I459 WeakPolarHBondContact CB-O 3.38Å; V443-I459 PolarHBondContact N-O 2.95Å; V443-I459 PolarHBondContact O-N 2.96Å; V443-Y573 HydrophobicContact CB-CD1 4.5Å; V443-Y573 HydrophobicContact CG2-CD1 3.13Å; V443-Y573 HydrophobicContact CG2-CD2 3.97Å; V443-Y573 HydrophobicContact CG2-CE1 3.52Å; V443-Y573 HydrophobicContact CG2-CE2 4.29Å; V443-Y573 HydrophobicContact CG2-CG 3.41Å; V443-Y573 VanDerWaalsContact CG2-CG 3.41Å
444	L	85.8	Confident	77	Confident	22 Å²	22	41.4 Å²	41.4	12%	0.115	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	124.1	162.2	174.2	67.5	0	0	0	108.5	Y458 N668 N696	L444-Y458 HydrophobicContact CB-CD1 4.46Å; L444-Y458 HydrophobicContact CB-CE1 4.24Å; L444-Y458 HydrophobicContact CD1-CE1 4.3Å; L444-Y458 HydrophobicContact CD1-CE2 4.3Å; L444-N668 WeakPolarHBondContact CD2-OD1 3.46Å; L444-N696 HydrophobicContact CD2-CB 3.53Å; L444-N696 VanDerWaalsContact CD2-ND2 3.32Å; L444-N696 WeakPolarHBondContact CD2-ND2 3.43Å
445	V	83.6	Confident	77.4	Confident	5 Å²	5	39.8 Å²	39.8	3%	0.03	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	132.7	179.5	-177.8	0	0	0	0	110.7	F258 N259 L260 F263 S447 L457 I459	F258-V445 HydrophobicContact CB-CG1 3.99Å; F258-V445 HydrophobicContact CD1-CG1 4.31Å; N259-V445 VanDerWaalsContact O-CG1 3.31Å; N259-V445 WeakPolarHBondContact O-CG1 3.36Å; L260-V445 HydrophobicContact CD2-CG1 3.96Å; L260-V445 HydrophobicContact CD2-CG2 4.42Å; F263-V445 HydrophobicContact CE2-CG1 4.48Å; F263-V445 HydrophobicContact CE2-CG2 3.99Å; F263-V445 HydrophobicContact CZ-CG2 4.08Å; V445-S447 PolarHBondContact O-N 3.35Å; V445-L457 HydrophobicContact CB-CB 4.27Å; V445-L457 HydrophobicContact CB-CD2 4.28Å; V445-L457 HydrophobicContact CB-CG 4.22Å; V445-L457 HydrophobicContact CG1-CD2 4.43Å; V445-L457 HydrophobicContact CG2-CD2 4.28Å; V445-L457 HydrophobicContact CG2-CG 4.11Å; V445-L457 PolarHBondContact N-O 2.63Å; V445-I459 HydrophobicContact CG2-CB 4.05Å; V445-I459 HydrophobicContact CG2-CD1 3.58Å; V445-I459 HydrophobicContact CG2-CG1 3.53Å
446	R	77.9	Confident	77.9	Confident	113 Å²	113	38.8 Å²	38.8	43%	0.426	21%	0.209	S	C	.	.	P	Polyproline II helix	trans	-59.2	120.9	173.5	-71.4	171.7	167	-177.4	-11.7	111.3	N259 E612	N259-R446 PolarHBondContact N-O 3.46Å; R446-E612 IonicContact CZ-OE1 2.95Å; R446-E612 IonicContact NE-OE1 2.71Å; R446-E612 PolarHBondContact NE-OE1 2.97Å; R446-E612 IonicContact NE-OE2 2.82Å; R446-E612 IonicContact NH2-OE1 3.33Å; R446-E612 PolarHBondContact NH2-OE1 2.93Å
447	S	80.5	Confident	78.6	Confident	40 Å²	40	38.5 Å²	38.5	28%	0.28	21%	0.207	S	C	.	.	B	Isolated β-bridge	trans	-70.2	146.4	170.9	-64.1	0	0	0	0	110.3	F258 V445	F258-S447 WeakPolarHBondContact CE1-OG 3.45Å; V445-S447 PolarHBondContact O-N 3.35Å
448	R	80.4	Confident	79.3	Confident	78 Å²	78	35.7 Å²	35.7	29%	0.294	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-71.2	149.9	179	-74.9	-175.2	178	-146.2	8.2	112	L255 E256 H257 F258 S450 S451	L255-R448 PolarHBondContact O-NE 2.8Å; L255-R448 PolarHBondContact O-NH1 2.88Å; L255-R448 PolarHBondContact O-NH2 3.1Å; E256-R448 WeakPolarHBondContact O-CD 3.5Å; H257-R448 PolarHBondContact O-N 2.87Å; F258-R448 PolarHBondContact O-NE 2.7Å; R448-S450 PolarHBondContact O-N 2.95Å; R448-S451 WeakPolarHBondContact O-CB 3.27Å; R448-S451 PolarHBondContact O-N 2.94Å
449	P	70.6	Confident	80	Confident	77 Å²	77	35.7 Å²	35.7	50%	0.5	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51	-30.8	177.1	-31.9	37.4	0	0	0	115.8	R739	P449-R739 PolarHBondContact O-NH1 2.84Å; P449-R739 PolarHBondContact O-NH2 2.7Å
450	S	73	Confident	80.3	Confident	84 Å²	84	35.7 Å²	35.7	59%	0.587	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.6	1.7	-179.3	57.6	0	0	0	0	115	R448	R448-S450 PolarHBondContact O-N 2.95Å
451	S	79.3	Confident	80.7	Confident	15 Å²	15	34.8 Å²	34.8	11%	0.105	19%	0.185	C	C	.	.			trans	-75.3	131.2	-176.8	-169.6	0	0	0	0	111.5	H257 R448 Q453	H257-S451 PolarHBondContact ND1-OG 2.86Å; R448-S451 WeakPolarHBondContact O-CB 3.27Å; R448-S451 PolarHBondContact O-N 2.94Å; S451-Q453 PolarHBondContact OG-N 3.32Å
452	L	80.4	Confident	80.9	Confident	73 Å²	73	37.5 Å²	37.5	38%	0.382	19%	0.194	S	C	.	.			trans	-107.4	14.1	172.4	-57.8	179	0	0	0	112.7	K762 A764	L452-K762 HydrophobicContact CD1-CB 4.2Å; L452-K762 HydrophobicContact CD1-CD 4.01Å; L452-K762 HydrophobicContact CD2-CB 3.74Å; L452-A764 HydrophobicContact CD2-CB 3.93Å
453	Q	76.8	Confident	80.4	Confident	75 Å²	75	37.9 Å²	37.9	35%	0.35	20%	0.197	S	C	.	.			trans	-89.2	117.2	175.9	-71.9	-175.8	-10.1	0	0	110.4	H257 S451 T455	H257-Q453 VanDerWaalsContact CD2-CD 3.47Å; H257-Q453 PolarHBondContact CD2-NE2 2.89Å; H257-Q453 VanDerWaalsContact CD2-NE2 3.32Å; H257-Q453 PolarHBondContact NE2-NE2 3.1Å; H257-Q453 VanDerWaalsContact NE2-NE2 3.16Å; S451-Q453 PolarHBondContact OG-N 3.32Å; Q453-T455 PolarHBondContact O-N 2.95Å
454	L	82	Confident	80	Confident	49 Å²	49	38.2 Å²	38.2	26%	0.257	20%	0.197	S	C	.	.			trans	-78.6	54.6	172.1	-63.3	175.4	0	0	0	110.7	S431 K753 A764	S431-L454 PolarHBondContact N-O 3.31Å; S431-L454 VanDerWaalsContact N-O 3.07Å; S431-L454 WeakPolarHBondContact OG-CA 3.42Å; S431-L454 WeakPolarHBondContact OG-CB 3.46Å; S431-L454 PolarHBondContact OG-O 3.16Å; L454-K753 HydrophobicContact CD1-CB 4.16Å; L454-K753 HydrophobicContact CD1-CD 4.03Å; L454-A764 HydrophobicContact CD2-CB 4.03Å
455	T	81.6	Confident	79.2	Confident	37 Å²	37	39 Å²	39	23%	0.227	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	125.8	-178.6	56.3	0	0	0	0	110.7	V429 Q453	V429-T455 CarbonylContact O-C 3.49Å; V429-T455 WeakPolarHBondContact O-CA 3.39Å; Q453-T455 PolarHBondContact O-N 2.95Å
456	S	83.9	Confident	78.4	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.014	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	133.2	172.2	-63.2	0	0	0	0	111.1	F428 V429 N668	F428-S456 CarbonylContact C-O 3.52Å; F428-S456 WeakPolarHBondContact CA-O 3.49Å; V429-S456 PolarHBondContact N-O 2.93Å; V429-S456 PolarHBondContact O-N 2.93Å; S456-N668 WeakPolarHBondContact OG-CB 3.35Å
457	L	85.3	Confident	77.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	125.6	171.7	173.2	61.2	0	0	0	109.7	L254 F258 L260 L426 F428 V445 I459	L254-L457 HydrophobicContact CD2-CD2 3.74Å; F258-L457 HydrophobicContact CB-CD2 4.03Å; F258-L457 HydrophobicContact CD1-CB 3.66Å; F258-L457 HydrophobicContact CD1-CD2 4.04Å; F258-L457 HydrophobicContact CD1-CG 4.5Å; F258-L457 HydrophobicContact CD2-CB 4.27Å; F258-L457 HydrophobicContact CD2-CD2 3.75Å; F258-L457 HydrophobicContact CE1-CB 3.44Å; F258-L457 VanDerWaalsContact CE1-CB 3.44Å; F258-L457 HydrophobicContact CE2-CB 4.08Å; F258-L457 HydrophobicContact CE2-CD2 4.27Å; F258-L457 HydrophobicContact CG-CB 4.09Å; F258-L457 HydrophobicContact CG-CD2 3.63Å; F258-L457 HydrophobicContact CZ-CB 3.67Å; L260-L457 HydrophobicContact CD2-CD2 4.17Å; L426-L457 HydrophobicContact CB-CD1 4.14Å; L426-L457 HydrophobicContact CD2-CD1 4.47Å; F428-L457 HydrophobicContact CD1-CB 4.41Å; F428-L457 HydrophobicContact CD1-CD1 4.2Å; F428-L457 HydrophobicContact CE1-CB 4.33Å; F428-L457 HydrophobicContact CE1-CD1 3.9Å; F428-L457 HydrophobicContact CE2-CD1 4.33Å; F428-L457 HydrophobicContact CZ-CD1 3.99Å; V445-L457 HydrophobicContact CB-CB 4.27Å; V445-L457 HydrophobicContact CB-CD2 4.28Å; V445-L457 HydrophobicContact CB-CG 4.22Å; V445-L457 HydrophobicContact CG1-CD2 4.43Å; V445-L457 HydrophobicContact CG2-CD2 4.28Å; V445-L457 HydrophobicContact CG2-CG 4.11Å; V445-L457 PolarHBondContact N-O 2.63Å; L457-I459 HydrophobicContact CD1-CG1 4.38Å; L457-I459 HydrophobicContact CD2-CD1 4.25Å; L457-I459 HydrophobicContact CG-CD1 4.45Å; L457-I459 HydrophobicContact CG-CG1 4.18Å
458	Y	84.8	Confident	77.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	136.7	174.5	-74.8	-88.7	0	0	0	110.5	L426 I427 V429 E435 L439 F442 V443 L444 N668	L426-Y458 CarbonylContact C-O 3.57Å; L426-Y458 WeakPolarHBondContact CA-O 3.48Å; I427-Y458 PolarHBondContact N-O 3.25Å; I427-Y458 PolarHBondContact O-N 3.05Å; V429-Y458 HydrophobicContact CB-CD2 4.27Å; V429-Y458 HydrophobicContact CB-CE2 3.96Å; V429-Y458 HydrophobicContact CG2-CD2 3.78Å; V429-Y458 HydrophobicContact CG2-CE2 3.78Å; E435-Y458 WeakPolarHBondContact OE2-CE1 3.39Å; E435-Y458 PolarHBondContact OE2-OH 2.85Å; L439-Y458 HydrophobicContact CB-CE1 4.22Å; L439-Y458 HydrophobicContact CD1-CE2 4.34Å; L439-Y458 HydrophobicContact CD2-CG 4.37Å; F442-Y458 HydrophobicContact CB-CD1 3.75Å; F442-Y458 HydrophobicContact CB-CG 4.22Å; V443-Y458 CarbonylContact O-C 3.42Å; V443-Y458 VanDerWaalsContact O-CA 3.24Å; V443-Y458 WeakPolarHBondContact O-CA 3.5Å; L444-Y458 HydrophobicContact CB-CD1 4.46Å; L444-Y458 HydrophobicContact CB-CE1 4.24Å; L444-Y458 HydrophobicContact CD1-CE1 4.3Å; L444-Y458 HydrophobicContact CD1-CE2 4.3Å; Y458-N668 PolarHBondContact OH-ND2 3.12Å
459	I	84.8	Confident	77.6	Confident	1 Å²	1	47 Å²	47	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.2	179.4	-63.2	-168.3	0	0	0	110.9	L260 F263 F266 Y424 C425 L426 F442 V443 V445 L457	L260-I459 HydrophobicContact CD2-CD1 3.48Å; L260-I459 VanDerWaalsContact CD2-CD1 3.48Å; F263-I459 HydrophobicContact CD1-CG2 4.43Å; F263-I459 HydrophobicContact CE1-CG2 4.18Å; F263-I459 HydrophobicContact CE2-CD1 4.48Å; F263-I459 HydrophobicContact CZ-CB 4.49Å; F266-I459 HydrophobicContact CE2-CD1 3.96Å; Y424-I459 HydrophobicContact CD1-CG2 3.58Å; Y424-I459 HydrophobicContact CE1-CG2 4.23Å; Y424-I459 HydrophobicContact CG-CG2 4.49Å; C425-I459 WeakPolarHBondContact O-CA 3.36Å; L426-I459 HydrophobicContact CD2-CD1 3.61Å; L426-I459 HydrophobicContact CD2-CG1 3.59Å; F442-I459 WeakPolarHBondContact CA-O 3.41Å; V443-I459 WeakPolarHBondContact CB-O 3.38Å; V443-I459 PolarHBondContact N-O 2.95Å; V443-I459 PolarHBondContact O-N 2.96Å; V445-I459 HydrophobicContact CG2-CB 4.05Å; V445-I459 HydrophobicContact CG2-CD1 3.58Å; V445-I459 HydrophobicContact CG2-CG1 3.53Å; L457-I459 HydrophobicContact CD1-CG1 4.38Å; L457-I459 HydrophobicContact CD2-CD1 4.25Å; L457-I459 HydrophobicContact CG-CD1 4.45Å; L457-I459 HydrophobicContact CG-CG1 4.18Å
460	T	83.2	Confident	78.5	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	145.9	166	-149	0	0	0	0	110.3	C425 N441 F442 F465 Y573	C425-T460 HydrophobicContact CB-CG2 4.1Å; C425-T460 PolarHBondContact N-O 3.16Å; C425-T460 PolarHBondContact O-N 2.84Å; N441-T460 VanDerWaalsContact O-CB 3.24Å; N441-T460 WeakPolarHBondContact O-CB 3.4Å; N441-T460 PolarHBondContact O-OG1 3.32Å; F442-T460 HydrophobicContact CD1-CG2 3.88Å; F442-T460 HydrophobicContact CE1-CG2 3.46Å; F442-T460 VanDerWaalsContact CE1-CG2 3.46Å; F442-T460 HydrophobicContact CE2-CG2 4.33Å; F442-T460 HydrophobicContact CG-CG2 4.44Å; F442-T460 HydrophobicContact CZ-CG2 3.69Å; T460-F465 HydrophobicContact CG2-CE2 4.42Å; T460-Y573 PolarHBondContact OG1-OH 2.81Å
461	H	82.1	Confident	79.3	Confident	36 Å²	36	43.9 Å²	43.9	17%	0.167	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	149.2	-176	179.5	-111.4	0	0	0	110.9	E423 Y424 S463 R464 C571	E423-H461 CarbonylContact O-C 3.57Å; E423-H461 WeakPolarHBondContact O-CA 3.1Å; E423-H461 PolarHBondContact O-CD2 2.72Å; Y424-H461 HydrophobicContact CD1-CB 4.06Å; Y424-H461 HydrophobicContact CE1-CB 3.82Å; Y424-H461 AromaticContact CE1-CD2 3.69Å; Y424-H461 AromaticContact CE2-CD2 3.98Å; Y424-H461 AromaticContact CZ-CD2 3.69Å; H461-S463 WeakPolarHBondContact ND1-CB 3.36Å; H461-S463 PolarHBondContact ND1-N 2.82Å; H461-S463 PolarHBondContact ND1-OG 3.48Å; H461-S463 PolarHBondContact O-N 2.54Å; H461-R464 VanDerWaalsContact O-CB 3.22Å; H461-R464 WeakPolarHBondContact O-CB 3.34Å; H461-R464 PolarHBondContact O-N 3.39Å; H461-C571 HydrophobicContact CB-CB 4.27Å
462	R	77.3	Confident	79.9	Confident	65 Å²	65	46.7 Å²	46.7	25%	0.245	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-55.9	-22.1	-178.5	-178.1	161	-171.1	-172.3	3	114.7	V416 H420 E423 R464	V416-R462 HydrophobicContact CG1-CB 4.17Å; V416-R462 HydrophobicContact CG1-CG 3.56Å; H420-R462 PolarHBondContact O-NH1 2.86Å; E423-R462 WeakPolarHBondContact O-CB 3.32Å; E423-R462 PolarHBondContact O-N 3.07Å; R462-R464 PolarHBondContact O-N 3.18Å
463	S	71.6	Confident	80.5	Confident	8 Å²	8	47 Å²	47	6%	0.056	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-64.6	-23.8	172.6	61	0	0	0	0	113.7	H461 F465 R466	H461-S463 WeakPolarHBondContact ND1-CB 3.36Å; H461-S463 PolarHBondContact ND1-N 2.82Å; H461-S463 PolarHBondContact ND1-OG 3.48Å; H461-S463 PolarHBondContact O-N 2.54Å; S463-F465 PolarHBondContact O-N 2.89Å; S463-R466 WeakPolarHBondContact O-CB 3.48Å; S463-R466 PolarHBondContact O-N 3.38Å
464	R	75.7	Confident	81.3	Confident	20 Å²	20	43.8 Å²	43.8	8%	0.075	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-53.3	-30	178	173.1	61.6	-167.2	117	-16	114	D135 N441 H461 R462 H574	D135-R464 VanDerWaalsContact CG-NH2 3.29Å; D135-R464 IonicContact OD1-CZ 3.39Å; D135-R464 VanDerWaalsContact OD1-CZ 3.27Å; D135-R464 IonicContact OD1-NH1 3.46Å; D135-R464 PolarHBondContact OD1-NH1 3.3Å; D135-R464 IonicContact OD1-NH2 2.65Å; D135-R464 PolarHBondContact OD1-NH2 3.07Å; D135-R464 IonicContact OD2-CZ 2.73Å; D135-R464 IonicContact OD2-NH1 2.75Å; D135-R464 IonicContact OD2-NH2 3.6Å; D135-R464 PolarHBondContact OD2-NH2 3.5Å; N441-R464 PolarHBondContact OD1-NE 2.73Å; N441-R464 PolarHBondContact OD1-NH2 2.95Å; H461-R464 VanDerWaalsContact O-CB 3.22Å; H461-R464 WeakPolarHBondContact O-CB 3.34Å; H461-R464 PolarHBondContact O-N 3.39Å; R462-R464 PolarHBondContact O-N 3.18Å; R464-H574 VanDerWaalsContact CD-CG 3.42Å
465	F	68.8	Low	81.8	Confident	39 Å²	39	44.1 Å²	44.1	17%	0.171	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-93.1	0.1	-176.8	-53.3	-83.7	0	0	0	113	L409 L412 N413 V416 T460 S463	L409-F465 HydrophobicContact CD2-CD1 4.31Å; L409-F465 HydrophobicContact CD2-CE1 3.89Å; L412-F465 HydrophobicContact CB-CE1 3.6Å; L412-F465 HydrophobicContact CB-CZ 3.55Å; N413-F465 HydrophobicContact CB-CD1 3.81Å; N413-F465 HydrophobicContact CB-CE1 4.32Å; N413-F465 HydrophobicContact CB-CG 4.48Å; V416-F465 HydrophobicContact CG1-CD2 4.45Å; V416-F465 HydrophobicContact CG2-CD2 4.33Å; V416-F465 HydrophobicContact CG2-CE2 3.92Å; V416-F465 HydrophobicContact CG2-CZ 4.48Å; T460-F465 HydrophobicContact CG2-CE2 4.42Å; S463-F465 PolarHBondContact O-N 2.89Å
466	R	66.9	Low	82.3	Confident	112 Å²	112	46.2 Å²	46.2	42%	0.423	22%	0.221	S	C	.	.			trans	-97.5	133.7	178.3	-53.7	-170.7	-172.2	-167.7	8.7	109	S463 E522	S463-R466 WeakPolarHBondContact O-CB 3.48Å; S463-R466 PolarHBondContact O-N 3.38Å; R466-E522 WeakPolarHBondContact CD-OE1 3.46Å; R466-E522 WeakPolarHBondContact CD-OE2 3.41Å; R466-E522 IonicContact CZ-OE1 2.84Å; R466-E522 IonicContact CZ-OE2 3.96Å; R466-E522 IonicContact NE-OE1 2.66Å; R466-E522 IonicContact NE-OE2 3.51Å; R466-E522 IonicContact NH1-OE1 3.19Å; R466-E522 PolarHBondContact NH1-OE1 3.32Å; R466-E522 IonicContact NH1-OE2 3.31Å; R466-E522 PolarHBondContact NH1-OE2 2.74Å
467	R	63.5	Low	82.6	Confident	177 Å²	177	53.3 Å²	53.3	67%	0.668	25%	0.254	S	S	*	.			trans	-89.4	-2.1	-166.4	-70.8	-178.9	171.1	143	-8.9	115.4	E137 V469	E137-R467 IonicContact OE1-CZ 3.19Å; E137-R467 IonicContact OE1-NE 2.97Å; E137-R467 PolarHBondContact OE1-NE 3.29Å; E137-R467 IonicContact OE1-NH2 2.72Å; E137-R467 PolarHBondContact OE1-NH2 3.43Å; E137-R467 IonicContact OE2-CZ 2.68Å; E137-R467 IonicContact OE2-NE 3.23Å; E137-R467 IonicContact OE2-NH2 2.73Å; R467-V469 PolarHBondContact O-N 3.06Å
468	T	73.9	Confident	82.9	Confident	87 Å²	87	54 Å²	54	53%	0.534	26%	0.258	S	S	.	.			trans	-93.7	87	-175.7	44.9	0	0	0	0	111.8	E522	T468-E522 PolarHBondContact O-N 2.75Å
469	V	84.9	Confident	83.3	Confident	28 Å²	28	58.3 Å²	58.3	17%	0.17	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	133.8	167.4	-175.4	0	0	0	0	108	L103 R467 V519 V521 V575	L103-V469 HydrophobicContact CD2-CB 4.36Å; L103-V469 HydrophobicContact CD2-CG2 4.21Å; R467-V469 PolarHBondContact O-N 3.06Å; V469-V519 HydrophobicContact CG1-CG2 4.25Å; V469-V521 HydrophobicContact CG1-CG2 4.32Å; V469-V521 HydrophobicContact CG2-CG2 4.29Å; V469-V575 HydrophobicContact CG1-CG1 3.53Å; V469-V575 HydrophobicContact CG1-CG2 4.21Å; V469-V575 HydrophobicContact CG2-CG2 4.12Å
470	D	88	Confident	83.6	Confident	82 Å²	82	65.8 Å²	65.8	44%	0.439	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	142.7	177.2	180	29.8	0	0	0	109.6	V520	D470-V520 HydrophobicContact CB-CB 4.37Å; D470-V520 PolarHBondContact N-O 2.68Å; D470-V520 PolarHBondContact O-N 3.27Å
471	V	91.2	Very high	83.9	Confident	14 Å²	14	67.6 Å²	67.6	9%	0.085	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	122.8	-179.9	178.5	0	0	0	0	108.2	V519 E582 L586	V471-V519 HydrophobicContact CG2-CB 4.37Å; V471-V519 HydrophobicContact CG2-CG2 4.1Å; V471-E582 HydrophobicContact CB-CB 3.91Å; V471-E582 HydrophobicContact CB-CG 4.27Å; V471-E582 HydrophobicContact CG1-CB 3.72Å; V471-E582 HydrophobicContact CG2-CB 4.23Å; V471-E582 HydrophobicContact CG2-CG 4.35Å; V471-L586 HydrophobicContact CG1-CD1 4.2Å
472	R	91.5	Very high	84.3	Confident	74 Å²	74	65.9 Å²	65.9	28%	0.279	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	169.4	-177.3	57.8	167.3	-179.7	76.4	-0.4	111.7	D478 F517 V518	R472-D478 IonicContact CZ-OD1 3.35Å; R472-D478 IonicContact CZ-OD2 3.18Å; R472-D478 IonicContact NH1-OD1 3.7Å; R472-D478 IonicContact NH1-OD2 3.16Å; R472-D478 PolarHBondContact NH1-OD2 3.34Å; R472-D478 IonicContact NH2-OD1 2.74Å; R472-D478 PolarHBondContact NH2-OD1 3.05Å; R472-D478 IonicContact NH2-OD2 2.69Å; R472-D478 PolarHBondContact NH2-OD2 3.38Å; R472-F517 CarbonylContact O-C 3.6Å; R472-F517 WeakPolarHBondContact O-CA 3.24Å; R472-V518 HydrophobicContact CG-CG2 3.93Å; R472-V518 PolarHBondContact N-O 2.91Å; R472-V518 VanDerWaalsContact NH1-CG2 3.29Å; R472-V518 PolarHBondContact O-N 3.01Å
473	H	92.6	Very high	84.9	Confident	78 Å²	78	64.4 Å²	64.4	36%	0.361	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	147.4	165.4	-65.4	-82.2	0	0	0	110.9	A516 F517	H473-A516 WeakPolarHBondContact CA-O 3.32Å; H473-F517 AromaticContact CE1-CE1 3.25Å; H473-F517 WeakPolarHBondContact CE1-CE1 3.41Å; H473-F517 AromaticContact CE1-CZ 3.52Å; H473-F517 AromaticContact ND1-CD1 3.95Å; H473-F517 AromaticContact ND1-CE1 3.35Å; H473-F517 VanDerWaalsContact ND1-CE1 3.35Å; H473-F517 WeakPolarHBondContact ND1-CE1 3.26Å; H473-F517 AromaticContact ND1-CZ 3.75Å; H473-F517 AromaticContact NE2-CE1 3.83Å
474	A	93.3	Very high	85.7	Confident	8 Å²	8	69.3 Å²	69.3	7%	0.066	34%	0.341	C	S	.	.			trans	-68.8	143	173.7	0	0	0	0	0	110.9	D478 L499 F502 Y503 A516 V518	A474-D478 WeakPolarHBondContact CA-OD2 3.24Å; A474-L499 HydrophobicContact CB-CD1 4.11Å; A474-F502 HydrophobicContact CB-CE1 4.45Å; A474-Y503 HydrophobicContact CB-CE1 4.16Å; A474-A516 HydrophobicContact CB-CB 3.8Å; A474-A516 PolarHBondContact N-O 2.88Å; A474-V518 HydrophobicContact CB-CG1 3.89Å
475	V	93.3	Very high	86.3	Confident	57 Å²	57	68.6 Å²	68.6	35%	0.345	34%	0.339	S	S	.	.			trans	-120.7	154.1	174.3	-59.6	0	0	0	0	110	E477 D478 Y503	V475-E477 WeakPolarHBondContact CB-OE2 3.5Å; V475-E477 HydrophobicContact CG2-CB 4.26Å; V475-E477 VanDerWaalsContact CG2-OE2 3.26Å; V475-E477 WeakPolarHBondContact CG2-OE2 3.49Å; V475-E477 PolarHBondContact O-N 3.01Å; V475-D478 WeakPolarHBondContact CG2-OD2 3.45Å; V475-D478 PolarHBondContact N-OD2 3.34Å; V475-D478 VanDerWaalsContact O-CB 3.29Å; V475-D478 WeakPolarHBondContact O-CB 3.39Å; V475-D478 PolarHBondContact O-N 3.35Å; V475-Y503 PolarHBondContact O-OH 3.45Å
476	P	90.9	Very high	87.1	Confident	81 Å²	81	67.1 Å²	67.1	53%	0.526	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-31.5	-174.2	-29.6	37.5	0	0	0	114.9	D478 R479 Y503	P476-D478 VanDerWaalsContact C-N 3.25Å; P476-D478 PolarHBondContact O-N 3.06Å; P476-R479 VanDerWaalsContact O-CB 3.3Å; P476-R479 WeakPolarHBondContact O-CB 3.22Å; P476-R479 PolarHBondContact O-N 2.83Å; P476-Y503 HydrophobicContact CG-CD1 4.27Å; P476-Y503 HydrophobicContact CG-CG 4.43Å
477	E	91.4	Very high	88	Confident	150 Å²	150	66.8 Å²	66.8	70%	0.701	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-24.3	175.9	-60.5	79.5	-177.8	0	0	113.6	V475 R479	V475-E477 WeakPolarHBondContact CB-OE2 3.5Å; V475-E477 HydrophobicContact CG2-CB 4.26Å; V475-E477 VanDerWaalsContact CG2-OE2 3.26Å; V475-E477 WeakPolarHBondContact CG2-OE2 3.49Å; V475-E477 PolarHBondContact O-N 3.01Å; E477-R479 PolarHBondContact O-N 2.93Å
478	D	91.8	Very high	88.8	Confident	15 Å²	15	60.6 Å²	60.6	8%	0.08	32%	0.323	C	S	.	.	H	α-helix	trans	-70	-16.1	177.5	-65.2	-43.1	0	0	0	112.8	R472 A474 V475 P476 E480 A481 V482 V518 L525	R472-D478 IonicContact CZ-OD1 3.35Å; R472-D478 IonicContact CZ-OD2 3.18Å; R472-D478 IonicContact NH1-OD1 3.7Å; R472-D478 IonicContact NH1-OD2 3.16Å; R472-D478 PolarHBondContact NH1-OD2 3.34Å; R472-D478 IonicContact NH2-OD1 2.74Å; R472-D478 PolarHBondContact NH2-OD1 3.05Å; R472-D478 IonicContact NH2-OD2 2.69Å; R472-D478 PolarHBondContact NH2-OD2 3.38Å; A474-D478 WeakPolarHBondContact CA-OD2 3.24Å; V475-D478 WeakPolarHBondContact CG2-OD2 3.45Å; V475-D478 PolarHBondContact N-OD2 3.34Å; V475-D478 VanDerWaalsContact O-CB 3.29Å; V475-D478 WeakPolarHBondContact O-CB 3.39Å; V475-D478 PolarHBondContact O-N 3.35Å; P476-D478 VanDerWaalsContact C-N 3.25Å; P476-D478 PolarHBondContact O-N 3.06Å; D478-E480 VanDerWaalsContact C-N 3.34Å; D478-E480 PolarHBondContact O-N 2.92Å; D478-A481 PolarHBondContact O-N 3.18Å; D478-A481 VanDerWaalsContact O-N 3.13Å; D478-V482 WeakPolarHBondContact O-CG2 3.37Å; D478-V482 PolarHBondContact O-N 2.84Å; D478-V518 HydrophobicContact CB-CG1 4.31Å; D478-L525 HydrophobicContact CB-CD1 3.94Å
479	R	91.9	Very high	89	Confident	90 Å²	90	57.9 Å²	57.9	34%	0.34	31%	0.305	S	S	.	.	H	α-helix	trans	-58.1	-41.3	-171.1	-168.1	-168.4	-175.2	-72.6	-4.9	113.1	P476 E477 V482 S483 D500 Y503	P476-R479 VanDerWaalsContact O-CB 3.3Å; P476-R479 WeakPolarHBondContact O-CB 3.22Å; P476-R479 PolarHBondContact O-N 2.83Å; E477-R479 PolarHBondContact O-N 2.93Å; R479-V482 PolarHBondContact O-N 2.7Å; R479-S483 PolarHBondContact O-N 3.43Å; R479-D500 WeakPolarHBondContact CD-OD1 3.19Å; R479-D500 IonicContact CZ-OD1 2.72Å; R479-D500 IonicContact CZ-OD2 3.6Å; R479-D500 VanDerWaalsContact NE-CG 3.34Å; R479-D500 IonicContact NE-OD1 3.82Å; R479-D500 PolarHBondContact NE-OD1 2.6Å; R479-D500 IonicContact NE-OD2 3.58Å; R479-D500 PolarHBondContact NE-OD2 2.83Å; R479-D500 VanDerWaalsContact NE-OD2 3.16Å; R479-D500 IonicContact NH2-OD1 3.45Å; R479-D500 IonicContact NH2-OD2 3.44Å; R479-D500 PolarHBondContact NH2-OD2 3.04Å; R479-Y503 HydrophobicContact CB-CE2 4.33Å
480	E	91.1	Very high	88.6	Confident	159 Å²	159	63.5 Å²	63.5	74%	0.743	33%	0.334	S	S	*	.	H	α-helix	trans	-66.8	-44	178	-64.1	-171.2	159.6	0	0	110.9	D478 V482 S483 D484	D478-E480 VanDerWaalsContact C-N 3.34Å; D478-E480 PolarHBondContact O-N 2.92Å; E480-V482 VanDerWaalsContact C-N 3.33Å; E480-V482 PolarHBondContact O-N 3.04Å; E480-S483 WeakPolarHBondContact O-CB 3.04Å; E480-S483 PolarHBondContact O-N 2.77Å; E480-S483 VanDerWaalsContact O-N 3.12Å; E480-D484 PolarHBondContact O-N 3.02Å
481	A	90.3	Very high	88.2	Confident	40 Å²	40	61.7 Å²	61.7	33%	0.331	32%	0.324	S	S	.	.	H	α-helix	trans	-66.8	-30.3	177.5	0	0	0	0	0	113.3	D478 L485 L525	D478-A481 PolarHBondContact O-N 3.18Å; D478-A481 VanDerWaalsContact O-N 3.13Å; A481-L485 WeakPolarHBondContact O-CB 3.33Å; A481-L485 PolarHBondContact O-N 2.85Å; A481-L525 HydrophobicContact CB-CB 4.09Å; A481-L525 HydrophobicContact CB-CD1 4.11Å
482	V	90.1	Very high	86.9	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-71.2	-38.4	170.5	173	0	0	0	0	111.5	D478 R479 E480 L485 L486 V495 L496 L499 L525 V528	D478-V482 WeakPolarHBondContact O-CG2 3.37Å; D478-V482 PolarHBondContact O-N 2.84Å; R479-V482 PolarHBondContact O-N 2.7Å; E480-V482 VanDerWaalsContact C-N 3.33Å; E480-V482 PolarHBondContact O-N 3.04Å; V482-L485 WeakPolarHBondContact O-CB 3.27Å; V482-L485 PolarHBondContact O-N 2.91Å; V482-L486 HydrophobicContact CG1-CD1 4.4Å; V482-L486 WeakPolarHBondContact O-CG 3.43Å; V482-L486 PolarHBondContact O-N 3.06Å; V482-V495 HydrophobicContact CG1-CG1 4.32Å; V482-L496 HydrophobicContact CB-CD2 4.5Å; V482-L496 HydrophobicContact CG1-CD2 3.95Å; V482-L499 HydrophobicContact CB-CD2 4.26Å; V482-L499 HydrophobicContact CG1-CD2 4.15Å; V482-L499 HydrophobicContact CG2-CD2 4.23Å; V482-L525 HydrophobicContact CG2-CD1 3.94Å; V482-L525 HydrophobicContact CG2-CD2 4.21Å; V482-V528 HydrophobicContact CG1-CG1 3.93Å; V482-V528 HydrophobicContact CG2-CB 4.13Å; V482-V528 HydrophobicContact CG2-CG1 4.28Å; V482-V528 HydrophobicContact CG2-CG2 4.33Å
483	S	90.4	Very high	85.9	Confident	33 Å²	33	66.3 Å²	66.3	23%	0.231	36%	0.362	C	S	.	.	H	α-helix	trans	-62	-44.1	172.3	-179.2	0	0	0	0	111.5	R479 E480 L485 L486 N487	R479-S483 PolarHBondContact O-N 3.43Å; E480-S483 WeakPolarHBondContact O-CB 3.04Å; E480-S483 PolarHBondContact O-N 2.77Å; E480-S483 VanDerWaalsContact O-N 3.12Å; S483-L485 VanDerWaalsContact C-N 3.33Å; S483-L485 PolarHBondContact O-N 2.94Å; S483-L486 PolarHBondContact O-N 2.84Å; S483-N487 WeakPolarHBondContact O-CB 3.46Å; S483-N487 VanDerWaalsContact O-CG 3.28Å; S483-N487 PolarHBondContact O-N 3.14Å; S483-N487 PolarHBondContact O-ND2 2.88Å
484	D	88.6	Confident	85.4	Confident	112 Å²	112	63.5 Å²	63.5	60%	0.599	35%	0.351	S	S	*	.	H	α-helix	trans	-65.1	-35	175.1	-76.9	-14.3	0	0	0	112.7	E480 S488	E480-D484 PolarHBondContact O-N 3.02Å; D484-S488 WeakPolarHBondContact O-CB 3.42Å; D484-S488 PolarHBondContact O-N 2.81Å; D484-S488 PolarHBondContact O-OG 2.73Å
485	L	87.1	Confident	85	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.021	35%	0.348	C	S	.	.	H	α-helix	trans	-61.4	-49.6	172	177.5	62.5	0	0	0	111.2	A481 V482 S483 N487 S488 L489 L525 V528 L567 K569	A481-L485 WeakPolarHBondContact O-CB 3.33Å; A481-L485 PolarHBondContact O-N 2.85Å; V482-L485 WeakPolarHBondContact O-CB 3.27Å; V482-L485 PolarHBondContact O-N 2.91Å; S483-L485 VanDerWaalsContact C-N 3.33Å; S483-L485 PolarHBondContact O-N 2.94Å; L485-N487 PolarHBondContact O-N 2.79Å; L485-S488 PolarHBondContact O-N 3.27Å; L485-S488 PolarHBondContact O-OG 3.37Å; L485-L489 HydrophobicContact CD1-CD1 3.98Å; L485-L489 HydrophobicContact CD1-CG 4.31Å; L485-L489 HydrophobicContact CG-CD1 4.22Å; L485-L489 WeakPolarHBondContact O-CG 3.49Å; L485-L489 PolarHBondContact O-N 2.93Å; L485-L525 HydrophobicContact CD2-CD2 4.02Å; L485-V528 HydrophobicContact CD2-CG1 4.45Å; L485-L567 HydrophobicContact CD2-CB 4.17Å; L485-K569 HydrophobicContact CD1-CD 4.19Å; L485-K569 HydrophobicContact CD1-CG 3.5Å; L485-K569 VanDerWaalsContact CD1-CG 3.5Å
486	L	87	Confident	84.8	Confident	9 Å²	9	62.1 Å²	62.1	5%	0.047	34%	0.341	C	S	.	.	H	α-helix	trans	-58.7	-45.6	176.9	-75.7	166.4	0	0	0	112	V482 S483 S488 L489 N490 L491 C493 V495 L496 L567	V482-L486 HydrophobicContact CG1-CD1 4.4Å; V482-L486 WeakPolarHBondContact O-CG 3.43Å; V482-L486 PolarHBondContact O-N 3.06Å; S483-L486 PolarHBondContact O-N 2.84Å; L486-S488 PolarHBondContact O-N 3.39Å; L486-L489 CarbonylContact O-C 3.59Å; L486-L489 PolarHBondContact O-N 2.85Å; L486-N490 PolarHBondContact O-N 3.27Å; L486-L491 HydrophobicContact CD2-CB 3.92Å; L486-L491 PolarHBondContact O-N 2.74Å; L486-C493 VanDerWaalsContact CD2-SG 3.52Å; L486-V495 HydrophobicContact CD1-CB 4.4Å; L486-V495 HydrophobicContact CD1-CG1 4.44Å; L486-L496 HydrophobicContact CD1-CD1 3.95Å; L486-L496 HydrophobicContact CD1-CD2 3.98Å; L486-L496 HydrophobicContact CD1-CG 3.6Å; L486-L567 HydrophobicContact CD2-CD1 3.52Å; L486-L567 HydrophobicContact CG-CD1 4.15Å
487	N	85.8	Confident	84.6	Confident	105 Å²	105	64.6 Å²	64.6	56%	0.561	35%	0.345	S	S	*	.	H	α-helix	trans	-59.8	-44.8	174.7	-72	-33.1	0	0	0	111.7	S483 L485 L489 N490	S483-N487 WeakPolarHBondContact O-CB 3.46Å; S483-N487 VanDerWaalsContact O-CG 3.28Å; S483-N487 PolarHBondContact O-N 3.14Å; S483-N487 PolarHBondContact O-ND2 2.88Å; L485-N487 PolarHBondContact O-N 2.79Å; N487-L489 VanDerWaalsContact C-N 3.28Å; N487-L489 PolarHBondContact O-N 3.03Å; N487-N490 PolarHBondContact O-N 2.89Å; N487-N490 VanDerWaalsContact O-N 3.11Å
488	S	80.4	Confident	84.5	Confident	46 Å²	46	58.5 Å²	58.5	32%	0.322	32%	0.317	S	S	.	.	H	α-helix	trans	-64.7	-31	178.9	72.1	0	0	0	0	113.3	D484 L485 L486	D484-S488 WeakPolarHBondContact O-CB 3.42Å; D484-S488 PolarHBondContact O-N 2.81Å; D484-S488 PolarHBondContact O-OG 2.73Å; L485-S488 PolarHBondContact O-N 3.27Å; L485-S488 PolarHBondContact O-OG 3.37Å; L486-S488 PolarHBondContact O-N 3.39Å
489	L	77.4	Confident	84.4	Confident	30 Å²	30	57.8 Å²	57.8	16%	0.157	31%	0.313	C	S	.	.	H	α-helix	trans	-88	-6.5	175.8	-62.5	176.1	0	0	0	113.3	L485 L486 N487 L491	L485-L489 HydrophobicContact CD1-CD1 3.98Å; L485-L489 HydrophobicContact CD1-CG 4.31Å; L485-L489 HydrophobicContact CG-CD1 4.22Å; L485-L489 WeakPolarHBondContact O-CG 3.49Å; L485-L489 PolarHBondContact O-N 2.93Å; L486-L489 CarbonylContact O-C 3.59Å; L486-L489 PolarHBondContact O-N 2.85Å; N487-L489 VanDerWaalsContact C-N 3.28Å; N487-L489 PolarHBondContact O-N 3.03Å; L489-L491 HydrophobicContact CB-CD1 3.66Å; L489-L491 HydrophobicContact CB-CG 3.74Å; L489-L491 HydrophobicContact CD1-CD1 3.88Å; L489-L491 HydrophobicContact CG-CD1 4.43Å
490	N	77.6	Confident	84.3	Confident	147 Å²	147	55.2 Å²	55.2	79%	0.786	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	43.7	-173.7	-57.6	-98.7	0	0	0	113.1	L486 N487	L486-N490 PolarHBondContact O-N 3.27Å; N487-N490 PolarHBondContact O-N 2.89Å; N487-N490 VanDerWaalsContact O-N 3.11Å
491	L	77.7	Confident	84.2	Confident	43 Å²	43	48.6 Å²	48.6	23%	0.225	28%	0.278	C	S	.	.			trans	-105.4	131.4	-176.6	-63.4	174	0	0	0	112.4	L486 L489 L567 H609	L486-L491 HydrophobicContact CD2-CB 3.92Å; L486-L491 PolarHBondContact O-N 2.74Å; L489-L491 HydrophobicContact CB-CD1 3.66Å; L489-L491 HydrophobicContact CB-CG 3.74Å; L489-L491 HydrophobicContact CD1-CD1 3.88Å; L489-L491 HydrophobicContact CG-CD1 4.43Å; L491-L567 HydrophobicContact CD1-CD2 3.61Å; L491-H609 HydrophobicContact CD1-CB 3.73Å
492	T	65.1	Low	84.2	Confident	147 Å²	147	47.5 Å²	47.5	90%	0.902	27%	0.266	S	S	*	.			trans	-113.4	106.2	172.4	53.2	0	0	0	0	109.6
493	C	69.7	Low	84.2	Confident	39 Å²	39	49.8 Å²	49.8	26%	0.264	28%	0.275	S	S	.	.	S	Bend	trans	-159.5	159.6	-173.1	52.9	0	0	0	0	111.5	L486 V495 C607	L486-C493 VanDerWaalsContact CD2-SG 3.52Å; C493-V495 HydrophobicContact CB-CG2 4.32Å; C493-V495 PolarHBondContact O-N 3.36Å; C493-V495 WeakPolarHBondContact SG-CG2 3.19Å; C493-C607 HydrophobicContact CB-CB 3.83Å; C493-C607 VanDerWaalsContact SG-SG 3.65Å
494	S	81.8	Confident	84.1	Confident	19 Å²	19	56.8 Å²	56.8	13%	0.133	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-4.1	-173.9	65.2	0	0	0	0	115.5	L496 E497 D498 H565 T605	S494-L496 CarbonylContact O-C 3.52Å; S494-L496 PolarHBondContact O-N 2.89Å; S494-E497 WeakPolarHBondContact O-CA 3.19Å; S494-E497 WeakPolarHBondContact O-CB 3.39Å; S494-E497 PolarHBondContact O-N 3.02Å; S494-D498 VanDerWaalsContact C-OD2 3.22Å; S494-D498 WeakPolarHBondContact CB-OD2 3.48Å; S494-D498 PolarHBondContact O-N 3.03Å; S494-D498 PolarHBondContact OG-OD2 2.7Å; S494-H565 PolarHBondContact OG-CE1 3.05Å; S494-T605 PolarHBondContact OG-O 2.83Å
495	V	85.7	Confident	84	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-41.3	-38.7	-178.3	175	0	0	0	0	114.4	V482 L486 C493 L499 V528 H565 L567 C607	V482-V495 HydrophobicContact CG1-CG1 4.32Å; L486-V495 HydrophobicContact CD1-CB 4.4Å; L486-V495 HydrophobicContact CD1-CG1 4.44Å; C493-V495 HydrophobicContact CB-CG2 4.32Å; C493-V495 PolarHBondContact O-N 3.36Å; C493-V495 WeakPolarHBondContact SG-CG2 3.19Å; V495-L499 WeakPolarHBondContact O-CB 3.46Å; V495-L499 PolarHBondContact O-N 2.99Å; V495-V528 HydrophobicContact CG1-CG1 4.31Å; V495-H565 HydrophobicContact CG2-CB 3.88Å; V495-H565 WeakPolarHBondContact CG2-ND1 3.26Å; V495-L567 HydrophobicContact CG1-CD1 4.11Å; V495-L567 HydrophobicContact CG2-CD1 4.25Å; V495-C607 HydrophobicContact CG2-CB 3.92Å
496	L	88.5	Confident	84.1	Confident	36 Å²	36	60.8 Å²	60.8	19%	0.188	32%	0.317	C	S	.	.	H	α-helix	trans	-75.4	-33.2	177.3	-67.8	176.7	0	0	0	113.4	V482 L486 S494 D500	V482-L496 HydrophobicContact CB-CD2 4.5Å; V482-L496 HydrophobicContact CG1-CD2 3.95Å; L486-L496 HydrophobicContact CD1-CD1 3.95Å; L486-L496 HydrophobicContact CD1-CD2 3.98Å; L486-L496 HydrophobicContact CD1-CG 3.6Å; S494-L496 CarbonylContact O-C 3.52Å; S494-L496 PolarHBondContact O-N 2.89Å; L496-D500 VanDerWaalsContact O-CB 3.23Å; L496-D500 WeakPolarHBondContact O-CB 3.44Å; L496-D500 PolarHBondContact O-N 3.06Å
497	E	87.8	Confident	84.1	Confident	133 Å²	133	61.8 Å²	61.8	62%	0.621	32%	0.324	S	S	*	.	H	α-helix	trans	-71.6	-40.4	177.1	-51.6	-175.3	137	0	0	110.8	S494 D500 S501	S494-E497 WeakPolarHBondContact O-CA 3.19Å; S494-E497 WeakPolarHBondContact O-CB 3.39Å; S494-E497 PolarHBondContact O-N 3.02Å; E497-D500 PolarHBondContact O-N 3.45Å; E497-S501 WeakPolarHBondContact O-CB 3.37Å; E497-S501 PolarHBondContact O-N 2.81Å; E497-S501 PolarHBondContact O-OG 2.9Å
498	D	88.4	Confident	84	Confident	21 Å²	21	57.5 Å²	57.5	11%	0.112	30%	0.301	C	S	.	.	H	α-helix	trans	-71	-37.5	175.9	-60.3	-56.5	0	0	0	111.3	S494 S501 F502 I530 H565	S494-D498 VanDerWaalsContact C-OD2 3.22Å; S494-D498 WeakPolarHBondContact CB-OD2 3.48Å; S494-D498 PolarHBondContact O-N 3.03Å; S494-D498 PolarHBondContact OG-OD2 2.7Å; D498-S501 PolarHBondContact O-N 2.83Å; D498-F502 PolarHBondContact O-N 2.64Å; D498-I530 HydrophobicContact CB-CD1 4.21Å; D498-H565 IonicContact OD2-CE1 3.79Å; D498-H565 PolarHBondContact OD2-CE1 2.69Å; D498-H565 IonicContact OD2-NE2 3.36Å; D498-H565 PolarHBondContact OD2-NE2 2.81Å
499	L	90	Very high	83.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-67.8	-43.1	171.9	-172.2	67.9	0	0	0	112.1	A474 V482 V495 S501 F502 Y503 A516 I530	A474-L499 HydrophobicContact CB-CD1 4.11Å; V482-L499 HydrophobicContact CB-CD2 4.26Å; V482-L499 HydrophobicContact CG1-CD2 4.15Å; V482-L499 HydrophobicContact CG2-CD2 4.23Å; V495-L499 WeakPolarHBondContact O-CB 3.46Å; V495-L499 PolarHBondContact O-N 2.99Å; L499-S501 PolarHBondContact O-N 2.94Å; L499-F502 WeakPolarHBondContact O-CB 3.5Å; L499-F502 PolarHBondContact O-N 3.07Å; L499-Y503 HydrophobicContact CD1-CE1 4.26Å; L499-Y503 HydrophobicContact CD1-CE2 4.14Å; L499-Y503 HydrophobicContact CD2-CE2 4Å; L499-Y503 HydrophobicContact CG-CD2 4.31Å; L499-Y503 HydrophobicContact CG-CE2 3.6Å; L499-Y503 WeakPolarHBondContact O-CD2 3.47Å; L499-Y503 PolarHBondContact O-N 2.84Å; L499-A516 HydrophobicContact CD1-CB 3.67Å; L499-I530 HydrophobicContact CB-CD1 4.09Å; L499-I530 HydrophobicContact CD1-CD1 4.37Å
500	D	90.2	Very high	84.1	Confident	36 Å²	36	65.2 Å²	65.2	19%	0.193	35%	0.345	C	S	.	.	H	α-helix	trans	-66.2	-27.7	174	-77.8	-22.1	0	0	0	112	R479 L496 E497 R504	R479-D500 WeakPolarHBondContact CD-OD1 3.19Å; R479-D500 IonicContact CZ-OD1 2.72Å; R479-D500 IonicContact CZ-OD2 3.6Å; R479-D500 VanDerWaalsContact NE-CG 3.34Å; R479-D500 IonicContact NE-OD1 3.82Å; R479-D500 PolarHBondContact NE-OD1 2.6Å; R479-D500 IonicContact NE-OD2 3.58Å; R479-D500 PolarHBondContact NE-OD2 2.83Å; R479-D500 VanDerWaalsContact NE-OD2 3.16Å; R479-D500 IonicContact NH2-OD1 3.45Å; R479-D500 IonicContact NH2-OD2 3.44Å; R479-D500 PolarHBondContact NH2-OD2 3.04Å; L496-D500 VanDerWaalsContact O-CB 3.23Å; L496-D500 WeakPolarHBondContact O-CB 3.44Å; L496-D500 PolarHBondContact O-N 3.06Å; E497-D500 PolarHBondContact O-N 3.45Å; D500-R504 WeakPolarHBondContact O-CB 3.43Å; D500-R504 VanDerWaalsContact O-CG 3.3Å; D500-R504 WeakPolarHBondContact O-CG 3.05Å; D500-R504 PolarHBondContact O-N 3.31Å; D500-R504 PolarHBondContact O-NE 3.18Å
501	S	88.2	Confident	84.4	Confident	20 Å²	20	60.6 Å²	60.6	14%	0.14	33%	0.332	C	S	.	.	H	α-helix	trans	-72.3	-46	171.5	-59	0	0	0	0	110.5	E497 D498 L499 Y503 R504 T505 H506	E497-S501 WeakPolarHBondContact O-CB 3.37Å; E497-S501 PolarHBondContact O-N 2.81Å; E497-S501 PolarHBondContact O-OG 2.9Å; D498-S501 PolarHBondContact O-N 2.83Å; L499-S501 PolarHBondContact O-N 2.94Å; S501-Y503 VanDerWaalsContact C-N 3.27Å; S501-Y503 PolarHBondContact O-N 3.17Å; S501-R504 PolarHBondContact O-N 3.48Å; S501-T505 PolarHBondContact O-N 3.32Å; S501-T505 PolarHBondContact O-OG1 2.58Å; S501-H506 PolarHBondContact O-N 3.43Å
502	F	90.4	Very high	84.9	Confident	17 Å²	17	59.4 Å²	59.4	8%	0.075	33%	0.327	C	S	.	.	H	α-helix	trans	-52.3	-43	170.7	171.1	-104	0	0	0	112.6	A474 D498 L499 R504 H506 L514 A516	A474-F502 HydrophobicContact CB-CE1 4.45Å; D498-F502 PolarHBondContact O-N 2.64Å; L499-F502 WeakPolarHBondContact O-CB 3.5Å; L499-F502 PolarHBondContact O-N 3.07Å; F502-R504 PolarHBondContact O-N 3.09Å; F502-H506 AromaticContact CD2-ND1 3.68Å; F502-H506 AromaticContact CE2-ND1 3.4Å; F502-H506 WeakPolarHBondContact CE2-ND1 3.39Å; F502-H506 AromaticContact CZ-ND1 3.85Å; F502-H506 WeakPolarHBondContact O-CA 3.47Å; F502-H506 PolarHBondContact O-CE1 2.89Å; F502-H506 PolarHBondContact O-N 3.13Å; F502-H506 VanDerWaalsContact O-N 3.12Å; F502-H506 PolarHBondContact O-ND1 2.89Å; F502-L514 HydrophobicContact CB-CB 4.34Å; F502-L514 HydrophobicContact CB-CD1 4.39Å; F502-L514 HydrophobicContact CD2-CB 4.08Å; F502-L514 WeakPolarHBondContact CD2-O 3.39Å; F502-L514 WeakPolarHBondContact CE2-O 3.29Å; F502-A516 HydrophobicContact CB-CB 4.47Å; F502-A516 HydrophobicContact CD1-CB 3.56Å; F502-A516 HydrophobicContact CD2-CB 4.41Å; F502-A516 HydrophobicContact CE1-CB 3.82Å; F502-A516 HydrophobicContact CG-CB 3.88Å; F502-A516 HydrophobicContact CZ-CB 4.35Å
503	Y	90.5	Very high	86.1	Confident	48 Å²	48	55.3 Å²	55.3	19%	0.188	30%	0.303	C	S	.	.	H	α-helix	trans	-72.4	-20.1	177.3	-61.9	-35.8	0	0	0	115.3	A474 V475 P476 R479 L499 S501	A474-Y503 HydrophobicContact CB-CE1 4.16Å; V475-Y503 PolarHBondContact O-OH 3.45Å; P476-Y503 HydrophobicContact CG-CD1 4.27Å; P476-Y503 HydrophobicContact CG-CG 4.43Å; R479-Y503 HydrophobicContact CB-CE2 4.33Å; L499-Y503 HydrophobicContact CD1-CE1 4.26Å; L499-Y503 HydrophobicContact CD1-CE2 4.14Å; L499-Y503 HydrophobicContact CD2-CE2 4Å; L499-Y503 HydrophobicContact CG-CD2 4.31Å; L499-Y503 HydrophobicContact CG-CE2 3.6Å; L499-Y503 WeakPolarHBondContact O-CD2 3.47Å; L499-Y503 PolarHBondContact O-N 2.84Å; S501-Y503 VanDerWaalsContact C-N 3.27Å; S501-Y503 PolarHBondContact O-N 3.17Å
504	R	88.9	Confident	87.1	Confident	180 Å²	180	53.7 Å²	53.7	68%	0.679	29%	0.292	S	S	*	.	H	α-helix	trans	-101	-36.6	-176.4	-75.9	177.7	-69	172.7	1.4	113.9	D500 S501 F502	D500-R504 WeakPolarHBondContact O-CB 3.43Å; D500-R504 VanDerWaalsContact O-CG 3.3Å; D500-R504 WeakPolarHBondContact O-CG 3.05Å; D500-R504 PolarHBondContact O-N 3.31Å; D500-R504 PolarHBondContact O-NE 3.18Å; S501-R504 PolarHBondContact O-N 3.48Å; F502-R504 PolarHBondContact O-N 3.09Å
505	T	86.1	Confident	87.7	Confident	87 Å²	87	54.5 Å²	54.5	53%	0.534	29%	0.293	S	S	.	.	H	α-helix	trans	-129.4	-13.1	-171.8	48.9	0	0	0	0	113.5	S501 S507	S501-T505 PolarHBondContact O-N 3.32Å; S501-T505 PolarHBondContact O-OG1 2.58Å; T505-S507 PolarHBondContact O-N 3.41Å; T505-S507 VanDerWaalsContact O-N 3.13Å; T505-S507 PolarHBondContact O-OG 3.26Å; T505-S507 PolarHBondContact OG1-N 3.08Å; T505-S507 PolarHBondContact OG1-O 3.41Å
506	H	87.9	Confident	88.1	Confident	114 Å²	114	54.5 Å²	54.5	53%	0.528	29%	0.293	S	S	.	.	S	Bend	trans	51.1	23.1	-164.6	-62.1	-59.9	0	0	0	113.8	S501 F502 L514	S501-H506 PolarHBondContact O-N 3.43Å; F502-H506 AromaticContact CD2-ND1 3.68Å; F502-H506 AromaticContact CE2-ND1 3.4Å; F502-H506 WeakPolarHBondContact CE2-ND1 3.39Å; F502-H506 AromaticContact CZ-ND1 3.85Å; F502-H506 WeakPolarHBondContact O-CA 3.47Å; F502-H506 PolarHBondContact O-CE1 2.89Å; F502-H506 PolarHBondContact O-N 3.13Å; F502-H506 VanDerWaalsContact O-N 3.12Å; F502-H506 PolarHBondContact O-ND1 2.89Å; H506-L514 PolarHBondContact O-N 3.2Å
507	S	88.3	Confident	88.5	Confident	29 Å²	29	52.8 Å²	52.8	20%	0.203	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-146.6	149.1	-174.3	-62.4	0	0	0	0	112.3	T505 V512	T505-S507 PolarHBondContact O-N 3.41Å; T505-S507 VanDerWaalsContact O-N 3.13Å; T505-S507 PolarHBondContact O-OG 3.26Å; T505-S507 PolarHBondContact OG1-N 3.08Å; T505-S507 PolarHBondContact OG1-O 3.41Å; S507-V512 CarbonylContact C-O 3.49Å; S507-V512 WeakPolarHBondContact CA-O 3.47Å
508	D	83.6	Confident	88.8	Confident	15 Å²	15	46.4 Å²	46.4	8%	0.08	26%	0.255	C	S	.	.			trans	-57.1	163.5	169.6	-119.1	-18	0	0	0	110.9	D510 G511 V512 L514 R532	D508-D510 HydrophobicContact CB-CB 4.44Å; D508-D510 PolarHBondContact O-N 3.09Å; D508-D510 VanDerWaalsContact O-N 3.16Å; D508-G511 WeakPolarHBondContact O-CA 3.18Å; D508-G511 PolarHBondContact O-N 3.4Å; D508-V512 HydrophobicContact CB-CB 4.2Å; D508-V512 PolarHBondContact N-O 2.72Å; D508-L514 HydrophobicContact CB-CD2 4.43Å; D508-L514 HydrophobicContact CB-CG 4.47Å; D508-R532 WeakPolarHBondContact OD2-CD 3.1Å; D508-R532 IonicContact OD2-CZ 3.37Å; D508-R532 IonicContact OD2-NE 3.73Å; D508-R532 IonicContact OD2-NH1 3.73Å; D508-R532 PolarHBondContact OD2-NH1 3.08Å
509	P	77.9	Confident	89	Confident	111 Å²	111	45.4 Å²	45.4	72%	0.721	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-29.4	167.7	-25.6	36.2	0	0	0	113.3	G511	P509-G511 PolarHBondContact O-N 3.11Å
510	D	80.8	Confident	89.1	Confident	127 Å²	127	46.4 Å²	46.4	68%	0.679	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-3.6	173.8	-62.4	-34.4	0	0	0	113.9	D508 V512 R532	D508-D510 HydrophobicContact CB-CB 4.44Å; D508-D510 PolarHBondContact O-N 3.09Å; D508-D510 VanDerWaalsContact O-N 3.16Å; D510-V512 VanDerWaalsContact C-N 3.33Å; D510-V512 HydrophobicContact CB-CG2 4.23Å; D510-V512 PolarHBondContact O-N 2.65Å; D510-R532 IonicContact OD2-NH1 2.68Å
511	G	84.4	Confident	88.9	Confident	50 Å²	50	45.1 Å²	45.1	52%	0.515	25%	0.249	S	C	.	.	S	Bend	trans	81.2	3.2	-177.3	0	0	0	0	0	115.3	D508 P509	D508-G511 WeakPolarHBondContact O-CA 3.18Å; D508-G511 PolarHBondContact O-N 3.4Å; P509-G511 PolarHBondContact O-N 3.11Å
512	V	87.8	Confident	88.6	Confident	19 Å²	19	48.1 Å²	48.1	12%	0.115	26%	0.261	C	S	.	.			trans	-73.6	134	178.8	179.8	0	0	0	0	110.7	S507 D508 D510 L514 R532 D533 Q535	S507-V512 CarbonylContact C-O 3.49Å; S507-V512 WeakPolarHBondContact CA-O 3.47Å; D508-V512 HydrophobicContact CB-CB 4.2Å; D508-V512 PolarHBondContact N-O 2.72Å; D510-V512 VanDerWaalsContact C-N 3.33Å; D510-V512 HydrophobicContact CB-CG2 4.23Å; D510-V512 PolarHBondContact O-N 2.65Å; V512-L514 PolarHBondContact O-N 3.49Å; V512-R532 HydrophobicContact CG1-CB 4.16Å; V512-R532 HydrophobicContact CG1-CG 4.38Å; V512-D533 HydrophobicContact CG1-CB 4.47Å; V512-D533 VanDerWaalsContact CG1-O 3.25Å; V512-D533 WeakPolarHBondContact CG1-O 3.38Å; V512-Q535 HydrophobicContact CG1-CG 4.25Å; V512-Q535 HydrophobicContact CG2-CG 3.91Å
513	P	90.2	Very high	88.2	Confident	61 Å²	61	58.9 Å²	58.9	40%	0.396	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	-57.8	133.3	179.9	-26.4	35.1	0	0	0	113.9	R532 D533	P513-R532 VanDerWaalsContact O-CA 3.29Å; P513-R532 WeakPolarHBondContact O-CA 3.5Å; P513-D533 PolarHBondContact O-N 2.67Å; P513-D533 VanDerWaalsContact O-N 3.15Å
514	L	92.6	Very high	88	Confident	5 Å²	5	63.2 Å²	63.2	3%	0.026	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	147.5	175.7	-68.6	178.6	0	0	0	111.6	F502 H506 D508 V512 I530 I531 R532 L564	F502-L514 HydrophobicContact CB-CB 4.34Å; F502-L514 HydrophobicContact CB-CD1 4.39Å; F502-L514 HydrophobicContact CD2-CB 4.08Å; F502-L514 WeakPolarHBondContact CD2-O 3.39Å; F502-L514 WeakPolarHBondContact CE2-O 3.29Å; H506-L514 PolarHBondContact O-N 3.2Å; D508-L514 HydrophobicContact CB-CD2 4.43Å; D508-L514 HydrophobicContact CB-CG 4.47Å; V512-L514 PolarHBondContact O-N 3.49Å; L514-I530 HydrophobicContact CD2-CG2 4.37Å; L514-I531 WeakPolarHBondContact CA-O 3.2Å; L514-R532 HydrophobicContact CD2-CB 3.71Å; L514-L564 HydrophobicContact CD2-CD1 3.64Å
515	Q	93.6	Very high	88.1	Confident	35 Å²	35	55.9 Å²	55.9	16%	0.164	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	124.4	166.9	-57.7	-173.8	49	0	0	110.3	F517 I531	Q515-F517 HydrophobicContact CB-CE2 3.65Å; Q515-F517 HydrophobicContact CB-CZ 4.03Å; Q515-I531 HydrophobicContact CB-CD1 4.37Å; Q515-I531 HydrophobicContact CB-CG1 3.9Å; Q515-I531 PolarHBondContact N-O 3.14Å; Q515-I531 PolarHBondContact O-N 3.03Å
516	A	94.9	Very high	88.2	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	139.1	175.7	0	0	0	0	0	111.7	H473 A474 L499 F502 I530	H473-A516 WeakPolarHBondContact CA-O 3.32Å; A474-A516 HydrophobicContact CB-CB 3.8Å; A474-A516 PolarHBondContact N-O 2.88Å; L499-A516 HydrophobicContact CD1-CB 3.67Å; F502-A516 HydrophobicContact CB-CB 4.47Å; F502-A516 HydrophobicContact CD1-CB 3.56Å; F502-A516 HydrophobicContact CD2-CB 4.41Å; F502-A516 HydrophobicContact CE1-CB 3.82Å; F502-A516 HydrophobicContact CG-CB 3.88Å; F502-A516 HydrophobicContact CZ-CB 4.35Å; A516-I530 HydrophobicContact CB-CG1 4.06Å
517	F	95.4	Very high	88.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	137.7	-177.5	-62	-85.2	0	0	0	110.8	R472 H473 Q515 V528 T529 I531 V583 L586 A587	R472-F517 CarbonylContact O-C 3.6Å; R472-F517 WeakPolarHBondContact O-CA 3.24Å; H473-F517 AromaticContact CE1-CE1 3.25Å; H473-F517 WeakPolarHBondContact CE1-CE1 3.41Å; H473-F517 AromaticContact CE1-CZ 3.52Å; H473-F517 AromaticContact ND1-CD1 3.95Å; H473-F517 AromaticContact ND1-CE1 3.35Å; H473-F517 VanDerWaalsContact ND1-CE1 3.35Å; H473-F517 WeakPolarHBondContact ND1-CE1 3.26Å; H473-F517 AromaticContact ND1-CZ 3.75Å; H473-F517 AromaticContact NE2-CE1 3.83Å; Q515-F517 HydrophobicContact CB-CE2 3.65Å; Q515-F517 HydrophobicContact CB-CZ 4.03Å; F517-V528 CarbonylContact O-C 3.6Å; F517-V528 WeakPolarHBondContact O-CA 3.28Å; F517-T529 PolarHBondContact N-O 3.34Å; F517-T529 PolarHBondContact O-N 2.93Å; F517-I531 HydrophobicContact CE2-CD1 3.9Å; F517-I531 HydrophobicContact CE2-CG1 4.12Å; F517-V583 HydrophobicContact CB-CG2 3.96Å; F517-V583 HydrophobicContact CD1-CG2 4.5Å; F517-V583 HydrophobicContact CD2-CG1 4.02Å; F517-V583 HydrophobicContact CD2-CG2 4.14Å; F517-V583 HydrophobicContact CE2-CG1 4.13Å; F517-V583 HydrophobicContact CG-CG2 3.94Å; F517-L586 HydrophobicContact CD1-CB 4.43Å; F517-L586 HydrophobicContact CD1-CD1 4.26Å; F517-L586 HydrophobicContact CE1-CB 3.63Å; F517-L586 HydrophobicContact CE1-CD1 4.22Å; F517-L586 HydrophobicContact CZ-CB 4.36Å; F517-A587 HydrophobicContact CE2-CB 4.13Å; F517-A587 HydrophobicContact CZ-CB 3.77Å
518	V	95	Very high	88.7	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	149.4	173.8	-63.5	0	0	0	0	110.5	R472 A474 D478 V520 L525 G527 V528	R472-V518 HydrophobicContact CG-CG2 3.93Å; R472-V518 PolarHBondContact N-O 2.91Å; R472-V518 VanDerWaalsContact NH1-CG2 3.29Å; R472-V518 PolarHBondContact O-N 3.01Å; A474-V518 HydrophobicContact CB-CG1 3.89Å; D478-V518 HydrophobicContact CB-CG1 4.31Å; V518-V520 HydrophobicContact CG2-CG2 4.47Å; V518-L525 HydrophobicContact CB-CD1 4Å; V518-L525 HydrophobicContact CB-CG 4.4Å; V518-L525 HydrophobicContact CG1-CD1 3.75Å; V518-G527 WeakPolarHBondContact CA-O 3.24Å; V518-V528 HydrophobicContact CG1-CB 4.43Å; V518-V528 HydrophobicContact CG1-CG2 4.22Å
519	V	93.2	Very high	89.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.9	172.5	55.4	0	0	0	0	109.9	V469 V471 V526 G527 L568 V575 W579	V469-V519 HydrophobicContact CG1-CG2 4.25Å; V471-V519 HydrophobicContact CG2-CB 4.37Å; V471-V519 HydrophobicContact CG2-CG2 4.1Å; V519-V526 HydrophobicContact CG1-CG2 4.05Å; V519-V526 HydrophobicContact CG2-CG2 4.32Å; V519-V526 PolarHBondContact O-N 3.22Å; V519-G527 PolarHBondContact N-O 3.45Å; V519-L568 HydrophobicContact CG1-CD1 3.87Å; V519-V575 HydrophobicContact CG2-CG1 3.68Å; V519-W579 HydrophobicContact CB-CD2 4.07Å; V519-W579 HydrophobicContact CB-CG 4.18Å; V519-W579 HydrophobicContact CB-CZ2 4.3Å; V519-W579 HydrophobicContact CG1-CD2 3.77Å; V519-W579 HydrophobicContact CG1-CE3 4.02Å; V519-W579 HydrophobicContact CG1-CG 4.37Å; V519-W579 HydrophobicContact CG1-CH2 3.94Å; V519-W579 HydrophobicContact CG1-CZ2 3.67Å; V519-W579 HydrophobicContact CG1-CZ3 4.12Å
520	V	90.7	Very high	90	Very high	20 Å²	20	39.3 Å²	39.3	12%	0.121	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.3	-173.2	179.1	0	0	0	0	109	D470 V518 Q524	D470-V520 HydrophobicContact CB-CB 4.37Å; D470-V520 PolarHBondContact N-O 2.68Å; D470-V520 PolarHBondContact O-N 3.27Å; V518-V520 HydrophobicContact CG2-CG2 4.47Å; V520-Q524 CarbonylContact C-O 3.49Å; V520-Q524 VanDerWaalsContact CA-O 3.3Å; V520-Q524 WeakPolarHBondContact CA-O 3.11Å
521	V	87.1	Confident	90.7	Very high	10 Å²	10	33.4 Å²	33.4	6%	0.061	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	124.5	177.9	176	0	0	0	0	107.9	V469 R523 Q524 V526 V575	V469-V521 HydrophobicContact CG1-CG2 4.32Å; V469-V521 HydrophobicContact CG2-CG2 4.29Å; V521-R523 PolarHBondContact O-N 3.44Å; V521-R523 VanDerWaalsContact O-N 3.15Å; V521-Q524 PolarHBondContact N-O 3.19Å; V521-Q524 PolarHBondContact O-N 3.34Å; V521-V526 HydrophobicContact CB-CG1 4.14Å; V521-V526 HydrophobicContact CB-CG2 4.11Å; V521-V526 HydrophobicContact CG2-CG2 3.65Å; V521-V575 HydrophobicContact CG2-CG2 4.23Å
522	E	80.7	Confident	91.1	Very high	83 Å²	83	33.5 Å²	33.5	39%	0.388	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	34.4	-176.6	-56.5	-160.7	98	0	0	114.8	R466 T468 Q524	R466-E522 WeakPolarHBondContact CD-OE1 3.46Å; R466-E522 WeakPolarHBondContact CD-OE2 3.41Å; R466-E522 IonicContact CZ-OE1 2.84Å; R466-E522 IonicContact CZ-OE2 3.96Å; R466-E522 IonicContact NE-OE1 2.66Å; R466-E522 IonicContact NE-OE2 3.51Å; R466-E522 IonicContact NH1-OE1 3.19Å; R466-E522 PolarHBondContact NH1-OE1 3.32Å; R466-E522 IonicContact NH1-OE2 3.31Å; R466-E522 PolarHBondContact NH1-OE2 2.74Å; T468-E522 PolarHBondContact O-N 2.75Å; E522-Q524 VanDerWaalsContact C-N 3.26Å; E522-Q524 PolarHBondContact O-N 3.15Å
523	R	82.6	Confident	91.3	Very high	242 Å²	242	34 Å²	34	91%	0.913	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.1	7.8	-173.9	-48.7	177	177.3	176.5	-2	115.7	V521	V521-R523 PolarHBondContact O-N 3.44Å; V521-R523 VanDerWaalsContact O-N 3.15Å
524	Q	86.8	Confident	91.3	Very high	139 Å²	139	31.5 Å²	31.5	65%	0.65	14%	0.139	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	135.8	168.6	-62.8	-173.3	-14.2	0	0	110.2	V520 V521 E522 V526	V520-Q524 CarbonylContact C-O 3.49Å; V520-Q524 VanDerWaalsContact CA-O 3.3Å; V520-Q524 WeakPolarHBondContact CA-O 3.11Å; V521-Q524 PolarHBondContact N-O 3.19Å; V521-Q524 PolarHBondContact O-N 3.34Å; E522-Q524 VanDerWaalsContact C-N 3.26Å; E522-Q524 PolarHBondContact O-N 3.15Å; Q524-V526 PolarHBondContact O-N 3.36Å
525	L	90.6	Very high	91.2	Very high	26 Å²	26	36.7 Å²	36.7	14%	0.136	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	124.6	169.1	-172	155.1	0	0	0	108.4	D478 A481 V482 L485 V518	D478-L525 HydrophobicContact CB-CD1 3.94Å; A481-L525 HydrophobicContact CB-CB 4.09Å; A481-L525 HydrophobicContact CB-CD1 4.11Å; V482-L525 HydrophobicContact CG2-CD1 3.94Å; V482-L525 HydrophobicContact CG2-CD2 4.21Å; L485-L525 HydrophobicContact CD2-CD2 4.02Å; V518-L525 HydrophobicContact CB-CD1 4Å; V518-L525 HydrophobicContact CB-CG 4.4Å; V518-L525 HydrophobicContact CG1-CD1 3.75Å
526	V	89	Confident	90.9	Very high	7 Å²	7	37.1 Å²	37.1	4%	0.042	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	-5.7	-177.4	-59.4	0	0	0	0	113.7	V519 V521 Q524 L568 K569 C572	V519-V526 HydrophobicContact CG1-CG2 4.05Å; V519-V526 HydrophobicContact CG2-CG2 4.32Å; V519-V526 PolarHBondContact O-N 3.22Å; V521-V526 HydrophobicContact CB-CG1 4.14Å; V521-V526 HydrophobicContact CB-CG2 4.11Å; V521-V526 HydrophobicContact CG2-CG2 3.65Å; Q524-V526 PolarHBondContact O-N 3.36Å; V526-L568 HydrophobicContact CG2-CD1 4.27Å; V526-K569 HydrophobicContact CB-CB 4.49Å; V526-K569 PolarHBondContact O-N 2.86Å; V526-C572 HydrophobicContact CB-CB 4.28Å; V526-C572 HydrophobicContact CG2-CB 3.99Å
527	G	91.9	Very high	90.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.1	159.1	176.9	0	0	0	0	0	114.2	V518 V519 L567	V518-G527 WeakPolarHBondContact CA-O 3.24Å; V519-G527 PolarHBondContact N-O 3.45Å; G527-L567 CarbonylContact C-O 3.6Å; G527-L567 WeakPolarHBondContact CA-O 3.27Å
528	V	94.5	Very high	90.2	Very high	1 Å²	1	40 Å²	40	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	139.1	175.2	61.6	0	0	0	0	110.3	V482 L485 V495 F517 V518 L567 W579	V482-V528 HydrophobicContact CG1-CG1 3.93Å; V482-V528 HydrophobicContact CG2-CB 4.13Å; V482-V528 HydrophobicContact CG2-CG1 4.28Å; V482-V528 HydrophobicContact CG2-CG2 4.33Å; L485-V528 HydrophobicContact CD2-CG1 4.45Å; V495-V528 HydrophobicContact CG1-CG1 4.31Å; F517-V528 CarbonylContact O-C 3.6Å; F517-V528 WeakPolarHBondContact O-CA 3.28Å; V518-V528 HydrophobicContact CG1-CB 4.43Å; V518-V528 HydrophobicContact CG1-CG2 4.22Å; V528-L567 HydrophobicContact CG1-CB 4.09Å; V528-L567 HydrophobicContact CG1-CD1 3.9Å; V528-L567 HydrophobicContact CG1-CG 4.3Å; V528-L567 PolarHBondContact N-O 2.89Å; V528-L567 PolarHBondContact O-N 3.04Å; V528-W579 VanDerWaalsContact C-CH2 3.42Å; V528-W579 VanDerWaalsContact C-CZ2 3.47Å; V528-W579 WeakPolarHBondContact O-CH2 3.22Å
529	T	94.8	Very high	90	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	136	175.3	-71.8	0	0	0	0	108.7	F517 I531 M563 H565 F566 W579	F517-T529 PolarHBondContact N-O 3.34Å; F517-T529 PolarHBondContact O-N 2.93Å; T529-I531 HydrophobicContact CG2-CG2 4Å; T529-M563 HydrophobicContact CG2-CG 4.35Å; T529-H565 VanDerWaalsContact CA-O 3.28Å; T529-H565 WeakPolarHBondContact CA-O 3.46Å; T529-F566 VanDerWaalsContact OG1-CD2 3.24Å; T529-F566 WeakPolarHBondContact OG1-CD2 3.24Å; T529-W579 WeakPolarHBondContact OG1-CH2 3.45Å; T529-W579 WeakPolarHBondContact OG1-CZ2 3.43Å
530	I	93.9	Very high	89.9	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	131	174.9	-54.7	177.7	0	0	0	108.1	D498 L499 L514 A516 L564 H565	D498-I530 HydrophobicContact CB-CD1 4.21Å; L499-I530 HydrophobicContact CB-CD1 4.09Å; L499-I530 HydrophobicContact CD1-CD1 4.37Å; L514-I530 HydrophobicContact CD2-CG2 4.37Å; A516-I530 HydrophobicContact CB-CG1 4.06Å; I530-L564 HydrophobicContact CG2-CD1 4.38Å; I530-L564 PolarHBondContact O-N 3.26Å; I530-H565 PolarHBondContact N-O 3.26Å; I530-H565 PolarHBondContact O-N 2.77Å
531	I	94.6	Very high	89.8	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.01	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	154	176.5	70.4	175.6	0	0	0	110.3	L514 Q515 F517 T529 A561 H562 V583 A587 L592	L514-I531 WeakPolarHBondContact CA-O 3.2Å; Q515-I531 HydrophobicContact CB-CD1 4.37Å; Q515-I531 HydrophobicContact CB-CG1 3.9Å; Q515-I531 PolarHBondContact N-O 3.14Å; Q515-I531 PolarHBondContact O-N 3.03Å; F517-I531 HydrophobicContact CE2-CD1 3.9Å; F517-I531 HydrophobicContact CE2-CG1 4.12Å; T529-I531 HydrophobicContact CG2-CG2 4Å; I531-A561 HydrophobicContact CD1-CB 4.15Å; I531-H562 CarbonylContact C-O 3.55Å; I531-H562 VanDerWaalsContact CA-O 3.25Å; I531-H562 WeakPolarHBondContact CA-O 3.42Å; I531-V583 HydrophobicContact CD1-CG1 4.36Å; I531-V583 HydrophobicContact CG2-CG1 4.34Å; I531-A587 HydrophobicContact CD1-CB 3.6Å; I531-L592 HydrophobicContact CB-CD1 4.27Å; I531-L592 HydrophobicContact CG2-CD1 3.74Å; I531-L592 HydrophobicContact CG2-CD2 4.33Å
532	R	92.9	Very high	89.8	Confident	52 Å²	52	42.4 Å²	42.4	20%	0.196	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	156.7	169.3	76.6	178.1	-176.3	-176.6	6.5	111.1	D508 D510 V512 P513 L514 A561 H562 L564	D508-R532 WeakPolarHBondContact OD2-CD 3.1Å; D508-R532 IonicContact OD2-CZ 3.37Å; D508-R532 IonicContact OD2-NE 3.73Å; D508-R532 IonicContact OD2-NH1 3.73Å; D508-R532 PolarHBondContact OD2-NH1 3.08Å; D510-R532 IonicContact OD2-NH1 2.68Å; V512-R532 HydrophobicContact CG1-CB 4.16Å; V512-R532 HydrophobicContact CG1-CG 4.38Å; P513-R532 VanDerWaalsContact O-CA 3.29Å; P513-R532 WeakPolarHBondContact O-CA 3.5Å; L514-R532 HydrophobicContact CD2-CB 3.71Å; R532-A561 CarbonylContact O-C 3.56Å; R532-A561 WeakPolarHBondContact O-CA 3.49Å; R532-A561 WeakPolarHBondContact O-CB 3.31Å; R532-H562 HydrophobicContact CG-CB 3.97Å; R532-H562 PolarHBondContact N-O 2.94Å; R532-H562 PolarHBondContact O-N 3.24Å; R532-L564 HydrophobicContact CB-CD1 4.17Å; R532-L564 HydrophobicContact CB-CG 4.49Å; R532-L564 HydrophobicContact CG-CD1 4.35Å; R532-L564 HydrophobicContact CG-CD2 4.43Å; R532-L564 HydrophobicContact CG-CG 4.27Å
533	D	92	Very high	90.2	Very high	29 Å²	29	39.2 Å²	39.2	16%	0.155	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	131.1	174.8	-78.6	-13.9	0	0	0	111.4	V512 P513 Q535 R589	V512-D533 HydrophobicContact CG1-CB 4.47Å; V512-D533 VanDerWaalsContact CG1-O 3.25Å; V512-D533 WeakPolarHBondContact CG1-O 3.38Å; P513-D533 PolarHBondContact O-N 2.67Å; P513-D533 VanDerWaalsContact O-N 3.15Å; D533-Q535 PolarHBondContact O-N 2.6Å; D533-Q535 PolarHBondContact O-NE2 3.36Å; D533-R589 IonicContact OD1-CZ 2.89Å; D533-R589 IonicContact OD1-NE 2.74Å; D533-R589 PolarHBondContact OD1-NE 3.03Å; D533-R589 IonicContact OD1-NH2 3.63Å; D533-R589 PolarHBondContact OD1-NH2 2.68Å; D533-R589 IonicContact OD2-CZ 3.42Å; D533-R589 IonicContact OD2-NH2 3.6Å; D533-R589 PolarHBondContact OD2-NH2 3.08Å
534	E	91.4	Very high	90.7	Very high	9 Å²	9	27.7 Å²	27.7	4%	0.042	13%	0.133	C	C	.	.			trans	-76.9	120.9	-174.3	-177.2	53.6	-82.4	0	0	110.7	D536 V537 L540 H560 Y593 R595	E534-D536 PolarHBondContact OE1-N 3.06Å; E534-V537 HydrophobicContact CB-CG2 4.14Å; E534-V537 HydrophobicContact CG-CG2 3.87Å; E534-V537 VanDerWaalsContact O-CG2 3.29Å; E534-V537 WeakPolarHBondContact O-CG2 3.34Å; E534-L540 HydrophobicContact CG-CD1 3.81Å; E534-L540 WeakPolarHBondContact OE2-CD1 3.33Å; E534-H560 HydrophobicContact CB-CB 4.09Å; E534-H560 PolarHBondContact N-O 2.77Å; E534-H560 VanDerWaalsContact N-O 3.09Å; E534-Y593 HydrophobicContact CB-CD2 4.42Å; E534-Y593 HydrophobicContact CG-CD2 4Å; E534-Y593 HydrophobicContact CG-CE2 4.21Å; E534-R595 IonicContact OE1-CZ 2.65Å; E534-R595 IonicContact OE1-NH2 3.95Å; E534-R595 PolarHBondContact OE1-NH2 2.99Å; E534-R595 IonicContact OE2-CZ 3.67Å; E534-R595 IonicContact OE2-NE 3.69Å; E534-R595 PolarHBondContact OE2-NE 3.43Å; E534-R595 IonicContact OE2-NH2 3.72Å; E534-R595 PolarHBondContact OE2-NH2 3.24Å
535	Q	88.8	Confident	90.9	Very high	115 Å²	115	23 Å²	23	54%	0.537	11%	0.112	S	C	.	.	S	Bend	trans	-92.5	-30.4	179.5	-54	-52.1	-63.8	0	0	111.6	V512 D533 V537	V512-Q535 HydrophobicContact CG1-CG 4.25Å; V512-Q535 HydrophobicContact CG2-CG 3.91Å; D533-Q535 PolarHBondContact O-N 2.6Å; D533-Q535 PolarHBondContact O-NE2 3.36Å; Q535-V537 PolarHBondContact O-N 3Å
536	D	88.3	Confident	90.9	Very high	44 Å²	44	21.8 Å²	21.8	24%	0.235	11%	0.105	C	C	.	.			trans	-88.4	24.6	-172	-62.1	-27.3	0	0	0	112.8	E534 E538 Y539 L540 R595 Q647	E534-D536 PolarHBondContact OE1-N 3.06Å; D536-E538 PolarHBondContact O-N 2.98Å; D536-E538 VanDerWaalsContact O-N 3.09Å; D536-Y539 WeakPolarHBondContact O-CB 3.43Å; D536-Y539 PolarHBondContact O-N 3.36Å; D536-L540 WeakPolarHBondContact O-CG 3.49Å; D536-L540 PolarHBondContact O-N 2.92Å; D536-R595 IonicContact OD2-CZ 2.76Å; D536-R595 IonicContact OD2-NH1 3.93Å; D536-R595 PolarHBondContact OD2-NH1 3Å; D536-R595 IonicContact OD2-NH2 3.93Å; D536-R595 PolarHBondContact OD2-NH2 3.28Å; D536-Q647 VanDerWaalsContact CG-NE2 3.27Å; D536-Q647 PolarHBondContact OD1-NE2 3.11Å; D536-Q647 PolarHBondContact OD2-NE2 3.42Å
537	V	89.2	Confident	90.8	Very high	4 Å²	4	23.8 Å²	23.8	2%	0.024	12%	0.116	C	C	.	.	H	α-helix	trans	-54.4	-37.5	-171.7	-172	0	0	0	0	112.2	E534 Q535 R541 F552 Y557 H560	E534-V537 HydrophobicContact CB-CG2 4.14Å; E534-V537 HydrophobicContact CG-CG2 3.87Å; E534-V537 VanDerWaalsContact O-CG2 3.29Å; E534-V537 WeakPolarHBondContact O-CG2 3.34Å; Q535-V537 PolarHBondContact O-N 3Å; V537-R541 WeakPolarHBondContact O-CB 3.37Å; V537-R541 PolarHBondContact O-N 3.39Å; V537-R541 VanDerWaalsContact O-N 3.08Å; V537-F552 HydrophobicContact CG1-CE2 3.52Å; V537-F552 HydrophobicContact CG1-CZ 3.62Å; V537-Y557 HydrophobicContact CB-CD1 3.95Å; V537-Y557 HydrophobicContact CB-CE1 4.33Å; V537-Y557 HydrophobicContact CG1-CD1 3.98Å; V537-Y557 HydrophobicContact CG1-CE1 4.24Å; V537-Y557 HydrophobicContact CG2-CD1 4.31Å; V537-H560 HydrophobicContact CG2-CB 4Å
538	E	87.3	Confident	90.6	Very high	57 Å²	57	27.8 Å²	27.8	27%	0.266	14%	0.144	S	C	.	.	H	α-helix	trans	-68.6	-43.8	178	-66.8	154.5	-162.2	0	0	112.1	D536 R541 A542 Y557 R642	D536-E538 PolarHBondContact O-N 2.98Å; D536-E538 VanDerWaalsContact O-N 3.09Å; E538-R541 PolarHBondContact O-N 3.37Å; E538-A542 WeakPolarHBondContact O-CB 3.36Å; E538-A542 PolarHBondContact O-N 3.35Å; E538-Y557 HydrophobicContact CG-CE1 4.11Å; E538-R642 VanDerWaalsContact CD-NH1 3.26Å; E538-R642 IonicContact OE1-NH1 2.7Å; E538-R642 PolarHBondContact OE1-NH1 3.48Å; E538-R642 WeakPolarHBondContact OE2-CD 3.45Å; E538-R642 IonicContact OE2-CZ 3.86Å; E538-R642 IonicContact OE2-NE 3.64Å; E538-R642 IonicContact OE2-NH1 2.73Å; E538-R642 PolarHBondContact OE2-NH1 2.95Å
539	Y	89.8	Confident	90.3	Very high	3 Å²	3	29.9 Å²	29.9	1%	0.012	15%	0.153	C	C	.	.	H	α-helix	trans	-62.5	-48.5	173.9	175.8	-92.5	0	0	0	111	D536 R541 A542 R543 R642 E645 Q647 F650	D536-Y539 WeakPolarHBondContact O-CB 3.43Å; D536-Y539 PolarHBondContact O-N 3.36Å; Y539-R541 VanDerWaalsContact C-N 3.32Å; Y539-R541 PolarHBondContact O-N 3.35Å; Y539-A542 PolarHBondContact O-N 2.86Å; Y539-R543 HydrophobicContact CD2-CG 4.33Å; Y539-R543 HydrophobicContact CE1-CG 4.47Å; Y539-R543 HydrophobicContact CE2-CG 4.13Å; Y539-R543 VanDerWaalsContact CE2-CZ 3.47Å; Y539-R543 WeakPolarHBondContact O-CB 3.33Å; Y539-R543 WeakPolarHBondContact O-CG 3.39Å; Y539-R543 PolarHBondContact O-N 3.41Å; Y539-R543 PolarHBondContact OH-NH1 2.88Å; Y539-R642 WeakPolarHBondContact CB-O 3.47Å; Y539-R642 WeakPolarHBondContact CD2-O 3.47Å; Y539-E645 WeakPolarHBondContact CE2-O 3.46Å; Y539-Q647 HydrophobicContact CE1-CB 4.38Å; Y539-Q647 HydrophobicContact CE1-CG 4.27Å; Y539-Q647 HydrophobicContact CE2-CB 4.34Å; Y539-Q647 HydrophobicContact CE2-CG 3.95Å; Y539-Q647 WeakPolarHBondContact OH-CB 3.25Å; Y539-F650 HydrophobicContact CE1-CE1 4.12Å; Y539-F650 AromaticContact CE1-CZ 3.91Å; Y539-F650 HydrophobicContact CE1-CZ 3.91Å
540	L	90.8	Very high	90	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.5	-43.2	179	-69.9	-175.1	0	0	0	111.7	E534 D536 R543 Y544 I546 Y593 F650 L652	E534-L540 HydrophobicContact CG-CD1 3.81Å; E534-L540 WeakPolarHBondContact OE2-CD1 3.33Å; D536-L540 WeakPolarHBondContact O-CG 3.49Å; D536-L540 PolarHBondContact O-N 2.92Å; L540-R543 PolarHBondContact O-N 2.68Å; L540-Y544 HydrophobicContact CD2-CD2 4.17Å; L540-Y544 HydrophobicContact CD2-CE2 4.17Å; L540-Y544 WeakPolarHBondContact O-CB 3.18Å; L540-Y544 PolarHBondContact O-N 2.82Å; L540-I546 HydrophobicContact CB-CD1 3.77Å; L540-I546 WeakPolarHBondContact O-CD1 3.41Å; L540-Y593 HydrophobicContact CD1-CD1 4.45Å; L540-Y593 HydrophobicContact CD1-CD2 3.68Å; L540-Y593 HydrophobicContact CD1-CE2 3.78Å; L540-Y593 HydrophobicContact CD1-CG 4.03Å; L540-F650 HydrophobicContact CD2-CE2 3.75Å; L540-F650 HydrophobicContact CD2-CZ 3.67Å; L540-L652 HydrophobicContact CD2-CD1 4.11Å; L540-L652 HydrophobicContact CD2-CD2 4.18Å
541	R	89.1	Confident	89.6	Confident	51 Å²	51	32.5 Å²	32.5	19%	0.192	17%	0.171	C	C	.	.	H	α-helix	trans	-69	-34.1	177.8	-169.6	-177.2	-176.9	-147.2	-9.8	113.2	V537 E538 Y539 D547 F552 R624	V537-R541 WeakPolarHBondContact O-CB 3.37Å; V537-R541 PolarHBondContact O-N 3.39Å; V537-R541 VanDerWaalsContact O-N 3.08Å; E538-R541 PolarHBondContact O-N 3.37Å; Y539-R541 VanDerWaalsContact C-N 3.32Å; Y539-R541 PolarHBondContact O-N 3.35Å; R541-D547 IonicContact CZ-OD1 2.83Å; R541-D547 IonicContact CZ-OD2 3.74Å; R541-D547 IonicContact NE-OD1 2.79Å; R541-D547 PolarHBondContact NE-OD1 3.13Å; R541-D547 IonicContact NE-OD2 3.04Å; R541-D547 IonicContact NH2-OD1 3.39Å; R541-D547 PolarHBondContact NH2-OD1 2.92Å; R541-D547 IonicContact NH2-OD2 3.36Å; R541-D547 PolarHBondContact NH2-OD2 3.39Å; R541-D547 VanDerWaalsContact NH2-OD2 3.12Å; R541-F552 HydrophobicContact CB-CE2 4.31Å; R541-F552 HydrophobicContact CG-CD2 4.24Å; R541-F552 HydrophobicContact CG-CE2 4.4Å; R541-F552 HydrophobicContact CG-CG 4.44Å; R541-R624 PolarHBondContact O-NE 3.15Å
542	A	87.5	Confident	89.1	Confident	26 Å²	26	33 Å²	33	22%	0.215	17%	0.173	C	C	.	.	H	α-helix	trans	-76	-29.8	177.3	0	0	0	0	0	113.1	E538 Y539 R624 Q626 I643	E538-A542 WeakPolarHBondContact O-CB 3.36Å; E538-A542 PolarHBondContact O-N 3.35Å; Y539-A542 PolarHBondContact O-N 2.86Å; A542-R624 WeakPolarHBondContact O-CD 3.3Å; A542-Q626 PolarHBondContact O-NE2 2.73Å; A542-I643 HydrophobicContact CB-CB 4.48Å; A542-I643 HydrophobicContact CB-CG1 4.18Å; A542-I643 HydrophobicContact CB-CG2 3.74Å
543	R	88.9	Confident	88.6	Confident	16 Å²	16	34 Å²	34	6%	0.06	20%	0.199	C	C	.	.	H	α-helix	trans	-103.1	-13.4	-176.8	-58.6	-143.2	-179.5	-178.5	-2	115.7	Y539 L540 P623 R624 I643 T644 E645 E646	Y539-R543 HydrophobicContact CD2-CG 4.33Å; Y539-R543 HydrophobicContact CE1-CG 4.47Å; Y539-R543 HydrophobicContact CE2-CG 4.13Å; Y539-R543 VanDerWaalsContact CE2-CZ 3.47Å; Y539-R543 WeakPolarHBondContact O-CB 3.33Å; Y539-R543 WeakPolarHBondContact O-CG 3.39Å; Y539-R543 PolarHBondContact O-N 3.41Å; Y539-R543 PolarHBondContact OH-NH1 2.88Å; L540-R543 PolarHBondContact O-N 2.68Å; R543-P623 CarbonylContact O-C 3.49Å; R543-P623 WeakPolarHBondContact O-CA 3.24Å; R543-R624 PolarHBondContact O-N 2.85Å; R543-I643 PolarHBondContact NE-O 2.94Å; R543-I643 PolarHBondContact NH2-O 2.93Å; R543-T644 PolarHBondContact NH2-O 3.17Å; R543-E645 PolarHBondContact NH1-O 3.44Å; R543-E645 PolarHBondContact NH2-O 3.37Å; R543-E646 IonicContact NH1-OE1 3.8Å
544	Y	92.1	Very high	88.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-134.6	151	178.4	-56.6	-85.6	0	0	0	112.6	L540 I546 R622 P623 R624 F650 L652	L540-Y544 HydrophobicContact CD2-CD2 4.17Å; L540-Y544 HydrophobicContact CD2-CE2 4.17Å; L540-Y544 WeakPolarHBondContact O-CB 3.18Å; L540-Y544 PolarHBondContact O-N 2.82Å; Y544-I546 PolarHBondContact O-N 3.1Å; Y544-R622 CarbonylContact C-O 3.18Å; Y544-R622 WeakPolarHBondContact CA-O 3.35Å; Y544-P623 HydrophobicContact CD1-CB 4.22Å; Y544-P623 HydrophobicContact CE1-CB 4.14Å; Y544-R624 PolarHBondContact O-NE 2.94Å; Y544-F650 HydrophobicContact CE2-CD2 4.38Å; Y544-F650 AromaticContact CE2-CE2 3.58Å; Y544-F650 HydrophobicContact CE2-CE2 3.58Å; Y544-F650 AromaticContact CE2-CZ 3.97Å; Y544-F650 HydrophobicContact CE2-CZ 3.97Å; Y544-F650 AromaticContact CZ-CE2 3.76Å; Y544-F650 PolarHBondContact OH-O 3.11Å; Y544-L652 HydrophobicContact CD1-CB 3.81Å; Y544-L652 HydrophobicContact CD1-CD2 4.32Å; Y544-L652 HydrophobicContact CD2-CB 4.2Å; Y544-L652 HydrophobicContact CD2-CD2 3.68Å; Y544-L652 HydrophobicContact CE1-CB 4Å; Y544-L652 HydrophobicContact CE2-CB 4.36Å; Y544-L652 HydrophobicContact CE2-CD2 4.47Å; Y544-L652 HydrophobicContact CG-CB 3.94Å; Y544-L652 HydrophobicContact CG-CD2 3.61Å; Y544-L652 HydrophobicContact CG-CG 4.42Å
545	D	91.5	Very high	88.1	Confident	40 Å²	40	37 Å²	37	21%	0.214	21%	0.209	C	C	.	.			trans	-79.1	53.4	-175.8	-164	31.6	0	0	0	114.3	D547 S548 V621 R622 R624	D545-D547 VanDerWaalsContact C-N 3.32Å; D545-D547 PolarHBondContact O-N 3.44Å; D545-S548 VanDerWaalsContact CG-OG 3.27Å; D545-S548 PolarHBondContact O-N 3.11Å; D545-S548 PolarHBondContact OD1-OG 3.06Å; D545-S548 VanDerWaalsContact OD2-CB 3.29Å; D545-S548 WeakPolarHBondContact OD2-CB 3.1Å; D545-S548 PolarHBondContact OD2-OG 3.16Å; D545-V621 VanDerWaalsContact C-CG1 3.44Å; D545-R622 PolarHBondContact N-O 2.89Å; D545-R624 IonicContact OD1-CZ 2.87Å; D545-R624 IonicContact OD1-NH1 2.82Å; D545-R624 PolarHBondContact OD1-NH1 3.29Å; D545-R624 IonicContact OD1-NH2 2.73Å; D545-R624 PolarHBondContact OD1-NH2 3.3Å
546	I	91	Very high	88	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-66.3	-35.1	-178.5	-62.2	172.4	0	0	0	111.4	L540 Y544 S548 F549 I550 Y593 V621 L652 L654	L540-I546 HydrophobicContact CB-CD1 3.77Å; L540-I546 WeakPolarHBondContact O-CD1 3.41Å; Y544-I546 PolarHBondContact O-N 3.1Å; I546-S548 PolarHBondContact O-N 2.9Å; I546-S548 VanDerWaalsContact O-N 3.11Å; I546-F549 PolarHBondContact O-N 3.32Å; I546-I550 HydrophobicContact CG2-CD1 3.55Å; I546-I550 HydrophobicContact CG2-CG1 3.52Å; I546-I550 PolarHBondContact O-N 3.36Å; I546-Y593 HydrophobicContact CD1-CE1 3.85Å; I546-Y593 HydrophobicContact CG1-CE1 4.44Å; I546-V621 HydrophobicContact CG1-CG1 4Å; I546-L652 HydrophobicContact CD1-CD2 3.8Å; I546-L652 HydrophobicContact CG1-CD2 4.07Å; I546-L654 HydrophobicContact CG2-CD2 4.39Å
547	D	87.5	Confident	87.9	Confident	50 Å²	50	37 Å²	37	27%	0.267	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-58.6	-21.4	177.8	-73.2	-8.1	0	0	0	112.7	R541 D545 F552 R624 R1158	R541-D547 IonicContact CZ-OD1 2.83Å; R541-D547 IonicContact CZ-OD2 3.74Å; R541-D547 IonicContact NE-OD1 2.79Å; R541-D547 PolarHBondContact NE-OD1 3.13Å; R541-D547 IonicContact NE-OD2 3.04Å; R541-D547 IonicContact NH2-OD1 3.39Å; R541-D547 PolarHBondContact NH2-OD1 2.92Å; R541-D547 IonicContact NH2-OD2 3.36Å; R541-D547 PolarHBondContact NH2-OD2 3.39Å; R541-D547 VanDerWaalsContact NH2-OD2 3.12Å; D545-D547 VanDerWaalsContact C-N 3.32Å; D545-D547 PolarHBondContact O-N 3.44Å; D547-F552 WeakPolarHBondContact OD1-CB 3.48Å; D547-R624 IonicContact OD2-NH2 3.72Å; D547-R1158 IonicContact OD2-NH1 3.38Å; D547-R1158 PolarHBondContact OD2-NH1 3.47Å
548	S	86.9	Confident	87.9	Confident	83 Å²	83	44.4 Å²	44.4	58%	0.58	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-79.4	-18.2	174.5	-74.5	0	0	0	0	114.1	D545 I546	D545-S548 VanDerWaalsContact CG-OG 3.27Å; D545-S548 PolarHBondContact O-N 3.11Å; D545-S548 PolarHBondContact OD1-OG 3.06Å; D545-S548 VanDerWaalsContact OD2-CB 3.29Å; D545-S548 WeakPolarHBondContact OD2-CB 3.1Å; D545-S548 PolarHBondContact OD2-OG 3.16Å; I546-S548 PolarHBondContact O-N 2.9Å; I546-S548 VanDerWaalsContact O-N 3.11Å
549	F	87.6	Confident	88	Confident	46 Å²	46	43.6 Å²	43.6	20%	0.202	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-31.5	-177.8	-66.3	-70.4	0	0	0	113.5	I546 V619 V621 L654 K658	I546-F549 PolarHBondContact O-N 3.32Å; F549-V619 HydrophobicContact CB-CG2 4.29Å; F549-V619 HydrophobicContact CD1-CB 4.07Å; F549-V619 HydrophobicContact CD1-CG1 4.34Å; F549-V619 HydrophobicContact CD1-CG2 3.57Å; F549-V619 HydrophobicContact CD2-CG2 4.23Å; F549-V619 HydrophobicContact CE1-CB 3.85Å; F549-V619 HydrophobicContact CE1-CG1 4.19Å; F549-V619 HydrophobicContact CE1-CG2 3.85Å; F549-V619 HydrophobicContact CE2-CG2 4.47Å; F549-V619 HydrophobicContact CG-CG2 3.76Å; F549-V619 HydrophobicContact CZ-CB 4.26Å; F549-V619 HydrophobicContact CZ-CG2 4.28Å; F549-V621 HydrophobicContact CD2-CG1 4.17Å; F549-V621 HydrophobicContact CD2-CG2 4.15Å; F549-V621 HydrophobicContact CE2-CB 4.38Å; F549-V621 HydrophobicContact CE2-CG1 4.14Å; F549-V621 HydrophobicContact CE2-CG2 4.25Å; F549-L654 HydrophobicContact CB-CD2 3.88Å; F549-K658 WeakPolarHBondContact O-CE 3.31Å; F549-K658 PolarHBondContact O-NZ 3.29Å
550	I	88.8	Confident	88.2	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.015	24%	0.242	C	C	.	.	S	Bend	trans	-135.2	145.4	177.6	55.5	170.7	0	0	0	111.3	E49 I546 F552 C591 L654	E49-I550 WeakPolarHBondContact OE1-CA 3.48Å; I546-I550 HydrophobicContact CG2-CD1 3.55Å; I546-I550 HydrophobicContact CG2-CG1 3.52Å; I546-I550 PolarHBondContact O-N 3.36Å; I550-F552 PolarHBondContact O-N 2.85Å; I550-C591 HydrophobicContact CD1-CB 4.43Å; I550-C591 WeakPolarHBondContact CD1-SG 3.41Å; I550-L654 HydrophobicContact CD1-CD2 4.23Å; I550-L654 HydrophobicContact CG1-CD2 4.17Å; I550-L654 HydrophobicContact CG2-CD2 4.05Å
551	S	86.4	Confident	88.3	Confident	53 Å²	53	43.5 Å²	43.5	37%	0.371	24%	0.242	S	C	.	.			trans	-74.2	72.5	172.8	-57	0	0	0	0	110.6	E49 G553 R554 H555	E49-S551 VanDerWaalsContact CD-N 3.26Å; E49-S551 PolarHBondContact OE1-N 3.25Å; E49-S551 WeakPolarHBondContact OE2-CB 3.28Å; E49-S551 PolarHBondContact OE2-N 3.49Å; E49-S551 PolarHBondContact OE2-OG 2.84Å; S551-G553 VanDerWaalsContact C-N 3.28Å; S551-G553 PolarHBondContact O-N 3.26Å; S551-R554 WeakPolarHBondContact O-CB 3.37Å; S551-R554 WeakPolarHBondContact O-CG 3.02Å; S551-R554 PolarHBondContact O-N 3.32Å; S551-H555 PolarHBondContact O-CD2 2.9Å
552	F	84	Confident	88.5	Confident	13 Å²	13	41.4 Å²	41.4	6%	0.057	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-36.6	-50.8	-168.3	-177.3	-88.5	0	0	0	115.1	V537 R541 D547 I550 R554 H555 Y557 H560	V537-F552 HydrophobicContact CG1-CE2 3.52Å; V537-F552 HydrophobicContact CG1-CZ 3.62Å; R541-F552 HydrophobicContact CB-CE2 4.31Å; R541-F552 HydrophobicContact CG-CD2 4.24Å; R541-F552 HydrophobicContact CG-CE2 4.4Å; R541-F552 HydrophobicContact CG-CG 4.44Å; D547-F552 WeakPolarHBondContact OD1-CB 3.48Å; I550-F552 PolarHBondContact O-N 2.85Å; F552-R554 PolarHBondContact O-N 3.37Å; F552-H555 PolarHBondContact O-N 3.43Å; F552-Y557 HydrophobicContact CZ-CE1 4.24Å; F552-H560 AromaticContact CE2-NE2 3.89Å
553	G	82.4	Confident	88.7	Confident	72 Å²	72	40.2 Å²	40.2	74%	0.742	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-65.5	8	178.5	0	0	0	0	0	116.7	S551	S551-G553 VanDerWaalsContact C-N 3.28Å; S551-G553 PolarHBondContact O-N 3.26Å
554	R	85.4	Confident	88.8	Confident	88 Å²	88	40.1 Å²	40.1	33%	0.332	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-102.7	-10.1	168.8	-57.4	-48.6	-174.5	156.6	-23.1	113.2	N43 D46 E49 K50 S551 F552	N43-R554 PolarHBondContact ND2-NH1 3.47Å; D46-R554 WeakPolarHBondContact OD1-CD 3.3Å; D46-R554 IonicContact OD1-CZ 3.07Å; D46-R554 IonicContact OD1-NE 2.72Å; D46-R554 PolarHBondContact OD1-NE 2.84Å; D46-R554 IonicContact OD1-NH1 3.39Å; D46-R554 PolarHBondContact OD1-NH1 2.85Å; D46-R554 IonicContact OD2-NH1 2.75Å; E49-R554 HydrophobicContact CG-CB 4.37Å; K50-R554 WeakPolarHBondContact CE-O 3.47Å; K50-R554 PolarHBondContact NZ-O 3.32Å; S551-R554 WeakPolarHBondContact O-CB 3.37Å; S551-R554 WeakPolarHBondContact O-CG 3.02Å; S551-R554 PolarHBondContact O-N 3.32Å; F552-R554 PolarHBondContact O-N 3.37Å
555	H	86.5	Confident	88.7	Confident	14 Å²	14	40.2 Å²	40.2	7%	0.065	23%	0.225	C	C	.	.	S	Bend	trans	-104.7	130.9	178.9	-53.1	-94.9	0	0	0	108.4	E49 S551 F552 E559 S590	E49-H555 VanDerWaalsContact CG-NE2 3.34Å; E49-H555 WeakPolarHBondContact CG-NE2 3.19Å; E49-H555 IonicContact OE1-NE2 3.68Å; S551-H555 PolarHBondContact O-CD2 2.9Å; F552-H555 PolarHBondContact O-N 3.43Å; H555-E559 IonicContact ND1-OE2 3.84Å; H555-S590 PolarHBondContact ND1-OG 3.05Å
556	G	86.8	Confident	88.8	Confident	33 Å²	33	38.3 Å²	38.3	34%	0.34	22%	0.215	S	C	.	.			trans	-72.2	152.1	168.7	0	0	0	0	0	110.9	Q558 E559 H560	G556-Q558 PolarHBondContact O-N 2.83Å; G556-Q558 VanDerWaalsContact O-N 3.14Å; G556-E559 PolarHBondContact N-OE1 2.7Å; G556-E559 WeakPolarHBondContact O-CB 3.37Å; G556-E559 PolarHBondContact O-N 2.79Å; G556-H560 PolarHBondContact O-CD2 2.96Å
557	Y	86.9	Confident	88.8	Confident	125 Å²	125	38.3 Å²	38.3	49%	0.49	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-51	-39.1	176.3	-70.4	-80.3	0	0	0	112.7	V537 E538 F552 E559 H560	V537-Y557 HydrophobicContact CB-CD1 3.95Å; V537-Y557 HydrophobicContact CB-CE1 4.33Å; V537-Y557 HydrophobicContact CG1-CD1 3.98Å; V537-Y557 HydrophobicContact CG1-CE1 4.24Å; V537-Y557 HydrophobicContact CG2-CD1 4.31Å; E538-Y557 HydrophobicContact CG-CE1 4.11Å; F552-Y557 HydrophobicContact CZ-CE1 4.24Å; Y557-E559 PolarHBondContact O-N 3.12Å; Y557-H560 PolarHBondContact O-N 3.3Å
558	Q	88.4	Confident	88.9	Confident	160 Å²	160	36 Å²	36	75%	0.748	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-69.3	-10.7	176.4	-66.8	174.9	-21.5	0	0	114.8	G556 H560 R589	G556-Q558 PolarHBondContact O-N 2.83Å; G556-Q558 VanDerWaalsContact O-N 3.14Å; Q558-H560 VanDerWaalsContact C-N 3.31Å; Q558-R589 WeakPolarHBondContact O-CD 3.25Å; Q558-R589 VanDerWaalsContact O-CZ 3.27Å; Q558-R589 PolarHBondContact O-NE 3.18Å; Q558-R589 PolarHBondContact O-NH1 2.87Å
559	E	89.9	Confident	88.9	Confident	39 Å²	39	34.2 Å²	34.2	18%	0.182	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-86.3	-3.8	175.9	-58.6	-178.7	-133.7	0	0	113.1	K50 H555 G556 Y557 R589 S590 C591	K50-E559 WeakPolarHBondContact CE-OE2 2.92Å; K50-E559 IonicContact NZ-OE1 3.43Å; K50-E559 PolarHBondContact NZ-OE1 3.23Å; K50-E559 IonicContact NZ-OE2 2.67Å; K50-E559 PolarHBondContact NZ-OE2 3.17Å; H555-E559 IonicContact ND1-OE2 3.84Å; G556-E559 PolarHBondContact N-OE1 2.7Å; G556-E559 WeakPolarHBondContact O-CB 3.37Å; G556-E559 PolarHBondContact O-N 2.79Å; Y557-E559 PolarHBondContact O-N 3.12Å; E559-R589 WeakPolarHBondContact O-CB 3.49Å; E559-S590 VanDerWaalsContact CB-OG 3.29Å; E559-S590 WeakPolarHBondContact CB-OG 3.49Å; E559-S590 PolarHBondContact O-N 2.84Å; E559-S590 VanDerWaalsContact OE2-CB 3.23Å; E559-S590 WeakPolarHBondContact OE2-CB 3.22Å; E559-S590 PolarHBondContact OE2-OG 3.17Å; E559-C591 PolarHBondContact O-N 2.88Å
560	H	92.9	Very high	88.6	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	127.7	179.1	-66.3	-81	0	0	0	111	E534 V537 F552 G556 Y557 Q558 C591 Y593	E534-H560 HydrophobicContact CB-CB 4.09Å; E534-H560 PolarHBondContact N-O 2.77Å; E534-H560 VanDerWaalsContact N-O 3.09Å; V537-H560 HydrophobicContact CG2-CB 4Å; F552-H560 AromaticContact CE2-NE2 3.89Å; G556-H560 PolarHBondContact O-CD2 2.96Å; Y557-H560 PolarHBondContact O-N 3.3Å; Q558-H560 VanDerWaalsContact C-N 3.31Å; H560-C591 WeakPolarHBondContact ND1-CB 3.36Å; H560-Y593 HydrophobicContact CB-CE2 3.99Å; H560-Y593 PolarHBondContact CE1-OH 3.12Å; H560-Y593 AromaticContact ND1-CE2 3.47Å; H560-Y593 WeakPolarHBondContact ND1-CE2 3.27Å; H560-Y593 AromaticContact ND1-CZ 3.58Å; H560-Y593 PolarHBondContact ND1-OH 3.21Å
561	A	94.1	Very high	88.1	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	157.1	175.3	0	0	0	0	0	111.5	I531 R532 R589 C591 L592 Y593	I531-A561 HydrophobicContact CD1-CB 4.15Å; R532-A561 CarbonylContact O-C 3.56Å; R532-A561 WeakPolarHBondContact O-CA 3.49Å; R532-A561 WeakPolarHBondContact O-CB 3.31Å; A561-R589 HydrophobicContact CB-CG 3.97Å; A561-C591 PolarHBondContact N-O 3.19Å; A561-L592 HydrophobicContact CB-CD1 3.89Å; A561-L592 WeakPolarHBondContact O-CA 3.49Å; A561-Y593 PolarHBondContact O-N 3.11Å
562	H	92.7	Very high	87.8	Confident	8 Å²	8	31 Å²	31	4%	0.037	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	130	172.9	178	-115.4	0	0	0	109.8	I531 R532 Y593 R595	I531-H562 CarbonylContact C-O 3.55Å; I531-H562 VanDerWaalsContact CA-O 3.25Å; I531-H562 WeakPolarHBondContact CA-O 3.42Å; R532-H562 HydrophobicContact CG-CB 3.97Å; R532-H562 PolarHBondContact N-O 2.94Å; R532-H562 PolarHBondContact O-N 3.24Å; H562-Y593 WeakPolarHBondContact CA-O 3.2Å; H562-R595 WeakPolarHBondContact NE2-CG 3.27Å
563	M	92.7	Very high	87.7	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	118	175	-167.2	-169.4	-73.7	0	0	109.3	T529 F566 L580 L592 Y593 F608 I614 I655	T529-M563 HydrophobicContact CG2-CG 4.35Å; M563-F566 HydrophobicContact CE-CD2 4.4Å; M563-F566 HydrophobicContact SD-CB 3.71Å; M563-F566 HydrophobicContact SD-CD2 4.26Å; M563-F566 HydrophobicContact SD-CG 4.32Å; M563-L580 HydrophobicContact CE-CD2 3.66Å; M563-L592 HydrophobicContact CB-CD1 3.95Å; M563-L592 HydrophobicContact CB-CG 4.22Å; M563-L592 HydrophobicContact CE-CD2 3.49Å; M563-L592 VanDerWaalsContact CE-CD2 3.49Å; M563-L592 HydrophobicContact CE-CG 4.08Å; M563-Y593 PolarHBondContact N-O 3.07Å; M563-F608 HydrophobicContact CB-CE1 4.41Å; M563-F608 HydrophobicContact CG-CE1 3.95Å; M563-F608 WeakPolarHBondContact O-CZ 3.49Å; M563-F608 HydrophobicContact SD-CD1 4.18Å; M563-F608 HydrophobicContact SD-CE1 3.82Å; M563-I614 HydrophobicContact SD-CD1 4.01Å; M563-I655 HydrophobicContact CE-CD1 3.84Å
564	L	89.8	Confident	87.6	Confident	14 Å²	14	29.6 Å²	29.6	7%	0.073	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-44.5	176.3	-69.1	174.9	0	0	0	111.6	L514 I530 R532 S606 C607 F608	L514-L564 HydrophobicContact CD2-CD1 3.64Å; I530-L564 HydrophobicContact CG2-CD1 4.38Å; I530-L564 PolarHBondContact O-N 3.26Å; R532-L564 HydrophobicContact CB-CD1 4.17Å; R532-L564 HydrophobicContact CB-CG 4.49Å; R532-L564 HydrophobicContact CG-CD1 4.35Å; R532-L564 HydrophobicContact CG-CD2 4.43Å; R532-L564 HydrophobicContact CG-CG 4.27Å; L564-S606 VanDerWaalsContact O-CA 3.25Å; L564-S606 WeakPolarHBondContact O-CA 3.3Å; L564-S606 WeakPolarHBondContact O-CB 3.46Å; L564-C607 PolarHBondContact O-N 2.86Å; L564-F608 WeakPolarHBondContact O-CZ 3.31Å
565	H	91.4	Very high	87.6	Confident	3 Å²	3	25.5 Å²	25.5	1%	0.014	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	148.5	-178.5	-46.2	-88.7	0	0	0	111.4	S494 V495 D498 T529 I530 T605 C607	S494-H565 PolarHBondContact OG-CE1 3.05Å; V495-H565 HydrophobicContact CG2-CB 3.88Å; V495-H565 WeakPolarHBondContact CG2-ND1 3.26Å; D498-H565 IonicContact OD2-CE1 3.79Å; D498-H565 PolarHBondContact OD2-CE1 2.69Å; D498-H565 IonicContact OD2-NE2 3.36Å; D498-H565 PolarHBondContact OD2-NE2 2.81Å; T529-H565 VanDerWaalsContact CA-O 3.28Å; T529-H565 WeakPolarHBondContact CA-O 3.46Å; I530-H565 PolarHBondContact N-O 3.26Å; I530-H565 PolarHBondContact O-N 2.77Å; H565-T605 PolarHBondContact CE1-O 2.93Å; H565-T605 VanDerWaalsContact CE1-O 3.3Å; H565-C607 CarbonylContact C-O 3.53Å; H565-C607 VanDerWaalsContact CA-O 3.3Å; H565-C607 WeakPolarHBondContact CA-O 3.34Å; H565-C607 PolarHBondContact ND1-N 3.27Å
566	F	92.1	Very high	87.7	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	117.1	173.7	175.8	-80.5	0	0	0	108.8	T529 M563 L568 T576 W579 L580 C607 F608 H609 F613 I614	T529-F566 VanDerWaalsContact OG1-CD2 3.24Å; T529-F566 WeakPolarHBondContact OG1-CD2 3.24Å; M563-F566 HydrophobicContact CE-CD2 4.4Å; M563-F566 HydrophobicContact SD-CB 3.71Å; M563-F566 HydrophobicContact SD-CD2 4.26Å; M563-F566 HydrophobicContact SD-CG 4.32Å; F566-L568 HydrophobicContact CE1-CB 4.03Å; F566-L568 HydrophobicContact CZ-CB 4.33Å; F566-L568 HydrophobicContact CZ-CD2 4.3Å; F566-T576 HydrophobicContact CE2-CG2 4.38Å; F566-T576 HydrophobicContact CZ-CG2 3.85Å; F566-W579 HydrophobicContact CD2-CE3 4.16Å; F566-W579 HydrophobicContact CD2-CH2 4.25Å; F566-W579 AromaticContact CD2-CZ3 3.71Å; F566-W579 HydrophobicContact CD2-CZ3 3.71Å; F566-W579 HydrophobicContact CE1-CZ3 4.17Å; F566-W579 HydrophobicContact CE2-CD2 4.35Å; F566-W579 AromaticContact CE2-CE3 3.38Å; F566-W579 HydrophobicContact CE2-CE3 3.38Å; F566-W579 HydrophobicContact CE2-CH2 4.23Å; F566-W579 AromaticContact CE2-CZ3 3.28Å; F566-W579 HydrophobicContact CE2-CZ3 3.28Å; F566-W579 HydrophobicContact CG-CZ3 4.31Å; F566-W579 AromaticContact CZ-CE3 3.72Å; F566-W579 HydrophobicContact CZ-CE3 3.72Å; F566-W579 AromaticContact CZ-CZ3 3.53Å; F566-W579 HydrophobicContact CZ-CZ3 3.53Å; F566-L580 HydrophobicContact CD2-CD2 4.3Å; F566-L580 HydrophobicContact CE2-CD2 3.99Å; F566-L580 HydrophobicContact CE2-CG 4.38Å; F566-C607 PolarHBondContact N-O 2.92Å; F566-F608 HydrophobicContact CB-CD1 4.03Å; F566-F608 WeakPolarHBondContact O-CA 3.39Å; F566-H609 PolarHBondContact O-N 2.81Å; F566-F613 HydrophobicContact CE1-CB 4.23Å; F566-I614 HydrophobicContact CB-CD1 3.84Å; F566-I614 HydrophobicContact CD1-CD1 3.82Å; F566-I614 HydrophobicContact CD1-CG1 3.76Å; F566-I614 HydrophobicContact CD2-CG1 4.39Å; F566-I614 HydrophobicContact CE1-CG1 4Å; F566-I614 HydrophobicContact CG-CD1 3.85Å; F566-I614 HydrophobicContact CG-CG1 4Å; F566-I614 HydrophobicContact CZ-CG1 4.42Å
567	L	91.8	Very high	87.8	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	129.2	177.3	-60.7	178.3	0	0	0	109.4	L485 L486 L491 V495 G527 V528 W579 H609	L485-L567 HydrophobicContact CD2-CB 4.17Å; L486-L567 HydrophobicContact CD2-CD1 3.52Å; L486-L567 HydrophobicContact CG-CD1 4.15Å; L491-L567 HydrophobicContact CD1-CD2 3.61Å; V495-L567 HydrophobicContact CG1-CD1 4.11Å; V495-L567 HydrophobicContact CG2-CD1 4.25Å; G527-L567 CarbonylContact C-O 3.6Å; G527-L567 WeakPolarHBondContact CA-O 3.27Å; V528-L567 HydrophobicContact CG1-CB 4.09Å; V528-L567 HydrophobicContact CG1-CD1 3.9Å; V528-L567 HydrophobicContact CG1-CG 4.3Å; V528-L567 PolarHBondContact N-O 2.89Å; V528-L567 PolarHBondContact O-N 3.04Å; L567-W579 VanDerWaalsContact O-CH2 3.28Å; L567-W579 WeakPolarHBondContact O-CH2 3.21Å; L567-H609 WeakPolarHBondContact CA-O 3.38Å; L567-H609 HydrophobicContact CD2-CB 3.84Å
568	L	89.6	Confident	87.8	Confident	0 Å²	0	22 Å²	22	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	133.5	175.7	-169	61	0	0	0	111.1	V519 V526 F566 C572 T576 W579 H609 P610 F613	V519-L568 HydrophobicContact CG1-CD1 3.87Å; V526-L568 HydrophobicContact CG2-CD1 4.27Å; F566-L568 HydrophobicContact CE1-CB 4.03Å; F566-L568 HydrophobicContact CZ-CB 4.33Å; F566-L568 HydrophobicContact CZ-CD2 4.3Å; L568-C572 HydrophobicContact CD1-CB 4.11Å; L568-C572 HydrophobicContact CG-CB 4.39Å; L568-T576 VanDerWaalsContact CD2-OG1 3.25Å; L568-T576 WeakPolarHBondContact CD2-OG1 3.4Å; L568-W579 HydrophobicContact CB-CZ3 4.06Å; L568-W579 HydrophobicContact CD1-CE3 4.19Å; L568-W579 HydrophobicContact CD1-CZ3 3.98Å; L568-W579 HydrophobicContact CD2-CE3 4.36Å; L568-W579 HydrophobicContact CD2-CZ3 4.44Å; L568-W579 HydrophobicContact CG-CZ3 4.39Å; L568-H609 PolarHBondContact N-O 3.22Å; L568-P610 WeakPolarHBondContact O-CD 3.24Å; L568-F613 HydrophobicContact CB-CD2 4.31Å; L568-F613 HydrophobicContact CD2-CD2 3.99Å; L568-F613 HydrophobicContact CD2-CE2 4.38Å
569	K	86.8	Confident	88	Confident	46 Å²	46	14.4 Å²	14.4	20%	0.2	7%	0.067	C	C	.	.			trans	-60.1	130.5	171.6	-70.2	-158.1	169.1	-149	0	110.4	D264 L485 V526 C571 C572	D264-K569 IonicContact OD2-NZ 2.95Å; D264-K569 PolarHBondContact OD2-NZ 3.47Å; L485-K569 HydrophobicContact CD1-CD 4.19Å; L485-K569 HydrophobicContact CD1-CG 3.5Å; L485-K569 VanDerWaalsContact CD1-CG 3.5Å; V526-K569 HydrophobicContact CB-CB 4.49Å; V526-K569 PolarHBondContact O-N 2.86Å; K569-C571 PolarHBondContact O-N 3.03Å; K569-C571 VanDerWaalsContact O-N 3.11Å; K569-C572 WeakPolarHBondContact O-CA 3.47Å; K569-C572 WeakPolarHBondContact O-CB 3.4Å; K569-C572 PolarHBondContact O-N 3.5Å
570	P	81.8	Confident	88.1	Confident	8 Å²	8	12.6 Å²	12.6	5%	0.052	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-56.7	-30.4	-175	-31.7	38.7	0	0	0	115.6	E262 F263 C572 Y573 P610 F613	E262-P570 HydrophobicContact CB-CG 4.23Å; E262-P570 WeakPolarHBondContact O-CG 3.35Å; F263-P570 HydrophobicContact CE1-CB 4.31Å; P570-C572 PolarHBondContact O-N 2.84Å; P570-Y573 PolarHBondContact O-N 2.86Å; P570-P610 HydrophobicContact CG-CG 4.18Å; P570-F613 HydrophobicContact CB-CZ 4.36Å
571	C	77.4	Confident	88.1	Confident	22 Å²	22	12.9 Å²	12.9	15%	0.149	6%	0.06	C	C	.	.	G	3₁₀ helix	trans	-63.7	-21.9	173.5	57.9	0	0	0	0	113.9	H461 K569 H574	H461-C571 HydrophobicContact CB-CB 4.27Å; K569-C571 PolarHBondContact O-N 3.03Å; K569-C571 VanDerWaalsContact O-N 3.11Å; C571-H574 PolarHBondContact O-ND1 2.93Å
572	C	81.6	Confident	87.9	Confident	4 Å²	4	13 Å²	13	3%	0.027	6%	0.06	C	C	.	.	G	3₁₀ helix	trans	-101.2	7.5	-177.8	-70.7	0	0	0	0	114.3	V526 L568 K569 P570 H574 V575	V526-C572 HydrophobicContact CB-CB 4.28Å; V526-C572 HydrophobicContact CG2-CB 3.99Å; L568-C572 HydrophobicContact CD1-CB 4.11Å; L568-C572 HydrophobicContact CG-CB 4.39Å; K569-C572 WeakPolarHBondContact O-CA 3.47Å; K569-C572 WeakPolarHBondContact O-CB 3.4Å; K569-C572 PolarHBondContact O-N 3.5Å; P570-C572 PolarHBondContact O-N 2.84Å; C572-H574 PolarHBondContact O-N 3.26Å; C572-V575 WeakPolarHBondContact O-CB 3.27Å; C572-V575 WeakPolarHBondContact O-CG2 3.47Å; C572-V575 PolarHBondContact O-N 3.11Å
573	Y	81.3	Confident	88	Confident	23 Å²	23	12.7 Å²	12.7	9%	0.09	6%	0.059	C	C	.	.	G	3₁₀ helix	trans	-43.4	-35.7	178.6	80.3	-71.2	0	0	0	114.8	N441 F442 V443 T460 P570 V575 T576	N441-Y573 PolarHBondContact O-OH 3.22Å; F442-Y573 WeakPolarHBondContact CA-OH 3.48Å; F442-Y573 PolarHBondContact N-OH 3.34Å; F442-Y573 VanDerWaalsContact N-OH 3.13Å; V443-Y573 HydrophobicContact CB-CD1 4.5Å; V443-Y573 HydrophobicContact CG2-CD1 3.13Å; V443-Y573 HydrophobicContact CG2-CD2 3.97Å; V443-Y573 HydrophobicContact CG2-CE1 3.52Å; V443-Y573 HydrophobicContact CG2-CE2 4.29Å; V443-Y573 HydrophobicContact CG2-CG 3.41Å; V443-Y573 VanDerWaalsContact CG2-CG 3.41Å; T460-Y573 PolarHBondContact OG1-OH 2.81Å; P570-Y573 PolarHBondContact O-N 2.86Å; Y573-V575 PolarHBondContact O-N 3.23Å; Y573-T576 VanDerWaalsContact O-CB 3.22Å; Y573-T576 WeakPolarHBondContact O-CB 3.35Å; Y573-T576 PolarHBondContact O-N 3.39Å; Y573-T576 PolarHBondContact O-OG1 3.22Å
574	H	79.9	Confident	87.9	Confident	33 Å²	33	12.8 Å²	12.8	15%	0.153	6%	0.059	C	C	.	.	G	3₁₀ helix	trans	-61.3	-25.3	-177.5	59.5	-90.1	0	0	0	112.6	R464 C571 C572 T576	R464-H574 VanDerWaalsContact CD-CG 3.42Å; C571-H574 PolarHBondContact O-ND1 2.93Å; C572-H574 PolarHBondContact O-N 3.26Å; H574-T576 VanDerWaalsContact C-N 3.28Å; H574-T576 PolarHBondContact O-N 2.91Å
575	V	85.7	Confident	88	Confident	3 Å²	3	12.9 Å²	12.9	2%	0.018	6%	0.059	C	C	.	.	G	3₁₀ helix	trans	-72.8	-20.9	176.9	-175.7	0	0	0	0	111.8	V469 V519 V521 C572 Y573 R577 H578 W579	V469-V575 HydrophobicContact CG1-CG1 3.53Å; V469-V575 HydrophobicContact CG1-CG2 4.21Å; V469-V575 HydrophobicContact CG2-CG2 4.12Å; V519-V575 HydrophobicContact CG2-CG1 3.68Å; V521-V575 HydrophobicContact CG2-CG2 4.23Å; C572-V575 WeakPolarHBondContact O-CB 3.27Å; C572-V575 WeakPolarHBondContact O-CG2 3.47Å; C572-V575 PolarHBondContact O-N 3.11Å; Y573-V575 PolarHBondContact O-N 3.23Å; V575-R577 PolarHBondContact O-N 3.35Å; V575-H578 CarbonylContact O-C 3.58Å; V575-H578 PolarHBondContact O-N 2.81Å; V575-W579 HydrophobicContact CG1-CB 4.22Å; V575-W579 PolarHBondContact O-N 3.05Å
576	T	88.8	Confident	87.9	Confident	6 Å²	6	13.8 Å²	13.8	4%	0.037	6%	0.064	C	C	.	.	H	α-helix	trans	-50.5	-47.6	-170.8	-55.5	0	0	0	0	114.3	F566 L568 Y573 H574 W579 L580 F613	F566-T576 HydrophobicContact CE2-CG2 4.38Å; F566-T576 HydrophobicContact CZ-CG2 3.85Å; L568-T576 VanDerWaalsContact CD2-OG1 3.25Å; L568-T576 WeakPolarHBondContact CD2-OG1 3.4Å; Y573-T576 VanDerWaalsContact O-CB 3.22Å; Y573-T576 WeakPolarHBondContact O-CB 3.35Å; Y573-T576 PolarHBondContact O-N 3.39Å; Y573-T576 PolarHBondContact O-OG1 3.22Å; H574-T576 VanDerWaalsContact C-N 3.28Å; H574-T576 PolarHBondContact O-N 2.91Å; T576-W579 PolarHBondContact O-N 3.22Å; T576-L580 HydrophobicContact CG2-CD1 3.72Å; T576-L580 HydrophobicContact CG2-CG 4.26Å; T576-L580 WeakPolarHBondContact O-CB 3.35Å; T576-L580 WeakPolarHBondContact O-CG 3.49Å; T576-L580 PolarHBondContact O-N 3.16Å; T576-F613 HydrophobicContact CG2-CB 4.12Å
577	R	87.9	Confident	87.8	Confident	70 Å²	70	13.9 Å²	13.9	26%	0.264	7%	0.065	S	C	.	.	H	α-helix	trans	-63.2	-44.5	179.7	-76.2	-173.3	-173.2	157.2	8	111.8	V575 K581 T660	V575-R577 PolarHBondContact O-N 3.35Å; R577-K581 WeakPolarHBondContact O-CB 3.3Å; R577-K581 PolarHBondContact O-N 3.16Å; R577-K581 VanDerWaalsContact O-N 3.09Å; R577-T660 WeakPolarHBondContact CD-O 3.5Å
578	H	88.4	Confident	87.6	Confident	22 Å²	22	18.9 Å²	18.9	10%	0.102	9%	0.088	C	C	.	.	H	α-helix	trans	-65.1	-44.2	175.8	171.5	54.2	0	0	0	111.2	L103 V575 K581 E582	L103-H578 HydrophobicContact CD1-CB 3.85Å; L103-H578 PolarHBondContact N-CE1 2.85Å; V575-H578 CarbonylContact O-C 3.58Å; V575-H578 PolarHBondContact O-N 2.81Å; H578-K581 WeakPolarHBondContact O-CB 3.4Å; H578-K581 PolarHBondContact O-N 2.96Å; H578-E582 WeakPolarHBondContact CE1-CG 3.43Å; H578-E582 IonicContact CE1-OE1 3.92Å; H578-E582 IonicContact ND1-OE1 3.39Å; H578-E582 WeakPolarHBondContact O-CG 3.31Å; H578-E582 PolarHBondContact O-N 2.93Å
579	W	91.6	Very high	87.7	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.9	-47.9	179.4	-171.6	25	0	0	0	112.5	V519 V528 T529 F566 L567 L568 V575 T576 K581 E582 V583	V519-W579 HydrophobicContact CB-CD2 4.07Å; V519-W579 HydrophobicContact CB-CG 4.18Å; V519-W579 HydrophobicContact CB-CZ2 4.3Å; V519-W579 HydrophobicContact CG1-CD2 3.77Å; V519-W579 HydrophobicContact CG1-CE3 4.02Å; V519-W579 HydrophobicContact CG1-CG 4.37Å; V519-W579 HydrophobicContact CG1-CH2 3.94Å; V519-W579 HydrophobicContact CG1-CZ2 3.67Å; V519-W579 HydrophobicContact CG1-CZ3 4.12Å; V528-W579 VanDerWaalsContact C-CH2 3.42Å; V528-W579 VanDerWaalsContact C-CZ2 3.47Å; V528-W579 WeakPolarHBondContact O-CH2 3.22Å; T529-W579 WeakPolarHBondContact OG1-CH2 3.45Å; T529-W579 WeakPolarHBondContact OG1-CZ2 3.43Å; F566-W579 HydrophobicContact CD2-CE3 4.16Å; F566-W579 HydrophobicContact CD2-CH2 4.25Å; F566-W579 AromaticContact CD2-CZ3 3.71Å; F566-W579 HydrophobicContact CD2-CZ3 3.71Å; F566-W579 HydrophobicContact CE1-CZ3 4.17Å; F566-W579 HydrophobicContact CE2-CD2 4.35Å; F566-W579 AromaticContact CE2-CE3 3.38Å; F566-W579 HydrophobicContact CE2-CE3 3.38Å; F566-W579 HydrophobicContact CE2-CH2 4.23Å; F566-W579 AromaticContact CE2-CZ3 3.28Å; F566-W579 HydrophobicContact CE2-CZ3 3.28Å; F566-W579 HydrophobicContact CG-CZ3 4.31Å; F566-W579 AromaticContact CZ-CE3 3.72Å; F566-W579 HydrophobicContact CZ-CE3 3.72Å; F566-W579 AromaticContact CZ-CZ3 3.53Å; F566-W579 HydrophobicContact CZ-CZ3 3.53Å; L567-W579 VanDerWaalsContact O-CH2 3.28Å; L567-W579 WeakPolarHBondContact O-CH2 3.21Å; L568-W579 HydrophobicContact CB-CZ3 4.06Å; L568-W579 HydrophobicContact CD1-CE3 4.19Å; L568-W579 HydrophobicContact CD1-CZ3 3.98Å; L568-W579 HydrophobicContact CD2-CE3 4.36Å; L568-W579 HydrophobicContact CD2-CZ3 4.44Å; L568-W579 HydrophobicContact CG-CZ3 4.39Å; V575-W579 HydrophobicContact CG1-CB 4.22Å; V575-W579 PolarHBondContact O-N 3.05Å; T576-W579 PolarHBondContact O-N 3.22Å; W579-K581 VanDerWaalsContact C-N 3.27Å; W579-K581 PolarHBondContact O-N 2.91Å; W579-E582 PolarHBondContact O-N 3.15Å; W579-V583 WeakPolarHBondContact O-CB 3.41Å; W579-V583 VanDerWaalsContact O-CG2 3.3Å; W579-V583 WeakPolarHBondContact O-CG2 3.4Å; W579-V583 PolarHBondContact O-N 3.43Å
580	L	92.8	Very high	87.9	Confident	1 Å²	1	18.5 Å²	18.5	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-64.6	-32.3	176.5	-67.6	171.2	0	0	0	112.2	M563 F566 T576 L584 C617 I655	M563-L580 HydrophobicContact CE-CD2 3.66Å; F566-L580 HydrophobicContact CD2-CD2 4.3Å; F566-L580 HydrophobicContact CE2-CD2 3.99Å; F566-L580 HydrophobicContact CE2-CG 4.38Å; T576-L580 HydrophobicContact CG2-CD1 3.72Å; T576-L580 HydrophobicContact CG2-CG 4.26Å; T576-L580 WeakPolarHBondContact O-CB 3.35Å; T576-L580 WeakPolarHBondContact O-CG 3.49Å; T576-L580 PolarHBondContact O-N 3.16Å; L580-L584 WeakPolarHBondContact O-CG 3.46Å; L580-L584 PolarHBondContact O-N 3.43Å; L580-L584 VanDerWaalsContact O-N 3.15Å; L580-C617 HydrophobicContact CD1-CB 3.62Å; L580-I655 HydrophobicContact CD1-CD1 4.04Å; L580-I655 HydrophobicContact CD2-CD1 4.09Å
581	K	91.6	Very high	88.4	Confident	8 Å²	8	18.1 Å²	18.1	4%	0.035	8%	0.083	C	C	.	.	H	α-helix	trans	-64.9	-49.7	171.4	-166.8	-161.1	73.9	163.6	0	111.3	D72 P102 R577 H578 W579 L584 R585 T660	D72-K581 HydrophobicContact CB-CD 3.87Å; D72-K581 HydrophobicContact CB-CG 4.43Å; D72-K581 WeakPolarHBondContact OD2-CD 3.39Å; D72-K581 WeakPolarHBondContact OD2-CG 3.49Å; P102-K581 PolarHBondContact O-NZ 3.49Å; R577-K581 WeakPolarHBondContact O-CB 3.3Å; R577-K581 PolarHBondContact O-N 3.16Å; R577-K581 VanDerWaalsContact O-N 3.09Å; H578-K581 WeakPolarHBondContact O-CB 3.4Å; H578-K581 PolarHBondContact O-N 2.96Å; W579-K581 VanDerWaalsContact C-N 3.27Å; W579-K581 PolarHBondContact O-N 2.91Å; K581-L584 PolarHBondContact O-N 3.08Å; K581-R585 PolarHBondContact O-N 3.39Å; K581-T660 HydrophobicContact CB-CG2 4.31Å
582	E	91.1	Very high	89.2	Confident	3 Å²	3	17.1 Å²	17.1	1%	0.014	8%	0.076	C	C	.	.	H	α-helix	trans	-67.5	-34.9	179.2	-67.1	-51.8	118.3	0	0	113	P102 V471 H578 W579 R585 L586	P102-E582 HydrophobicContact CB-CG 4.45Å; P102-E582 VanDerWaalsContact CB-OE1 3.27Å; P102-E582 WeakPolarHBondContact CB-OE1 3.48Å; P102-E582 VanDerWaalsContact CB-OE2 3.28Å; P102-E582 WeakPolarHBondContact CB-OE2 3.24Å; V471-E582 HydrophobicContact CB-CB 3.91Å; V471-E582 HydrophobicContact CB-CG 4.27Å; V471-E582 HydrophobicContact CG1-CB 3.72Å; V471-E582 HydrophobicContact CG2-CB 4.23Å; V471-E582 HydrophobicContact CG2-CG 4.35Å; H578-E582 WeakPolarHBondContact CE1-CG 3.43Å; H578-E582 IonicContact CE1-OE1 3.92Å; H578-E582 IonicContact ND1-OE1 3.39Å; H578-E582 WeakPolarHBondContact O-CG 3.31Å; H578-E582 PolarHBondContact O-N 2.93Å; W579-E582 PolarHBondContact O-N 3.15Å; E582-R585 PolarHBondContact O-N 3.27Å; E582-R585 IonicContact OE1-NE 2.66Å; E582-R585 IonicContact OE2-CZ 3.41Å; E582-R585 IonicContact OE2-NE 3.29Å; E582-R585 PolarHBondContact OE2-NE 3.42Å; E582-R585 IonicContact OE2-NH2 3.92Å; E582-R585 PolarHBondContact OE2-NH2 3.18Å; E582-L586 WeakPolarHBondContact O-CB 3.37Å; E582-L586 WeakPolarHBondContact O-CG 3.43Å; E582-L586 PolarHBondContact O-N 3.39Å
583	V	93.1	Very high	89.9	Confident	1 Å²	1	16.9 Å²	16.9	1%	0.006	8%	0.075	C	C	.	.	H	α-helix	trans	-62.2	-44.8	172.1	167.8	0	0	0	0	110.5	F517 I531 W579 R585 A587 L592	F517-V583 HydrophobicContact CB-CG2 3.96Å; F517-V583 HydrophobicContact CD1-CG2 4.5Å; F517-V583 HydrophobicContact CD2-CG1 4.02Å; F517-V583 HydrophobicContact CD2-CG2 4.14Å; F517-V583 HydrophobicContact CE2-CG1 4.13Å; F517-V583 HydrophobicContact CG-CG2 3.94Å; I531-V583 HydrophobicContact CD1-CG1 4.36Å; I531-V583 HydrophobicContact CG2-CG1 4.34Å; W579-V583 WeakPolarHBondContact O-CB 3.41Å; W579-V583 VanDerWaalsContact O-CG2 3.3Å; W579-V583 WeakPolarHBondContact O-CG2 3.4Å; W579-V583 PolarHBondContact O-N 3.43Å; V583-R585 VanDerWaalsContact C-N 3.34Å; V583-R585 PolarHBondContact O-N 3.03Å; V583-A587 WeakPolarHBondContact O-CB 3.48Å; V583-A587 PolarHBondContact O-N 3.47Å; V583-L592 HydrophobicContact CG1-CD2 4.42Å
584	L	92.3	Very high	90.3	Very high	2 Å²	2	16 Å²	16	1%	0.01	7%	0.071	C	C	.	.	H	α-helix	trans	-62.8	-39.4	173.5	-75	171.7	0	0	0	112.2	L580 K581 Q588 R589 L592 I655 R657 T660	L580-L584 WeakPolarHBondContact O-CG 3.46Å; L580-L584 PolarHBondContact O-N 3.43Å; L580-L584 VanDerWaalsContact O-N 3.15Å; K581-L584 PolarHBondContact O-N 3.08Å; L584-Q588 PolarHBondContact O-N 3.15Å; L584-R589 HydrophobicContact CD2-CB 4.11Å; L584-R589 PolarHBondContact O-N 2.9Å; L584-L592 HydrophobicContact CD2-CB 3.98Å; L584-I655 HydrophobicContact CD1-CG2 4.34Å; L584-R657 HydrophobicContact CB-CG 4.34Å; L584-R657 HydrophobicContact CD1-CG 4.06Å; L584-T660 HydrophobicContact CD1-CG2 3.93Å
585	R	90.3	Very high	90.8	Very high	15 Å²	15	14.5 Å²	14.5	6%	0.057	7%	0.065	C	C	.	.	H	α-helix	trans	-63.9	-59.9	178.1	-170.3	-176.7	65.9	82.9	0.4	111.6	L73 H84 D85 K581 E582 V583 Q588	L73-R585 HydrophobicContact CD2-CG 3.53Å; L73-R585 HydrophobicContact CG-CG 4.02Å; H84-R585 PolarHBondContact O-NH1 3.35Å; D85-R585 PolarHBondContact O-NH1 3.42Å; K581-R585 PolarHBondContact O-N 3.39Å; E582-R585 PolarHBondContact O-N 3.27Å; E582-R585 IonicContact OE1-NE 2.66Å; E582-R585 IonicContact OE2-CZ 3.41Å; E582-R585 IonicContact OE2-NE 3.29Å; E582-R585 PolarHBondContact OE2-NE 3.42Å; E582-R585 IonicContact OE2-NH2 3.92Å; E582-R585 PolarHBondContact OE2-NH2 3.18Å; V583-R585 VanDerWaalsContact C-N 3.34Å; V583-R585 PolarHBondContact O-N 3.03Å; R585-Q588 WeakPolarHBondContact O-CA 3.4Å; R585-Q588 PolarHBondContact O-N 3.18Å
586	L	90.2	Very high	90.8	Very high	22 Å²	22	14.9 Å²	14.9	12%	0.115	7%	0.068	C	C	.	.	H	α-helix	trans	-67.2	-37.4	-175.3	-67.7	170.9	0	0	0	112.6	V471 F517 E582 Q588	V471-L586 HydrophobicContact CG1-CD1 4.2Å; F517-L586 HydrophobicContact CD1-CB 4.43Å; F517-L586 HydrophobicContact CD1-CD1 4.26Å; F517-L586 HydrophobicContact CE1-CB 3.63Å; F517-L586 HydrophobicContact CE1-CD1 4.22Å; F517-L586 HydrophobicContact CZ-CB 4.36Å; E582-L586 WeakPolarHBondContact O-CB 3.37Å; E582-L586 WeakPolarHBondContact O-CG 3.43Å; E582-L586 PolarHBondContact O-N 3.39Å; L586-Q588 PolarHBondContact O-N 2.68Å
587	A	89.8	Confident	90.5	Very high	3 Å²	3	18.3 Å²	18.3	3%	0.025	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-9.5	173.5	0	0	0	0	0	113.2	F517 I531 V583 R589	F517-A587 HydrophobicContact CE2-CB 4.13Å; F517-A587 HydrophobicContact CZ-CB 3.77Å; I531-A587 HydrophobicContact CD1-CB 3.6Å; V583-A587 WeakPolarHBondContact O-CB 3.48Å; V583-A587 PolarHBondContact O-N 3.47Å; A587-R589 VanDerWaalsContact C-N 3.26Å; A587-R589 HydrophobicContact CB-CB 4.38Å; A587-R589 HydrophobicContact CB-CG 3.74Å; A587-R589 PolarHBondContact O-N 2.79Å; A587-R589 PolarHBondContact O-NH1 3.13Å
588	Q	88.6	Confident	89.6	Confident	105 Å²	105	15.2 Å²	15.2	49%	0.491	7%	0.07	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	45.4	-171.5	-55.5	-177.4	5.6	0	0	111.7	D85 L584 R585 L586	D85-Q588 VanDerWaalsContact CG-NE2 3.34Å; D85-Q588 PolarHBondContact OD1-NE2 2.73Å; D85-Q588 PolarHBondContact OD2-NE2 2.97Å; L584-Q588 PolarHBondContact O-N 3.15Å; R585-Q588 WeakPolarHBondContact O-CA 3.4Å; R585-Q588 PolarHBondContact O-N 3.18Å; L586-Q588 PolarHBondContact O-N 2.68Å
589	R	91.3	Very high	88.4	Confident	35 Å²	35	18.3 Å²	18.3	13%	0.132	9%	0.092	C	C	.	.			trans	-110.2	167.3	177.3	-59.4	-64.5	174	-100.3	11.8	109.9	D533 Q558 E559 A561 L584 A587 R657	D533-R589 IonicContact OD1-CZ 2.89Å; D533-R589 IonicContact OD1-NE 2.74Å; D533-R589 PolarHBondContact OD1-NE 3.03Å; D533-R589 IonicContact OD1-NH2 3.63Å; D533-R589 PolarHBondContact OD1-NH2 2.68Å; D533-R589 IonicContact OD2-CZ 3.42Å; D533-R589 IonicContact OD2-NH2 3.6Å; D533-R589 PolarHBondContact OD2-NH2 3.08Å; Q558-R589 WeakPolarHBondContact O-CD 3.25Å; Q558-R589 VanDerWaalsContact O-CZ 3.27Å; Q558-R589 PolarHBondContact O-NE 3.18Å; Q558-R589 PolarHBondContact O-NH1 2.87Å; E559-R589 WeakPolarHBondContact O-CB 3.49Å; A561-R589 HydrophobicContact CB-CG 3.97Å; L584-R589 HydrophobicContact CD2-CB 4.11Å; L584-R589 PolarHBondContact O-N 2.9Å; A587-R589 VanDerWaalsContact C-N 3.26Å; A587-R589 HydrophobicContact CB-CB 4.38Å; A587-R589 HydrophobicContact CB-CG 3.74Å; A587-R589 PolarHBondContact O-N 2.79Å; A587-R589 PolarHBondContact O-NH1 3.13Å; R589-R657 PolarHBondContact O-NE 2.62Å; R589-R657 PolarHBondContact O-NH2 2.89Å
590	S	89.9	Confident	86.8	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.014	12%	0.115	C	C	.	.	S	Bend	trans	-127.8	-20.8	174.8	62.4	0	0	0	0	113.6	H555 E559 S656	H555-S590 PolarHBondContact ND1-OG 3.05Å; E559-S590 VanDerWaalsContact CB-OG 3.29Å; E559-S590 WeakPolarHBondContact CB-OG 3.49Å; E559-S590 PolarHBondContact O-N 2.84Å; E559-S590 VanDerWaalsContact OE2-CB 3.23Å; E559-S590 WeakPolarHBondContact OE2-CB 3.22Å; E559-S590 PolarHBondContact OE2-OG 3.17Å; S590-S656 WeakPolarHBondContact O-CA 3.29Å
591	C	93.4	Very high	85.1	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	127.7	178	-58.4	0	0	0	0	109.7	I550 E559 H560 A561 L654 I655	I550-C591 HydrophobicContact CD1-CB 4.43Å; I550-C591 WeakPolarHBondContact CD1-SG 3.41Å; E559-C591 PolarHBondContact O-N 2.88Å; H560-C591 WeakPolarHBondContact ND1-CB 3.36Å; A561-C591 PolarHBondContact N-O 3.19Å; C591-L654 HydrophobicContact CB-CD1 3.91Å; C591-I655 WeakPolarHBondContact CA-O 3.4Å
592	L	94.5	Very high	83.2	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	115.6	176.8	-178.3	59	0	0	0	108.9	I531 A561 M563 V583 L584 I655	I531-L592 HydrophobicContact CB-CD1 4.27Å; I531-L592 HydrophobicContact CG2-CD1 3.74Å; I531-L592 HydrophobicContact CG2-CD2 4.33Å; A561-L592 HydrophobicContact CB-CD1 3.89Å; A561-L592 WeakPolarHBondContact O-CA 3.49Å; M563-L592 HydrophobicContact CB-CD1 3.95Å; M563-L592 HydrophobicContact CB-CG 4.22Å; M563-L592 HydrophobicContact CE-CD2 3.49Å; M563-L592 VanDerWaalsContact CE-CD2 3.49Å; M563-L592 HydrophobicContact CE-CG 4.08Å; V583-L592 HydrophobicContact CG1-CD2 4.42Å; L584-L592 HydrophobicContact CD2-CB 3.98Å; L592-I655 HydrophobicContact CB-CB 4.37Å; L592-I655 HydrophobicContact CD2-CD1 4.49Å; L592-I655 PolarHBondContact N-O 3.44Å; L592-I655 PolarHBondContact O-N 2.84Å
593	Y	94.4	Very high	81.5	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	143.7	179.5	-60.7	-64.8	0	0	0	111.1	E534 L540 I546 H560 A561 H562 M563 L652 S653 L654	E534-Y593 HydrophobicContact CB-CD2 4.42Å; E534-Y593 HydrophobicContact CG-CD2 4Å; E534-Y593 HydrophobicContact CG-CE2 4.21Å; L540-Y593 HydrophobicContact CD1-CD1 4.45Å; L540-Y593 HydrophobicContact CD1-CD2 3.68Å; L540-Y593 HydrophobicContact CD1-CE2 3.78Å; L540-Y593 HydrophobicContact CD1-CG 4.03Å; I546-Y593 HydrophobicContact CD1-CE1 3.85Å; I546-Y593 HydrophobicContact CG1-CE1 4.44Å; H560-Y593 HydrophobicContact CB-CE2 3.99Å; H560-Y593 PolarHBondContact CE1-OH 3.12Å; H560-Y593 AromaticContact ND1-CE2 3.47Å; H560-Y593 WeakPolarHBondContact ND1-CE2 3.27Å; H560-Y593 AromaticContact ND1-CZ 3.58Å; H560-Y593 PolarHBondContact ND1-OH 3.21Å; A561-Y593 PolarHBondContact O-N 3.11Å; H562-Y593 WeakPolarHBondContact CA-O 3.2Å; M563-Y593 PolarHBondContact N-O 3.07Å; Y593-L652 HydrophobicContact CD1-CD1 3.98Å; Y593-L652 HydrophobicContact CD1-CD2 4.34Å; Y593-L652 HydrophobicContact CD1-CG 4.42Å; Y593-L652 HydrophobicContact CG-CD1 4.24Å; Y593-S653 WeakPolarHBondContact CA-O 3.33Å; Y593-L654 HydrophobicContact CD1-CB 4.34Å; Y593-L654 HydrophobicContact CD1-CD1 3.92Å; Y593-L654 HydrophobicContact CE1-CB 4.47Å; Y593-L654 HydrophobicContact CE1-CD1 3.7Å; Y593-L654 HydrophobicContact CE1-CG 4.48Å
594	H	91.6	Very high	79.8	Confident	3 Å²	3	42.3 Å²	42.3	1%	0.014	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	116.2	167.3	152.6	-120	0	0	0	108	F608 S653 F733	H594-F608 AromaticContact CD2-CD2 3.89Å; H594-F608 AromaticContact CD2-CE1 3.83Å; H594-F608 AromaticContact CD2-CE2 3.41Å; H594-F608 VanDerWaalsContact CD2-CE2 3.41Å; H594-F608 WeakPolarHBondContact CD2-CE2 3.29Å; H594-F608 AromaticContact CD2-CZ 3.39Å; H594-F608 WeakPolarHBondContact CD2-CZ 3.11Å; H594-F608 AromaticContact NE2-CD2 3.61Å; H594-F608 AromaticContact NE2-CE2 3.54Å; H594-S653 PolarHBondContact N-O 2.84Å; H594-S653 PolarHBondContact ND1-OG 3.04Å; H594-S653 PolarHBondContact O-N 2.71Å; H594-S653 PolarHBondContact O-OG 2.85Å; H594-F733 AromaticContact CE1-CE1 3.88Å
595	R	89.6	Confident	78.4	Confident	3 Å²	3	46.8 Å²	46.8	1%	0.011	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	110.5	174.8	-58.5	178.8	-167.5	-158.6	14.2	109.3	E534 D536 H562 Y597 F650 L652	E534-R595 IonicContact OE1-CZ 2.65Å; E534-R595 IonicContact OE1-NH2 3.95Å; E534-R595 PolarHBondContact OE1-NH2 2.99Å; E534-R595 IonicContact OE2-CZ 3.67Å; E534-R595 IonicContact OE2-NE 3.69Å; E534-R595 PolarHBondContact OE2-NE 3.43Å; E534-R595 IonicContact OE2-NH2 3.72Å; E534-R595 PolarHBondContact OE2-NH2 3.24Å; D536-R595 IonicContact OD2-CZ 2.76Å; D536-R595 IonicContact OD2-NH1 3.93Å; D536-R595 PolarHBondContact OD2-NH1 3Å; D536-R595 IonicContact OD2-NH2 3.93Å; D536-R595 PolarHBondContact OD2-NH2 3.28Å; H562-R595 WeakPolarHBondContact NE2-CG 3.27Å; R595-Y597 HydrophobicContact CB-CD2 4.41Å; R595-Y597 HydrophobicContact CB-CE2 3.75Å; R595-Y597 WeakPolarHBondContact CD-OH 3.33Å; R595-F650 HydrophobicContact CB-CB 4.28Å; R595-F650 HydrophobicContact CB-CD2 3.78Å; R595-F650 HydrophobicContact CB-CE2 4.27Å; R595-F650 HydrophobicContact CB-CG 4.02Å; R595-F650 HydrophobicContact CG-CD2 3.74Å; R595-F650 HydrophobicContact CG-CE2 3.69Å; R595-F650 HydrophobicContact CG-CG 4.29Å; R595-F650 HydrophobicContact CG-CZ 4.18Å; R595-L652 HydrophobicContact CG-CD1 4.25Å
596	A	85.9	Confident	77.6	Confident	11 Å²	11	46.8 Å²	46.8	9%	0.091	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	105	172.8	0	0	0	0	0	110.1	F650 A651 F733	A596-F650 CarbonylContact O-C 3.58Å; A596-F650 WeakPolarHBondContact O-CA 3.45Å; A596-A651 HydrophobicContact CB-CB 4.38Å; A596-A651 PolarHBondContact N-O 3.29Å; A596-A651 PolarHBondContact O-N 3.4Å; A596-F733 HydrophobicContact CB-CD1 4.21Å; A596-F733 HydrophobicContact CB-CE1 3.55Å; A596-F733 HydrophobicContact CB-CZ 4.31Å
597	Y	82	Confident	77.1	Confident	77 Å²	77	46.5 Å²	46.5	30%	0.302	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	143.4	173.2	-67.1	-93.4	0	0	0	110.2	R595 Q604 A648 F650	R595-Y597 HydrophobicContact CB-CD2 4.41Å; R595-Y597 HydrophobicContact CB-CE2 3.75Å; R595-Y597 WeakPolarHBondContact CD-OH 3.33Å; Y597-Q604 PolarHBondContact O-NE2 2.68Å; Y597-A648 HydrophobicContact CE1-CB 4.44Å; Y597-F650 HydrophobicContact CD1-CB 3.84Å; Y597-F650 HydrophobicContact CD1-CD1 4.37Å; Y597-F650 HydrophobicContact CD2-CB 4.28Å; Y597-F650 HydrophobicContact CE1-CB 3.86Å; Y597-F650 AromaticContact CE1-CD1 3.57Å; Y597-F650 HydrophobicContact CE1-CD1 3.57Å; Y597-F650 HydrophobicContact CE1-CG 4.11Å; Y597-F650 HydrophobicContact CE2-CB 4.27Å; Y597-F650 HydrophobicContact CG-CB 4.05Å; Y597-F650 AromaticContact CZ-CD1 3.64Å
598	S	70	Confident	76.8	Confident	5 Å²	5	47.9 Å²	47.9	4%	0.035	26%	0.257	C	S	.	.			trans	-62.1	130.2	176.7	179.2	0	0	0	0	110.6	L600 L601 L735	S598-L600 PolarHBondContact O-N 3.06Å; S598-L600 WeakPolarHBondContact OG-CB 3.45Å; S598-L600 PolarHBondContact OG-N 3.4Å; S598-L601 PolarHBondContact O-N 3.23Å; S598-L735 VanDerWaalsContact OG-CD1 3.25Å; S598-L735 WeakPolarHBondContact OG-CD1 3.25Å
599	P	62.5	Low	76.5	Confident	87 Å²	87	45 Å²	45	57%	0.565	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-15.2	171.9	-23.7	34.1	0	0	0	113.8	L601	P599-L601 VanDerWaalsContact C-N 3.34Å
600	L	57.3	Low	76.1	Confident	93 Å²	93	43.6 Å²	43.6	49%	0.487	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-10.6	176.6	-49.2	176.7	0	0	0	112.9	S598 N709 L735	S598-L600 PolarHBondContact O-N 3.06Å; S598-L600 WeakPolarHBondContact OG-CB 3.45Å; S598-L600 PolarHBondContact OG-N 3.4Å; L600-N709 WeakPolarHBondContact CB-OD1 3.46Å; L600-N709 PolarHBondContact O-ND2 3.02Å; L600-L735 HydrophobicContact CD1-CD1 4.33Å
601	L	57.6	Low	75.7	Confident	83 Å²	83	45.4 Å²	45.4	44%	0.435	25%	0.248	S	C	.	.	S	Bend	trans	-118	-3.1	-168.9	-68.9	175.6	0	0	0	115.1	S598 P599 P649 N709 A730	S598-L601 PolarHBondContact O-N 3.23Å; P599-L601 VanDerWaalsContact C-N 3.34Å; L601-P649 HydrophobicContact CD1-CG 3.55Å; L601-N709 WeakPolarHBondContact CD2-ND2 3.3Å; L601-A730 HydrophobicContact CD1-CB 3.74Å
602	G	52.7	Low	75.1	Confident	48 Å²	48	47.5 Å²	47.5	50%	0.495	26%	0.258	S	S	.	.	S	Bend	trans	166.7	170.7	175.4	0	0	0	0	0	113.7	Q604	G602-Q604 PolarHBondContact O-N 3.49Å
603	E	54.1	Low	74.7	Confident	196 Å²	196	48.1 Å²	48.1	92%	0.916	26%	0.261	S	S	*	.			trans	-70.5	124	172.9	-64	-177.3	156.4	0	0	110	T605	E603-T605 PolarHBondContact O-N 2.84Å
604	Q	58.9	Low	74.3	Confident	98 Å²	98	48.1 Å²	48.1	46%	0.458	26%	0.261	S	S	.	.			trans	-78.1	108.4	172.9	-69.6	-178.1	-9.1	0	0	109.4	Y597 G602	Y597-Q604 PolarHBondContact O-NE2 2.68Å; G602-Q604 PolarHBondContact O-N 3.49Å
605	T	61.3	Low	73.9	Confident	96 Å²	96	48.4 Å²	48.4	59%	0.589	26%	0.262	S	S	*	.			trans	-69.7	-41.1	166.8	51.5	0	0	0	0	111	S494 H565 E603	S494-T605 PolarHBondContact OG-O 2.83Å; H565-T605 PolarHBondContact CE1-O 2.93Å; H565-T605 VanDerWaalsContact CE1-O 3.3Å; E603-T605 PolarHBondContact O-N 2.84Å
606	S	73.3	Confident	73.6	Confident	15 Å²	15	49.9 Å²	49.9	11%	0.105	27%	0.27	C	S	.	.	S	Bend	trans	-61.9	143.2	177.3	52.1	0	0	0	0	112.5	L564	L564-S606 VanDerWaalsContact O-CA 3.25Å; L564-S606 WeakPolarHBondContact O-CA 3.3Å; L564-S606 WeakPolarHBondContact O-CB 3.46Å
607	C	80.4	Confident	73.6	Confident	16 Å²	16	49.8 Å²	49.8	11%	0.108	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	119.3	-173.9	-165.1	0	0	0	0	111.9	C493 V495 L564 H565 F566	C493-C607 HydrophobicContact CB-CB 3.83Å; C493-C607 VanDerWaalsContact SG-SG 3.65Å; V495-C607 HydrophobicContact CG2-CB 3.92Å; L564-C607 PolarHBondContact O-N 2.86Å; H565-C607 CarbonylContact C-O 3.53Å; H565-C607 VanDerWaalsContact CA-O 3.3Å; H565-C607 WeakPolarHBondContact CA-O 3.34Å; H565-C607 PolarHBondContact ND1-N 3.27Å; F566-C607 PolarHBondContact N-O 2.92Å
608	F	83.1	Confident	74	Confident	31 Å²	31	46.2 Å²	46.2	14%	0.136	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	93.5	-173.1	-58.6	-68.2	0	0	0	110.9	M563 L564 F566 H594 L611 I614	M563-F608 HydrophobicContact CB-CE1 4.41Å; M563-F608 HydrophobicContact CG-CE1 3.95Å; M563-F608 WeakPolarHBondContact O-CZ 3.49Å; M563-F608 HydrophobicContact SD-CD1 4.18Å; M563-F608 HydrophobicContact SD-CE1 3.82Å; L564-F608 WeakPolarHBondContact O-CZ 3.31Å; F566-F608 HydrophobicContact CB-CD1 4.03Å; F566-F608 WeakPolarHBondContact O-CA 3.39Å; H594-F608 AromaticContact CD2-CD2 3.89Å; H594-F608 AromaticContact CD2-CE1 3.83Å; H594-F608 AromaticContact CD2-CE2 3.41Å; H594-F608 VanDerWaalsContact CD2-CE2 3.41Å; H594-F608 WeakPolarHBondContact CD2-CE2 3.29Å; H594-F608 AromaticContact CD2-CZ 3.39Å; H594-F608 WeakPolarHBondContact CD2-CZ 3.11Å; H594-F608 AromaticContact NE2-CD2 3.61Å; H594-F608 AromaticContact NE2-CE2 3.54Å; F608-L611 HydrophobicContact CB-CB 4.36Å; F608-L611 HydrophobicContact CB-CD1 4.13Å; F608-L611 PolarHBondContact O-N 3.37Å; F608-L611 VanDerWaalsContact O-N 3.11Å; F608-I614 HydrophobicContact CB-CD1 3.89Å; F608-I614 HydrophobicContact CD1-CD1 3.49Å; F608-I614 VanDerWaalsContact CD1-CD1 3.49Å; F608-I614 HydrophobicContact CE1-CD1 4.4Å; F608-I614 HydrophobicContact CG-CD1 4.01Å
609	H	83.5	Confident	75.1	Confident	44 Å²	44	46.2 Å²	46.2	20%	0.204	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	119.1	-174.1	-168.9	-80.9	0	0	0	114.1	L491 F566 L567 L568	L491-H609 HydrophobicContact CD1-CB 3.73Å; F566-H609 PolarHBondContact O-N 2.81Å; L567-H609 WeakPolarHBondContact CA-O 3.38Å; L567-H609 HydrophobicContact CD2-CB 3.84Å; L568-H609 PolarHBondContact N-O 3.22Å
610	P	82.6	Confident	76.5	Confident	7 Å²	7	42.8 Å²	42.8	5%	0.045	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	cis	-74.6	127.6	-16.6	-20.7	35.1	0	0	0	113.3	L568 P570 E612 F613	L568-P610 WeakPolarHBondContact O-CD 3.24Å; P570-P610 HydrophobicContact CG-CG 4.18Å; P610-E612 PolarHBondContact O-N 3.35Å; P610-E612 VanDerWaalsContact O-N 3.08Å; P610-F613 HydrophobicContact CB-CD1 4.33Å; P610-F613 HydrophobicContact CB-CD2 4.35Å; P610-F613 HydrophobicContact CB-CE1 4.23Å; P610-F613 HydrophobicContact CB-CE2 4.27Å; P610-F613 HydrophobicContact CB-CG 4.38Å; P610-F613 HydrophobicContact CB-CZ 4.2Å; P610-F613 VanDerWaalsContact CD-CE2 3.48Å; P610-F613 HydrophobicContact CG-CD2 4.14Å; P610-F613 HydrophobicContact CG-CE1 4.23Å; P610-F613 HydrophobicContact CG-CE2 3.67Å; P610-F613 HydrophobicContact CG-CZ 3.71Å; P610-F613 WeakPolarHBondContact O-CB 3.09Å; P610-F613 PolarHBondContact O-N 3.29Å
611	L	82.1	Confident	78.1	Confident	39 Å²	39	38.3 Å²	38.3	20%	0.204	21%	0.209	C	C	.	.	H	α-helix	trans	-50.7	-33.3	175.9	174.3	60.7	0	0	0	114.1	F608 F613 I614 L615	F608-L611 HydrophobicContact CB-CB 4.36Å; F608-L611 HydrophobicContact CB-CD1 4.13Å; F608-L611 PolarHBondContact O-N 3.37Å; F608-L611 VanDerWaalsContact O-N 3.11Å; L611-F613 PolarHBondContact O-N 3.35Å; L611-I614 HydrophobicContact CD1-CD1 4.41Å; L611-I614 WeakPolarHBondContact O-CB 3.31Å; L611-I614 PolarHBondContact O-N 2.95Å; L611-I614 VanDerWaalsContact O-N 3.09Å; L611-L615 HydrophobicContact CD1-CD1 4.35Å; L611-L615 HydrophobicContact CD1-CG 4.15Å; L611-L615 HydrophobicContact CD2-CD1 4.25Å; L611-L615 HydrophobicContact CG-CD1 3.88Å; L611-L615 HydrophobicContact CG-CG 4.15Å; L611-L615 PolarHBondContact O-N 3.24Å; L611-L615 VanDerWaalsContact O-N 3.12Å
612	E	80.9	Confident	79.8	Confident	44 Å²	44	38.3 Å²	38.3	21%	0.206	20%	0.203	C	C	.	.	H	α-helix	trans	-58.1	-31.5	179	-72.5	173.6	-172.1	0	0	113.3	R446 P610 I614 L615 N616	R446-E612 IonicContact CZ-OE1 2.95Å; R446-E612 IonicContact NE-OE1 2.71Å; R446-E612 PolarHBondContact NE-OE1 2.97Å; R446-E612 IonicContact NE-OE2 2.82Å; R446-E612 IonicContact NH2-OE1 3.33Å; R446-E612 PolarHBondContact NH2-OE1 2.93Å; P610-E612 PolarHBondContact O-N 3.35Å; P610-E612 VanDerWaalsContact O-N 3.08Å; E612-I614 VanDerWaalsContact C-N 3.28Å; E612-I614 PolarHBondContact O-N 2.85Å; E612-L615 PolarHBondContact O-N 3.2Å; E612-N616 WeakPolarHBondContact O-CB 3.43Å; E612-N616 VanDerWaalsContact O-CG 3.27Å; E612-N616 PolarHBondContact O-N 3.31Å; E612-N616 PolarHBondContact O-ND2 3.08Å
613	F	84.6	Confident	81.6	Confident	15 Å²	15	37.6 Å²	37.6	7%	0.066	19%	0.19	C	C	.	.	H	α-helix	trans	-67.1	-33.7	179.6	-61.6	-7	0	0	0	111.3	F566 L568 P570 T576 P610 L611	F566-F613 HydrophobicContact CE1-CB 4.23Å; L568-F613 HydrophobicContact CB-CD2 4.31Å; L568-F613 HydrophobicContact CD2-CD2 3.99Å; L568-F613 HydrophobicContact CD2-CE2 4.38Å; P570-F613 HydrophobicContact CB-CZ 4.36Å; T576-F613 HydrophobicContact CG2-CB 4.12Å; P610-F613 HydrophobicContact CB-CD1 4.33Å; P610-F613 HydrophobicContact CB-CD2 4.35Å; P610-F613 HydrophobicContact CB-CE1 4.23Å; P610-F613 HydrophobicContact CB-CE2 4.27Å; P610-F613 HydrophobicContact CB-CG 4.38Å; P610-F613 HydrophobicContact CB-CZ 4.2Å; P610-F613 VanDerWaalsContact CD-CE2 3.48Å; P610-F613 HydrophobicContact CG-CD2 4.14Å; P610-F613 HydrophobicContact CG-CE1 4.23Å; P610-F613 HydrophobicContact CG-CE2 3.67Å; P610-F613 HydrophobicContact CG-CZ 3.71Å; P610-F613 WeakPolarHBondContact O-CB 3.09Å; P610-F613 PolarHBondContact O-N 3.29Å; L611-F613 PolarHBondContact O-N 3.35Å
614	I	86.4	Confident	83.2	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-72.1	-47.8	174.3	-49.5	174.3	0	0	0	109.8	M563 F566 F608 L611 E612 N616 C617 S618 I655	M563-I614 HydrophobicContact SD-CD1 4.01Å; F566-I614 HydrophobicContact CB-CD1 3.84Å; F566-I614 HydrophobicContact CD1-CD1 3.82Å; F566-I614 HydrophobicContact CD1-CG1 3.76Å; F566-I614 HydrophobicContact CD2-CG1 4.39Å; F566-I614 HydrophobicContact CE1-CG1 4Å; F566-I614 HydrophobicContact CG-CD1 3.85Å; F566-I614 HydrophobicContact CG-CG1 4Å; F566-I614 HydrophobicContact CZ-CG1 4.42Å; F608-I614 HydrophobicContact CB-CD1 3.89Å; F608-I614 HydrophobicContact CD1-CD1 3.49Å; F608-I614 VanDerWaalsContact CD1-CD1 3.49Å; F608-I614 HydrophobicContact CE1-CD1 4.4Å; F608-I614 HydrophobicContact CG-CD1 4.01Å; L611-I614 HydrophobicContact CD1-CD1 4.41Å; L611-I614 WeakPolarHBondContact O-CB 3.31Å; L611-I614 PolarHBondContact O-N 2.95Å; L611-I614 VanDerWaalsContact O-N 3.09Å; E612-I614 VanDerWaalsContact C-N 3.28Å; E612-I614 PolarHBondContact O-N 2.85Å; I614-N616 PolarHBondContact O-N 3.15Å; I614-C617 CarbonylContact O-C 3.59Å; I614-C617 WeakPolarHBondContact O-CA 3.4Å; I614-C617 PolarHBondContact O-N 3.22Å; I614-S618 PolarHBondContact O-N 3.44Å; I614-S618 PolarHBondContact O-OG 3.01Å; I614-I655 HydrophobicContact CG2-CD1 4.15Å
615	L	84.1	Confident	84.5	Confident	8 Å²	8	29 Å²	29	4%	0.042	15%	0.149	C	C	.	.	H	α-helix	trans	-66.2	-17.9	-178.6	-62.5	177.9	0	0	0	114.2	L611 E612 C617 K664 F733	L611-L615 HydrophobicContact CD1-CD1 4.35Å; L611-L615 HydrophobicContact CD1-CG 4.15Å; L611-L615 HydrophobicContact CD2-CD1 4.25Å; L611-L615 HydrophobicContact CG-CD1 3.88Å; L611-L615 HydrophobicContact CG-CG 4.15Å; L611-L615 PolarHBondContact O-N 3.24Å; L611-L615 VanDerWaalsContact O-N 3.12Å; E612-L615 PolarHBondContact O-N 3.2Å; L615-C617 VanDerWaalsContact C-N 3.32Å; L615-K664 PolarHBondContact O-NZ 3.22Å; L615-F733 HydrophobicContact CD2-CD1 4.35Å; L615-F733 HydrophobicContact CD2-CE1 4.32Å
616	N	83.4	Confident	85.6	Confident	34 Å²	34	27.4 Å²	27.4	18%	0.182	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-13.6	169.3	-76.5	-43.6	0	0	0	113.7	E612 I614	E612-N616 WeakPolarHBondContact O-CB 3.43Å; E612-N616 VanDerWaalsContact O-CG 3.27Å; E612-N616 PolarHBondContact O-N 3.31Å; E612-N616 PolarHBondContact O-ND2 3.08Å; I614-N616 PolarHBondContact O-N 3.15Å
617	C	85.8	Confident	86.3	Confident	10 Å²	10	27.3 Å²	27.3	7%	0.068	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-15.6	-176.2	-61.3	0	0	0	0	113.7	L580 I614 L615	L580-C617 HydrophobicContact CD1-CB 3.62Å; I614-C617 CarbonylContact O-C 3.59Å; I614-C617 WeakPolarHBondContact O-CA 3.4Å; I614-C617 PolarHBondContact O-N 3.22Å; L615-C617 VanDerWaalsContact C-N 3.32Å
618	S	90	Very high	86.7	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.007	15%	0.15	C	C	.	.	S	Bend	trans	-105.1	149.9	177.3	73.7	0	0	0	0	112.2	I614 S653 L654 I655 K664	I614-S618 PolarHBondContact O-N 3.44Å; I614-S618 PolarHBondContact O-OG 3.01Å; S618-S653 WeakPolarHBondContact OG-CB 3.26Å; S618-L654 CarbonylContact C-O 3.58Å; S618-L654 VanDerWaalsContact CA-O 3.27Å; S618-L654 WeakPolarHBondContact CA-O 3.49Å; S618-I655 VanDerWaalsContact CB-CG1 3.45Å; S618-K664 WeakPolarHBondContact O-CE 3.3Å; S618-K664 PolarHBondContact O-NZ 3.25Å
619	V	91.6	Very high	86.8	Confident	6 Å²	6	32.4 Å²	32.4	4%	0.036	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	133.6	169.1	-68.2	0	0	0	0	110.2	F549 S653 L654 L659	F549-V619 HydrophobicContact CB-CG2 4.29Å; F549-V619 HydrophobicContact CD1-CB 4.07Å; F549-V619 HydrophobicContact CD1-CG1 4.34Å; F549-V619 HydrophobicContact CD1-CG2 3.57Å; F549-V619 HydrophobicContact CD2-CG2 4.23Å; F549-V619 HydrophobicContact CE1-CB 3.85Å; F549-V619 HydrophobicContact CE1-CG1 4.19Å; F549-V619 HydrophobicContact CE1-CG2 3.85Å; F549-V619 HydrophobicContact CE2-CG2 4.47Å; F549-V619 HydrophobicContact CG-CG2 3.76Å; F549-V619 HydrophobicContact CZ-CB 4.26Å; F549-V619 HydrophobicContact CZ-CG2 4.28Å; V619-S653 CarbonylContact O-C 3.09Å; V619-S653 VanDerWaalsContact O-CA 3.26Å; V619-S653 WeakPolarHBondContact O-CA 3.41Å; V619-S653 WeakPolarHBondContact O-CB 3.36Å; V619-L654 HydrophobicContact CG2-CB 4.15Å; V619-L654 PolarHBondContact N-O 2.68Å; V619-L654 PolarHBondContact O-N 2.76Å; V619-L659 HydrophobicContact CB-CD1 4.41Å; V619-L659 HydrophobicContact CG1-CD1 3.92Å; V619-L659 HydrophobicContact CG1-CD2 4.02Å; V619-L659 HydrophobicContact CG2-CD1 3.71Å
620	P	92.1	Very high	86.8	Confident	14 Å²	14	31.7 Å²	31.7	9%	0.091	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	131.2	171.9	30.4	-31.9	0	0	0	109.6	S688 F689 F733	P620-S688 VanDerWaalsContact CG-O 3.29Å; P620-S688 WeakPolarHBondContact CG-O 3.22Å; P620-F689 HydrophobicContact CB-CD1 3.96Å; P620-F689 HydrophobicContact CB-CE1 4.13Å; P620-F689 HydrophobicContact CG-CD1 4.2Å; P620-F733 HydrophobicContact CB-CD2 3.71Å; P620-F733 HydrophobicContact CB-CE2 3.99Å
621	V	92.6	Very high	86.9	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127	-175.1	-167.7	0	0	0	0	109.6	D545 I546 F549 L652 L654 F689	D545-V621 VanDerWaalsContact C-CG1 3.44Å; I546-V621 HydrophobicContact CG1-CG1 4Å; F549-V621 HydrophobicContact CD2-CG1 4.17Å; F549-V621 HydrophobicContact CD2-CG2 4.15Å; F549-V621 HydrophobicContact CE2-CB 4.38Å; F549-V621 HydrophobicContact CE2-CG1 4.14Å; F549-V621 HydrophobicContact CE2-CG2 4.25Å; V621-L652 HydrophobicContact CB-CB 4.49Å; V621-L652 HydrophobicContact CB-CD2 4.31Å; V621-L652 HydrophobicContact CB-CG 4.47Å; V621-L652 HydrophobicContact CG2-CD2 4.42Å; V621-L652 HydrophobicContact CG2-CG 4.44Å; V621-L652 PolarHBondContact N-O 3.31Å; V621-L654 HydrophobicContact CG2-CB 3.84Å; V621-F689 WeakPolarHBondContact O-CE1 3.31Å
622	R	91.6	Very high	86.9	Confident	83 Å²	83	42.5 Å²	42.5	31%	0.313	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-66.5	139.4	179.6	-76.9	179.3	164.2	148.1	-0.4	111.4	Y544 D545 E686 F689	Y544-R622 CarbonylContact C-O 3.18Å; Y544-R622 WeakPolarHBondContact CA-O 3.35Å; D545-R622 PolarHBondContact N-O 2.89Å; R622-E686 IonicContact CZ-OE1 2.71Å; R622-E686 IonicContact NH1-OE1 3.62Å; R622-E686 IonicContact NH2-OE1 3.66Å; R622-E686 PolarHBondContact NH2-OE1 2.94Å; R622-E686 IonicContact NH2-OE2 3.46Å; R622-E686 PolarHBondContact NH2-OE2 2.91Å; R622-F689 HydrophobicContact CB-CD1 4.5Å; R622-F689 HydrophobicContact CB-CE1 4.37Å; R622-F689 HydrophobicContact CG-CB 4.07Å; R622-F689 HydrophobicContact CG-CD1 3.52Å; R622-F689 HydrophobicContact CG-CD2 3.72Å; R622-F689 HydrophobicContact CG-CE1 3.79Å; R622-F689 HydrophobicContact CG-CE2 3.95Å; R622-F689 HydrophobicContact CG-CG 3.5Å; R622-F689 HydrophobicContact CG-CZ 3.99Å
623	P	91.3	Very high	86.9	Confident	33 Å²	33	46.6 Å²	46.6	21%	0.214	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-65.5	145.7	167.2	28.3	-33.4	0	0	0	110.7	R543 Y544 Q731	R543-P623 CarbonylContact O-C 3.49Å; R543-P623 WeakPolarHBondContact O-CA 3.24Å; Y544-P623 HydrophobicContact CD1-CB 4.22Å; Y544-P623 HydrophobicContact CE1-CB 4.14Å; P623-Q731 HydrophobicContact CB-CB 4.23Å; P623-Q731 VanDerWaalsContact CB-OE1 3.26Å; P623-Q731 HydrophobicContact CG-CB 4.21Å
624	R	87.9	Confident	86.7	Confident	18 Å²	18	46.2 Å²	46.2	7%	0.068	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-88.9	137.8	173.4	-67.7	-167.6	-175.6	-67.7	-5.2	110.3	R541 A542 R543 Y544 D545 D547 Q626 D1157	R541-R624 PolarHBondContact O-NE 3.15Å; A542-R624 WeakPolarHBondContact O-CD 3.3Å; R543-R624 PolarHBondContact O-N 2.85Å; Y544-R624 PolarHBondContact O-NE 2.94Å; D545-R624 IonicContact OD1-CZ 2.87Å; D545-R624 IonicContact OD1-NH1 2.82Å; D545-R624 PolarHBondContact OD1-NH1 3.29Å; D545-R624 IonicContact OD1-NH2 2.73Å; D545-R624 PolarHBondContact OD1-NH2 3.3Å; D547-R624 IonicContact OD2-NH2 3.72Å; R624-Q626 PolarHBondContact O-N 2.86Å; R624-Q626 VanDerWaalsContact O-N 3.11Å; R624-Q626 PolarHBondContact O-NE2 3.28Å; R624-D1157 VanDerWaalsContact CD-OD2 3.26Å; R624-D1157 WeakPolarHBondContact CD-OD2 3.42Å; R624-D1157 VanDerWaalsContact CG-OD2 3.28Å; R624-D1157 WeakPolarHBondContact CG-OD2 3.43Å; R624-D1157 IonicContact CZ-OD2 3.51Å; R624-D1157 IonicContact NE-OD2 4Å; R624-D1157 IonicContact NH1-OD2 2.74Å; R624-D1157 PolarHBondContact NH1-OD2 2.84Å
625	Q	85.1	Confident	86.5	Confident	94 Å²	94	48.5 Å²	48.5	44%	0.439	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-56.4	117.5	165	178.3	176.4	-12.8	0	0	109.7	G1114 D1157	Q625-G1114 PolarHBondContact NE2-O 3.29Å; Q625-D1157 HydrophobicContact CB-CB 4.48Å
626	Q	86.1	Confident	86.2	Confident	63 Å²	63	56.5 Å²	56.5	29%	0.294	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-81	151	177.8	-62.2	-54.3	-73.5	0	0	111	A542 R624	A542-Q626 PolarHBondContact O-NE2 2.73Å; R624-Q626 PolarHBondContact O-N 2.86Å; R624-Q626 VanDerWaalsContact O-N 3.11Å; R624-Q626 PolarHBondContact O-NE2 3.28Å
627	V	87.6	Confident	85.9	Confident	14 Å²	14	57.1 Å²	57.1	9%	0.085	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-93.9	129	170.3	176.4	0	0	0	0	108.1	Y629 F1155 H1156	V627-Y629 HydrophobicContact CB-CD2 4.25Å; V627-Y629 HydrophobicContact CB-CE1 4.31Å; V627-Y629 HydrophobicContact CB-CE2 3.66Å; V627-Y629 HydrophobicContact CG1-CD1 4.14Å; V627-Y629 HydrophobicContact CG1-CD2 4.25Å; V627-Y629 HydrophobicContact CG1-CE1 3.84Å; V627-Y629 HydrophobicContact CG1-CE2 3.97Å; V627-Y629 HydrophobicContact CG1-CG 4.34Å; V627-Y629 WeakPolarHBondContact O-CD2 3.33Å; V627-Y629 VanDerWaalsContact O-CE2 3.31Å; V627-Y629 WeakPolarHBondContact O-CE2 3.38Å; V627-Y629 PolarHBondContact O-N 2.73Å; V627-F1155 HydrophobicContact CB-CB 4.47Å; V627-F1155 HydrophobicContact CG1-CB 4.01Å; V627-F1155 HydrophobicContact CG1-CD2 4.16Å; V627-F1155 VanDerWaalsContact CG2-C 3.49Å; V627-F1155 HydrophobicContact CG2-CB 3.77Å; V627-F1155 WeakPolarHBondContact CG2-O 3.46Å; V627-H1156 HydrophobicContact CG2-CB 4.27Å
628	E	87.4	Confident	85.5	Confident	96 Å²	96	57.9 Å²	57.9	45%	0.449	30%	0.297	S	S	.	.			trans	-82.7	109	174.1	-67.8	172.3	-108.1	0	0	108.7	P1112 V1113 N1115	E628-P1112 HydrophobicContact CB-CB 3.78Å; E628-P1112 VanDerWaalsContact CD-CA 3.43Å; E628-P1112 VanDerWaalsContact CD-CB 3.49Å; E628-P1112 HydrophobicContact CG-CB 4.27Å; E628-P1112 VanDerWaalsContact OE1-C 3.28Å; E628-P1112 WeakPolarHBondContact OE1-CA 2.94Å; E628-P1112 VanDerWaalsContact OE2-CA 3.26Å; E628-P1112 WeakPolarHBondContact OE2-CA 3.47Å; E628-P1112 WeakPolarHBondContact OE2-CB 3.39Å; E628-V1113 PolarHBondContact OE1-N 2.87Å; E628-N1115 PolarHBondContact N-OD1 2.81Å; E628-N1115 PolarHBondContact O-ND2 3.08Å
629	Y	85.1	Confident	85.1	Confident	58 Å²	58	59.1 Å²	59.1	23%	0.227	31%	0.305	C	S	.	.			trans	-95.3	132.5	-174	-67.7	-84.6	0	0	0	111.8	V627 L631 L634 P639 L1152	V627-Y629 HydrophobicContact CB-CD2 4.25Å; V627-Y629 HydrophobicContact CB-CE1 4.31Å; V627-Y629 HydrophobicContact CB-CE2 3.66Å; V627-Y629 HydrophobicContact CG1-CD1 4.14Å; V627-Y629 HydrophobicContact CG1-CD2 4.25Å; V627-Y629 HydrophobicContact CG1-CE1 3.84Å; V627-Y629 HydrophobicContact CG1-CE2 3.97Å; V627-Y629 HydrophobicContact CG1-CG 4.34Å; V627-Y629 WeakPolarHBondContact O-CD2 3.33Å; V627-Y629 VanDerWaalsContact O-CE2 3.31Å; V627-Y629 WeakPolarHBondContact O-CE2 3.38Å; V627-Y629 PolarHBondContact O-N 2.73Å; Y629-L631 PolarHBondContact O-N 2.81Å; Y629-L634 HydrophobicContact CD1-CD1 4.1Å; Y629-P639 HydrophobicContact CD1-CG 3.96Å; Y629-P639 HydrophobicContact CD2-CG 3.62Å; Y629-P639 HydrophobicContact CE1-CG 4.14Å; Y629-P639 HydrophobicContact CE2-CG 3.81Å; Y629-P639 HydrophobicContact CG-CG 3.7Å; Y629-L1152 HydrophobicContact CD1-CD1 4.24Å
630	P	84.4	Confident	84.7	Confident	29 Å²	29	61.6 Å²	61.6	19%	0.188	32%	0.322	C	S	.	.			trans	-76	74.2	171.7	31.9	-34.8	0	0	0	110.3	Q632 E633 L634 T1147	P630-Q632 PolarHBondContact O-N 3.24Å; P630-Q632 VanDerWaalsContact O-N 3.12Å; P630-E633 HydrophobicContact CB-CB 4.18Å; P630-E633 HydrophobicContact CB-CG 4.2Å; P630-E633 PolarHBondContact O-N 3.42Å; P630-L634 HydrophobicContact CG-CD1 4.3Å; P630-L634 HydrophobicContact CG-CG 4.26Å; P630-L634 WeakPolarHBondContact O-CG 3.49Å; P630-L634 PolarHBondContact O-N 2.82Å; P630-L634 VanDerWaalsContact O-N 3.12Å; P630-T1147 HydrophobicContact CB-CG2 4.48Å; P630-T1147 HydrophobicContact CG-CG2 4.29Å
631	L	84.1	Confident	84	Confident	77 Å²	77	65.3 Å²	65.3	40%	0.403	35%	0.348	S	S	.	.	H	α-helix	trans	-52.6	-39.7	-170.1	-56.3	-179.8	0	0	0	113.3	Y629 L634 G635 A638 P639 T644	Y629-L631 PolarHBondContact O-N 2.81Å; L631-L634 PolarHBondContact O-N 3.31Å; L631-G635 PolarHBondContact O-N 2.64Å; L631-A638 HydrophobicContact CD2-CB 4.05Å; L631-P639 HydrophobicContact CD2-CG 4.36Å; L631-T644 HydrophobicContact CD1-CG2 4.45Å; L631-T644 HydrophobicContact CD2-CG2 3.85Å
632	Q	81.9	Confident	83.4	Confident	195 Å²	195	72.1 Å²	72.1	91%	0.911	37%	0.374	S	S	*	.	H	α-helix	trans	-66.1	-36	179.2	-61.7	-177.4	6.5	0	0	113	P630	P630-Q632 PolarHBondContact O-N 3.24Å; P630-Q632 VanDerWaalsContact O-N 3.12Å
633	E	81.2	Confident	82.9	Confident	130 Å²	130	70.2 Å²	70.2	61%	0.607	37%	0.369	S	S	*	.	H	α-helix	trans	-79.7	-27.2	179.7	-59	-178.9	-179.7	0	0	112.2	P630 T1147	P630-E633 HydrophobicContact CB-CB 4.18Å; P630-E633 HydrophobicContact CB-CG 4.2Å; P630-E633 PolarHBondContact O-N 3.42Å; E633-T1147 PolarHBondContact OE2-OG1 2.91Å
634	L	80.3	Confident	82.4	Confident	8 Å²	8	70.6 Å²	70.6	4%	0.042	37%	0.371	C	S	.	.	H	α-helix	trans	-81.2	-37.5	179.5	-67.4	173.2	0	0	0	112.6	Y629 P630 L631 I636 N637 A638 R1149 L1152	Y629-L634 HydrophobicContact CD1-CD1 4.1Å; P630-L634 HydrophobicContact CG-CD1 4.3Å; P630-L634 HydrophobicContact CG-CG 4.26Å; P630-L634 WeakPolarHBondContact O-CG 3.49Å; P630-L634 PolarHBondContact O-N 2.82Å; P630-L634 VanDerWaalsContact O-N 3.12Å; L631-L634 PolarHBondContact O-N 3.31Å; L634-I636 PolarHBondContact O-N 3.33Å; L634-N637 HydrophobicContact CB-CB 4.48Å; L634-N637 WeakPolarHBondContact O-CB 3.29Å; L634-N637 PolarHBondContact O-N 3.48Å; L634-N637 PolarHBondContact O-ND2 2.95Å; L634-A638 HydrophobicContact CB-CB 4.02Å; L634-R1149 HydrophobicContact CD2-CG 3.84Å; L634-L1152 HydrophobicContact CD1-CD1 3.94Å; L634-L1152 HydrophobicContact CD2-CD1 3.88Å; L634-L1152 HydrophobicContact CG-CD1 4.48Å
635	G	82.5	Confident	82.1	Confident	48 Å²	48	75.3 Å²	75.3	50%	0.495	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	58.2	-118.9	179.1	0	0	0	0	0	111.9	L631 N637 A638	L631-G635 PolarHBondContact O-N 2.64Å; G635-N637 PolarHBondContact O-N 2.85Å; G635-A638 VanDerWaalsContact O-CB 3.27Å; G635-A638 WeakPolarHBondContact O-CB 3.36Å; G635-A638 PolarHBondContact O-N 3.48Å
636	I	78.8	Confident	81.7	Confident	175 Å²	175	77.2 Å²	77.2	90%	0.897	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-59.1	-16.3	175.2	-58.1	169.1	0	0	0	112.4	L634	L634-I636 PolarHBondContact O-N 3.33Å
637	N	75.9	Confident	81.6	Confident	48 Å²	48	76.1 Å²	76.1	26%	0.257	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-101.8	12.3	-179.5	-46.4	-106.6	0	0	0	111.8	L634 G635 R1149 L1193	L634-N637 HydrophobicContact CB-CB 4.48Å; L634-N637 WeakPolarHBondContact O-CB 3.29Å; L634-N637 PolarHBondContact O-N 3.48Å; L634-N637 PolarHBondContact O-ND2 2.95Å; G635-N637 PolarHBondContact O-N 2.85Å; N637-R1149 PolarHBondContact ND2-NH1 2.9Å; N637-R1149 VanDerWaalsContact ND2-NH1 3.19Å; N637-R1149 PolarHBondContact ND2-NH2 2.89Å; N637-R1149 VanDerWaalsContact ND2-NH2 3.13Å; N637-R1149 PolarHBondContact OD1-NH1 3.35Å; N637-L1193 HydrophobicContact CB-CD2 3.88Å; N637-L1193 WeakPolarHBondContact O-CD2 3.24Å
638	A	78.8	Confident	81.4	Confident	26 Å²	26	78.3 Å²	78.3	22%	0.215	42%	0.417	C	S	.	.	S	Bend	trans	-75.4	146.4	170.3	0	0	0	0	0	109.6	L631 L634 G635	L631-A638 HydrophobicContact CD2-CB 4.05Å; L634-A638 HydrophobicContact CB-CB 4.02Å; G635-A638 VanDerWaalsContact O-CB 3.27Å; G635-A638 WeakPolarHBondContact O-CB 3.36Å; G635-A638 PolarHBondContact O-N 3.48Å
639	P	80.6	Confident	81.4	Confident	27 Å²	27	74.6 Å²	74.6	18%	0.175	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-60.5	158.4	168.6	25.3	-32.1	0	0	0	111.2	Y629 L631 T644	Y629-P639 HydrophobicContact CD1-CG 3.96Å; Y629-P639 HydrophobicContact CD2-CG 3.62Å; Y629-P639 HydrophobicContact CE1-CG 4.14Å; Y629-P639 HydrophobicContact CE2-CG 3.81Å; Y629-P639 HydrophobicContact CG-CG 3.7Å; L631-P639 HydrophobicContact CD2-CG 4.36Å; P639-T644 HydrophobicContact CB-CG2 4.34Å; P639-T644 HydrophobicContact CG-CG2 3.72Å
640	S	82.3	Confident	81.5	Confident	57 Å²	57	71.9 Å²	71.9	40%	0.399	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-62.7	147.1	-174.8	60.2	0	0	0	0	112.5	R642 I643 T644	S640-R642 PolarHBondContact O-N 2.99Å; S640-I643 PolarHBondContact O-N 3.32Å; S640-T644 PolarHBondContact O-N 3.1Å
641	C	79.2	Confident	81.8	Confident	93 Å²	93	70.6 Å²	70.6	63%	0.628	38%	0.382	S	S	*	.	H	α-helix	trans	-51.8	-41.8	179.1	49.3	0	0	0	0	112.4	I643 T644 E645	C641-I643 PolarHBondContact O-N 3.04Å; C641-T644 WeakPolarHBondContact CA-OG1 3.5Å; C641-T644 PolarHBondContact O-N 2.93Å; C641-T644 VanDerWaalsContact O-N 3.08Å; C641-T644 PolarHBondContact O-OG1 2.95Å; C641-E645 VanDerWaalsContact O-CB 3.23Å; C641-E645 WeakPolarHBondContact O-CB 3.31Å; C641-E645 PolarHBondContact O-N 2.65Å
642	R	78.6	Confident	82.2	Confident	143 Å²	143	66.9 Å²	66.9	54%	0.54	36%	0.363	S	S	.	.	H	α-helix	trans	-54.3	-22	176	-64.3	179.6	175.5	-176.9	-6.6	115.1	E538 Y539 S640	E538-R642 VanDerWaalsContact CD-NH1 3.26Å; E538-R642 IonicContact OE1-NH1 2.7Å; E538-R642 PolarHBondContact OE1-NH1 3.48Å; E538-R642 WeakPolarHBondContact OE2-CD 3.45Å; E538-R642 IonicContact OE2-CZ 3.86Å; E538-R642 IonicContact OE2-NE 3.64Å; E538-R642 IonicContact OE2-NH1 2.73Å; E538-R642 PolarHBondContact OE2-NH1 2.95Å; Y539-R642 WeakPolarHBondContact CB-O 3.47Å; Y539-R642 WeakPolarHBondContact CD2-O 3.47Å; S640-R642 PolarHBondContact O-N 2.99Å
643	I	81.4	Confident	82.7	Confident	43 Å²	43	57.7 Å²	57.7	22%	0.221	32%	0.32	C	S	.	.	H	α-helix	trans	-95.1	-40.3	177.2	-66.6	171.7	0	0	0	110.5	A542 R543 S640 C641	A542-I643 HydrophobicContact CB-CB 4.48Å; A542-I643 HydrophobicContact CB-CG1 4.18Å; A542-I643 HydrophobicContact CB-CG2 3.74Å; R543-I643 PolarHBondContact NE-O 2.94Å; R543-I643 PolarHBondContact NH2-O 2.93Å; S640-I643 PolarHBondContact O-N 3.32Å; C641-I643 PolarHBondContact O-N 3.04Å
644	T	80.6	Confident	83.3	Confident	40 Å²	40	51.5 Å²	51.5	25%	0.245	29%	0.291	C	S	.	.	H	α-helix	trans	-80.9	-21	-175.9	59.1	0	0	0	0	113.8	R543 L631 P639 S640 C641	R543-T644 PolarHBondContact NH2-O 3.17Å; L631-T644 HydrophobicContact CD1-CG2 4.45Å; L631-T644 HydrophobicContact CD2-CG2 3.85Å; P639-T644 HydrophobicContact CB-CG2 4.34Å; P639-T644 HydrophobicContact CG-CG2 3.72Å; S640-T644 PolarHBondContact O-N 3.1Å; C641-T644 WeakPolarHBondContact CA-OG1 3.5Å; C641-T644 PolarHBondContact O-N 2.93Å; C641-T644 VanDerWaalsContact O-N 3.08Å; C641-T644 PolarHBondContact O-OG1 2.95Å
645	E	81.2	Confident	83.9	Confident	117 Å²	117	51.2 Å²	51.2	55%	0.547	29%	0.29	S	S	.	.			trans	-56.5	141.2	-176	-178.9	160.3	-138.3	0	0	113.2	Y539 R543 C641 Q647	Y539-E645 WeakPolarHBondContact CE2-O 3.46Å; R543-E645 PolarHBondContact NH1-O 3.44Å; R543-E645 PolarHBondContact NH2-O 3.37Å; C641-E645 VanDerWaalsContact O-CB 3.23Å; C641-E645 WeakPolarHBondContact O-CB 3.31Å; C641-E645 PolarHBondContact O-N 2.65Å; E645-Q647 PolarHBondContact O-N 3.38Å
646	E	78.3	Confident	84.3	Confident	135 Å²	135	49 Å²	49	63%	0.631	27%	0.267	S	S	*	.			trans	-94.5	76	-172.3	-70.2	-94.3	75.6	0	0	110.6	R543 R727	R543-E646 IonicContact NH1-OE1 3.8Å; E646-R727 IonicContact OE1-CZ 2.67Å; E646-R727 IonicContact OE1-NH1 2.92Å; E646-R727 PolarHBondContact OE1-NH1 2.97Å; E646-R727 IonicContact OE1-NH2 3.61Å; E646-R727 PolarHBondContact OE1-NH2 2.92Å; E646-R727 IonicContact OE2-NH1 3.84Å
647	Q	83.9	Confident	84.7	Confident	40 Å²	40	42.1 Å²	42.1	19%	0.187	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-72.5	155.5	168.6	-51.5	-170.9	-8.3	0	0	111.3	D536 Y539 E645 R727	D536-Q647 VanDerWaalsContact CG-NE2 3.27Å; D536-Q647 PolarHBondContact OD1-NE2 3.11Å; D536-Q647 PolarHBondContact OD2-NE2 3.42Å; Y539-Q647 HydrophobicContact CE1-CB 4.38Å; Y539-Q647 HydrophobicContact CE1-CG 4.27Å; Y539-Q647 HydrophobicContact CE2-CB 4.34Å; Y539-Q647 HydrophobicContact CE2-CG 3.95Å; Y539-Q647 WeakPolarHBondContact OH-CB 3.25Å; E645-Q647 PolarHBondContact O-N 3.38Å; Q647-R727 PolarHBondContact O-NH2 2.95Å
648	A	83.8	Confident	85.2	Confident	60 Å²	60	42.1 Å²	42.1	50%	0.496	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-58.2	142.4	170.6	0	0	0	0	0	111.3	Y597 F650	Y597-A648 HydrophobicContact CE1-CB 4.44Å; A648-F650 VanDerWaalsContact O-CD1 3.3Å; A648-F650 WeakPolarHBondContact O-CD1 3.06Å
649	P	85.8	Confident	85.5	Confident	18 Å²	18	41.9 Å²	41.9	12%	0.117	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-72	142.3	-178.2	30.2	-35.3	0	0	0	112.4	L601 R727 A730 Q731	L601-P649 HydrophobicContact CD1-CG 3.55Å; P649-R727 HydrophobicContact CB-CG 3.88Å; P649-R727 HydrophobicContact CG-CG 4.06Å; P649-A730 HydrophobicContact CB-CB 3.9Å; P649-A730 HydrophobicContact CG-CB 3.74Å; P649-Q731 HydrophobicContact CB-CG 3.81Å
650	F	88.6	Confident	85.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	150.4	177.5	52.7	-98.9	0	0	0	110	Y539 L540 Y544 R595 A596 Y597 A648 L652 A730	Y539-F650 HydrophobicContact CE1-CE1 4.12Å; Y539-F650 AromaticContact CE1-CZ 3.91Å; Y539-F650 HydrophobicContact CE1-CZ 3.91Å; L540-F650 HydrophobicContact CD2-CE2 3.75Å; L540-F650 HydrophobicContact CD2-CZ 3.67Å; Y544-F650 HydrophobicContact CE2-CD2 4.38Å; Y544-F650 AromaticContact CE2-CE2 3.58Å; Y544-F650 HydrophobicContact CE2-CE2 3.58Å; Y544-F650 AromaticContact CE2-CZ 3.97Å; Y544-F650 HydrophobicContact CE2-CZ 3.97Å; Y544-F650 AromaticContact CZ-CE2 3.76Å; Y544-F650 PolarHBondContact OH-O 3.11Å; R595-F650 HydrophobicContact CB-CB 4.28Å; R595-F650 HydrophobicContact CB-CD2 3.78Å; R595-F650 HydrophobicContact CB-CE2 4.27Å; R595-F650 HydrophobicContact CB-CG 4.02Å; R595-F650 HydrophobicContact CG-CD2 3.74Å; R595-F650 HydrophobicContact CG-CE2 3.69Å; R595-F650 HydrophobicContact CG-CG 4.29Å; R595-F650 HydrophobicContact CG-CZ 4.18Å; A596-F650 CarbonylContact O-C 3.58Å; A596-F650 WeakPolarHBondContact O-CA 3.45Å; Y597-F650 HydrophobicContact CD1-CB 3.84Å; Y597-F650 HydrophobicContact CD1-CD1 4.37Å; Y597-F650 HydrophobicContact CD2-CB 4.28Å; Y597-F650 HydrophobicContact CE1-CB 3.86Å; Y597-F650 AromaticContact CE1-CD1 3.57Å; Y597-F650 HydrophobicContact CE1-CD1 3.57Å; Y597-F650 HydrophobicContact CE1-CG 4.11Å; Y597-F650 HydrophobicContact CE2-CB 4.27Å; Y597-F650 HydrophobicContact CG-CB 4.05Å; Y597-F650 AromaticContact CZ-CD1 3.64Å; A648-F650 VanDerWaalsContact O-CD1 3.3Å; A648-F650 WeakPolarHBondContact O-CD1 3.06Å; F650-L652 HydrophobicContact CD2-CB 4.5Å; F650-L652 HydrophobicContact CE2-CB 4.4Å; F650-L652 HydrophobicContact CE2-CD1 4.32Å; F650-A730 CarbonylContact C-O 3.53Å
651	A	90.1	Very high	86	Confident	2 Å²	2	38.9 Å²	38.9	2%	0.017	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	128.3	169.6	0	0	0	0	0	110.1	A596 A730 Q731 T732 F733	A596-A651 HydrophobicContact CB-CB 4.38Å; A596-A651 PolarHBondContact N-O 3.29Å; A596-A651 PolarHBondContact O-N 3.4Å; A651-A730 PolarHBondContact N-O 3.28Å; A651-Q731 WeakPolarHBondContact CA-O 3.48Å; A651-T732 VanDerWaalsContact CB-C 3.44Å; A651-F733 HydrophobicContact CB-CD1 3.92Å; A651-F733 HydrophobicContact CB-CD2 3.72Å; A651-F733 HydrophobicContact CB-CE1 3.86Å; A651-F733 HydrophobicContact CB-CE2 3.64Å; A651-F733 HydrophobicContact CB-CG 3.84Å; A651-F733 HydrophobicContact CB-CZ 3.7Å; A651-F733 WeakPolarHBondContact O-CZ 3.35Å
652	L	92.3	Very high	86.1	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	124.9	-178.2	-175.7	69.6	0	0	0	111.6	L540 Y544 I546 Y593 R595 V621 F650 F733	L540-L652 HydrophobicContact CD2-CD1 4.11Å; L540-L652 HydrophobicContact CD2-CD2 4.18Å; Y544-L652 HydrophobicContact CD1-CB 3.81Å; Y544-L652 HydrophobicContact CD1-CD2 4.32Å; Y544-L652 HydrophobicContact CD2-CB 4.2Å; Y544-L652 HydrophobicContact CD2-CD2 3.68Å; Y544-L652 HydrophobicContact CE1-CB 4Å; Y544-L652 HydrophobicContact CE2-CB 4.36Å; Y544-L652 HydrophobicContact CE2-CD2 4.47Å; Y544-L652 HydrophobicContact CG-CB 3.94Å; Y544-L652 HydrophobicContact CG-CD2 3.61Å; Y544-L652 HydrophobicContact CG-CG 4.42Å; I546-L652 HydrophobicContact CD1-CD2 3.8Å; I546-L652 HydrophobicContact CG1-CD2 4.07Å; Y593-L652 HydrophobicContact CD1-CD1 3.98Å; Y593-L652 HydrophobicContact CD1-CD2 4.34Å; Y593-L652 HydrophobicContact CD1-CG 4.42Å; Y593-L652 HydrophobicContact CG-CD1 4.24Å; R595-L652 HydrophobicContact CG-CD1 4.25Å; V621-L652 HydrophobicContact CB-CB 4.49Å; V621-L652 HydrophobicContact CB-CD2 4.31Å; V621-L652 HydrophobicContact CB-CG 4.47Å; V621-L652 HydrophobicContact CG2-CD2 4.42Å; V621-L652 HydrophobicContact CG2-CG 4.44Å; V621-L652 PolarHBondContact N-O 3.31Å; F650-L652 HydrophobicContact CD2-CB 4.5Å; F650-L652 HydrophobicContact CE2-CB 4.4Å; F650-L652 HydrophobicContact CE2-CD1 4.32Å; L652-F733 WeakPolarHBondContact O-CE2 3.05Å
653	S	92.4	Very high	86.1	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.007	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	148	166.4	62.9	0	0	0	0	111.9	Y593 H594 S618 V619	Y593-S653 WeakPolarHBondContact CA-O 3.33Å; H594-S653 PolarHBondContact N-O 2.84Å; H594-S653 PolarHBondContact ND1-OG 3.04Å; H594-S653 PolarHBondContact O-N 2.71Å; H594-S653 PolarHBondContact O-OG 2.85Å; S618-S653 WeakPolarHBondContact OG-CB 3.26Å; V619-S653 CarbonylContact O-C 3.09Å; V619-S653 VanDerWaalsContact O-CA 3.26Å; V619-S653 WeakPolarHBondContact O-CA 3.41Å; V619-S653 WeakPolarHBondContact O-CB 3.36Å
654	L	93.6	Very high	86.2	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	133.2	-174	168.1	62.8	0	0	0	110.9	I546 F549 I550 C591 Y593 S618 V619 V621	I546-L654 HydrophobicContact CG2-CD2 4.39Å; F549-L654 HydrophobicContact CB-CD2 3.88Å; I550-L654 HydrophobicContact CD1-CD2 4.23Å; I550-L654 HydrophobicContact CG1-CD2 4.17Å; I550-L654 HydrophobicContact CG2-CD2 4.05Å; C591-L654 HydrophobicContact CB-CD1 3.91Å; Y593-L654 HydrophobicContact CD1-CB 4.34Å; Y593-L654 HydrophobicContact CD1-CD1 3.92Å; Y593-L654 HydrophobicContact CE1-CB 4.47Å; Y593-L654 HydrophobicContact CE1-CD1 3.7Å; Y593-L654 HydrophobicContact CE1-CG 4.48Å; S618-L654 CarbonylContact C-O 3.58Å; S618-L654 VanDerWaalsContact CA-O 3.27Å; S618-L654 WeakPolarHBondContact CA-O 3.49Å; V619-L654 HydrophobicContact CG2-CB 4.15Å; V619-L654 PolarHBondContact N-O 2.68Å; V619-L654 PolarHBondContact O-N 2.76Å; V621-L654 HydrophobicContact CG2-CB 3.84Å
655	I	92.9	Very high	86.4	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.01	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	133.8	165.4	-54.8	159.1	0	0	0	107.3	M563 L580 L584 C591 L592 I614 S618 T660	M563-I655 HydrophobicContact CE-CD1 3.84Å; L580-I655 HydrophobicContact CD1-CD1 4.04Å; L580-I655 HydrophobicContact CD2-CD1 4.09Å; L584-I655 HydrophobicContact CD1-CG2 4.34Å; C591-I655 WeakPolarHBondContact CA-O 3.4Å; L592-I655 HydrophobicContact CB-CB 4.37Å; L592-I655 HydrophobicContact CD2-CD1 4.49Å; L592-I655 PolarHBondContact N-O 3.44Å; L592-I655 PolarHBondContact O-N 2.84Å; I614-I655 HydrophobicContact CG2-CD1 4.15Å; S618-I655 VanDerWaalsContact CB-CG1 3.45Å; I655-T660 HydrophobicContact CG2-CG2 4.09Å
656	S	91.1	Very high	86.6	Confident	2 Å²	2	27.6 Å²	27.6	1%	0.014	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	161.9	173.3	63	0	0	0	0	110.5	S590 K658 L659 T660	S590-S656 WeakPolarHBondContact O-CA 3.29Å; S656-K658 VanDerWaalsContact C-N 3.28Å; S656-K658 PolarHBondContact O-N 2.86Å; S656-K658 VanDerWaalsContact O-N 3.15Å; S656-L659 WeakPolarHBondContact O-CA 3.23Å; S656-L659 WeakPolarHBondContact O-CB 3.49Å; S656-L659 PolarHBondContact O-N 3.37Å; S656-T660 PolarHBondContact O-N 2.89Å
657	R	88.1	Confident	87.1	Confident	31 Å²	31	21.6 Å²	21.6	12%	0.117	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-38.6	-171.5	-82.6	-172.5	-114.4	-176.2	-6.4	114.5	L584 R589 L659 T660	L584-R657 HydrophobicContact CB-CG 4.34Å; L584-R657 HydrophobicContact CD1-CG 4.06Å; R589-R657 PolarHBondContact O-NE 2.62Å; R589-R657 PolarHBondContact O-NH2 2.89Å; R657-L659 VanDerWaalsContact C-N 3.34Å; R657-L659 PolarHBondContact O-N 2.99Å; R657-T660 PolarHBondContact O-N 2.86Å; R657-T660 PolarHBondContact O-OG1 3.13Å
658	K	86.3	Confident	87.3	Confident	48 Å²	48	19.9 Å²	19.9	21%	0.209	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-29.4	175.3	66.2	-165.1	-177.2	-171.7	0	114	E49 F549 S656	E49-K658 IonicContact OE1-NZ 2.81Å; E49-K658 PolarHBondContact OE1-NZ 3.06Å; E49-K658 IonicContact OE2-NZ 3.24Å; F549-K658 WeakPolarHBondContact O-CE 3.31Å; F549-K658 PolarHBondContact O-NZ 3.29Å; S656-K658 VanDerWaalsContact C-N 3.28Å; S656-K658 PolarHBondContact O-N 2.86Å; S656-K658 VanDerWaalsContact O-N 3.15Å
659	L	85.2	Confident	87.6	Confident	20 Å²	20	17.1 Å²	17.1	11%	0.105	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-24.6	178.1	-65	173.7	0	0	0	112.8	V619 S656 R657 L661 E662	V619-L659 HydrophobicContact CB-CD1 4.41Å; V619-L659 HydrophobicContact CG1-CD1 3.92Å; V619-L659 HydrophobicContact CG1-CD2 4.02Å; V619-L659 HydrophobicContact CG2-CD1 3.71Å; S656-L659 WeakPolarHBondContact O-CA 3.23Å; S656-L659 WeakPolarHBondContact O-CB 3.49Å; S656-L659 PolarHBondContact O-N 3.37Å; R657-L659 VanDerWaalsContact C-N 3.34Å; R657-L659 PolarHBondContact O-N 2.99Å; L659-L661 PolarHBondContact O-N 2.88Å; L659-E662 HydrophobicContact CD2-CB 4.34Å; L659-E662 PolarHBondContact O-N 3.03Å
660	T	86.6	Confident	87.8	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.006	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-26.2	179.7	67.5	0	0	0	0	113.1	R577 K581 L584 I655 S656 R657	R577-T660 WeakPolarHBondContact CD-O 3.5Å; K581-T660 HydrophobicContact CB-CG2 4.31Å; L584-T660 HydrophobicContact CD1-CG2 3.93Å; I655-T660 HydrophobicContact CG2-CG2 4.09Å; S656-T660 PolarHBondContact O-N 2.89Å; R657-T660 PolarHBondContact O-N 2.86Å; R657-T660 PolarHBondContact O-OG1 3.13Å
661	L	85.5	Confident	88.1	Confident	21 Å²	21	17.1 Å²	17.1	11%	0.11	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	9.1	171.6	-57.9	-174.3	0	0	0	113.1	R18 N52 L53 L106 T133 L659 P663	R18-L661 PolarHBondContact NH2-O 3.15Å; N52-L661 HydrophobicContact CB-CD1 3.67Å; N52-L661 HydrophobicContact CB-CG 4.23Å; L53-L661 HydrophobicContact CB-CD1 4.16Å; L106-L661 HydrophobicContact CD1-CD1 4.07Å; T133-L661 HydrophobicContact CG2-CD2 4.42Å; L659-L661 PolarHBondContact O-N 2.88Å; L661-P663 WeakPolarHBondContact O-CD 3.46Å
662	E	82.8	Confident	88.4	Confident	76 Å²	76	17 Å²	17	36%	0.355	9%	0.087	S	C	.	.			trans	-94.4	109.9	177	-164.7	144.4	124.2	0	0	111.3	R18 L659 K664	R18-E662 VanDerWaalsContact CD-OE2 3.25Å; R18-E662 WeakPolarHBondContact CD-OE2 3.17Å; R18-E662 IonicContact CZ-OE2 3Å; R18-E662 IonicContact NE-OE2 2.66Å; R18-E662 IonicContact NH1-OE2 2.68Å; R18-E662 PolarHBondContact NH1-OE2 2.84Å; L659-E662 HydrophobicContact CD2-CB 4.34Å; L659-E662 PolarHBondContact O-N 3.03Å; E662-K664 PolarHBondContact O-N 2.95Å
663	P	77.4	Confident	88.6	Confident	43 Å²	43	17 Å²	17	28%	0.279	9%	0.087	S	C	.	.	P	Polyproline II helix	trans	-78.4	119.5	179.2	31.5	-34.2	0	0	0	111.4	L661	L661-P663 WeakPolarHBondContact O-CD 3.46Å
664	K	84.3	Confident	88.8	Confident	24 Å²	24	17.2 Å²	17.2	10%	0.104	9%	0.088	C	C	.	.	P	Polyproline II helix	trans	-67.5	145.7	164	-67.6	-170.9	178.9	-175	0	111.6	L615 S618 E662 S691 H692 R694	L615-K664 PolarHBondContact O-NZ 3.22Å; S618-K664 WeakPolarHBondContact O-CE 3.3Å; S618-K664 PolarHBondContact O-NZ 3.25Å; E662-K664 PolarHBondContact O-N 2.95Å; K664-S691 VanDerWaalsContact CE-O 3.29Å; K664-S691 WeakPolarHBondContact CE-O 3.42Å; K664-H692 CarbonylContact C-O 3.54Å; K664-H692 WeakPolarHBondContact CA-O 3.3Å; K664-R694 HydrophobicContact CD-CB 4.22Å
665	V	84.4	Confident	88.7	Confident	34 Å²	34	17.8 Å²	17.8	21%	0.206	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	123	166.5	-178.9	0	0	0	0	108.8	H692 L693 R694 P1018	V665-H692 PolarHBondContact N-O 3.11Å; V665-L693 HydrophobicContact CB-CD2 3.86Å; V665-L693 HydrophobicContact CG1-CD2 4.37Å; V665-L693 CarbonylContact O-C 3.55Å; V665-L693 WeakPolarHBondContact O-CA 3.43Å; V665-R694 PolarHBondContact O-N 3.22Å; V665-P1018 HydrophobicContact CG1-CG 3.8Å; V665-P1018 HydrophobicContact CG2-CG 4.25Å
666	R	85.9	Confident	88.6	Confident	21 Å²	21	18.6 Å²	18.6	8%	0.079	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	129.7	174.3	-73	-174.1	-65.1	-163.7	-2.4	110.2	E435 L439 F442 R694	E435-R666 IonicContact OE1-CZ 2.77Å; E435-R666 IonicContact OE1-NE 3.16Å; E435-R666 PolarHBondContact OE1-NE 3.39Å; E435-R666 IonicContact OE1-NH2 3.67Å; E435-R666 PolarHBondContact OE1-NH2 3.37Å; E435-R666 WeakPolarHBondContact OE2-CB 3.38Å; E435-R666 IonicContact OE2-CZ 2.68Å; E435-R666 VanDerWaalsContact OE2-CZ 3.24Å; E435-R666 IonicContact OE2-NE 3.13Å; E435-R666 PolarHBondContact OE2-NE 3.18Å; E435-R666 IonicContact OE2-NH2 3.18Å; E435-R666 PolarHBondContact OE2-NH2 2.88Å; E435-R666 VanDerWaalsContact OE2-NH2 3.07Å; L439-R666 PolarHBondContact O-NH2 3.03Å; F442-R666 PolarHBondContact O-NH1 3.38Å; R666-R694 WeakPolarHBondContact CA-O 3.37Å; R666-R694 HydrophobicContact CG-CB 4.45Å
667	V	88.6	Confident	88.5	Confident	10 Å²	10	20 Å²	20	6%	0.061	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	113.1	175.1	-178.6	0	0	0	0	108.1	A669 R694 F695 N696 L1016	V667-A669 HydrophobicContact CG1-CB 4.38Å; V667-R694 PolarHBondContact N-O 3.39Å; V667-F695 HydrophobicContact CB-CD1 3.74Å; V667-F695 HydrophobicContact CB-CE1 3.91Å; V667-F695 HydrophobicContact CB-CG 4.45Å; V667-F695 HydrophobicContact CG1-CD1 3.72Å; V667-F695 HydrophobicContact CG1-CE1 3.74Å; V667-F695 HydrophobicContact CG2-CD1 4.37Å; V667-F695 HydrophobicContact CG2-CE1 4.1Å; V667-N696 PolarHBondContact O-N 2.88Å; V667-L1016 HydrophobicContact CG1-CB 4.31Å; V667-L1016 HydrophobicContact CG1-CD1 4.4Å; V667-L1016 HydrophobicContact CG1-CD2 4.1Å
668	N	88.1	Confident	88.7	Confident	3 Å²	3	20.5 Å²	20.5	2%	0.016	12%	0.116	C	C	.	.			trans	-101.8	-4.3	-173.2	-53	-48.7	0	0	0	113.9	S431 L444 S456 Y458 S670 N696 N697	S431-N668 WeakPolarHBondContact CB-O 3.44Å; S431-N668 CarbonylContact O-C 3.27Å; L444-N668 WeakPolarHBondContact CD2-OD1 3.46Å; S456-N668 WeakPolarHBondContact OG-CB 3.35Å; Y458-N668 PolarHBondContact OH-ND2 3.12Å; N668-S670 PolarHBondContact O-N 2.93Å; N668-N696 PolarHBondContact OD1-ND2 2.74Å; N668-N697 PolarHBondContact O-ND2 3.03Å
669	A	89.3	Confident	89	Confident	3 Å²	3	18.3 Å²	18.3	3%	0.025	11%	0.106	C	C	.	.			trans	-56.6	133.9	179.4	0	0	0	0	0	110.1	S431 V667 I671 D766 F767 L1016	S431-A669 WeakPolarHBondContact O-CA 3.31Å; S431-A669 PolarHBondContact O-N 3.03Å; V667-A669 HydrophobicContact CG1-CB 4.38Å; A669-I671 PolarHBondContact O-N 2.95Å; A669-I671 VanDerWaalsContact O-N 3.14Å; A669-D766 WeakPolarHBondContact CA-OD2 3.29Å; A669-D766 HydrophobicContact CB-CB 4.13Å; A669-F767 HydrophobicContact CB-CD2 3.96Å; A669-F767 HydrophobicContact CB-CE2 3.8Å; A669-L1016 HydrophobicContact CB-CD2 4.11Å
670	S	91.6	Very high	89.4	Confident	17 Å²	17	17.3 Å²	17.3	12%	0.119	10%	0.101	C	C	.	.			trans	-73.3	104.9	175.1	-175.3	0	0	0	0	109.2	N668 A764 D766 F767	N668-S670 PolarHBondContact O-N 2.93Å; S670-A764 PolarHBondContact OG-O 2.98Å; S670-D766 PolarHBondContact N-OD2 2.74Å; S670-D766 PolarHBondContact O-N 3.26Å; S670-F767 PolarHBondContact O-N 3.37Å
671	I	94.6	Very high	89.7	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	112.2	177.4	-53.8	176.9	0	0	0	107.5	A669 L687 F695 N697 L698 T699 L1016	A669-I671 PolarHBondContact O-N 2.95Å; A669-I671 VanDerWaalsContact O-N 3.14Å; I671-L687 HydrophobicContact CD1-CD1 4.4Å; I671-F695 HydrophobicContact CD1-CD1 3.82Å; I671-F695 HydrophobicContact CD1-CE1 3.95Å; I671-N697 PolarHBondContact N-O 3.27Å; I671-L698 HydrophobicContact CB-CD2 3.95Å; I671-L698 HydrophobicContact CD1-CD2 3.98Å; I671-L698 HydrophobicContact CG1-CD2 4.37Å; I671-T699 PolarHBondContact O-N 2.89Å; I671-L1016 HydrophobicContact CD1-CD1 3.75Å
672	V	95.7	Very high	90.1	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	114.9	-179.4	-179.3	0	0	0	0	109.2	V674 T699 I701 V763 F767 L768 V769	V672-V674 HydrophobicContact CG1-CG2 4.37Å; V672-T699 WeakPolarHBondContact CA-O 3.01Å; V672-I701 HydrophobicContact CG1-CD1 3.56Å; V672-I701 HydrophobicContact CG1-CG1 3.93Å; V672-V763 HydrophobicContact CG1-CG1 4.34Å; V672-V763 HydrophobicContact CG2-CG1 3.86Å; V672-F767 PolarHBondContact N-O 2.92Å; V672-L768 HydrophobicContact CB-CD1 3.98Å; V672-L768 HydrophobicContact CG1-CD1 3.84Å; V672-L768 CarbonylContact O-C 3.39Å; V672-L768 WeakPolarHBondContact O-CA 3.36Å; V672-V769 PolarHBondContact O-N 3.23Å
673	V	96.6	Very high	90.7	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	131.6	173.8	-177	0	0	0	0	108.5	L683 L684 T699 L700 I701 V769 C771	V673-L683 HydrophobicContact CG1-CD2 4.35Å; V673-L683 HydrophobicContact CG2-CD2 3.75Å; V673-L683 HydrophobicContact CG2-CG 4.41Å; V673-L684 HydrophobicContact CG2-CD2 3.89Å; V673-L684 HydrophobicContact CG2-CG 4.19Å; V673-T699 PolarHBondContact N-O 2.79Å; V673-L700 HydrophobicContact CB-CD1 4.38Å; V673-L700 HydrophobicContact CG1-CD1 4.31Å; V673-L700 WeakPolarHBondContact O-CA 3.14Å; V673-I701 PolarHBondContact O-N 2.89Å; V673-V769 HydrophobicContact CG2-CB 4.5Å; V673-C771 HydrophobicContact CG1-CB 4.43Å
674	V	95.6	Very high	91.4	Very high	5 Å²	5	10.9 Å²	10.9	3%	0.03	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	118.2	-179.5	-171.2	0	0	0	0	110.3	V672 I701 I745 L768 V769 L770 C771 T772	V672-V674 HydrophobicContact CG1-CG2 4.37Å; V674-I701 HydrophobicContact CG1-CB 4.44Å; V674-I701 HydrophobicContact CG2-CB 4.44Å; V674-I701 HydrophobicContact CG2-CD1 4.4Å; V674-I745 HydrophobicContact CG1-CD1 4.19Å; V674-I745 HydrophobicContact CG1-CG1 4.29Å; V674-I745 HydrophobicContact CG1-CG2 3.51Å; V674-I745 HydrophobicContact CG2-CG2 4.35Å; V674-L768 HydrophobicContact CG2-CD1 3.66Å; V674-V769 PolarHBondContact N-O 2.95Å; V674-L770 HydrophobicContact CB-CD2 4.05Å; V674-L770 HydrophobicContact CG2-CD2 3.91Å; V674-C771 CarbonylContact O-C 3.36Å; V674-C771 VanDerWaalsContact O-CA 3.28Å; V674-C771 WeakPolarHBondContact O-CA 3.15Å; V674-C771 WeakPolarHBondContact O-CB 3.31Å; V674-C771 PolarHBondContact O-N 3.5Å; V674-T772 HydrophobicContact CB-CG2 4.38Å; V674-T772 HydrophobicContact CG1-CG2 3.7Å; V674-T772 PolarHBondContact O-N 3.3Å
675	G	91.8	Very high	91.8	Very high	12 Å²	12	10.5 Å²	10.5	12%	0.124	7%	0.066	C	C	.	.	S	Bend	trans	94.3	117.6	-177.1	0	0	0	0	0	112.5	S677 I701	G675-S677 PolarHBondContact O-N 2.93Å; G675-I701 PolarHBondContact N-O 2.68Å
676	A	90.6	Very high	92.1	Very high	20 Å²	20	10.5 Å²	10.5	17%	0.165	6%	0.063	C	C	.	.			trans	-78.1	40.5	176.5	0	0	0	0	0	113.4	L681 L700 S702 G705	A676-L681 HydrophobicContact CB-CD2 4.45Å; A676-L681 WeakPolarHBondContact O-CD1 3.5Å; A676-L700 HydrophobicContact CB-CD1 4.28Å; A676-L700 HydrophobicContact CB-CD2 4.05Å; A676-S702 VanDerWaalsContact CB-OG 3.32Å; A676-S702 WeakPolarHBondContact CB-OG 3.37Å; A676-G705 WeakPolarHBondContact CB-O 3.23Å
677	S	90.6	Very high	92.4	Very high	32 Å²	32	9.5 Å²	9.5	22%	0.224	6%	0.06	C	C	.	.	S	Bend	trans	-74.8	162.2	174.7	68.5	0	0	0	0	111.5	G675 T679 G680 L681 C771	G675-S677 PolarHBondContact O-N 2.93Å; S677-T679 PolarHBondContact O-N 3.01Å; S677-G680 WeakPolarHBondContact O-CA 3.12Å; S677-G680 PolarHBondContact O-N 3.18Å; S677-L681 WeakPolarHBondContact O-CG 3.44Å; S677-L681 PolarHBondContact O-N 3.13Å; S677-C771 WeakPolarHBondContact CB-O 3.35Å; S677-C771 PolarHBondContact OG-O 3.2Å
678	D	91.4	Very high	92.4	Very high	40 Å²	40	10.1 Å²	10.1	21%	0.214	7%	0.065	C	C	.	.	H	α-helix	trans	-43.8	-36.3	172.4	-66.6	-1.1	0	0	0	113.9	S682 S721 V723	D678-S682 WeakPolarHBondContact O-CB 3.5Å; D678-S682 PolarHBondContact O-N 2.79Å; D678-S721 WeakPolarHBondContact OD2-CB 3.28Å; D678-S721 PolarHBondContact OD2-OG 2.81Å; D678-V723 HydrophobicContact CB-CB 4.4Å; D678-V723 HydrophobicContact CB-CG1 4.26Å
679	T	93.4	Very high	92.5	Very high	2 Å²	2	10.6 Å²	10.6	1%	0.012	7%	0.067	C	C	.	.	H	α-helix	trans	-72.3	-42	178.5	-50.9	0	0	0	0	111.8	S677 L683 A979 V1004 G1005	S677-T679 PolarHBondContact O-N 3.01Å; T679-L683 WeakPolarHBondContact O-CB 3.35Å; T679-L683 PolarHBondContact O-N 3.16Å; T679-L683 VanDerWaalsContact O-N 3.08Å; T679-A979 HydrophobicContact CG2-CB 3.66Å; T679-V1004 HydrophobicContact CG2-CB 4.2Å; T679-V1004 HydrophobicContact CG2-CG1 3.79Å; T679-G1005 WeakPolarHBondContact O-CA 3.36Å
680	G	93.8	Very high	92.5	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-69.2	-40.5	175.8	0	0	0	0	0	112.7	S677 L683 L684	S677-G680 WeakPolarHBondContact O-CA 3.12Å; S677-G680 PolarHBondContact O-N 3.18Å; G680-L683 WeakPolarHBondContact O-CB 3.35Å; G680-L683 PolarHBondContact O-N 3.37Å; G680-L684 WeakPolarHBondContact O-CG 3.25Å; G680-L684 PolarHBondContact O-N 3.49Å; G680-L684 VanDerWaalsContact O-N 3.09Å
681	L	92.4	Very high	92.2	Very high	3 Å²	3	12.5 Å²	12.5	2%	0.016	8%	0.08	C	C	.	.	H	α-helix	trans	-66.3	-42.5	176.2	-64.3	174.5	0	0	0	111.4	A676 S677 L683 L684 E685 F706 P707 F724 L729	A676-L681 HydrophobicContact CB-CD2 4.45Å; A676-L681 WeakPolarHBondContact O-CD1 3.5Å; S677-L681 WeakPolarHBondContact O-CG 3.44Å; S677-L681 PolarHBondContact O-N 3.13Å; L681-L683 VanDerWaalsContact C-N 3.35Å; L681-L683 PolarHBondContact O-N 2.98Å; L681-L684 PolarHBondContact O-N 3.21Å; L681-E685 WeakPolarHBondContact O-CB 3.42Å; L681-E685 PolarHBondContact O-N 3.46Å; L681-F706 HydrophobicContact CD2-CD1 3.69Å; L681-F706 HydrophobicContact CD2-CE1 3.7Å; L681-P707 HydrophobicContact CD1-CG 3.91Å; L681-F724 HydrophobicContact CB-CD2 3.91Å; L681-F724 HydrophobicContact CB-CE2 3.58Å; L681-F724 HydrophobicContact CB-CZ 4.19Å; L681-F724 HydrophobicContact CD1-CD2 4.19Å; L681-L729 HydrophobicContact CD1-CD1 4.49Å; L681-L729 HydrophobicContact CD1-CD2 4.36Å
682	S	93.3	Very high	91.8	Very high	2 Å²	2	15.7 Å²	15.7	1%	0.014	10%	0.095	C	C	.	.	H	α-helix	trans	-70.1	-28.2	176.7	-173.9	0	0	0	0	114.1	D678 E686 R1002	D678-S682 WeakPolarHBondContact O-CB 3.5Å; D678-S682 PolarHBondContact O-N 2.79Å; S682-E686 PolarHBondContact O-N 3.3Å; S682-R1002 WeakPolarHBondContact OG-CA 2.96Å; S682-R1002 WeakPolarHBondContact OG-CG 3.19Å; S682-R1002 PolarHBondContact OG-O 3.47Å
683	L	94.8	Very high	91.4	Very high	1 Å²	1	16 Å²	16	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-63.5	-51.3	168.7	160.8	61.2	0	0	0	110.4	V673 T679 G680 L681 E685 E686 L687 V769 G1005 V1008 A1009 L1012	V673-L683 HydrophobicContact CG1-CD2 4.35Å; V673-L683 HydrophobicContact CG2-CD2 3.75Å; V673-L683 HydrophobicContact CG2-CG 4.41Å; T679-L683 WeakPolarHBondContact O-CB 3.35Å; T679-L683 PolarHBondContact O-N 3.16Å; T679-L683 VanDerWaalsContact O-N 3.08Å; G680-L683 WeakPolarHBondContact O-CB 3.35Å; G680-L683 PolarHBondContact O-N 3.37Å; L681-L683 VanDerWaalsContact C-N 3.35Å; L681-L683 PolarHBondContact O-N 2.98Å; L683-E685 VanDerWaalsContact C-N 3.28Å; L683-E685 PolarHBondContact O-N 3.21Å; L683-E686 PolarHBondContact O-N 2.86Å; L683-L687 HydrophobicContact CD1-CD1 3.75Å; L683-L687 HydrophobicContact CD1-CG 4.12Å; L683-L687 HydrophobicContact CG-CD1 4.34Å; L683-L687 WeakPolarHBondContact O-CG 3.3Å; L683-L687 PolarHBondContact O-N 2.83Å; L683-V769 HydrophobicContact CD2-CB 4.04Å; L683-V769 HydrophobicContact CD2-CG1 3.8Å; L683-V769 HydrophobicContact CD2-CG2 4Å; L683-G1005 WeakPolarHBondContact CA-O 3.48Å; L683-V1008 HydrophobicContact CD1-CB 4.49Å; L683-V1008 HydrophobicContact CD1-CG1 4.08Å; L683-V1008 HydrophobicContact CD2-CG1 4.05Å; L683-A1009 HydrophobicContact CD1-CB 3.69Å; L683-L1012 HydrophobicContact CD1-CD1 3.98Å
684	L	93.4	Very high	91	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-64.3	-33.2	178.5	-65.9	167	0	0	0	112	V673 G680 L681 S688 L698 L700 L734 T738	V673-L684 HydrophobicContact CG2-CD2 3.89Å; V673-L684 HydrophobicContact CG2-CG 4.19Å; G680-L684 WeakPolarHBondContact O-CG 3.25Å; G680-L684 PolarHBondContact O-N 3.49Å; G680-L684 VanDerWaalsContact O-N 3.09Å; L681-L684 PolarHBondContact O-N 3.21Å; L684-S688 WeakPolarHBondContact O-CB 3.34Å; L684-S688 PolarHBondContact O-N 3.4Å; L684-S688 PolarHBondContact O-OG 3.47Å; L684-L698 HydrophobicContact CD2-CD1 4.31Å; L684-L700 HydrophobicContact CD1-CB 4.39Å; L684-L700 HydrophobicContact CD1-CD1 4.38Å; L684-L700 HydrophobicContact CD1-CD2 4.37Å; L684-L734 HydrophobicContact CB-CD2 3.5Å; L684-T738 HydrophobicContact CD1-CG2 4.14Å; L684-T738 HydrophobicContact CD2-CG2 4.26Å
685	E	91.4	Very high	90.7	Very high	15 Å²	15	17.6 Å²	17.6	7%	0.07	10%	0.102	C	C	.	.	H	α-helix	trans	-59	-54.8	174.1	179.6	-178.6	-144.8	0	0	111.9	L681 L683 L687 S688 F689 R1002	L681-E685 WeakPolarHBondContact O-CB 3.42Å; L681-E685 PolarHBondContact O-N 3.46Å; L683-E685 VanDerWaalsContact C-N 3.28Å; L683-E685 PolarHBondContact O-N 3.21Å; E685-L687 PolarHBondContact O-N 3.42Å; E685-S688 PolarHBondContact O-N 2.84Å; E685-F689 HydrophobicContact CG-CD2 3.79Å; E685-F689 HydrophobicContact CG-CE2 3.9Å; E685-F689 VanDerWaalsContact O-CD2 3.27Å; E685-F689 WeakPolarHBondContact O-CD2 3.45Å; E685-F689 PolarHBondContact O-N 3.33Å; E685-R1002 IonicContact OE1-CZ 3.5Å; E685-R1002 IonicContact OE1-NH2 3.28Å; E685-R1002 PolarHBondContact OE1-NH2 3.46Å; E685-R1002 IonicContact OE2-CZ 2.75Å; E685-R1002 IonicContact OE2-NE 3.77Å; E685-R1002 PolarHBondContact OE2-NE 2.63Å; E685-R1002 IonicContact OE2-NH2 3.89Å; E685-R1002 PolarHBondContact OE2-NH2 3.11Å
686	E	92.3	Very high	90.4	Very high	34 Å²	34	18.5 Å²	18.5	16%	0.159	10%	0.104	C	C	.	.	H	α-helix	trans	-67.7	-37.1	-176.6	-169.6	73.6	-125.7	0	0	111.9	R622 S682 L683 S690 R1006 A1009	R622-E686 IonicContact CZ-OE1 2.71Å; R622-E686 IonicContact NH1-OE1 3.62Å; R622-E686 IonicContact NH2-OE1 3.66Å; R622-E686 PolarHBondContact NH2-OE1 2.94Å; R622-E686 IonicContact NH2-OE2 3.46Å; R622-E686 PolarHBondContact NH2-OE2 2.91Å; S682-E686 PolarHBondContact O-N 3.3Å; L683-E686 PolarHBondContact O-N 2.86Å; E686-S690 PolarHBondContact O-N 3.28Å; E686-S690 PolarHBondContact O-OG 3.23Å; E686-S690 VanDerWaalsContact O-OG 3.09Å; E686-R1006 HydrophobicContact CG-CG 4.12Å; E686-R1006 WeakPolarHBondContact OE2-CD 3.38Å; E686-R1006 WeakPolarHBondContact OE2-CG 3.26Å; E686-R1006 IonicContact OE2-CZ 3.48Å; E686-R1006 IonicContact OE2-NE 3.18Å; E686-R1006 PolarHBondContact OE2-NE 2.73Å; E686-R1006 IonicContact OE2-NH2 3.52Å; E686-A1009 HydrophobicContact CB-CB 3.8Å; E686-A1009 HydrophobicContact CG-CB 4.03Å
687	L	91.6	Very high	90.4	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-62.9	-44.1	171.4	-65.1	177.2	0	0	0	111.7	I671 L683 E685 F689 S690 F695 L698 A1009 L1013	I671-L687 HydrophobicContact CD1-CD1 4.4Å; L683-L687 HydrophobicContact CD1-CD1 3.75Å; L683-L687 HydrophobicContact CD1-CG 4.12Å; L683-L687 HydrophobicContact CG-CD1 4.34Å; L683-L687 WeakPolarHBondContact O-CG 3.3Å; L683-L687 PolarHBondContact O-N 2.83Å; E685-L687 PolarHBondContact O-N 3.42Å; L687-F689 VanDerWaalsContact C-N 3.33Å; L687-F689 PolarHBondContact O-N 2.91Å; L687-S690 WeakPolarHBondContact O-CB 3.29Å; L687-S690 PolarHBondContact O-N 3.48Å; L687-S690 PolarHBondContact O-OG 2.96Å; L687-F695 HydrophobicContact CB-CD2 4.16Å; L687-F695 HydrophobicContact CB-CE2 3.94Å; L687-F695 HydrophobicContact CB-CZ 4.37Å; L687-F695 HydrophobicContact CD2-CE1 4.18Å; L687-F695 HydrophobicContact CD2-CE2 4.07Å; L687-F695 HydrophobicContact CD2-CZ 3.68Å; L687-F695 WeakPolarHBondContact O-CD2 3.36Å; L687-F695 VanDerWaalsContact O-CE2 3.26Å; L687-F695 WeakPolarHBondContact O-CE2 3.39Å; L687-L698 HydrophobicContact CD1-CD2 4.47Å; L687-A1009 HydrophobicContact CD2-CB 4.2Å; L687-A1009 HydrophobicContact CG-CB 4.21Å; L687-L1013 HydrophobicContact CD2-CD1 4.44Å; L687-L1013 HydrophobicContact CD2-CD2 4.19Å; L687-L1013 HydrophobicContact CD2-CG 4.04Å
688	S	88.8	Confident	90.4	Very high	23 Å²	23	18.3 Å²	18.3	16%	0.161	10%	0.098	C	C	.	.	H	α-helix	trans	-68.2	-29.7	-177.6	-62.4	0	0	0	0	113.6	P620 L684 E685	P620-S688 VanDerWaalsContact CG-O 3.29Å; P620-S688 WeakPolarHBondContact CG-O 3.22Å; L684-S688 WeakPolarHBondContact O-CB 3.34Å; L684-S688 PolarHBondContact O-N 3.4Å; L684-S688 PolarHBondContact O-OG 3.47Å; E685-S688 PolarHBondContact O-N 2.84Å
689	F	89.9	Confident	90.5	Very high	13 Å²	13	16.8 Å²	16.8	6%	0.057	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	7.2	177.7	-73.9	-62.2	0	0	0	114.5	P620 V621 R622 E685 L687 S691 T732	P620-F689 HydrophobicContact CB-CD1 3.96Å; P620-F689 HydrophobicContact CB-CE1 4.13Å; P620-F689 HydrophobicContact CG-CD1 4.2Å; V621-F689 WeakPolarHBondContact O-CE1 3.31Å; R622-F689 HydrophobicContact CB-CD1 4.5Å; R622-F689 HydrophobicContact CB-CE1 4.37Å; R622-F689 HydrophobicContact CG-CB 4.07Å; R622-F689 HydrophobicContact CG-CD1 3.52Å; R622-F689 HydrophobicContact CG-CD2 3.72Å; R622-F689 HydrophobicContact CG-CE1 3.79Å; R622-F689 HydrophobicContact CG-CE2 3.95Å; R622-F689 HydrophobicContact CG-CG 3.5Å; R622-F689 HydrophobicContact CG-CZ 3.99Å; E685-F689 HydrophobicContact CG-CD2 3.79Å; E685-F689 HydrophobicContact CG-CE2 3.9Å; E685-F689 VanDerWaalsContact O-CD2 3.27Å; E685-F689 WeakPolarHBondContact O-CD2 3.45Å; E685-F689 PolarHBondContact O-N 3.33Å; L687-F689 VanDerWaalsContact C-N 3.33Å; L687-F689 PolarHBondContact O-N 2.91Å; F689-S691 PolarHBondContact O-N 3.38Å; F689-S691 VanDerWaalsContact O-N 3.08Å; F689-T732 HydrophobicContact CE2-CG2 3.98Å; F689-T732 HydrophobicContact CZ-CG2 4.11Å
690	S	88.3	Confident	90.6	Very high	15 Å²	15	16.7 Å²	16.7	11%	0.105	9%	0.089	C	C	.	.			trans	-69.2	101.4	172	-66.7	0	0	0	0	110.4	E686 L687 H692 L693	E686-S690 PolarHBondContact O-N 3.28Å; E686-S690 PolarHBondContact O-OG 3.23Å; E686-S690 VanDerWaalsContact O-OG 3.09Å; L687-S690 WeakPolarHBondContact O-CB 3.29Å; L687-S690 PolarHBondContact O-N 3.48Å; L687-S690 PolarHBondContact O-OG 2.96Å; S690-H692 PolarHBondContact O-N 3.01Å; S690-L693 PolarHBondContact O-N 3.16Å; S690-L693 VanDerWaalsContact O-O 3.13Å
691	S	85.7	Confident	90.6	Very high	45 Å²	45	16.7 Å²	16.7	32%	0.315	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-36.6	-164.1	55.1	0	0	0	0	115.3	K664 F689	K664-S691 VanDerWaalsContact CE-O 3.29Å; K664-S691 WeakPolarHBondContact CE-O 3.42Å; F689-S691 PolarHBondContact O-N 3.38Å; F689-S691 VanDerWaalsContact O-N 3.08Å
692	H	86.2	Confident	90.6	Very high	67 Å²	67	17.1 Å²	17.1	31%	0.31	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-8.7	179.4	62.5	-65	0	0	0	113.8	K664 V665 S690 D1017	K664-H692 CarbonylContact C-O 3.54Å; K664-H692 WeakPolarHBondContact CA-O 3.3Å; V665-H692 PolarHBondContact N-O 3.11Å; S690-H692 PolarHBondContact O-N 3.01Å; H692-D1017 IonicContact CD2-OD1 3.77Å; H692-D1017 IonicContact CD2-OD2 3Å; H692-D1017 IonicContact CE1-OD2 2.72Å; H692-D1017 PolarHBondContact CE1-OD2 3.02Å; H692-D1017 VanDerWaalsContact NE2-CG 3.29Å; H692-D1017 IonicContact NE2-OD1 3.4Å; H692-D1017 PolarHBondContact NE2-OD1 2.58Å; H692-D1017 IonicContact NE2-OD2 3.28Å; H692-D1017 PolarHBondContact NE2-OD2 2.72Å
693	L	88.4	Confident	90.3	Very high	5 Å²	5	19 Å²	19	3%	0.026	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	158.8	-179.9	-56.4	-175.5	0	0	0	111.5	V665 S690 F695 L1013 D1017	V665-L693 HydrophobicContact CB-CD2 3.86Å; V665-L693 HydrophobicContact CG1-CD2 4.37Å; V665-L693 CarbonylContact O-C 3.55Å; V665-L693 WeakPolarHBondContact O-CA 3.43Å; S690-L693 PolarHBondContact O-N 3.16Å; S690-L693 VanDerWaalsContact O-O 3.13Å; L693-F695 HydrophobicContact CB-CE2 4.14Å; L693-F695 HydrophobicContact CD1-CE2 4.17Å; L693-F695 HydrophobicContact CD1-CZ 3.91Å; L693-L1013 HydrophobicContact CD1-CD2 3.35Å; L693-D1017 HydrophobicContact CD1-CB 4.2Å
694	R	88	Confident	89.9	Confident	31 Å²	31	22.5 Å²	22.5	12%	0.117	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	107.2	166.6	177.4	64.3	-165.9	165.9	1.9	110.2	K664 V665 R666 V667 N696 C737	K664-R694 HydrophobicContact CD-CB 4.22Å; V665-R694 PolarHBondContact O-N 3.22Å; R666-R694 WeakPolarHBondContact CA-O 3.37Å; R666-R694 HydrophobicContact CG-CB 4.45Å; V667-R694 PolarHBondContact N-O 3.39Å; R694-N696 WeakPolarHBondContact CG-OD1 3.28Å; R694-C737 PolarHBondContact NH1-SG 3.28Å
695	F	88.8	Confident	89.5	Confident	8 Å²	8	22.6 Å²	22.6	4%	0.035	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	128.2	170.3	-59.8	-86.4	0	0	0	110.1	V667 I671 L687 L693 L698 L1013 L1016	V667-F695 HydrophobicContact CB-CD1 3.74Å; V667-F695 HydrophobicContact CB-CE1 3.91Å; V667-F695 HydrophobicContact CB-CG 4.45Å; V667-F695 HydrophobicContact CG1-CD1 3.72Å; V667-F695 HydrophobicContact CG1-CE1 3.74Å; V667-F695 HydrophobicContact CG2-CD1 4.37Å; V667-F695 HydrophobicContact CG2-CE1 4.1Å; I671-F695 HydrophobicContact CD1-CD1 3.82Å; I671-F695 HydrophobicContact CD1-CE1 3.95Å; L687-F695 HydrophobicContact CB-CD2 4.16Å; L687-F695 HydrophobicContact CB-CE2 3.94Å; L687-F695 HydrophobicContact CB-CZ 4.37Å; L687-F695 HydrophobicContact CD2-CE1 4.18Å; L687-F695 HydrophobicContact CD2-CE2 4.07Å; L687-F695 HydrophobicContact CD2-CZ 3.68Å; L687-F695 WeakPolarHBondContact O-CD2 3.36Å; L687-F695 VanDerWaalsContact O-CE2 3.26Å; L687-F695 WeakPolarHBondContact O-CE2 3.39Å; L693-F695 HydrophobicContact CB-CE2 4.14Å; L693-F695 HydrophobicContact CD1-CE2 4.17Å; L693-F695 HydrophobicContact CD1-CZ 3.91Å; F695-L698 HydrophobicContact CB-CD1 3.93Å; F695-L698 HydrophobicContact CB-CD2 3.74Å; F695-L698 HydrophobicContact CB-CG 3.69Å; F695-L698 HydrophobicContact CD1-CD2 4.22Å; F695-L698 HydrophobicContact CG-CD2 4.09Å; F695-L698 HydrophobicContact CG-CG 4.48Å; F695-L1013 HydrophobicContact CZ-CD2 3.86Å; F695-L1016 HydrophobicContact CE1-CD1 4.17Å
696	N	86.3	Confident	89	Confident	32 Å²	32	23 Å²	23	17%	0.171	12%	0.123	C	C	.	.	S	Bend	trans	-105.1	-24.4	-177.3	-62.5	-45.9	0	0	0	113.5	L444 V667 N668 R694	L444-N696 HydrophobicContact CD2-CB 3.53Å; L444-N696 VanDerWaalsContact CD2-ND2 3.32Å; L444-N696 WeakPolarHBondContact CD2-ND2 3.43Å; V667-N696 PolarHBondContact O-N 2.88Å; N668-N696 PolarHBondContact OD1-ND2 2.74Å; R694-N696 WeakPolarHBondContact CG-OD1 3.28Å
697	N	88.9	Confident	88.1	Confident	42 Å²	42	23.4 Å²	23.4	23%	0.225	13%	0.128	C	C	.	.			trans	-124.1	56.5	-174.7	-67.9	-45.3	0	0	0	111.9	N668 I671	N668-N697 PolarHBondContact O-ND2 3.03Å; I671-N697 PolarHBondContact N-O 3.27Å
698	L	92.1	Very high	86.6	Confident	6 Å²	6	24.7 Å²	24.7	3%	0.031	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	126.4	169.4	-59.3	-175.6	0	0	0	110	I671 L684 L687 F695 T738 R739	I671-L698 HydrophobicContact CB-CD2 3.95Å; I671-L698 HydrophobicContact CD1-CD2 3.98Å; I671-L698 HydrophobicContact CG1-CD2 4.37Å; L684-L698 HydrophobicContact CD2-CD1 4.31Å; L687-L698 HydrophobicContact CD1-CD2 4.47Å; F695-L698 HydrophobicContact CB-CD1 3.93Å; F695-L698 HydrophobicContact CB-CD2 3.74Å; F695-L698 HydrophobicContact CB-CG 3.69Å; F695-L698 HydrophobicContact CD1-CD2 4.22Å; F695-L698 HydrophobicContact CG-CD2 4.09Å; F695-L698 HydrophobicContact CG-CG 4.48Å; L698-T738 HydrophobicContact CB-CG2 4.25Å; L698-R739 PolarHBondContact O-N 2.82Å
699	T	93.4	Very high	85.2	Confident	7 Å²	7	26.9 Å²	26.9	4%	0.043	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	133.1	175	-56.8	0	0	0	0	111.2	I671 V672 V673 R739 V741 V763	I671-T699 PolarHBondContact O-N 2.89Å; V672-T699 WeakPolarHBondContact CA-O 3.01Å; V673-T699 PolarHBondContact N-O 2.79Å; T699-R739 CarbonylContact C-O 3.59Å; T699-R739 VanDerWaalsContact CA-O 3.3Å; T699-R739 WeakPolarHBondContact CA-O 3.44Å; T699-R739 HydrophobicContact CG2-CG 4.44Å; T699-V741 HydrophobicContact CG2-CG2 3.83Å; T699-V763 HydrophobicContact CG2-CG1 4.06Å
700	L	94.4	Very high	83.9	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	117	173.4	174.7	60.7	0	0	0	109.4	V673 A676 L684 F706 T738 R739 V740 V741	V673-L700 HydrophobicContact CB-CD1 4.38Å; V673-L700 HydrophobicContact CG1-CD1 4.31Å; V673-L700 WeakPolarHBondContact O-CA 3.14Å; A676-L700 HydrophobicContact CB-CD1 4.28Å; A676-L700 HydrophobicContact CB-CD2 4.05Å; L684-L700 HydrophobicContact CD1-CB 4.39Å; L684-L700 HydrophobicContact CD1-CD1 4.38Å; L684-L700 HydrophobicContact CD1-CD2 4.37Å; L700-F706 HydrophobicContact CD2-CD1 3.81Å; L700-F706 HydrophobicContact CD2-CD2 4.24Å; L700-F706 HydrophobicContact CD2-CE1 3.61Å; L700-F706 HydrophobicContact CD2-CE2 4.07Å; L700-F706 HydrophobicContact CD2-CG 4.12Å; L700-F706 HydrophobicContact CD2-CZ 3.75Å; L700-T738 HydrophobicContact CB-CG2 3.71Å; L700-R739 PolarHBondContact N-O 3.22Å; L700-V740 CarbonylContact O-C 3.53Å; L700-V741 PolarHBondContact O-N 3.48Å
701	I	94.3	Very high	82.7	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.5	170.3	-55.8	177.9	0	0	0	107.8	V672 V673 V674 G675 V741 I745 V755 V757 V763	V672-I701 HydrophobicContact CG1-CD1 3.56Å; V672-I701 HydrophobicContact CG1-CG1 3.93Å; V673-I701 PolarHBondContact O-N 2.89Å; V674-I701 HydrophobicContact CG1-CB 4.44Å; V674-I701 HydrophobicContact CG2-CB 4.44Å; V674-I701 HydrophobicContact CG2-CD1 4.4Å; G675-I701 PolarHBondContact N-O 2.68Å; I701-V741 WeakPolarHBondContact CA-O 3.22Å; I701-V741 HydrophobicContact CG1-CB 4.31Å; I701-I745 HydrophobicContact CG2-CG2 4.04Å; I701-V755 HydrophobicContact CD1-CB 4.17Å; I701-V755 HydrophobicContact CD1-CG1 4.07Å; I701-V757 HydrophobicContact CD1-CG2 4.01Å; I701-V757 HydrophobicContact CG2-CG2 3.91Å; I701-V763 HydrophobicContact CD1-CB 4.15Å; I701-V763 HydrophobicContact CD1-CG1 4.38Å; I701-V763 HydrophobicContact CD1-CG2 4.12Å
702	S	92.2	Very high	81.6	Confident	12 Å²	12	34 Å²	34	8%	0.084	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	150.4	-174.8	-173.5	0	0	0	0	111.4	A676 H704 G705 V741 E742 G743	A676-S702 VanDerWaalsContact CB-OG 3.32Å; A676-S702 WeakPolarHBondContact CB-OG 3.37Å; S702-H704 PolarHBondContact O-N 2.88Å; S702-G705 WeakPolarHBondContact CB-O 3.2Å; S702-G705 PolarHBondContact OG-O 2.82Å; S702-V741 PolarHBondContact N-O 2.88Å; S702-V741 VanDerWaalsContact N-O 3.11Å; S702-E742 CarbonylContact O-C 3.54Å; S702-E742 VanDerWaalsContact O-CA 3.31Å; S702-E742 WeakPolarHBondContact O-CA 3.33Å; S702-G743 CarbonylContact C-O 3.6Å; S702-G743 PolarHBondContact O-N 2.89Å
703	T	88.1	Confident	80.4	Confident	40 Å²	40	37.3 Å²	37.3	25%	0.245	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-46.5	-178.9	37	0	0	0	0	113	K744	T703-K744 HydrophobicContact CG2-CG 3.77Å
704	H	85.6	Confident	79.4	Confident	75 Å²	75	42 Å²	42	35%	0.347	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.4	26.2	-176	-55.7	-65.2	0	0	0	112	S702 D817 H819	S702-H704 PolarHBondContact O-N 2.88Å; H704-D817 IonicContact CD2-OD2 3.62Å; H704-D817 PolarHBondContact CD2-OD2 2.91Å; H704-H819 HydrophobicContact CB-CB 4.04Å; H704-H819 AromaticContact CD2-CD2 3.89Å; H704-H819 AromaticContact CD2-CG 3.84Å; H704-H819 AromaticContact CE1-CD2 3.47Å; H704-H819 PolarHBondContact CE1-CD2 2.81Å; H704-H819 VanDerWaalsContact CE1-CD2 3.47Å; H704-H819 AromaticContact CE1-NE2 3.9Å; H704-H819 AromaticContact CG-CD2 3.7Å; H704-H819 AromaticContact CG-CG 3.54Å; H704-H819 AromaticContact ND1-CD2 3.42Å; H704-H819 PolarHBondContact ND1-CD2 3.08Å; H704-H819 AromaticContact ND1-CG 3.72Å; H704-H819 AromaticContact ND1-NE2 3.65Å; H704-H819 AromaticContact NE2-CD2 3.8Å
705	G	85.2	Confident	78.8	Confident	3 Å²	3	40.7 Å²	40.7	3%	0.031	21%	0.213	C	C	.	.	S	Bend	trans	73.3	-137.6	-178.3	0	0	0	0	0	113.8	A676 S702 V740	A676-G705 WeakPolarHBondContact CB-O 3.23Å; S702-G705 WeakPolarHBondContact CB-O 3.2Å; S702-G705 PolarHBondContact OG-O 2.82Å; G705-V740 VanDerWaalsContact CA-CG1 3.48Å
706	F	81.7	Confident	78.4	Confident	23 Å²	23	41.1 Å²	41.1	10%	0.101	22%	0.219	C	C	.	.	S	Bend	trans	-75.2	157.5	168.1	-81.2	-78.1	0	0	0	110.5	L681 L700 G708 L734 L735 T738 V740	L681-F706 HydrophobicContact CD2-CD1 3.69Å; L681-F706 HydrophobicContact CD2-CE1 3.7Å; L700-F706 HydrophobicContact CD2-CD1 3.81Å; L700-F706 HydrophobicContact CD2-CD2 4.24Å; L700-F706 HydrophobicContact CD2-CE1 3.61Å; L700-F706 HydrophobicContact CD2-CE2 4.07Å; L700-F706 HydrophobicContact CD2-CG 4.12Å; L700-F706 HydrophobicContact CD2-CZ 3.75Å; F706-G708 PolarHBondContact O-N 2.94Å; F706-L734 HydrophobicContact CE1-CB 4.06Å; F706-L734 HydrophobicContact CZ-CB 4.02Å; F706-L735 HydrophobicContact CB-CD2 4.1Å; F706-L735 HydrophobicContact CD1-CD2 4.45Å; F706-L735 HydrophobicContact CD2-CD2 3.53Å; F706-L735 HydrophobicContact CE2-CD2 3.99Å; F706-L735 HydrophobicContact CG-CD2 3.79Å; F706-T738 HydrophobicContact CZ-CG2 4.18Å; F706-V740 HydrophobicContact CD2-CG2 3.45Å; F706-V740 VanDerWaalsContact CD2-CG2 3.45Å; F706-V740 HydrophobicContact CE2-CG2 3.56Å
707	P	72.1	Confident	78.5	Confident	43 Å²	43	39.7 Å²	39.7	28%	0.279	21%	0.212	S	C	.	.			trans	-53.6	127	165.8	-22.1	33.5	0	0	0	110.2	L681 L729	L681-P707 HydrophobicContact CD1-CG 3.91Å; P707-L729 HydrophobicContact CB-CD1 3.99Å; P707-L729 HydrophobicContact CG-CD1 3.91Å
708	G	61.2	Low	78.5	Confident	27 Å²	27	38.7 Å²	38.7	28%	0.278	21%	0.206	S	C	.	.			trans	-72.3	-176.4	177.4	0	0	0	0	0	112.8	F706 Y710	F706-G708 PolarHBondContact O-N 2.94Å; G708-Y710 PolarHBondContact O-N 3.46Å
709	N	59.2	Low	78.3	Confident	69 Å²	69	40 Å²	40	37%	0.369	22%	0.215	S	C	.	.	S	Bend	trans	-71.8	35.8	177	-52.8	-14.9	0	0	0	113.4	L600 L601	L600-N709 WeakPolarHBondContact CB-OD1 3.46Å; L600-N709 PolarHBondContact O-ND2 3.02Å; L601-N709 WeakPolarHBondContact CD2-ND2 3.3Å
710	Y	62.7	Low	78	Confident	100 Å²	100	40.7 Å²	40.7	39%	0.392	22%	0.22	S	C	.	.			trans	-104.5	105.3	-178.5	-56.8	-59.7	0	0	0	108.9	G708 V822	G708-Y710 PolarHBondContact O-N 3.46Å; Y710-V822 HydrophobicContact CD1-CG2 3.8Å; Y710-V822 HydrophobicContact CD2-CG2 3.93Å; Y710-V822 HydrophobicContact CE1-CG1 4.34Å; Y710-V822 HydrophobicContact CE1-CG2 4.07Å; Y710-V822 HydrophobicContact CE2-CG2 4.19Å; Y710-V822 HydrophobicContact CG-CG2 3.73Å
711	D	62.2	Low	77.5	Confident	66 Å²	66	42.3 Å²	42.3	35%	0.353	23%	0.231	S	C	.	.			trans	-75.5	148.3	174.9	-73.6	-32.2	0	0	0	110.9	E713 D714 V715 S726	D711-E713 PolarHBondContact O-N 2.88Å; D711-E713 VanDerWaalsContact O-N 3.11Å; D711-D714 PolarHBondContact O-N 2.88Å; D711-V715 PolarHBondContact O-N 3.41Å; D711-V715 VanDerWaalsContact O-N 3.11Å; D711-S726 VanDerWaalsContact OD1-CB 3.29Å; D711-S726 WeakPolarHBondContact OD1-CB 2.93Å; D711-S726 PolarHBondContact OD1-OG 3.26Å; D711-S726 PolarHBondContact OD2-OG 2.67Å
712	H	61.8	Low	76.9	Confident	57 Å²	57	45.8 Å²	45.8	26%	0.264	25%	0.247	S	C	.	.	H	α-helix	trans	-59.6	-25.6	-176.7	-83.6	-106.3	0	0	0	113.2	G716 L718 T720	H712-G716 WeakPolarHBondContact O-CA 3.38Å; H712-G716 PolarHBondContact O-N 3.36Å; H712-L718 PolarHBondContact ND1-O 3.39Å; H712-T720 HydrophobicContact CB-CG2 3.44Å; H712-T720 VanDerWaalsContact CB-CG2 3.44Å; H712-T720 VanDerWaalsContact CG-CG2 3.47Å
713	E	61.5	Low	76.4	Confident	137 Å²	137	45.7 Å²	45.7	64%	0.64	25%	0.246	S	C	*	.	H	α-helix	trans	-72.6	-31.3	176.5	-56.4	-161.4	155.5	0	0	112.2	D711	D711-E713 PolarHBondContact O-N 2.88Å; D711-E713 VanDerWaalsContact O-N 3.11Å
714	D	66.8	Low	76.1	Confident	104 Å²	104	45 Å²	45	56%	0.556	24%	0.24	S	C	*	.	H	α-helix	trans	-77.7	-37.1	173.4	-79.6	-42.1	0	0	0	112.7	D711 R825	D711-D714 PolarHBondContact O-N 2.88Å; D714-R825 PolarHBondContact O-NH1 3.1Å
715	V	77.1	Confident	75.9	Confident	3 Å²	3	43.4 Å²	43.4	2%	0.018	24%	0.238	C	C	.	.	H	α-helix	trans	-78.7	-42.9	180	-175.7	0	0	0	0	110.9	D711 F717 L818 V822	D711-V715 PolarHBondContact O-N 3.41Å; D711-V715 VanDerWaalsContact O-N 3.11Å; V715-F717 VanDerWaalsContact C-N 3.28Å; V715-F717 HydrophobicContact CG1-CD2 4.37Å; V715-F717 WeakPolarHBondContact O-CD2 3.19Å; V715-F717 PolarHBondContact O-N 2.87Å; V715-F717 VanDerWaalsContact O-N 3.14Å; V715-L818 HydrophobicContact CB-CD2 3.9Å; V715-L818 HydrophobicContact CG1-CD2 4.19Å; V715-L818 HydrophobicContact CG2-CD2 3.78Å; V715-V822 HydrophobicContact CG1-CG2 4.4Å; V715-V822 HydrophobicContact CG2-CG2 3.69Å
716	G	80.6	Confident	75.5	Confident	17 Å²	17	44.7 Å²	44.7	18%	0.175	25%	0.246	C	C	.	.			trans	70.2	5.2	165.1	0	0	0	0	0	117.4	H712 V850 T854	H712-G716 WeakPolarHBondContact O-CA 3.38Å; H712-G716 PolarHBondContact O-N 3.36Å; G716-V850 WeakPolarHBondContact O-CG1 3.37Å; G716-T854 WeakPolarHBondContact O-CB 3.37Å; G716-T854 WeakPolarHBondContact O-CG2 3.42Å; G716-T854 PolarHBondContact O-OG1 2.99Å
717	F	87.8	Confident	75.4	Confident	1 Å²	1	47.3 Å²	47.3	0%	0.004	26%	0.255	C	S	.	.	S	Bend	trans	-100.2	-26.3	-178.7	-74.4	-72.7	0	0	0	115.4	V715 I815 A824 R825 L828 T851 T854 L858 L937	V715-F717 VanDerWaalsContact C-N 3.28Å; V715-F717 HydrophobicContact CG1-CD2 4.37Å; V715-F717 WeakPolarHBondContact O-CD2 3.19Å; V715-F717 PolarHBondContact O-N 2.87Å; V715-F717 VanDerWaalsContact O-N 3.14Å; F717-I815 HydrophobicContact CB-CD1 3.89Å; F717-I815 HydrophobicContact CB-CG2 4.1Å; F717-I815 HydrophobicContact CD1-CD1 3.59Å; F717-I815 HydrophobicContact CD2-CD1 4.02Å; F717-I815 HydrophobicContact CE1-CD1 4.14Å; F717-I815 HydrophobicContact CG-CD1 3.55Å; F717-A824 HydrophobicContact CE2-CB 4.35Å; F717-R825 HydrophobicContact CE2-CB 3.95Å; F717-R825 HydrophobicContact CE2-CG 4.46Å; F717-L828 HydrophobicContact CE1-CD1 4.1Å; F717-L828 HydrophobicContact CZ-CD1 3.55Å; F717-T851 HydrophobicContact CD1-CG2 4.01Å; F717-T851 HydrophobicContact CE1-CG2 4.22Å; F717-T851 PolarHBondContact O-OG1 2.89Å; F717-T854 HydrophobicContact CD1-CG2 4.1Å; F717-T854 WeakPolarHBondContact CD1-OG1 3.19Å; F717-T854 HydrophobicContact CD2-CG2 4.08Å; F717-T854 HydrophobicContact CE1-CG2 3.86Å; F717-T854 HydrophobicContact CE2-CG2 3.83Å; F717-T854 HydrophobicContact CG-CG2 4.19Å; F717-T854 HydrophobicContact CZ-CG2 3.7Å; F717-L858 HydrophobicContact CZ-CD1 4.38Å; F717-L937 HydrophobicContact CE1-CD2 4.37Å
718	L	88.9	Confident	75.9	Confident	22 Å²	22	48.3 Å²	48.3	12%	0.115	26%	0.258	C	S	.	.	S	Bend	trans	-118.1	141.1	-171.5	-66.3	177.2	0	0	0	112	H712 I815 D847	H712-L718 PolarHBondContact ND1-O 3.39Å; L718-I815 HydrophobicContact CD1-CG2 4.16Å; L718-I815 HydrophobicContact CD2-CG2 4.12Å; L718-I815 HydrophobicContact CG-CG2 4Å; L718-D847 HydrophobicContact CD2-CB 4.27Å
719	S	88.7	Confident	77	Confident	32 Å²	32	47.7 Å²	47.7	22%	0.224	25%	0.248	C	C	.	.			trans	-66.3	153.6	172.2	61.4	0	0	0	0	112.4	D847 G1044	S719-D847 VanDerWaalsContact CB-OD1 3.25Å; S719-D847 WeakPolarHBondContact CB-OD1 3.45Å; S719-D847 PolarHBondContact N-OD1 3.29Å; S719-D847 PolarHBondContact OG-OD1 3.31Å; S719-G1044 WeakPolarHBondContact CA-O 3.34Å; S719-G1044 WeakPolarHBondContact CB-O 3.44Å
720	T	86	Confident	78.1	Confident	23 Å²	23	44.7 Å²	44.7	14%	0.141	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-99.5	140.1	-173.9	50.4	0	0	0	0	111.8	H712 H722 R1043 G1044	H712-T720 HydrophobicContact CB-CG2 3.44Å; H712-T720 VanDerWaalsContact CB-CG2 3.44Å; H712-T720 VanDerWaalsContact CG-CG2 3.47Å; T720-H722 PolarHBondContact OG1-CD2 2.82Å; T720-H722 PolarHBondContact OG1-CE1 2.77Å; T720-H722 PolarHBondContact OG1-NE2 3.28Å; T720-R1043 WeakPolarHBondContact O-CA 3.36Å; T720-G1044 PolarHBondContact N-O 3.48Å; T720-G1044 PolarHBondContact O-N 3.36Å; T720-G1044 WeakPolarHBondContact OG1-CA 3.3Å; T720-G1044 PolarHBondContact OG1-N 2.79Å; T720-G1044 PolarHBondContact OG1-O 3.47Å
721	S	83.4	Confident	79.2	Confident	33 Å²	33	40.7 Å²	40.7	23%	0.231	22%	0.218	C	C	.	.			trans	-85	-19	164.3	67.6	0	0	0	0	112.6	D678 V723 I1042	D678-S721 WeakPolarHBondContact OD2-CB 3.28Å; D678-S721 PolarHBondContact OD2-OG 2.81Å; S721-V723 PolarHBondContact O-N 3.27Å; S721-V723 WeakPolarHBondContact OG-CG2 3.02Å; S721-V723 PolarHBondContact OG-N 2.86Å; S721-I1042 WeakPolarHBondContact O-CB 3.4Å; S721-I1042 WeakPolarHBondContact O-CG2 3.43Å
722	H	82.5	Confident	80.2	Confident	74 Å²	74	37.9 Å²	37.9	34%	0.343	20%	0.203	S	C	.	.			trans	50.2	30.6	-168.1	-61.9	-79.7	0	0	0	113.5	T720 I1042 V1113	T720-H722 PolarHBondContact OG1-CD2 2.82Å; T720-H722 PolarHBondContact OG1-CE1 2.77Å; T720-H722 PolarHBondContact OG1-NE2 3.28Å; H722-I1042 HydrophobicContact CB-CG2 4.29Å; H722-V1113 HydrophobicContact CB-CG1 4.24Å
723	V	81.8	Confident	81.1	Confident	11 Å²	11	35.5 Å²	35.5	7%	0.067	19%	0.192	C	C	.	.	S	Bend	trans	-84.7	-39.8	176.5	178.3	0	0	0	0	111.6	D678 S721 R1002	D678-V723 HydrophobicContact CB-CB 4.4Å; D678-V723 HydrophobicContact CB-CG1 4.26Å; S721-V723 PolarHBondContact O-N 3.27Å; S721-V723 WeakPolarHBondContact OG-CG2 3.02Å; S721-V723 PolarHBondContact OG-N 2.86Å; V723-R1002 HydrophobicContact CG1-CB 3.81Å; V723-R1002 HydrophobicContact CG1-CG 3.97Å
724	F	81.7	Confident	82.1	Confident	24 Å²	24	29 Å²	29	11%	0.105	16%	0.162	C	C	.	.			trans	-140.6	138.9	173.8	-63.3	-69.4	0	0	0	110.4	L681 L729	L681-F724 HydrophobicContact CB-CD2 3.91Å; L681-F724 HydrophobicContact CB-CE2 3.58Å; L681-F724 HydrophobicContact CB-CZ 4.19Å; L681-F724 HydrophobicContact CD1-CD2 4.19Å; F724-L729 HydrophobicContact CB-CD2 4.28Å; F724-L729 HydrophobicContact CB-CG 4.26Å; F724-L729 HydrophobicContact CD1-CD2 4.04Å; F724-L729 HydrophobicContact CG-CD2 4.13Å
725	S	80.6	Confident	82.5	Confident	43 Å²	43	26.5 Å²	26.5	30%	0.301	15%	0.148	S	C	.	.			trans	-104.4	169.8	161.7	64.9	0	0	0	0	111.2	R727 D728 L729	S725-R727 PolarHBondContact O-N 2.97Å; S725-R727 PolarHBondContact OG-N 2.84Å; S725-D728 WeakPolarHBondContact CB-OD2 3.44Å; S725-D728 PolarHBondContact N-OD2 2.96Å; S725-D728 PolarHBondContact O-N 2.79Å; S725-D728 PolarHBondContact OG-N 2.72Å; S725-D728 VanDerWaalsContact OG-N 3.08Å; S725-D728 PolarHBondContact OG-OD2 3.45Å; S725-L729 PolarHBondContact O-N 3.03Å; S725-L729 VanDerWaalsContact O-N 3.13Å
726	S	77.9	Confident	82.5	Confident	30 Å²	30	28.9 Å²	28.9	21%	0.21	17%	0.165	C	C	.	.	H	α-helix	trans	-54.7	-40.3	169.8	64	0	0	0	0	111.6	D711 L729 A730	D711-S726 VanDerWaalsContact OD1-CB 3.29Å; D711-S726 WeakPolarHBondContact OD1-CB 2.93Å; D711-S726 PolarHBondContact OD1-OG 3.26Å; D711-S726 PolarHBondContact OD2-OG 2.67Å; S726-L729 PolarHBondContact O-N 2.87Å; S726-A730 WeakPolarHBondContact O-CB 3.15Å; S726-A730 PolarHBondContact O-N 2.85Å
727	R	79.7	Confident	82.5	Confident	78 Å²	78	28.9 Å²	28.9	29%	0.294	16%	0.162	S	C	.	.	H	α-helix	trans	-64.3	-43.2	177.7	-163.1	180	-163.1	172.6	5.9	112.7	E646 Q647 P649 S725 A730 Q731	E646-R727 IonicContact OE1-CZ 2.67Å; E646-R727 IonicContact OE1-NH1 2.92Å; E646-R727 PolarHBondContact OE1-NH1 2.97Å; E646-R727 IonicContact OE1-NH2 3.61Å; E646-R727 PolarHBondContact OE1-NH2 2.92Å; E646-R727 IonicContact OE2-NH1 3.84Å; Q647-R727 PolarHBondContact O-NH2 2.95Å; P649-R727 HydrophobicContact CB-CG 3.88Å; P649-R727 HydrophobicContact CG-CG 4.06Å; S725-R727 PolarHBondContact O-N 2.97Å; S725-R727 PolarHBondContact OG-N 2.84Å; R727-A730 PolarHBondContact O-N 2.86Å; R727-Q731 WeakPolarHBondContact O-CG 3.24Å; R727-Q731 PolarHBondContact O-N 3.09Å; R727-Q731 VanDerWaalsContact O-N 3.14Å
728	D	83	Confident	82.5	Confident	64 Å²	64	29.3 Å²	29.3	34%	0.342	17%	0.165	S	C	.	.	H	α-helix	trans	-63.5	-46.3	177.5	-62.8	-58.7	0	0	0	110.8	S725 A730 Q731 T732	S725-D728 WeakPolarHBondContact CB-OD2 3.44Å; S725-D728 PolarHBondContact N-OD2 2.96Å; S725-D728 PolarHBondContact O-N 2.79Å; S725-D728 PolarHBondContact OG-N 2.72Å; S725-D728 VanDerWaalsContact OG-N 3.08Å; S725-D728 PolarHBondContact OG-OD2 3.45Å; D728-A730 VanDerWaalsContact C-N 3.32Å; D728-A730 PolarHBondContact O-N 2.96Å; D728-Q731 WeakPolarHBondContact O-CA 3.18Å; D728-Q731 WeakPolarHBondContact O-CB 3.41Å; D728-Q731 PolarHBondContact O-N 2.9Å; D728-T732 PolarHBondContact O-N 2.84Å
729	L	82.9	Confident	82.5	Confident	13 Å²	13	32.1 Å²	32.1	7%	0.068	17%	0.174	C	C	.	.	H	α-helix	trans	-61.4	-41.2	178.8	-66.5	174.6	0	0	0	111.4	L681 P707 F724 S725 S726 Q731 T732 L734	L681-L729 HydrophobicContact CD1-CD1 4.49Å; L681-L729 HydrophobicContact CD1-CD2 4.36Å; P707-L729 HydrophobicContact CB-CD1 3.99Å; P707-L729 HydrophobicContact CG-CD1 3.91Å; F724-L729 HydrophobicContact CB-CD2 4.28Å; F724-L729 HydrophobicContact CB-CG 4.26Å; F724-L729 HydrophobicContact CD1-CD2 4.04Å; F724-L729 HydrophobicContact CG-CD2 4.13Å; S725-L729 PolarHBondContact O-N 3.03Å; S725-L729 VanDerWaalsContact O-N 3.13Å; S726-L729 PolarHBondContact O-N 2.87Å; L729-Q731 PolarHBondContact O-N 3.03Å; L729-T732 PolarHBondContact O-N 2.83Å; L729-T732 PolarHBondContact O-OG1 2.69Å; L729-L734 HydrophobicContact CD2-CD1 4.01Å
730	A	82.5	Confident	82.6	Confident	6 Å²	6	33 Å²	33	5%	0.05	18%	0.178	C	C	.	.	H	α-helix	trans	-67	-16.9	174.1	0	0	0	0	0	114.4	L601 P649 F650 A651 S726 R727 D728 T732	L601-A730 HydrophobicContact CD1-CB 3.74Å; P649-A730 HydrophobicContact CB-CB 3.9Å; P649-A730 HydrophobicContact CG-CB 3.74Å; F650-A730 CarbonylContact C-O 3.53Å; A651-A730 PolarHBondContact N-O 3.28Å; S726-A730 WeakPolarHBondContact O-CB 3.15Å; S726-A730 PolarHBondContact O-N 2.85Å; R727-A730 PolarHBondContact O-N 2.86Å; D728-A730 VanDerWaalsContact C-N 3.32Å; D728-A730 PolarHBondContact O-N 2.96Å; A730-T732 VanDerWaalsContact C-N 3.33Å
731	Q	86.1	Confident	82.8	Confident	17 Å²	17	32.3 Å²	32.3	8%	0.079	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	3	170.7	-71.5	177.3	-4.6	0	0	113.5	P623 P649 A651 R727 D728 L729	P623-Q731 HydrophobicContact CB-CB 4.23Å; P623-Q731 VanDerWaalsContact CB-OE1 3.26Å; P623-Q731 HydrophobicContact CG-CB 4.21Å; P649-Q731 HydrophobicContact CB-CG 3.81Å; A651-Q731 WeakPolarHBondContact CA-O 3.48Å; R727-Q731 WeakPolarHBondContact O-CG 3.24Å; R727-Q731 PolarHBondContact O-N 3.09Å; R727-Q731 VanDerWaalsContact O-N 3.14Å; D728-Q731 WeakPolarHBondContact O-CA 3.18Å; D728-Q731 WeakPolarHBondContact O-CB 3.41Å; D728-Q731 PolarHBondContact O-N 2.9Å; L729-Q731 PolarHBondContact O-N 3.03Å
732	T	83.6	Confident	83.2	Confident	7 Å²	7	37.1 Å²	37.1	4%	0.043	19%	0.192	C	C	.	.	S	Bend	trans	-114	152.2	176.9	70.7	0	0	0	0	112.6	A651 F689 D728 L729 A730 L734	A651-T732 VanDerWaalsContact CB-C 3.44Å; F689-T732 HydrophobicContact CE2-CG2 3.98Å; F689-T732 HydrophobicContact CZ-CG2 4.11Å; D728-T732 PolarHBondContact O-N 2.84Å; L729-T732 PolarHBondContact O-N 2.83Å; L729-T732 PolarHBondContact O-OG1 2.69Å; A730-T732 VanDerWaalsContact C-N 3.33Å; T732-L734 PolarHBondContact O-N 2.92Å; T732-L734 VanDerWaalsContact O-N 3.1Å; T732-L734 WeakPolarHBondContact OG1-CB 3.44Å; T732-L734 WeakPolarHBondContact OG1-CD1 3.41Å; T732-L734 WeakPolarHBondContact OG1-CG 3.47Å; T732-L734 PolarHBondContact OG1-N 3.3Å
733	F	80.8	Confident	83.6	Confident	6 Å²	6	34.1 Å²	34.1	3%	0.026	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	12.4	172.7	-71.8	-80.5	0	0	0	114	H594 A596 L615 P620 A651 L652 L735 S736 C737	H594-F733 AromaticContact CE1-CE1 3.88Å; A596-F733 HydrophobicContact CB-CD1 4.21Å; A596-F733 HydrophobicContact CB-CE1 3.55Å; A596-F733 HydrophobicContact CB-CZ 4.31Å; L615-F733 HydrophobicContact CD2-CD1 4.35Å; L615-F733 HydrophobicContact CD2-CE1 4.32Å; P620-F733 HydrophobicContact CB-CD2 3.71Å; P620-F733 HydrophobicContact CB-CE2 3.99Å; A651-F733 HydrophobicContact CB-CD1 3.92Å; A651-F733 HydrophobicContact CB-CD2 3.72Å; A651-F733 HydrophobicContact CB-CE1 3.86Å; A651-F733 HydrophobicContact CB-CE2 3.64Å; A651-F733 HydrophobicContact CB-CG 3.84Å; A651-F733 HydrophobicContact CB-CZ 3.7Å; A651-F733 WeakPolarHBondContact O-CZ 3.35Å; L652-F733 WeakPolarHBondContact O-CE2 3.05Å; F733-L735 VanDerWaalsContact C-N 3.34Å; F733-L735 PolarHBondContact O-N 3.36Å; F733-S736 PolarHBondContact O-N 3.12Å; F733-C737 WeakPolarHBondContact O-CB 3.35Å; F733-C737 PolarHBondContact O-N 3.09Å; F733-C737 PolarHBondContact O-SG 3.06Å
734	L	81.5	Confident	84	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-56.3	-46.8	-176.8	-72.8	178.3	0	0	0	112	L684 F706 L729 T732 S736 C737 T738	L684-L734 HydrophobicContact CB-CD2 3.5Å; F706-L734 HydrophobicContact CE1-CB 4.06Å; F706-L734 HydrophobicContact CZ-CB 4.02Å; L729-L734 HydrophobicContact CD2-CD1 4.01Å; T732-L734 PolarHBondContact O-N 2.92Å; T732-L734 VanDerWaalsContact O-N 3.1Å; T732-L734 WeakPolarHBondContact OG1-CB 3.44Å; T732-L734 WeakPolarHBondContact OG1-CD1 3.41Å; T732-L734 WeakPolarHBondContact OG1-CG 3.47Å; T732-L734 PolarHBondContact OG1-N 3.3Å; L734-S736 VanDerWaalsContact C-N 3.26Å; L734-S736 PolarHBondContact O-N 2.92Å; L734-C737 PolarHBondContact O-N 3.21Å; L734-T738 WeakPolarHBondContact O-CB 3.36Å; L734-T738 PolarHBondContact O-N 3.08Å; L734-T738 PolarHBondContact O-OG1 3.11Å
735	L	76	Confident	84.5	Confident	52 Å²	52	36 Å²	36	27%	0.272	19%	0.189	S	C	.	.	H	α-helix	trans	-62.7	-30	178.1	-59.7	176.4	0	0	0	112.9	S598 L600 F706 F733	S598-L735 VanDerWaalsContact OG-CD1 3.25Å; S598-L735 WeakPolarHBondContact OG-CD1 3.25Å; L600-L735 HydrophobicContact CD1-CD1 4.33Å; F706-L735 HydrophobicContact CB-CD2 4.1Å; F706-L735 HydrophobicContact CD1-CD2 4.45Å; F706-L735 HydrophobicContact CD2-CD2 3.53Å; F706-L735 HydrophobicContact CE2-CD2 3.99Å; F706-L735 HydrophobicContact CG-CD2 3.79Å; F733-L735 VanDerWaalsContact C-N 3.34Å; F733-L735 PolarHBondContact O-N 3.36Å
736	S	76.3	Confident	85.1	Confident	53 Å²	53	36.9 Å²	36.9	37%	0.371	19%	0.192	S	C	.	.	H	α-helix	trans	-93.8	-15	-177.9	-44.8	0	0	0	0	114	F733 L734	F733-S736 PolarHBondContact O-N 3.12Å; L734-S736 VanDerWaalsContact C-N 3.26Å; L734-S736 PolarHBondContact O-N 2.92Å
737	C	80.5	Confident	85.9	Confident	17 Å²	17	42.4 Å²	42.4	12%	0.115	21%	0.209	C	C	.	.	H	α-helix	trans	-117	-13.2	-174.6	-59.7	0	0	0	0	114.1	R694 F733 L734	R694-C737 PolarHBondContact NH1-SG 3.28Å; F733-C737 WeakPolarHBondContact O-CB 3.35Å; F733-C737 PolarHBondContact O-N 3.09Å; F733-C737 PolarHBondContact O-SG 3.06Å; L734-C737 PolarHBondContact O-N 3.21Å
738	T	87.8	Confident	86.6	Confident	9 Å²	9	39 Å²	39	6%	0.055	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	123.9	-179.1	-40.6	0	0	0	0	109.6	L684 L698 L700 F706 L734 V740	L684-T738 HydrophobicContact CD1-CG2 4.14Å; L684-T738 HydrophobicContact CD2-CG2 4.26Å; L698-T738 HydrophobicContact CB-CG2 4.25Å; L700-T738 HydrophobicContact CB-CG2 3.71Å; F706-T738 HydrophobicContact CZ-CG2 4.18Å; L734-T738 WeakPolarHBondContact O-CB 3.36Å; L734-T738 PolarHBondContact O-N 3.08Å; L734-T738 PolarHBondContact O-OG1 3.11Å; T738-V740 PolarHBondContact O-N 3.01Å
739	R	89	Confident	87.1	Confident	82 Å²	82	37.6 Å²	37.6	31%	0.309	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	126	167.8	171.8	-178.4	160.8	-161.1	-2.5	109.1	P449 L698 T699 L700 V741	P449-R739 PolarHBondContact O-NH1 2.84Å; P449-R739 PolarHBondContact O-NH2 2.7Å; L698-R739 PolarHBondContact O-N 2.82Å; T699-R739 CarbonylContact C-O 3.59Å; T699-R739 VanDerWaalsContact CA-O 3.3Å; T699-R739 WeakPolarHBondContact CA-O 3.44Å; T699-R739 HydrophobicContact CG2-CG 4.44Å; L700-R739 PolarHBondContact N-O 3.22Å; R739-V741 HydrophobicContact CG-CG2 4.49Å
740	V	90.7	Very high	87.5	Confident	51 Å²	51	40.3 Å²	40.3	31%	0.309	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	143.2	169.4	-174.8	0	0	0	0	109.9	L700 G705 F706 T738 E742	L700-V740 CarbonylContact O-C 3.53Å; G705-V740 VanDerWaalsContact CA-CG1 3.48Å; F706-V740 HydrophobicContact CD2-CG2 3.45Å; F706-V740 VanDerWaalsContact CD2-CG2 3.45Å; F706-V740 HydrophobicContact CE2-CG2 3.56Å; T738-V740 PolarHBondContact O-N 3.01Å; V740-E742 HydrophobicContact CG1-CG 3.93Å
741	V	91.6	Very high	87.8	Confident	8 Å²	8	47.9 Å²	47.9	5%	0.048	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	115.8	163.9	177.5	0	0	0	0	107.4	T699 L700 I701 S702 R739 V757 V763	T699-V741 HydrophobicContact CG2-CG2 3.83Å; L700-V741 PolarHBondContact O-N 3.48Å; I701-V741 WeakPolarHBondContact CA-O 3.22Å; I701-V741 HydrophobicContact CG1-CB 4.31Å; S702-V741 PolarHBondContact N-O 2.88Å; S702-V741 VanDerWaalsContact N-O 3.11Å; R739-V741 HydrophobicContact CG-CG2 4.49Å; V741-V757 HydrophobicContact CG1-CG1 4.25Å; V741-V757 HydrophobicContact CG1-CG2 4.12Å; V741-V763 HydrophobicContact CG1-CG2 4.29Å; V741-V763 HydrophobicContact CG2-CG2 4.24Å
742	E	91.3	Very high	87.9	Confident	134 Å²	134	50.3 Å²	50.3	63%	0.626	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	125.7	-175.5	-66.4	177.8	-169.7	0	0	111.1	S702 V740	S702-E742 CarbonylContact O-C 3.54Å; S702-E742 VanDerWaalsContact O-CA 3.31Å; S702-E742 WeakPolarHBondContact O-CA 3.33Å; V740-E742 HydrophobicContact CG1-CG 3.93Å
743	G	90.3	Very high	88.3	Confident	11 Å²	11	52.3 Å²	52.3	11%	0.113	26%	0.257	C	S	.	.	S	Bend	trans	144.3	172.8	178.1	0	0	0	0	0	114.6	S702 S758	S702-G743 CarbonylContact C-O 3.6Å; S702-G743 PolarHBondContact O-N 2.89Å; G743-S758 WeakPolarHBondContact CA-OG 3.28Å
744	K	90.7	Very high	89	Confident	68 Å²	68	53.8 Å²	53.8	30%	0.296	26%	0.262	S	S	.	.			trans	-87.9	154	174.5	-72.5	-164.8	176.3	-167.3	0	111.6	T703 V757 S758 D945 D947	T703-K744 HydrophobicContact CG2-CG 3.77Å; K744-V757 CarbonylContact O-C 3.58Å; K744-V757 VanDerWaalsContact O-CA 3.31Å; K744-V757 WeakPolarHBondContact O-CA 3.26Å; K744-S758 PolarHBondContact N-OG 2.74Å; K744-S758 PolarHBondContact O-N 3.46Å; K744-D945 IonicContact NZ-OD1 3.5Å; K744-D945 PolarHBondContact NZ-OD1 2.83Å; K744-D947 WeakPolarHBondContact CD-OD2 3.44Å; K744-D947 IonicContact NZ-OD2 3.62Å
745	I	92.7	Very high	89.6	Confident	7 Å²	7	53.7 Å²	53.7	4%	0.036	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	129.7	169.1	60.2	161.8	0	0	0	110.7	V674 I701 I748 V755 D947 C948 S951	V674-I745 HydrophobicContact CG1-CD1 4.19Å; V674-I745 HydrophobicContact CG1-CG1 4.29Å; V674-I745 HydrophobicContact CG1-CG2 3.51Å; V674-I745 HydrophobicContact CG2-CG2 4.35Å; I701-I745 HydrophobicContact CG2-CG2 4.04Å; I745-I748 HydrophobicContact CD1-CD1 4.45Å; I745-V755 HydrophobicContact CB-CG1 4.06Å; I745-V755 HydrophobicContact CG2-CG1 3.51Å; I745-D947 CarbonylContact O-C 3.59Å; I745-D947 WeakPolarHBondContact O-CB 3.3Å; I745-C948 HydrophobicContact CD1-CB 4.46Å; I745-C948 HydrophobicContact CG1-CB 4.48Å; I745-S951 PolarHBondContact O-OG 3.48Å
746	V	92.4	Very high	90.5	Very high	61 Å²	61	53.2 Å²	53.2	37%	0.37	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	-27.7	-178	179.8	0	0	0	0	111.9	L756 S951	V746-L756 PolarHBondContact N-O 2.94Å; V746-S951 PolarHBondContact O-OG 3.21Å
747	R	93.7	Very high	91.3	Very high	146 Å²	146	50.8 Å²	50.8	55%	0.551	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-158.9	144.5	176.8	-173.1	177.5	178.5	124	1.9	111.8	L756 S951	R747-L756 HydrophobicContact CB-CB 4.07Å; R747-L756 HydrophobicContact CB-CD2 4.31Å; R747-L756 PolarHBondContact N-O 2.89Å; R747-L756 PolarHBondContact O-N 2.85Å; R747-S951 PolarHBondContact N-OG 3.16Å
748	I	95.3	Very high	91.8	Very high	6 Å²	6	53.5 Å²	53.5	3%	0.031	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.3	166.8	-59.2	166	0	0	0	108.2	I745 R750 V755 Y765 L768 L770 C955 I976	I745-I748 HydrophobicContact CD1-CD1 4.45Å; I748-R750 HydrophobicContact CG2-CG 4.29Å; I748-V755 HydrophobicContact CG1-CG2 4.46Å; I748-Y765 HydrophobicContact CG2-CE1 4.45Å; I748-L768 HydrophobicContact CD1-CD2 4.18Å; I748-L768 HydrophobicContact CG1-CD2 4.39Å; I748-L768 HydrophobicContact CG2-CD2 4Å; I748-L770 HydrophobicContact CD1-CD1 4.28Å; I748-L770 HydrophobicContact CD1-CD2 4.29Å; I748-C955 HydrophobicContact CB-CB 4.12Å; I748-C955 HydrophobicContact CG2-CB 4.45Å; I748-C955 WeakPolarHBondContact O-CB 3.45Å; I748-I976 HydrophobicContact CG2-CD1 4.26Å
749	D	93.4	Very high	91.7	Very high	34 Å²	34	57.6 Å²	57.6	18%	0.182	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	108.8	167	-174.1	-15	0	0	0	109.8	K751 S752 K753 Y754 Y765	D749-K751 PolarHBondContact OD1-N 3.39Å; D749-S752 VanDerWaalsContact CG-CB 3.48Å; D749-S752 VanDerWaalsContact CG-OG 3.3Å; D749-S752 PolarHBondContact OD1-N 2.92Å; D749-S752 WeakPolarHBondContact OD2-CB 3.44Å; D749-S752 PolarHBondContact OD2-OG 3.21Å; D749-K753 VanDerWaalsContact O-CA 3.27Å; D749-K753 WeakPolarHBondContact O-CA 3.41Å; D749-K753 PolarHBondContact O-N 3.09Å; D749-Y754 HydrophobicContact CB-CD1 4.15Å; D749-Y754 HydrophobicContact CB-CE1 3.88Å; D749-Y754 HydrophobicContact CB-CE2 4.32Å; D749-Y754 HydrophobicContact CB-CG 4.48Å; D749-Y754 PolarHBondContact N-O 3.07Å; D749-Y754 PolarHBondContact O-N 3.1Å; D749-Y765 PolarHBondContact O-OH 2.97Å
750	R	92	Very high	91.7	Very high	71 Å²	71	56 Å²	56	27%	0.268	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-29.3	179.3	-66	169.8	61.2	-172	-0.1	113.5	I748 C955 F956 D973 I976	I748-R750 HydrophobicContact CG2-CG 4.29Å; R750-C955 WeakPolarHBondContact CD-O 3.33Å; R750-C955 HydrophobicContact CG-CB 4.18Å; R750-C955 PolarHBondContact NH1-O 2.95Å; R750-F956 PolarHBondContact NH1-O 2.91Å; R750-D973 IonicContact CZ-OD2 3.53Å; R750-D973 VanDerWaalsContact CZ-OD2 3.24Å; R750-D973 IonicContact NE-OD2 3.53Å; R750-D973 PolarHBondContact NE-OD2 3.09Å; R750-D973 IonicContact NH2-OD2 3.54Å; R750-D973 PolarHBondContact NH2-OD2 3.1Å; R750-I976 HydrophobicContact CG-CD1 3.83Å
751	K	88.6	Confident	91.7	Very high	164 Å²	164	56.1 Å²	56.1	71%	0.713	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-37.6	-178.7	-177.7	179.2	178.4	-177.6	0	111.1	I382 D749	I382-K751 WeakPolarHBondContact CD1-O 3.49Å; D749-K751 PolarHBondContact OD1-N 3.39Å
752	S	87.9	Confident	91.7	Very high	69 Å²	69	59.9 Å²	59.9	48%	0.483	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	2	177.9	-44.6	0	0	0	0	113.2	D749 Y754	D749-S752 VanDerWaalsContact CG-CB 3.48Å; D749-S752 VanDerWaalsContact CG-OG 3.3Å; D749-S752 PolarHBondContact OD1-N 2.92Å; D749-S752 WeakPolarHBondContact OD2-CB 3.44Å; D749-S752 PolarHBondContact OD2-OG 3.21Å; S752-Y754 PolarHBondContact O-N 2.78Å
753	K	92.8	Very high	91.8	Very high	49 Å²	49	53.7 Å²	53.7	21%	0.213	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	44.1	54.5	-178.1	-79.2	-166.2	161.5	-153.2	0	114.2	L454 D749 A764 Y765 D766	L454-K753 HydrophobicContact CD1-CB 4.16Å; L454-K753 HydrophobicContact CD1-CD 4.03Å; D749-K753 VanDerWaalsContact O-CA 3.27Å; D749-K753 WeakPolarHBondContact O-CA 3.41Å; D749-K753 PolarHBondContact O-N 3.09Å; K753-A764 VanDerWaalsContact O-CA 3.31Å; K753-A764 WeakPolarHBondContact O-CA 3.45Å; K753-Y765 VanDerWaalsContact C-CE1 3.42Å; K753-Y765 HydrophobicContact CB-CE2 4.33Å; K753-Y765 WeakPolarHBondContact CB-O 3.06Å; K753-Y765 WeakPolarHBondContact CD-O 3.32Å; K753-Y765 HydrophobicContact CG-CE2 4.12Å; K753-Y765 PolarHBondContact O-N 3Å; K753-D766 PolarHBondContact NZ-O 3Å
754	Y	93.9	Very high	91.9	Very high	36 Å²	36	53.6 Å²	53.6	14%	0.141	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	153.6	171.6	76.3	-100.3	0	0	0	113.6	D749 S752 L756 K762 V763	D749-Y754 HydrophobicContact CB-CD1 4.15Å; D749-Y754 HydrophobicContact CB-CE1 3.88Å; D749-Y754 HydrophobicContact CB-CE2 4.32Å; D749-Y754 HydrophobicContact CB-CG 4.48Å; D749-Y754 PolarHBondContact N-O 3.07Å; D749-Y754 PolarHBondContact O-N 3.1Å; S752-Y754 PolarHBondContact O-N 2.78Å; Y754-L756 HydrophobicContact CE2-CB 4.44Å; Y754-K762 HydrophobicContact CD2-CB 3.95Å; Y754-K762 HydrophobicContact CD2-CD 4.09Å; Y754-K762 HydrophobicContact CD2-CG 3.92Å; Y754-K762 HydrophobicContact CE2-CB 4.41Å; Y754-K762 HydrophobicContact CE2-CD 3.78Å; Y754-K762 HydrophobicContact CE2-CG 3.88Å; Y754-K762 HydrophobicContact CG-CB 4.43Å; Y754-V763 CarbonylContact C-O 3.56Å; Y754-V763 VanDerWaalsContact CA-O 3.24Å; Y754-V763 WeakPolarHBondContact CA-O 3.25Å; Y754-V763 WeakPolarHBondContact CB-O 3.27Å
755	V	94.7	Very high	92.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	137.4	169.2	-176.8	0	0	0	0	108.9	I701 I745 I748 K762 V763 Y765 L768	I701-V755 HydrophobicContact CD1-CB 4.17Å; I701-V755 HydrophobicContact CD1-CG1 4.07Å; I745-V755 HydrophobicContact CB-CG1 4.06Å; I745-V755 HydrophobicContact CG2-CG1 3.51Å; I748-V755 HydrophobicContact CG1-CG2 4.46Å; V755-K762 CarbonylContact O-C 3.57Å; V755-K762 WeakPolarHBondContact O-CA 3.34Å; V755-V763 PolarHBondContact N-O 2.68Å; V755-V763 PolarHBondContact O-N 3.2Å; V755-Y765 HydrophobicContact CG2-CD1 3.99Å; V755-Y765 HydrophobicContact CG2-CE1 4.04Å; V755-L768 HydrophobicContact CG2-CD1 3.72Å; V755-L768 HydrophobicContact CG2-CD2 3.93Å
756	L	94.3	Very high	92.1	Very high	42 Å²	42	50.5 Å²	50.5	22%	0.22	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	124.7	170.4	-177.8	68.5	0	0	0	109.2	V746 R747 Y754 K762	V746-L756 PolarHBondContact N-O 2.94Å; R747-L756 HydrophobicContact CB-CB 4.07Å; R747-L756 HydrophobicContact CB-CD2 4.31Å; R747-L756 PolarHBondContact N-O 2.89Å; R747-L756 PolarHBondContact O-N 2.85Å; Y754-L756 HydrophobicContact CE2-CB 4.44Å; L756-K762 HydrophobicContact CD1-CG 3.9Å
757	V	93.5	Very high	92.2	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.012	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	159.6	178	-177.9	0	0	0	0	110.1	I701 V741 K744 D759 G760 Q761 V763	I701-V757 HydrophobicContact CD1-CG2 4.01Å; I701-V757 HydrophobicContact CG2-CG2 3.91Å; V741-V757 HydrophobicContact CG1-CG1 4.25Å; V741-V757 HydrophobicContact CG1-CG2 4.12Å; K744-V757 CarbonylContact O-C 3.58Å; K744-V757 VanDerWaalsContact O-CA 3.31Å; K744-V757 WeakPolarHBondContact O-CA 3.26Å; V757-D759 VanDerWaalsContact CB-OD1 3.31Å; V757-D759 WeakPolarHBondContact CB-OD1 3.45Å; V757-D759 WeakPolarHBondContact CG1-OD1 3.42Å; V757-D759 PolarHBondContact O-N 3.22Å; V757-G760 WeakPolarHBondContact O-CA 3.1Å; V757-G760 PolarHBondContact O-N 2.84Å; V757-Q761 PolarHBondContact N-O 2.97Å; V757-V763 HydrophobicContact CG2-CG2 4.26Å
758	S	91.2	Very high	92.3	Very high	73 Å²	73	41.9 Å²	41.9	51%	0.51	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-20.9	-175	52.7	0	0	0	0	115.5	G743 K744	G743-S758 WeakPolarHBondContact CA-OG 3.28Å; K744-S758 PolarHBondContact N-OG 2.74Å; K744-S758 PolarHBondContact O-N 3.46Å
759	D	86.7	Confident	92.4	Very high	95 Å²	95	41.6 Å²	41.6	51%	0.508	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-8	171.1	71.1	-29.4	0	0	0	113.2	V757 Q761	V757-D759 VanDerWaalsContact CB-OD1 3.31Å; V757-D759 WeakPolarHBondContact CB-OD1 3.45Å; V757-D759 WeakPolarHBondContact CG1-OD1 3.42Å; V757-D759 PolarHBondContact O-N 3.22Å; D759-Q761 WeakPolarHBondContact OD1-CB 3.35Å; D759-Q761 PolarHBondContact OD1-N 2.84Å; D759-Q761 WeakPolarHBondContact OD2-CB 3.35Å
760	G	88.2	Confident	92.5	Very high	49 Å²	49	40 Å²	40	51%	0.505	21%	0.213	S	C	.	.	S	Bend	trans	89.9	-1.6	-173.1	0	0	0	0	0	114.5	V757	V757-G760 WeakPolarHBondContact O-CA 3.1Å; V757-G760 PolarHBondContact O-N 2.84Å
761	Q	90.5	Very high	92.7	Very high	54 Å²	54	36.7 Å²	36.7	25%	0.252	20%	0.2	S	C	.	.			trans	-67.7	142.1	176.2	-176.2	168.2	123	0	0	110.9	V757 D759 V763	V757-Q761 PolarHBondContact N-O 2.97Å; D759-Q761 WeakPolarHBondContact OD1-CB 3.35Å; D759-Q761 PolarHBondContact OD1-N 2.84Å; D759-Q761 WeakPolarHBondContact OD2-CB 3.35Å; Q761-V763 HydrophobicContact CG-CG2 4.35Å
762	K	92.4	Very high	92.8	Very high	86 Å²	86	30.3 Å²	30.3	37%	0.374	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	125.1	173.7	-63.4	179.4	-176.8	-177.1	0	108.9	L452 Y754 V755 L756	L452-K762 HydrophobicContact CD1-CB 4.2Å; L452-K762 HydrophobicContact CD1-CD 4.01Å; L452-K762 HydrophobicContact CD2-CB 3.74Å; Y754-K762 HydrophobicContact CD2-CB 3.95Å; Y754-K762 HydrophobicContact CD2-CD 4.09Å; Y754-K762 HydrophobicContact CD2-CG 3.92Å; Y754-K762 HydrophobicContact CE2-CB 4.41Å; Y754-K762 HydrophobicContact CE2-CD 3.78Å; Y754-K762 HydrophobicContact CE2-CG 3.88Å; Y754-K762 HydrophobicContact CG-CB 4.43Å; V755-K762 CarbonylContact O-C 3.57Å; V755-K762 WeakPolarHBondContact O-CA 3.34Å; L756-K762 HydrophobicContact CD1-CG 3.9Å
763	V	92.9	Very high	92.9	Very high	4 Å²	4	27.4 Å²	27.4	2%	0.024	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	114.2	179.8	-174.9	0	0	0	0	108.4	V672 T699 I701 V741 Y754 V755 V757 Q761	V672-V763 HydrophobicContact CG1-CG1 4.34Å; V672-V763 HydrophobicContact CG2-CG1 3.86Å; T699-V763 HydrophobicContact CG2-CG1 4.06Å; I701-V763 HydrophobicContact CD1-CB 4.15Å; I701-V763 HydrophobicContact CD1-CG1 4.38Å; I701-V763 HydrophobicContact CD1-CG2 4.12Å; V741-V763 HydrophobicContact CG1-CG2 4.29Å; V741-V763 HydrophobicContact CG2-CG2 4.24Å; Y754-V763 CarbonylContact C-O 3.56Å; Y754-V763 VanDerWaalsContact CA-O 3.24Å; Y754-V763 WeakPolarHBondContact CA-O 3.25Å; Y754-V763 WeakPolarHBondContact CB-O 3.27Å; V755-V763 PolarHBondContact N-O 2.68Å; V755-V763 PolarHBondContact O-N 3.2Å; V757-V763 HydrophobicContact CG2-CG2 4.26Å; Q761-V763 HydrophobicContact CG-CG2 4.35Å
764	A	92.3	Very high	92.8	Very high	9 Å²	9	27 Å²	27	7%	0.074	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	144.2	177.5	0	0	0	0	0	111.9	L452 L454 S670 K753	L452-A764 HydrophobicContact CD2-CB 3.93Å; L454-A764 HydrophobicContact CD2-CB 4.03Å; S670-A764 PolarHBondContact OG-O 2.98Å; K753-A764 VanDerWaalsContact O-CA 3.31Å; K753-A764 WeakPolarHBondContact O-CA 3.45Å
765	Y	94.2	Very high	92.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.161	C	C	.	.			trans	-131.1	142.4	-178.2	62.7	-93.9	0	0	0	112	I748 D749 K753 V755 L768 I976	I748-Y765 HydrophobicContact CG2-CE1 4.45Å; D749-Y765 PolarHBondContact O-OH 2.97Å; K753-Y765 VanDerWaalsContact C-CE1 3.42Å; K753-Y765 HydrophobicContact CB-CE2 4.33Å; K753-Y765 WeakPolarHBondContact CB-O 3.06Å; K753-Y765 WeakPolarHBondContact CD-O 3.32Å; K753-Y765 HydrophobicContact CG-CE2 4.12Å; K753-Y765 PolarHBondContact O-N 3Å; V755-Y765 HydrophobicContact CG2-CD1 3.99Å; V755-Y765 HydrophobicContact CG2-CE1 4.04Å; Y765-L768 HydrophobicContact CD1-CB 4.33Å; Y765-L768 HydrophobicContact CD1-CD2 4.41Å; Y765-L768 HydrophobicContact CD2-CB 3.67Å; Y765-L768 HydrophobicContact CE1-CD2 4.02Å; Y765-L768 HydrophobicContact CE2-CB 3.87Å; Y765-L768 HydrophobicContact CE2-CD2 4.44Å; Y765-L768 HydrophobicContact CG-CB 3.91Å; Y765-I976 HydrophobicContact CE2-CG1 4.31Å
766	D	92.8	Very high	92.3	Very high	10 Å²	10	28.6 Å²	28.6	5%	0.053	17%	0.165	C	C	.	.	S	Bend	trans	-84.3	-42.7	158.6	-73.3	-59.1	0	0	0	109.4	S431 A432 A669 S670 K753	S431-D766 VanDerWaalsContact CB-OD2 3.27Å; S431-D766 WeakPolarHBondContact CB-OD2 3.34Å; S431-D766 PolarHBondContact OG-OD1 3.2Å; S431-D766 PolarHBondContact OG-OD2 3.38Å; A432-D766 HydrophobicContact CB-CB 4.29Å; A669-D766 WeakPolarHBondContact CA-OD2 3.29Å; A669-D766 HydrophobicContact CB-CB 4.13Å; S670-D766 PolarHBondContact N-OD2 2.74Å; S670-D766 PolarHBondContact O-N 3.26Å; K753-D766 PolarHBondContact NZ-O 3Å
767	F	94.7	Very high	91.9	Very high	26 Å²	26	30.4 Å²	30.4	11%	0.114	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	131.5	178	-57.7	-86.6	0	0	0	110.2	A669 S670 V672 Y977 L1012 L1016	A669-F767 HydrophobicContact CB-CD2 3.96Å; A669-F767 HydrophobicContact CB-CE2 3.8Å; S670-F767 PolarHBondContact O-N 3.37Å; V672-F767 PolarHBondContact N-O 2.92Å; F767-Y977 HydrophobicContact CD1-CE2 4.07Å; F767-L1012 HydrophobicContact CB-CD2 4.47Å; F767-L1012 HydrophobicContact CD1-CD2 4.17Å; F767-L1012 HydrophobicContact CG-CD2 4.4Å; F767-L1016 HydrophobicContact CE2-CD2 3.74Å; F767-L1016 HydrophobicContact CZ-CD2 4.1Å
768	L	96.6	Very high	91.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.9	178.7	178.9	65.3	0	0	0	109.8	V672 V674 I748 V755 Y765 L770 S975 I976 Y977	V672-L768 HydrophobicContact CB-CD1 3.98Å; V672-L768 HydrophobicContact CG1-CD1 3.84Å; V672-L768 CarbonylContact O-C 3.39Å; V672-L768 WeakPolarHBondContact O-CA 3.36Å; V674-L768 HydrophobicContact CG2-CD1 3.66Å; I748-L768 HydrophobicContact CD1-CD2 4.18Å; I748-L768 HydrophobicContact CG1-CD2 4.39Å; I748-L768 HydrophobicContact CG2-CD2 4Å; V755-L768 HydrophobicContact CG2-CD1 3.72Å; V755-L768 HydrophobicContact CG2-CD2 3.93Å; Y765-L768 HydrophobicContact CD1-CB 4.33Å; Y765-L768 HydrophobicContact CD1-CD2 4.41Å; Y765-L768 HydrophobicContact CD2-CB 3.67Å; Y765-L768 HydrophobicContact CE1-CD2 4.02Å; Y765-L768 HydrophobicContact CE2-CB 3.87Å; Y765-L768 HydrophobicContact CE2-CD2 4.44Å; Y765-L768 HydrophobicContact CG-CB 3.91Å; L768-L770 HydrophobicContact CD1-CD2 4.37Å; L768-L770 HydrophobicContact CD2-CD2 4.21Å; L768-L770 HydrophobicContact CG-CD2 4.12Å; L768-S975 PolarHBondContact N-O 3.44Å; L768-I976 HydrophobicContact CB-CG1 4.23Å; L768-I976 HydrophobicContact CB-CG2 4.45Å; L768-I976 HydrophobicContact CD2-CD1 4.21Å; L768-I976 HydrophobicContact CD2-CG1 4.22Å; L768-I976 HydrophobicContact CD2-CG2 4.18Å; L768-I976 HydrophobicContact CG-CG2 4.36Å; L768-I976 WeakPolarHBondContact O-CA 3.04Å; L768-Y977 PolarHBondContact O-N 3.03Å
769	V	97.2	Very high	91.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	120.6	177.5	-165.5	0	0	0	0	110.2	V672 V673 V674 L683 V1008 L1012	V672-V769 PolarHBondContact O-N 3.23Å; V673-V769 HydrophobicContact CG2-CB 4.5Å; V674-V769 PolarHBondContact N-O 2.95Å; L683-V769 HydrophobicContact CD2-CB 4.04Å; L683-V769 HydrophobicContact CD2-CG1 3.8Å; L683-V769 HydrophobicContact CD2-CG2 4Å; V769-V1008 HydrophobicContact CG1-CG1 4.02Å; V769-L1012 HydrophobicContact CG2-CD1 4.14Å
770	L	96.3	Very high	90.9	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	107.5	-178.3	-57.9	179	0	0	0	110.2	V674 I748 L768 I952 L957 L963 I976 Y977 A979 L982	V674-L770 HydrophobicContact CB-CD2 4.05Å; V674-L770 HydrophobicContact CG2-CD2 3.91Å; I748-L770 HydrophobicContact CD1-CD1 4.28Å; I748-L770 HydrophobicContact CD1-CD2 4.29Å; L768-L770 HydrophobicContact CD1-CD2 4.37Å; L768-L770 HydrophobicContact CD2-CD2 4.21Å; L768-L770 HydrophobicContact CG-CD2 4.12Å; L770-I952 HydrophobicContact CD1-CD1 4.22Å; L770-I952 HydrophobicContact CD1-CG1 4.09Å; L770-L957 HydrophobicContact CD1-CD1 4.47Å; L770-L963 HydrophobicContact CB-CD2 4.15Å; L770-L963 HydrophobicContact CD1-CD2 3.82Å; L770-I976 HydrophobicContact CD1-CG2 4.04Å; L770-I976 HydrophobicContact CG-CG2 4.27Å; L770-Y977 PolarHBondContact N-O 2.86Å; L770-A979 PolarHBondContact O-N 2.93Å; L770-L982 HydrophobicContact CB-CD2 3.74Å
771	C	94.9	Very high	90.8	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.007	13%	0.129	C	C	.	.			trans	-124.9	24.6	-174.6	-66.4	0	0	0	0	112.6	V673 V674 S677 G773	V673-C771 HydrophobicContact CG1-CB 4.43Å; V674-C771 CarbonylContact O-C 3.36Å; V674-C771 VanDerWaalsContact O-CA 3.28Å; V674-C771 WeakPolarHBondContact O-CA 3.15Å; V674-C771 WeakPolarHBondContact O-CB 3.31Å; V674-C771 PolarHBondContact O-N 3.5Å; S677-C771 WeakPolarHBondContact CB-O 3.35Å; S677-C771 PolarHBondContact OG-O 3.2Å; C771-G773 PolarHBondContact O-N 3.29Å
772	T	91	Very high	90.4	Very high	31 Å²	31	23.6 Å²	23.6	19%	0.19	12%	0.121	C	C	.	.			trans	-68.2	-3.2	-171.3	53.2	0	0	0	0	115.8	V674 C948	V674-T772 HydrophobicContact CB-CG2 4.38Å; V674-T772 HydrophobicContact CG1-CG2 3.7Å; V674-T772 PolarHBondContact O-N 3.3Å; T772-C948 PolarHBondContact OG1-SG 3.43Å
773	G	90.3	Very high	89.8	Confident	8 Å²	8	22 Å²	22	8%	0.082	13%	0.129	C	C	.	.			trans	65.3	-138	175.9	0	0	0	0	0	113.4	C771	C771-G773 PolarHBondContact O-N 3.29Å
774	L	90.3	Very high	89.3	Confident	40 Å²	40	23.6 Å²	23.6	21%	0.209	14%	0.139	C	C	.	.			trans	-137.8	151.7	172.8	-58.7	171.4	0	0	0	108	E942 G943 V944 P981	L774-E942 HydrophobicContact CB-CB 3.91Å; L774-E942 HydrophobicContact CD1-CB 4.42Å; L774-G943 CarbonylContact C-O 3.58Å; L774-G943 VanDerWaalsContact CA-O 3.31Å; L774-G943 WeakPolarHBondContact CA-O 3.46Å; L774-V944 HydrophobicContact CD2-CG2 3.93Å; L774-P981 HydrophobicContact CD1-CB 3.99Å; L774-P981 HydrophobicContact CG-CB 3.94Å
775	Q	89.5	Confident	88.7	Confident	52 Å²	52	26.3 Å²	26.3	24%	0.243	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	151.9	-179.6	-67.4	-178.1	-10.4	0	0	110.5	R777 E942 G943 D945	Q775-R777 PolarHBondContact O-N 2.77Å; Q775-E942 CarbonylContact O-C 3.51Å; Q775-E942 VanDerWaalsContact O-CA 3.25Å; Q775-E942 WeakPolarHBondContact O-CA 3.25Å; Q775-G943 PolarHBondContact N-O 3.37Å; Q775-G943 PolarHBondContact O-N 3.47Å; Q775-D945 PolarHBondContact OE1-OD1 3.04Å
776	Y	89.4	Confident	87.8	Confident	18 Å²	18	27.4 Å²	27.4	7%	0.071	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	121.5	175.5	-79.1	-74.6	0	0	0	110.6	I815 S816 T845 D847 L939 E942	Y776-I815 WeakPolarHBondContact CD2-O 3.25Å; Y776-S816 PolarHBondContact N-OG 3.4Å; Y776-T845 HydrophobicContact CE1-CG2 4.19Å; Y776-T845 WeakPolarHBondContact OH-CB 3.38Å; Y776-T845 WeakPolarHBondContact OH-CG2 3.39Å; Y776-T845 PolarHBondContact OH-OG1 3.48Å; Y776-D847 PolarHBondContact OH-OD2 2.75Å; Y776-L939 HydrophobicContact CD1-CB 4.4Å; Y776-L939 HydrophobicContact CD1-CD2 4.19Å; Y776-L939 HydrophobicContact CD2-CD2 3.67Å; Y776-L939 VanDerWaalsContact CE1-C 3.41Å; Y776-L939 VanDerWaalsContact CE1-CA 3.49Å; Y776-L939 HydrophobicContact CE1-CB 3.99Å; Y776-L939 HydrophobicContact CE1-CD2 4.12Å; Y776-L939 WeakPolarHBondContact CE1-O 3.38Å; Y776-L939 HydrophobicContact CE2-CD2 3.58Å; Y776-L939 HydrophobicContact CG-CD2 3.95Å; Y776-E942 HydrophobicContact CD1-CG 4.16Å; Y776-E942 HydrophobicContact CE1-CG 3.86Å; Y776-E942 HydrophobicContact CE2-CG 4.47Å
777	R	85.9	Confident	86.9	Confident	79 Å²	79	31.6 Å²	31.6	30%	0.298	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-87.7	150.6	-175.7	-56.3	179.6	-62	156.2	12.5	110.7	Q775 N938 S941	Q775-R777 PolarHBondContact O-N 2.77Å; R777-N938 PolarHBondContact O-ND2 2.9Å; R777-S941 PolarHBondContact N-O 3.31Å; R777-S941 PolarHBondContact NE-OG 3.25Å; R777-S941 PolarHBondContact NH2-OG 2.86Å
778	L	84.3	Confident	85.9	Confident	46 Å²	46	35.5 Å²	35.5	24%	0.241	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-60.3	136.5	170.1	-64.3	172.2	0	0	0	110.9	Y804 V808 L812 T814	L778-Y804 HydrophobicContact CB-CD1 4.3Å; L778-Y804 HydrophobicContact CB-CG 4.49Å; L778-Y804 HydrophobicContact CD1-CD1 3.92Å; L778-V808 HydrophobicContact CD1-CB 4.41Å; L778-V808 HydrophobicContact CD1-CG1 4.09Å; L778-V808 HydrophobicContact CD1-CG2 3.61Å; L778-V808 HydrophobicContact CD2-CG1 3.86Å; L778-L812 HydrophobicContact CD2-CD1 4.28Å; L778-L812 HydrophobicContact CD2-CD2 3.67Å; L778-T814 HydrophobicContact CD2-CG2 3.98Å
779	P	82.9	Confident	84.5	Confident	11 Å²	11	41 Å²	41	7%	0.071	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-75.6	129.9	-179.8	32.6	-31.8	0	0	0	109.4	P781 Y842 L905 F936 N938	P779-P781 WeakPolarHBondContact O-CD 3.45Å; P779-Y842 HydrophobicContact CB-CD1 4.43Å; P779-Y842 HydrophobicContact CB-CE1 4.34Å; P779-L905 HydrophobicContact CB-CD2 3.87Å; P779-L905 HydrophobicContact CG-CD2 3.87Å; P779-F936 HydrophobicContact CG-CE1 4.03Å; P779-N938 WeakPolarHBondContact CD-ND2 3.26Å; P779-N938 HydrophobicContact CG-CB 4.2Å
780	C	82.3	Confident	83.5	Confident	33 Å²	33	42.5 Å²	42.5	22%	0.223	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-87.1	117.6	172.4	-168.4	0	0	0	0	109.2	R802	C780-R802 HydrophobicContact CB-CB 3.97Å
781	P	85.4	Confident	82.8	Confident	26 Å²	26	44.1 Å²	44.1	17%	0.169	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-62.4	145.2	173.1	-18.8	32.2	0	0	0	110.5	P779 G783 L905 A906 I908	P779-P781 WeakPolarHBondContact O-CD 3.45Å; P781-G783 PolarHBondContact O-N 3.37Å; P781-L905 WeakPolarHBondContact CA-O 3.32Å; P781-L905 HydrophobicContact CB-CG 4.34Å; P781-L905 HydrophobicContact CG-CD2 4.11Å; P781-L905 HydrophobicContact CG-CG 4.41Å; P781-A906 VanDerWaalsContact CB-O 3.25Å; P781-A906 WeakPolarHBondContact CB-O 3.32Å; P781-I908 HydrophobicContact CG-CD1 3.92Å; P781-I908 HydrophobicContact CG-CG1 4Å
782	T	83.9	Confident	82.1	Confident	15 Å²	15	45.2 Å²	45.2	9%	0.092	27%	0.268	C	S	.	.			trans	-67.6	-22.9	179.6	65.6	0	0	0	0	112.9	V784 L795 W799 R802 V904 L905 A906	T782-V784 VanDerWaalsContact C-N 3.3Å; T782-V784 WeakPolarHBondContact OG1-CG2 3.47Å; T782-V784 PolarHBondContact OG1-N 2.84Å; T782-L795 HydrophobicContact CG2-CD2 4.29Å; T782-W799 HydrophobicContact CG2-CB 4.17Å; T782-W799 HydrophobicContact CG2-CG 4.42Å; T782-R802 PolarHBondContact O-NH1 3.18Å; T782-R802 VanDerWaalsContact O-NH1 3.13Å; T782-V904 HydrophobicContact CG2-CG1 3.77Å; T782-L905 PolarHBondContact N-O 3.36Å; T782-A906 PolarHBondContact N-O 3.06Å; T782-A906 WeakPolarHBondContact OG1-CA 3.5Å
783	G	79.9	Confident	81.3	Confident	53 Å²	53	48.8 Å²	48.8	55%	0.546	29%	0.294	S	S	.	.			trans	85.5	-2.4	-177	0	0	0	0	0	114	P781 D785 A906	P781-G783 PolarHBondContact O-N 3.37Å; G783-D785 PolarHBondContact O-N 3.26Å; G783-A906 PolarHBondContact N-O 3.3Å
784	V	82.3	Confident	80.5	Confident	37 Å²	37	54.1 Å²	54.1	22%	0.224	32%	0.317	C	S	.	.			trans	-63.3	130.6	-177.6	172.3	0	0	0	0	110.9	T782 V786 V790 L795 A906 Q907 T923	T782-V784 VanDerWaalsContact C-N 3.3Å; T782-V784 WeakPolarHBondContact OG1-CG2 3.47Å; T782-V784 PolarHBondContact OG1-N 2.84Å; V784-V786 VanDerWaalsContact O-CG2 3.31Å; V784-V786 WeakPolarHBondContact O-CG2 3.47Å; V784-V786 PolarHBondContact O-N 2.84Å; V784-V790 HydrophobicContact CG1-CB 3.72Å; V784-V790 HydrophobicContact CG1-CG1 3.81Å; V784-V790 HydrophobicContact CG1-CG2 3.79Å; V784-L795 HydrophobicContact CG2-CD2 3.94Å; V784-A906 HydrophobicContact CB-CB 4.48Å; V784-Q907 WeakPolarHBondContact O-CG 3.45Å; V784-Q907 PolarHBondContact O-NE2 3Å; V784-T923 HydrophobicContact CG1-CG2 4.27Å
785	D	78.3	Confident	79.9	Confident	65 Å²	65	53.2 Å²	53.2	35%	0.348	31%	0.312	S	S	.	.			trans	-68.2	113.2	174.8	173.5	11.9	0	0	0	110.9	G783 S787 Q788	G783-D785 PolarHBondContact O-N 3.26Å; D785-S787 VanDerWaalsContact C-N 3.26Å; D785-S787 PolarHBondContact O-N 3.43Å; D785-S787 VanDerWaalsContact OD1-CB 3.29Å; D785-S787 WeakPolarHBondContact OD1-CB 3.4Å; D785-S787 PolarHBondContact OD1-N 2.93Å; D785-S787 PolarHBondContact OD1-OG 2.88Å; D785-S787 PolarHBondContact OD2-OG 3.12Å; D785-Q788 PolarHBondContact O-N 3.36Å; D785-Q788 PolarHBondContact OD2-NE2 2.9Å
786	V	75.3	Confident	79.1	Confident	24 Å²	24	54 Å²	54	15%	0.145	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-4.7	-173.1	-164.9	0	0	0	0	112.4	V784 Q788 A906 Q907 P928	V784-V786 VanDerWaalsContact O-CG2 3.31Å; V784-V786 WeakPolarHBondContact O-CG2 3.47Å; V784-V786 PolarHBondContact O-N 2.84Å; V786-Q788 PolarHBondContact O-N 3.35Å; V786-A906 HydrophobicContact CG2-CB 3.6Å; V786-Q907 HydrophobicContact CG2-CB 4.47Å; V786-Q907 HydrophobicContact CG2-CG 4.23Å; V786-P928 HydrophobicContact CG1-CB 3.29Å; V786-P928 HydrophobicContact CG1-CG 3.95Å
787	S	74.4	Confident	78.1	Confident	98 Å²	98	57.8 Å²	57.8	69%	0.685	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-13.1	167.6	74.3	0	0	0	0	113	D785	D785-S787 VanDerWaalsContact C-N 3.26Å; D785-S787 PolarHBondContact O-N 3.43Å; D785-S787 VanDerWaalsContact OD1-CB 3.29Å; D785-S787 WeakPolarHBondContact OD1-CB 3.4Å; D785-S787 PolarHBondContact OD1-N 2.93Å; D785-S787 PolarHBondContact OD1-OG 2.88Å; D785-S787 PolarHBondContact OD2-OG 3.12Å
788	Q	73.4	Confident	77.2	Confident	108 Å²	108	58.7 Å²	58.7	51%	0.505	36%	0.356	S	S	.	.	S	Bend	trans	-104.1	144.6	177.5	-58.9	177.6	47.4	0	0	110	D785 V786 V790	D785-Q788 PolarHBondContact O-N 3.36Å; D785-Q788 PolarHBondContact OD2-NE2 2.9Å; V786-Q788 PolarHBondContact O-N 3.35Å; Q788-V790 HydrophobicContact CB-CG2 4.12Å; Q788-V790 PolarHBondContact O-N 2.95Å
789	P	68.3	Low	76.5	Confident	115 Å²	115	59.6 Å²	59.6	75%	0.747	36%	0.356	S	S	*	.			trans	-77.1	70.2	-177.5	32.6	-36.3	0	0	0	111.4
790	V	75.8	Confident	75.5	Confident	32 Å²	32	64.7 Å²	64.7	19%	0.194	38%	0.377	C	S	.	.			trans	-94.3	120.9	178.1	-172.5	0	0	0	0	109.8	V784 Q788 Q794 T923	V784-V790 HydrophobicContact CG1-CB 3.72Å; V784-V790 HydrophobicContact CG1-CG1 3.81Å; V784-V790 HydrophobicContact CG1-CG2 3.79Å; Q788-V790 HydrophobicContact CB-CG2 4.12Å; Q788-V790 PolarHBondContact O-N 2.95Å; V790-Q794 HydrophobicContact CG1-CB 3.99Å; V790-T923 WeakPolarHBondContact O-CG2 3.32Å
791	T	80.9	Confident	74.7	Confident	34 Å²	34	66.6 Å²	66.6	21%	0.209	39%	0.39	C	S	.	.			trans	-91.8	161	178.1	65.5	0	0	0	0	111.5	S793 Q794 S924	T791-S793 PolarHBondContact O-N 3.09Å; T791-S793 PolarHBondContact OG1-OG 3.14Å; T791-Q794 PolarHBondContact O-N 2.66Å; T791-Q794 PolarHBondContact OG1-OE1 3.4Å; T791-S924 WeakPolarHBondContact CA-O 3.43Å
792	N	80.5	Confident	74.1	Confident	25 Å²	25	70.3 Å²	70.3	13%	0.134	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-51.8	-28.7	173.5	-69.7	-26.1	0	0	0	114	Q794 L795 N902 T923 S924 D925	N792-Q794 PolarHBondContact O-N 2.88Å; N792-L795 HydrophobicContact CB-CD1 4.49Å; N792-L795 PolarHBondContact O-N 3.27Å; N792-N902 PolarHBondContact ND2-O 3.45Å; N792-T923 PolarHBondContact OD1-O 2.84Å; N792-T923 PolarHBondContact OD1-OG1 3.12Å; N792-S924 PolarHBondContact N-O 2.97Å; N792-D925 PolarHBondContact ND2-N 3.31Å; N792-D925 PolarHBondContact ND2-OD1 3.31Å
793	S	73.9	Confident	73.5	Confident	106 Å²	106	74.7 Å²	74.7	74%	0.741	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-67.8	-14	178.9	74.4	0	0	0	0	114.7	T791	T791-S793 PolarHBondContact O-N 3.09Å; T791-S793 PolarHBondContact OG1-OG 3.14Å
794	Q	74.1	Confident	73.4	Confident	120 Å²	120	74.2 Å²	74.2	56%	0.561	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-108.3	4.6	-176	-66	157.3	-56.5	0	0	112.7	V790 T791 N792	V790-Q794 HydrophobicContact CG1-CB 3.99Å; T791-Q794 PolarHBondContact O-N 2.66Å; T791-Q794 PolarHBondContact OG1-OE1 3.4Å; N792-Q794 PolarHBondContact O-N 2.88Å
795	L	77.3	Confident	73.1	Confident	21 Å²	21	79.7 Å²	79.7	11%	0.11	42%	0.422	C	S	.	.	S	Bend	trans	-75.2	149.1	176.5	-61	177.7	0	0	0	111.6	T782 V784 N792 V904 T923	T782-L795 HydrophobicContact CG2-CD2 4.29Å; V784-L795 HydrophobicContact CG2-CD2 3.94Å; N792-L795 HydrophobicContact CB-CD1 4.49Å; N792-L795 PolarHBondContact O-N 3.27Å; L795-V904 HydrophobicContact CD1-CB 3.92Å; L795-V904 HydrophobicContact CD1-CG1 3.89Å; L795-V904 HydrophobicContact CD1-CG2 3.96Å; L795-T923 HydrophobicContact CD2-CG2 4.32Å
796	D	73.4	Confident	73.1	Confident	67 Å²	67	78.3 Å²	78.3	36%	0.358	42%	0.423	S	S	.	.			trans	-54.6	119.9	166.4	166.5	18.8	0	0	0	109.8	D798 W799 R802	D796-D798 PolarHBondContact O-N 2.91Å; D796-D798 VanDerWaalsContact O-N 3.11Å; D796-D798 PolarHBondContact OD1-N 2.93Å; D796-D798 VanDerWaalsContact OD1-N 3.13Å; D796-W799 VanDerWaalsContact O-CB 3.32Å; D796-W799 WeakPolarHBondContact O-CB 3.39Å; D796-W799 PolarHBondContact O-N 3.16Å; D796-R802 IonicContact OD2-CZ 3.44Å; D796-R802 IonicContact OD2-NE 2.7Å; D796-R802 PolarHBondContact OD2-NE 3.24Å; D796-R802 IonicContact OD2-NH2 3.76Å; D796-R802 PolarHBondContact OD2-NH2 2.96Å
797	P	67.9	Low	73.3	Confident	99 Å²	99	81.2 Å²	81.2	64%	0.643	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-57.6	-29.5	-175	23	-34.2	0	0	0	113.4	W799 F800	P797-W799 VanDerWaalsContact C-N 3.25Å; P797-W799 PolarHBondContact O-N 3.21Å; P797-F800 VanDerWaalsContact O-CD1 3.26Å; P797-F800 WeakPolarHBondContact O-CD1 3.2Å; P797-F800 WeakPolarHBondContact O-CE1 3.38Å
798	D	67.8	Low	73.8	Confident	98 Å²	98	80.4 Å²	80.4	52%	0.524	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-84.4	12	179.5	-74.8	-43	0	0	0	113.7	D796 F800 C801	D796-D798 PolarHBondContact O-N 2.91Å; D796-D798 VanDerWaalsContact O-N 3.11Å; D796-D798 PolarHBondContact OD1-N 2.93Å; D796-D798 VanDerWaalsContact OD1-N 3.13Å; D798-F800 PolarHBondContact O-N 3.26Å; D798-F800 VanDerWaalsContact O-N 3.1Å; D798-C801 WeakPolarHBondContact O-CB 3.49Å; D798-C801 PolarHBondContact O-N 3.26Å
799	W	67.9	Low	74.6	Confident	64 Å²	64	75.4 Å²	75.4	24%	0.242	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-53.9	-35.2	-178.7	73.3	-99.2	0	0	0	113.5	T782 D796 P797 C801 R802 V904	T782-W799 HydrophobicContact CG2-CB 4.17Å; T782-W799 HydrophobicContact CG2-CG 4.42Å; D796-W799 VanDerWaalsContact O-CB 3.32Å; D796-W799 WeakPolarHBondContact O-CB 3.39Å; D796-W799 PolarHBondContact O-N 3.16Å; P797-W799 VanDerWaalsContact C-N 3.25Å; P797-W799 PolarHBondContact O-N 3.21Å; W799-C801 VanDerWaalsContact C-N 3.27Å; W799-C801 PolarHBondContact O-N 3.1Å; W799-R802 WeakPolarHBondContact O-CB 3.22Å; W799-R802 PolarHBondContact O-N 3.17Å; W799-V904 HydrophobicContact CD2-CG1 3.91Å; W799-V904 HydrophobicContact CE3-CG1 3.8Å; W799-V904 HydrophobicContact CH2-CB 4.44Å; W799-V904 HydrophobicContact CH2-CG1 3.7Å; W799-V904 HydrophobicContact CH2-CG2 3.99Å; W799-V904 HydrophobicContact CZ2-CB 4.38Å; W799-V904 HydrophobicContact CZ2-CG1 3.79Å; W799-V904 HydrophobicContact CZ2-CG2 3.61Å; W799-V904 HydrophobicContact CZ3-CG1 3.7Å
800	F	63.4	Low	75.5	Confident	119 Å²	119	73.1 Å²	73.1	52%	0.522	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-74.3	-14.1	-179.5	68.5	-93.1	0	0	0	114.1	P797 D798	P797-F800 VanDerWaalsContact O-CD1 3.26Å; P797-F800 WeakPolarHBondContact O-CD1 3.2Å; P797-F800 WeakPolarHBondContact O-CE1 3.38Å; D798-F800 PolarHBondContact O-N 3.26Å; D798-F800 VanDerWaalsContact O-N 3.1Å
801	C	63.9	Low	76.3	Confident	72 Å²	72	72.1 Å²	72.1	49%	0.486	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-84.2	-19.9	174.4	-69.9	0	0	0	0	112.6	D798 W799	D798-C801 WeakPolarHBondContact O-CB 3.49Å; D798-C801 PolarHBondContact O-N 3.26Å; W799-C801 VanDerWaalsContact C-N 3.27Å; W799-C801 PolarHBondContact O-N 3.1Å
802	R	73.1	Confident	76.9	Confident	105 Å²	105	71 Å²	71	40%	0.396	39%	0.388	S	S	.	.			trans	-64.5	141.5	-178	-60	179.1	177	-164.8	-1.6	111	C780 T782 D796 W799	C780-R802 HydrophobicContact CB-CB 3.97Å; T782-R802 PolarHBondContact O-NH1 3.18Å; T782-R802 VanDerWaalsContact O-NH1 3.13Å; D796-R802 IonicContact OD2-CZ 3.44Å; D796-R802 IonicContact OD2-NE 2.7Å; D796-R802 PolarHBondContact OD2-NE 3.24Å; D796-R802 IonicContact OD2-NH2 3.76Å; D796-R802 PolarHBondContact OD2-NH2 2.96Å; W799-R802 WeakPolarHBondContact O-CB 3.22Å; W799-R802 PolarHBondContact O-N 3.17Å
803	R	72.3	Confident	77.5	Confident	107 Å²	107	71.2 Å²	71.2	40%	0.404	39%	0.388	S	S	.	.			trans	-109.5	136.7	175.9	-61.6	-174.5	-174.5	-170.4	0.8	109.4
804	Y	78.5	Confident	78.3	Confident	43 Å²	43	68 Å²	68	17%	0.169	37%	0.365	C	S	.	.			trans	-70.8	130	172.2	-175.8	-101	0	0	0	109.9	L778 G806 P807	L778-Y804 HydrophobicContact CB-CD1 4.3Å; L778-Y804 HydrophobicContact CB-CG 4.49Å; L778-Y804 HydrophobicContact CD1-CD1 3.92Å; Y804-G806 VanDerWaalsContact CE1-C 3.47Å; Y804-G806 VanDerWaalsContact CE1-O 3.23Å; Y804-G806 WeakPolarHBondContact CE1-O 3.37Å; Y804-P807 VanDerWaalsContact CE1-O 3.26Å; Y804-P807 WeakPolarHBondContact CE1-O 3.17Å; Y804-P807 PolarHBondContact OH-O 2.85Å
805	M	75.5	Confident	79.1	Confident	151 Å²	151	62.5 Å²	62.5	74%	0.744	34%	0.339	S	S	*	.			trans	-123.6	7.5	-176.6	-62.9	-62.7	-56.9	0	0	112.9
806	G	77.3	Confident	79.5	Confident	36 Å²	36	63 Å²	63	37%	0.371	35%	0.345	S	S	.	.	S	Bend	trans	-84.9	179.2	176.7	0	0	0	0	0	112.9	Y804	Y804-G806 VanDerWaalsContact CE1-C 3.47Å; Y804-G806 VanDerWaalsContact CE1-O 3.23Å; Y804-G806 WeakPolarHBondContact CE1-O 3.37Å
807	P	80.4	Confident	80.2	Confident	85 Å²	85	62.1 Å²	62.1	55%	0.552	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-62.8	142	168.2	29.5	-34.6	0	0	0	110.1	Y804 P809 P914	Y804-P807 VanDerWaalsContact CE1-O 3.26Å; Y804-P807 WeakPolarHBondContact CE1-O 3.17Å; Y804-P807 PolarHBondContact OH-O 2.85Å; P807-P809 WeakPolarHBondContact O-CD 3.38Å; P807-P914 HydrophobicContact CG-CG 4.33Å
808	V	85.1	Confident	81	Confident	82 Å²	82	58.8 Å²	58.8	50%	0.497	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-76.3	124.3	177.2	-166.6	0	0	0	0	108.8	L778	L778-V808 HydrophobicContact CD1-CB 4.41Å; L778-V808 HydrophobicContact CD1-CG1 4.09Å; L778-V808 HydrophobicContact CD1-CG2 3.61Å; L778-V808 HydrophobicContact CD2-CG1 3.86Å
809	P	89	Confident	81.8	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.013	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-65.3	141.8	176.8	-22.2	34.7	0	0	0	112.2	P807 N811 L812 P914 D915 I917	P807-P809 WeakPolarHBondContact O-CD 3.38Å; P809-N811 PolarHBondContact O-N 3.46Å; P809-N811 VanDerWaalsContact O-N 3.11Å; P809-L812 HydrophobicContact CB-CB 4.12Å; P809-L812 HydrophobicContact CG-CB 4.32Å; P809-L812 HydrophobicContact CG-CD1 4.31Å; P809-L812 PolarHBondContact O-N 3.45Å; P809-P914 WeakPolarHBondContact CB-O 3.39Å; P809-P914 HydrophobicContact CG-CB 4.33Å; P809-P914 VanDerWaalsContact CG-O 3.28Å; P809-P914 WeakPolarHBondContact CG-O 3.41Å; P809-D915 WeakPolarHBondContact CA-OD1 3.36Å; P809-D915 HydrophobicContact CB-CB 4.27Å; P809-I917 HydrophobicContact CB-CD1 4.08Å; P809-I917 HydrophobicContact CB-CG1 3.68Å; P809-I917 HydrophobicContact CG-CD1 4.15Å; P809-I917 HydrophobicContact CG-CG1 3.97Å
810	A	88.9	Confident	82.8	Confident	67 Å²	67	57.4 Å²	57.4	55%	0.554	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.2	-173.1	0	0	0	0	0	114.3	D915	A810-D915 WeakPolarHBondContact CB-OD1 3.25Å; A810-D915 PolarHBondContact N-OD1 3.27Å
811	N	92.1	Very high	84.1	Confident	12 Å²	12	51.8 Å²	51.8	6%	0.064	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	19.1	175.6	65.4	-21	0	0	0	113.7	P809 W827 I917 G934 F936	P809-N811 PolarHBondContact O-N 3.46Å; P809-N811 VanDerWaalsContact O-N 3.11Å; N811-W827 HydrophobicContact CB-CH2 3.58Å; N811-W827 HydrophobicContact CB-CZ2 3.77Å; N811-I917 PolarHBondContact ND2-O 2.88Å; N811-I917 WeakPolarHBondContact OD1-CB 3.42Å; N811-I917 PolarHBondContact OD1-N 3.49Å; N811-G934 WeakPolarHBondContact CB-O 3.48Å; N811-G934 PolarHBondContact ND2-O 3.29Å; N811-F936 PolarHBondContact O-N 3.3Å
812	L	92.4	Very high	85.3	Confident	11 Å²	11	49.5 Å²	49.5	6%	0.058	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	112.9	168.3	-162.4	175.2	0	0	0	109.5	L778 P809 T814 I917 F936 N938	L778-L812 HydrophobicContact CD2-CD1 4.28Å; L778-L812 HydrophobicContact CD2-CD2 3.67Å; P809-L812 HydrophobicContact CB-CB 4.12Å; P809-L812 HydrophobicContact CG-CB 4.32Å; P809-L812 HydrophobicContact CG-CD1 4.31Å; P809-L812 PolarHBondContact O-N 3.45Å; L812-T814 HydrophobicContact CD2-CG2 4.31Å; L812-I917 HydrophobicContact CB-CD1 3.95Å; L812-I917 HydrophobicContact CD1-CD1 4.21Å; L812-I917 HydrophobicContact CG-CD1 4.19Å; L812-F936 CarbonylContact C-O 3.57Å; L812-F936 WeakPolarHBondContact CA-O 3.35Å; L812-F936 HydrophobicContact CD2-CD1 4.46Å; L812-F936 HydrophobicContact CG-CB 4.42Å; L812-F936 HydrophobicContact CG-CD1 4.09Å; L812-N938 HydrophobicContact CD2-CB 4.42Å
813	L	92.8	Very high	86.1	Confident	28 Å²	28	46.7 Å²	46.7	15%	0.147	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	133.4	-178.8	-55	179.2	0	0	0	111.3	A824 W827 L828 V935 F936 L937 N938	L813-A824 HydrophobicContact CD1-CB 4.05Å; L813-W827 HydrophobicContact CD1-CE3 4.06Å; L813-L828 HydrophobicContact CD1-CG 4.48Å; L813-V935 HydrophobicContact CD1-CG2 3.92Å; L813-V935 HydrophobicContact CG-CG2 4.24Å; L813-F936 PolarHBondContact N-O 3.34Å; L813-L937 HydrophobicContact CB-CD2 4.19Å; L813-L937 HydrophobicContact CB-CG 4.28Å; L813-L937 HydrophobicContact CD1-CD2 4.15Å; L813-L937 HydrophobicContact CD1-CG 4.49Å; L813-L937 WeakPolarHBondContact O-CA 3.31Å; L813-N938 PolarHBondContact O-N 2.61Å
814	T	91	Very high	87	Confident	40 Å²	40	41.8 Å²	41.8	25%	0.245	25%	0.252	C	S	.	.			trans	-121.8	117.9	166.3	45.2	0	0	0	0	107.9	L778 L812 N938	L778-T814 HydrophobicContact CD2-CG2 3.98Å; L812-T814 HydrophobicContact CD2-CG2 4.31Å; T814-N938 HydrophobicContact CG2-CB 4.1Å
815	I	90.8	Very high	87.6	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.015	26%	0.259	C	S	.	.			trans	-106.6	110	-175.4	-58.1	173.6	0	0	0	108	F717 L718 Y776 D820 A824 L937	F717-I815 HydrophobicContact CB-CD1 3.89Å; F717-I815 HydrophobicContact CB-CG2 4.1Å; F717-I815 HydrophobicContact CD1-CD1 3.59Å; F717-I815 HydrophobicContact CD2-CD1 4.02Å; F717-I815 HydrophobicContact CE1-CD1 4.14Å; F717-I815 HydrophobicContact CG-CD1 3.55Å; L718-I815 HydrophobicContact CD1-CG2 4.16Å; L718-I815 HydrophobicContact CD2-CG2 4.12Å; L718-I815 HydrophobicContact CG-CG2 4Å; Y776-I815 WeakPolarHBondContact CD2-O 3.25Å; I815-D820 HydrophobicContact CB-CB 4.38Å; I815-D820 HydrophobicContact CG2-CB 4Å; I815-A824 HydrophobicContact CD1-CB 3.57Å; I815-A824 HydrophobicContact CG1-CB 3.97Å; I815-L937 HydrophobicContact CD1-CD2 3.95Å
816	S	87.3	Confident	88.4	Confident	33 Å²	33	43 Å²	43	23%	0.231	25%	0.248	C	C	.	.			trans	-113.2	-24.2	-178.5	-56.6	0	0	0	0	113.7	Y776 D820	Y776-S816 PolarHBondContact N-OG 3.4Å; S816-D820 WeakPolarHBondContact CA-OD2 3.49Å; S816-D820 WeakPolarHBondContact CB-OD2 3.47Å; S816-D820 PolarHBondContact N-OD2 3.3Å
817	D	86.4	Confident	89.2	Confident	47 Å²	47	44.3 Å²	44.3	25%	0.251	24%	0.241	S	C	.	.	S	Bend	trans	-135.7	-179	172.4	72	39.9	0	0	0	113.7	H704 H819 D820 G821	H704-D817 IonicContact CD2-OD2 3.62Å; H704-D817 PolarHBondContact CD2-OD2 2.91Å; D817-H819 VanDerWaalsContact C-N 3.31Å; D817-H819 PolarHBondContact O-N 2.85Å; D817-H819 WeakPolarHBondContact OD1-CA 3.31Å; D817-H819 VanDerWaalsContact OD1-CB 3.27Å; D817-H819 WeakPolarHBondContact OD1-CB 3.22Å; D817-H819 PolarHBondContact OD1-N 2.9Å; D817-D820 PolarHBondContact N-OD2 2.87Å; D817-D820 VanDerWaalsContact N-OD2 3.15Å; D817-D820 PolarHBondContact OD1-N 2.78Å; D817-G821 PolarHBondContact O-N 3.44Å; D817-G821 VanDerWaalsContact O-N 3.08Å
818	L	84.9	Confident	89.8	Confident	29 Å²	29	40.2 Å²	40.2	15%	0.152	22%	0.215	C	C	.	.	H	α-helix	trans	-67.3	-28.6	-179.3	-72	166.2	0	0	0	113	V715 G821 V822	V715-L818 HydrophobicContact CB-CD2 3.9Å; V715-L818 HydrophobicContact CG1-CD2 4.19Å; V715-L818 HydrophobicContact CG2-CD2 3.78Å; L818-G821 PolarHBondContact O-N 3.41Å; L818-V822 WeakPolarHBondContact O-CG2 3.41Å; L818-V822 PolarHBondContact O-N 2.89Å
819	H	85.8	Confident	90.1	Very high	86 Å²	86	41 Å²	41	40%	0.398	21%	0.213	S	C	.	.	H	α-helix	trans	-74.1	-43.5	177.6	-168.2	96.4	0	0	0	110.6	H704 D817 G821 V822 A823	H704-H819 HydrophobicContact CB-CB 4.04Å; H704-H819 AromaticContact CD2-CD2 3.89Å; H704-H819 AromaticContact CD2-CG 3.84Å; H704-H819 AromaticContact CE1-CD2 3.47Å; H704-H819 PolarHBondContact CE1-CD2 2.81Å; H704-H819 VanDerWaalsContact CE1-CD2 3.47Å; H704-H819 AromaticContact CE1-NE2 3.9Å; H704-H819 AromaticContact CG-CD2 3.7Å; H704-H819 AromaticContact CG-CG 3.54Å; H704-H819 AromaticContact ND1-CD2 3.42Å; H704-H819 PolarHBondContact ND1-CD2 3.08Å; H704-H819 AromaticContact ND1-CG 3.72Å; H704-H819 AromaticContact ND1-NE2 3.65Å; H704-H819 AromaticContact NE2-CD2 3.8Å; D817-H819 VanDerWaalsContact C-N 3.31Å; D817-H819 PolarHBondContact O-N 2.85Å; D817-H819 WeakPolarHBondContact OD1-CA 3.31Å; D817-H819 VanDerWaalsContact OD1-CB 3.27Å; D817-H819 WeakPolarHBondContact OD1-CB 3.22Å; D817-H819 PolarHBondContact OD1-N 2.9Å; H819-G821 PolarHBondContact O-N 2.79Å; H819-V822 PolarHBondContact O-N 3.37Å; H819-A823 WeakPolarHBondContact O-CB 3.12Å; H819-A823 PolarHBondContact O-N 2.97Å
820	D	88.3	Confident	90.2	Very high	48 Å²	48	47.4 Å²	47.4	26%	0.257	24%	0.243	S	C	.	.	H	α-helix	trans	-52.9	-44.3	167.9	-69.7	-32.6	0	0	0	110.6	I815 S816 D817 A823 A824	I815-D820 HydrophobicContact CB-CB 4.38Å; I815-D820 HydrophobicContact CG2-CB 4Å; S816-D820 WeakPolarHBondContact CA-OD2 3.49Å; S816-D820 WeakPolarHBondContact CB-OD2 3.47Å; S816-D820 PolarHBondContact N-OD2 3.3Å; D817-D820 PolarHBondContact N-OD2 2.87Å; D817-D820 VanDerWaalsContact N-OD2 3.15Å; D817-D820 PolarHBondContact OD1-N 2.78Å; D820-A823 PolarHBondContact O-N 2.9Å; D820-A824 VanDerWaalsContact O-CB 3.27Å; D820-A824 WeakPolarHBondContact O-CB 3.34Å; D820-A824 PolarHBondContact O-N 2.87Å
821	G	89.9	Confident	90.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-66	-40.2	-179.1	0	0	0	0	0	113.5	D817 L818 H819 A824 R825	D817-G821 PolarHBondContact O-N 3.44Å; D817-G821 VanDerWaalsContact O-N 3.08Å; L818-G821 PolarHBondContact O-N 3.41Å; H819-G821 PolarHBondContact O-N 2.79Å; G821-A824 PolarHBondContact O-N 2.96Å; G821-R825 WeakPolarHBondContact O-CB 3.31Å; G821-R825 PolarHBondContact O-N 2.84Å
822	V	89.1	Confident	90.3	Very high	24 Å²	24	47.4 Å²	47.4	15%	0.145	23%	0.233	C	C	.	.	H	α-helix	trans	-67.1	-41.3	173.8	170.1	0	0	0	0	111.2	Y710 V715 L818 H819 R825 R826	Y710-V822 HydrophobicContact CD1-CG2 3.8Å; Y710-V822 HydrophobicContact CD2-CG2 3.93Å; Y710-V822 HydrophobicContact CE1-CG1 4.34Å; Y710-V822 HydrophobicContact CE1-CG2 4.07Å; Y710-V822 HydrophobicContact CE2-CG2 4.19Å; Y710-V822 HydrophobicContact CG-CG2 3.73Å; V715-V822 HydrophobicContact CG1-CG2 4.4Å; V715-V822 HydrophobicContact CG2-CG2 3.69Å; L818-V822 WeakPolarHBondContact O-CG2 3.41Å; L818-V822 PolarHBondContact O-N 2.89Å; H819-V822 PolarHBondContact O-N 3.37Å; V822-R825 PolarHBondContact O-N 2.92Å; V822-R826 PolarHBondContact O-N 2.95Å
823	A	89.7	Confident	90.2	Very high	47 Å²	47	48.3 Å²	48.3	39%	0.388	24%	0.239	S	C	.	.	H	α-helix	trans	-62.9	-44.6	175.5	0	0	0	0	0	111.4	H819 D820 R826 W827	H819-A823 WeakPolarHBondContact O-CB 3.12Å; H819-A823 PolarHBondContact O-N 2.97Å; D820-A823 PolarHBondContact O-N 2.9Å; A823-R826 PolarHBondContact O-N 3.12Å; A823-W827 WeakPolarHBondContact O-CB 3.31Å; A823-W827 PolarHBondContact O-N 2.71Å
824	A	92.1	Very high	89.9	Confident	4 Å²	4	54.3 Å²	54.3	3%	0.033	27%	0.272	C	S	.	.	H	α-helix	trans	-62.3	-43.2	174.2	0	0	0	0	0	112.3	F717 L813 I815 D820 G821 R826 W827 L828	F717-A824 HydrophobicContact CE2-CB 4.35Å; L813-A824 HydrophobicContact CD1-CB 4.05Å; I815-A824 HydrophobicContact CD1-CB 3.57Å; I815-A824 HydrophobicContact CG1-CB 3.97Å; D820-A824 VanDerWaalsContact O-CB 3.27Å; D820-A824 WeakPolarHBondContact O-CB 3.34Å; D820-A824 PolarHBondContact O-N 2.87Å; G821-A824 PolarHBondContact O-N 2.96Å; A824-R826 PolarHBondContact O-N 3.43Å; A824-W827 PolarHBondContact O-N 2.82Å; A824-L828 WeakPolarHBondContact O-CB 3.37Å; A824-L828 WeakPolarHBondContact O-CD1 3.32Å; A824-L828 VanDerWaalsContact O-CG 3.27Å; A824-L828 WeakPolarHBondContact O-CG 3.38Å; A824-L828 PolarHBondContact O-N 2.87Å
825	R	91.8	Very high	89.8	Confident	85 Å²	85	56.5 Å²	56.5	32%	0.321	28%	0.281	S	S	.	.	H	α-helix	trans	-58.1	-48.8	176.7	-162.5	174.6	179.8	-162.2	-4.3	111	D714 F717 G821 V822 L828 Q829 L858	D714-R825 PolarHBondContact O-NH1 3.1Å; F717-R825 HydrophobicContact CE2-CB 3.95Å; F717-R825 HydrophobicContact CE2-CG 4.46Å; G821-R825 WeakPolarHBondContact O-CB 3.31Å; G821-R825 PolarHBondContact O-N 2.84Å; V822-R825 PolarHBondContact O-N 2.92Å; R825-L828 PolarHBondContact O-N 3.23Å; R825-Q829 VanDerWaalsContact O-CG 3.28Å; R825-Q829 WeakPolarHBondContact O-CG 3.1Å; R825-Q829 PolarHBondContact O-N 3.13Å; R825-Q829 VanDerWaalsContact O-N 3.09Å; R825-Q829 PolarHBondContact O-OE1 3.31Å; R825-L858 HydrophobicContact CG-CD2 4.12Å
826	R	91.6	Very high	89.5	Confident	134 Å²	134	65 Å²	65	51%	0.506	32%	0.321	S	S	.	.	H	α-helix	trans	-61.6	-49.8	176.8	-176.7	-177.7	-60.3	134.9	4.8	111.5	V822 A823 A824 L828 Q829 E830	V822-R826 PolarHBondContact O-N 2.95Å; A823-R826 PolarHBondContact O-N 3.12Å; A824-R826 PolarHBondContact O-N 3.43Å; R826-L828 VanDerWaalsContact C-N 3.32Å; R826-L828 PolarHBondContact O-N 2.98Å; R826-Q829 PolarHBondContact O-N 3.33Å; R826-E830 WeakPolarHBondContact CD-OE1 3.43Å; R826-E830 VanDerWaalsContact CG-CD 3.49Å; R826-E830 HydrophobicContact CG-CG 4.31Å; R826-E830 WeakPolarHBondContact CG-OE1 3.45Å; R826-E830 WeakPolarHBondContact O-CB 3.38Å; R826-E830 WeakPolarHBondContact O-CG 3.26Å; R826-E830 PolarHBondContact O-N 2.83Å
827	W	93.2	Very high	89.7	Confident	63 Å²	63	67.1 Å²	67.1	24%	0.239	33%	0.33	C	S	.	.	H	α-helix	trans	-58.1	-43.7	-179.8	-174.5	95.6	0	0	0	111.8	N811 L813 A823 A824 E830 N831 F832 V935	N811-W827 HydrophobicContact CB-CH2 3.58Å; N811-W827 HydrophobicContact CB-CZ2 3.77Å; L813-W827 HydrophobicContact CD1-CE3 4.06Å; A823-W827 WeakPolarHBondContact O-CB 3.31Å; A823-W827 PolarHBondContact O-N 2.71Å; A824-W827 PolarHBondContact O-N 2.82Å; W827-E830 PolarHBondContact O-N 3.11Å; W827-N831 HydrophobicContact CD2-CB 4.25Å; W827-N831 HydrophobicContact CE3-CB 4.49Å; W827-N831 HydrophobicContact CH2-CB 4.31Å; W827-N831 HydrophobicContact CZ2-CB 4.08Å; W827-N831 VanDerWaalsContact O-CB 3.29Å; W827-N831 WeakPolarHBondContact O-CB 3.45Å; W827-N831 PolarHBondContact O-N 2.86Å; W827-N831 PolarHBondContact O-ND2 3.46Å; W827-F832 HydrophobicContact CZ3-CB 4.15Å; W827-V935 HydrophobicContact CE3-CG2 4.38Å; W827-V935 HydrophobicContact CH2-CB 4.3Å; W827-V935 HydrophobicContact CH2-CG2 4.16Å; W827-V935 HydrophobicContact CZ3-CB 3.92Å; W827-V935 HydrophobicContact CZ3-CG2 3.58Å
828	L	93.2	Very high	90.1	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-63.5	-42.7	177.4	-74.6	163.4	0	0	0	112.1	F717 L813 A824 R825 R826 F832 V833 L855 L858 V935	F717-L828 HydrophobicContact CE1-CD1 4.1Å; F717-L828 HydrophobicContact CZ-CD1 3.55Å; L813-L828 HydrophobicContact CD1-CG 4.48Å; A824-L828 WeakPolarHBondContact O-CB 3.37Å; A824-L828 WeakPolarHBondContact O-CD1 3.32Å; A824-L828 VanDerWaalsContact O-CG 3.27Å; A824-L828 WeakPolarHBondContact O-CG 3.38Å; A824-L828 PolarHBondContact O-N 2.87Å; R825-L828 PolarHBondContact O-N 3.23Å; R826-L828 VanDerWaalsContact C-N 3.32Å; R826-L828 PolarHBondContact O-N 2.98Å; L828-F832 HydrophobicContact CD2-CB 3.99Å; L828-F832 HydrophobicContact CD2-CD1 3.79Å; L828-F832 HydrophobicContact CD2-CG 4.06Å; L828-F832 WeakPolarHBondContact O-CA 3.4Å; L828-F832 PolarHBondContact O-N 2.72Å; L828-V833 WeakPolarHBondContact O-CG2 3.09Å; L828-V833 PolarHBondContact O-N 3.11Å; L828-L855 HydrophobicContact CD1-CD2 4.06Å; L828-L855 HydrophobicContact CD2-CD2 4.21Å; L828-L858 HydrophobicContact CB-CD1 4.45Å; L828-L858 HydrophobicContact CD1-CD1 4.26Å; L828-V935 HydrophobicContact CD2-CB 4.36Å; L828-V935 HydrophobicContact CD2-CG1 3.94Å; L828-V935 HydrophobicContact CD2-CG2 4.04Å
829	Q	91.7	Very high	90.6	Very high	99 Å²	99	65.4 Å²	65.4	46%	0.463	32%	0.321	S	S	.	.	H	α-helix	trans	-64.5	-39.8	176.6	-72.7	173.3	-47.6	0	0	112.1	R825 R826 L858	R825-Q829 VanDerWaalsContact O-CG 3.28Å; R825-Q829 WeakPolarHBondContact O-CG 3.1Å; R825-Q829 PolarHBondContact O-N 3.13Å; R825-Q829 VanDerWaalsContact O-N 3.09Å; R825-Q829 PolarHBondContact O-OE1 3.31Å; R826-Q829 PolarHBondContact O-N 3.33Å; Q829-L858 HydrophobicContact CG-CD2 4.07Å
830	E	91.5	Very high	91.2	Very high	136 Å²	136	61.3 Å²	61.3	64%	0.636	30%	0.302	S	S	*	.	H	α-helix	trans	-80	-28.2	-178.7	-71.5	170.1	-178.6	0	0	113.7	R826 W827	R826-E830 WeakPolarHBondContact CD-OE1 3.43Å; R826-E830 VanDerWaalsContact CG-CD 3.49Å; R826-E830 HydrophobicContact CG-CG 4.31Å; R826-E830 WeakPolarHBondContact CG-OE1 3.45Å; R826-E830 WeakPolarHBondContact O-CB 3.38Å; R826-E830 WeakPolarHBondContact O-CG 3.26Å; R826-E830 PolarHBondContact O-N 2.83Å; W827-E830 PolarHBondContact O-N 3.11Å
831	N	90.4	Very high	91.5	Very high	75 Å²	75	59 Å²	59	40%	0.401	29%	0.29	S	S	.	.	H	α-helix	trans	-128.9	-7.1	-165.7	-56	-92	0	0	0	115.8	W827 L835	W827-N831 HydrophobicContact CD2-CB 4.25Å; W827-N831 HydrophobicContact CE3-CB 4.49Å; W827-N831 HydrophobicContact CH2-CB 4.31Å; W827-N831 HydrophobicContact CZ2-CB 4.08Å; W827-N831 VanDerWaalsContact O-CB 3.29Å; W827-N831 WeakPolarHBondContact O-CB 3.45Å; W827-N831 PolarHBondContact O-N 2.86Å; W827-N831 PolarHBondContact O-ND2 3.46Å; N831-L835 WeakPolarHBondContact O-CD1 3.45Å
832	F	92.1	Very high	91.7	Very high	3 Å²	3	59.2 Å²	59.2	1%	0.013	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-138.4	-37.7	-171.1	179.7	-99	0	0	0	116.6	W827 L828 D834 L835 D837 A839 V860 R864 V935	W827-F832 HydrophobicContact CZ3-CB 4.15Å; L828-F832 HydrophobicContact CD2-CB 3.99Å; L828-F832 HydrophobicContact CD2-CD1 3.79Å; L828-F832 HydrophobicContact CD2-CG 4.06Å; L828-F832 WeakPolarHBondContact O-CA 3.4Å; L828-F832 PolarHBondContact O-N 2.72Å; F832-D834 PolarHBondContact O-N 3.37Å; F832-L835 PolarHBondContact O-N 2.77Å; F832-D837 HydrophobicContact CE2-CB 4.15Å; F832-D837 VanDerWaalsContact CE2-O 3.24Å; F832-D837 WeakPolarHBondContact CE2-O 3.43Å; F832-D837 WeakPolarHBondContact CZ-O 3.47Å; F832-A839 HydrophobicContact CE1-CB 3.92Å; F832-A839 HydrophobicContact CZ-CB 3.67Å; F832-V860 HydrophobicContact CD1-CG2 4.36Å; F832-V860 HydrophobicContact CE1-CG1 4.02Å; F832-V860 HydrophobicContact CE1-CG2 4Å; F832-R864 VanDerWaalsContact CZ-NH2 3.3Å; F832-R864 PolarHBondContact O-NH2 3.49Å; F832-R864 VanDerWaalsContact O-NH2 3.12Å; F832-V935 HydrophobicContact CD1-CG1 3.99Å; F832-V935 HydrophobicContact CD2-CB 4.12Å; F832-V935 HydrophobicContact CD2-CG1 3.76Å; F832-V935 HydrophobicContact CE1-CG1 3.96Å; F832-V935 HydrophobicContact CE2-CB 4.4Å; F832-V935 HydrophobicContact CE2-CG1 3.72Å; F832-V935 HydrophobicContact CG-CB 4.4Å; F832-V935 HydrophobicContact CG-CG1 3.91Å; F832-V935 HydrophobicContact CZ-CG1 3.83Å
833	V	90.2	Very high	91.7	Very high	31 Å²	31	58.1 Å²	58.1	19%	0.188	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-49.7	-172.9	168.8	0	0	0	0	111.7	L828 L835 L858 V860 R864	L828-V833 WeakPolarHBondContact O-CG2 3.09Å; L828-V833 PolarHBondContact O-N 3.11Å; V833-L835 VanDerWaalsContact C-N 3.31Å; V833-L835 PolarHBondContact O-N 2.88Å; V833-L858 HydrophobicContact CG2-CB 4.34Å; V833-V860 HydrophobicContact CG2-CG2 4.3Å; V833-R864 PolarHBondContact O-NH1 3.49Å; V833-R864 VanDerWaalsContact O-NH1 3.09Å
834	D	87.4	Confident	91.6	Very high	154 Å²	154	58.2 Å²	58.2	82%	0.824	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-11.2	-178.1	-69.8	-23.2	0	0	0	114.7	F832	F832-D834 PolarHBondContact O-N 3.37Å
835	L	87.5	Confident	91.4	Very high	86 Å²	86	59.1 Å²	59.1	45%	0.45	28%	0.283	S	S	.	.	S	Bend	trans	-77.7	172.4	174.9	-58.3	-172.9	0	0	0	111.2	N831 F832 V833 R864	N831-L835 WeakPolarHBondContact O-CD1 3.45Å; F832-L835 PolarHBondContact O-N 2.77Å; V833-L835 VanDerWaalsContact C-N 3.31Å; V833-L835 PolarHBondContact O-N 2.88Å; L835-R864 PolarHBondContact O-NH1 2.74Å; L835-R864 PolarHBondContact O-NH2 3.28Å
836	Q	86.4	Confident	91.3	Very high	180 Å²	180	55.5 Å²	55.5	84%	0.841	27%	0.27	S	S	*	.			trans	-101	0.5	172.9	-66.6	-165.4	-8.3	0	0	113.5
837	D	90.8	Very high	91.3	Very high	79 Å²	79	50 Å²	50	42%	0.422	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-69.7	158.9	-176.3	-58.4	-70.7	0	0	0	113.3	F832 R864	F832-D837 HydrophobicContact CE2-CB 4.15Å; F832-D837 VanDerWaalsContact CE2-O 3.24Å; F832-D837 WeakPolarHBondContact CE2-O 3.43Å; F832-D837 WeakPolarHBondContact CZ-O 3.47Å; D837-R864 VanDerWaalsContact O-CZ 3.27Å; D837-R864 PolarHBondContact O-NE 2.98Å; D837-R864 PolarHBondContact O-NH2 2.86Å
838	N	94.8	Very high	91.3	Very high	40 Å²	40	47 Å²	47	21%	0.214	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-85.1	146.3	-177	-69.2	-15	0	0	0	112.6	R864 H866 Q932 G934 V935	N838-R864 CarbonylContact C-O 3.56Å; N838-R864 VanDerWaalsContact CA-O 3.26Å; N838-R864 WeakPolarHBondContact CA-O 3.38Å; N838-R864 WeakPolarHBondContact CB-O 3.41Å; N838-H866 PolarHBondContact ND2-NE2 2.93Å; N838-H866 VanDerWaalsContact ND2-NE2 3.16Å; N838-Q932 WeakPolarHBondContact CB-O 3.2Å; N838-G934 PolarHBondContact O-N 3.41Å; N838-V935 PolarHBondContact O-N 3.26Å
839	A	96.3	Very high	91.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	130.5	168.5	0	0	0	0	0	109.9	F832 L855 R864 H866 V935	F832-A839 HydrophobicContact CE1-CB 3.92Å; F832-A839 HydrophobicContact CZ-CB 3.67Å; A839-L855 HydrophobicContact CB-CD1 3.91Å; A839-R864 PolarHBondContact N-O 2.66Å; A839-H866 PolarHBondContact O-N 2.89Å; A839-V935 HydrophobicContact CB-CG1 3.75Å
840	V	96.6	Very high	91.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	116.6	173.9	-177.5	0	0	0	0	109.1	H866 V868 V920 F922 L931 C933 V935 F936 L937	V840-H866 WeakPolarHBondContact CA-O 3.37Å; V840-H866 HydrophobicContact CG2-CB 4.45Å; V840-V868 HydrophobicContact CG1-CG2 3.92Å; V840-V920 HydrophobicContact CG1-CG2 4.33Å; V840-V920 HydrophobicContact CG2-CG2 4.09Å; V840-F922 HydrophobicContact CG1-CZ 4.12Å; V840-L931 HydrophobicContact CG1-CD1 4.43Å; V840-L931 HydrophobicContact CG2-CB 4.38Å; V840-L931 HydrophobicContact CG2-CD1 4.09Å; V840-C933 HydrophobicContact CG2-CB 3.89Å; V840-V935 PolarHBondContact N-O 3.33Å; V840-F936 HydrophobicContact CB-CD2 3.94Å; V840-F936 HydrophobicContact CB-CE2 4.36Å; V840-F936 HydrophobicContact CG1-CD2 3.87Å; V840-F936 HydrophobicContact CG1-CE2 3.77Å; V840-F936 CarbonylContact O-C 3.6Å; V840-F936 WeakPolarHBondContact O-CA 3.46Å; V840-L937 PolarHBondContact O-N 2.83Å
841	V	95.6	Very high	91.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	111.9	175.5	-176.8	0	0	0	0	107.9	A848 T851 V852 L855 H866 L867 V868 L937	V841-A848 HydrophobicContact CG1-CB 4.28Å; V841-T851 HydrophobicContact CG1-CG2 4.04Å; V841-T851 HydrophobicContact CG2-CG2 4.01Å; V841-V852 HydrophobicContact CB-CG2 4.42Å; V841-V852 HydrophobicContact CG2-CG2 4.23Å; V841-L855 HydrophobicContact CG2-CD1 3.81Å; V841-H866 PolarHBondContact N-O 3.06Å; V841-L867 HydrophobicContact CB-CD1 4.18Å; V841-L867 HydrophobicContact CG1-CD1 4.04Å; V841-V868 PolarHBondContact O-N 3.17Å; V841-L937 HydrophobicContact CG2-CD1 4.25Å
842	Y	93.4	Very high	91.8	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.016	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	105.6	-175.6	-177	-129.7	0	0	0	111.2	P779 V868 P870 C903 L905 F922 F936 L937 N938 L939 S940	P779-Y842 HydrophobicContact CB-CD1 4.43Å; P779-Y842 HydrophobicContact CB-CE1 4.34Å; Y842-V868 WeakPolarHBondContact CA-O 3.47Å; Y842-V868 HydrophobicContact CD2-CB 4.03Å; Y842-V868 HydrophobicContact CD2-CG1 3.86Å; Y842-V868 VanDerWaalsContact CD2-O 3.32Å; Y842-V868 WeakPolarHBondContact CD2-O 3.29Å; Y842-V868 HydrophobicContact CE2-CG1 4.22Å; Y842-P870 HydrophobicContact CE2-CB 3.99Å; Y842-P870 HydrophobicContact CE2-CG 4.42Å; Y842-C903 WeakPolarHBondContact CE2-O 3.4Å; Y842-C903 PolarHBondContact OH-O 3.36Å; Y842-L905 HydrophobicContact CE1-CB 4.25Å; Y842-F922 AromaticContact CD2-CE1 3.84Å; Y842-F922 HydrophobicContact CD2-CE1 3.84Å; Y842-F922 HydrophobicContact CE2-CD1 4.35Å; Y842-F922 AromaticContact CE2-CE1 3.92Å; Y842-F922 HydrophobicContact CE2-CE1 3.92Å; Y842-F922 HydrophobicContact CG-CE1 4.32Å; Y842-F936 HydrophobicContact CD1-CE1 4.24Å; Y842-F936 AromaticContact CD1-CZ 3.93Å; Y842-F936 HydrophobicContact CD1-CZ 3.93Å; Y842-F936 HydrophobicContact CG-CE1 4.42Å; Y842-F936 AromaticContact CG-CZ 3.93Å; Y842-F936 HydrophobicContact CG-CZ 3.93Å; Y842-L937 PolarHBondContact N-O 3.37Å; Y842-N938 VanDerWaalsContact CD1-OD1 3.23Å; Y842-N938 WeakPolarHBondContact CD1-OD1 3.41Å; Y842-N938 PolarHBondContact O-OD1 3.32Å; Y842-L939 CarbonylContact O-C 3.58Å; Y842-L939 PolarHBondContact O-N 3.1Å; Y842-S940 PolarHBondContact O-N 3.06Å; Y842-S940 VanDerWaalsContact O-N 3.11Å
843	G	90	Very high	91.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.5	166.2	-179.1	0	0	0	0	0	114.6	V868 L869	G843-V868 PolarHBondContact N-O 3.48Å; G843-V868 VanDerWaalsContact N-O 3.09Å; G843-L869 WeakPolarHBondContact O-CD2 3.48Å
844	N	87	Confident	92.1	Very high	50 Å²	50	33.3 Å²	33.3	27%	0.267	17%	0.171	S	C	.	.			trans	-138.2	39.7	176.3	-166.8	3.1	0	0	0	110.2	L869 P870 P878	N844-L869 HydrophobicContact CB-CD2 4.42Å; N844-P870 HydrophobicContact CB-CG 4.33Å; N844-P878 VanDerWaalsContact OD1-CD 3.27Å; N844-P878 WeakPolarHBondContact OD1-CD 3.34Å; N844-P878 WeakPolarHBondContact OD1-CG 3.15Å
845	T	88.6	Confident	92.4	Very high	22 Å²	22	26 Å²	26	14%	0.135	13%	0.132	C	C	.	.	S	Bend	trans	-101.5	167.9	173.1	59	0	0	0	0	109.6	Y776 D847 A848 Y849 L939	Y776-T845 HydrophobicContact CE1-CG2 4.19Å; Y776-T845 WeakPolarHBondContact OH-CB 3.38Å; Y776-T845 WeakPolarHBondContact OH-CG2 3.39Å; Y776-T845 PolarHBondContact OH-OG1 3.48Å; T845-D847 PolarHBondContact O-N 2.71Å; T845-A848 PolarHBondContact O-N 3.04Å; T845-A848 PolarHBondContact OG1-N 2.89Å; T845-Y849 VanDerWaalsContact O-CD2 3.29Å; T845-Y849 WeakPolarHBondContact O-CD2 3.47Å; T845-L939 WeakPolarHBondContact CG2-O 3.39Å; T845-L939 PolarHBondContact OG1-O 3.13Å
846	L	89.5	Confident	92.7	Very high	10 Å²	10	23.9 Å²	23.9	5%	0.052	12%	0.121	C	C	.	.	H	α-helix	trans	-59.1	-40.5	174.7	-174.7	58.5	0	0	0	110.7	A848 Y849 V850 F879 R1043 A1045 L1047 F1053	L846-A848 PolarHBondContact O-N 3.5Å; L846-Y849 PolarHBondContact O-N 3.02Å; L846-Y849 VanDerWaalsContact O-N 3.08Å; L846-V850 WeakPolarHBondContact O-CG2 3.37Å; L846-V850 PolarHBondContact O-N 2.88Å; L846-V850 VanDerWaalsContact O-N 3.15Å; L846-F879 HydrophobicContact CD1-CD1 4.42Å; L846-F879 HydrophobicContact CD1-CE1 3.58Å; L846-F879 HydrophobicContact CD1-CZ 4.12Å; L846-R1043 HydrophobicContact CD2-CB 4.09Å; L846-A1045 HydrophobicContact CD1-CB 4.14Å; L846-A1045 HydrophobicContact CD2-CB 4.13Å; L846-A1045 HydrophobicContact CG-CB 4.09Å; L846-L1047 HydrophobicContact CD1-CD2 3.86Å; L846-F1053 HydrophobicContact CD1-CD1 4.42Å; L846-F1053 HydrophobicContact CD1-CE1 4.28Å; L846-F1053 HydrophobicContact CD2-CE1 4.3Å
847	D	92.1	Very high	93	Very high	19 Å²	19	19.2 Å²	19.2	10%	0.102	11%	0.108	C	C	.	.	H	α-helix	trans	-62.6	-28.1	-178.7	-40.1	-71.9	0	0	0	112.9	L718 S719 Y776 T845 V850 T851 L939	L718-D847 HydrophobicContact CD2-CB 4.27Å; S719-D847 VanDerWaalsContact CB-OD1 3.25Å; S719-D847 WeakPolarHBondContact CB-OD1 3.45Å; S719-D847 PolarHBondContact N-OD1 3.29Å; S719-D847 PolarHBondContact OG-OD1 3.31Å; Y776-D847 PolarHBondContact OH-OD2 2.75Å; T845-D847 PolarHBondContact O-N 2.71Å; D847-V850 PolarHBondContact O-N 2.87Å; D847-T851 VanDerWaalsContact O-CB 3.26Å; D847-T851 WeakPolarHBondContact O-CB 3.47Å; D847-T851 PolarHBondContact O-N 2.65Å; D847-T851 PolarHBondContact O-OG1 2.72Å; D847-L939 HydrophobicContact CB-CD1 4.44Å
848	A	92.4	Very high	93	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65.2	-37.7	174.5	0	0	0	0	0	112.3	V841 T845 L846 V852 L867 L939	V841-A848 HydrophobicContact CG1-CB 4.28Å; T845-A848 PolarHBondContact O-N 3.04Å; T845-A848 PolarHBondContact OG1-N 2.89Å; L846-A848 PolarHBondContact O-N 3.5Å; A848-V852 WeakPolarHBondContact O-CG2 3.41Å; A848-V852 PolarHBondContact O-N 3.29Å; A848-V852 VanDerWaalsContact O-N 3.16Å; A848-L867 HydrophobicContact CB-CD1 4.37Å; A848-L939 HydrophobicContact CB-CB 4.29Å; A848-L939 HydrophobicContact CB-CD1 4.39Å
849	Y	93.3	Very high	92.8	Very high	12 Å²	12	17.3 Å²	17.3	5%	0.047	11%	0.111	C	C	.	.	H	α-helix	trans	-74.3	-37.7	174.6	-64.2	-95.4	0	0	0	111.4	T845 L846 T851 V852 Q853 L867 P878 F879 V888 M892 P1048	T845-Y849 VanDerWaalsContact O-CD2 3.29Å; T845-Y849 WeakPolarHBondContact O-CD2 3.47Å; L846-Y849 PolarHBondContact O-N 3.02Å; L846-Y849 VanDerWaalsContact O-N 3.08Å; Y849-T851 VanDerWaalsContact C-N 3.32Å; Y849-V852 PolarHBondContact O-N 2.88Å; Y849-Q853 PolarHBondContact O-N 3.3Å; Y849-Q853 VanDerWaalsContact O-N 3.08Å; Y849-L867 HydrophobicContact CD1-CD2 4.3Å; Y849-L867 HydrophobicContact CE1-CD2 4Å; Y849-P878 HydrophobicContact CE2-CB 4.11Å; Y849-P878 HydrophobicContact CE2-CG 3.7Å; Y849-F879 HydrophobicContact CD1-CE2 4.13Å; Y849-F879 HydrophobicContact CD1-CZ 4.35Å; Y849-F879 HydrophobicContact CD2-CE2 4.18Å; Y849-F879 HydrophobicContact CD2-CZ 4.2Å; Y849-F879 HydrophobicContact CE1-CE2 4.08Å; Y849-F879 HydrophobicContact CE2-CE2 4.18Å; Y849-F879 HydrophobicContact CG-CE2 4.17Å; Y849-F879 HydrophobicContact CG-CZ 4.06Å; Y849-V888 HydrophobicContact CD1-CG1 3.65Å; Y849-V888 HydrophobicContact CE1-CG1 4.16Å; Y849-M892 HydrophobicContact CD1-CE 4.17Å; Y849-M892 HydrophobicContact CD1-SD 4Å; Y849-M892 HydrophobicContact CE1-CE 3.81Å; Y849-M892 HydrophobicContact CE1-SD 4.19Å; Y849-P1048 WeakPolarHBondContact O-CD 3.46Å; Y849-P1048 WeakPolarHBondContact O-CG 3.28Å
850	V	94	Very high	92.7	Very high	5 Å²	5	17.4 Å²	17.4	3%	0.03	11%	0.112	C	C	.	.	H	α-helix	trans	-59.1	-46.1	172.9	-179.9	0	0	0	0	110	G716 L846 D847 V852 Q853 T854 A1045 L1047	G716-V850 WeakPolarHBondContact O-CG1 3.37Å; L846-V850 WeakPolarHBondContact O-CG2 3.37Å; L846-V850 PolarHBondContact O-N 2.88Å; L846-V850 VanDerWaalsContact O-N 3.15Å; D847-V850 PolarHBondContact O-N 2.87Å; V850-V852 PolarHBondContact O-N 3.21Å; V850-Q853 CarbonylContact O-C 3.59Å; V850-Q853 WeakPolarHBondContact O-CA 3.26Å; V850-Q853 WeakPolarHBondContact O-CB 3.41Å; V850-Q853 PolarHBondContact O-N 2.99Å; V850-T854 PolarHBondContact O-N 2.83Å; V850-T854 PolarHBondContact O-OG1 2.86Å; V850-A1045 HydrophobicContact CG2-CB 3.61Å; V850-L1047 HydrophobicContact CG2-CD2 4.35Å
851	T	94.5	Very high	92.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-58.4	-39.8	175.4	-67.5	0	0	0	0	113.5	F717 V841 D847 Y849 T854 L855 L937 L939	F717-T851 HydrophobicContact CD1-CG2 4.01Å; F717-T851 HydrophobicContact CE1-CG2 4.22Å; F717-T851 PolarHBondContact O-OG1 2.89Å; V841-T851 HydrophobicContact CG1-CG2 4.04Å; V841-T851 HydrophobicContact CG2-CG2 4.01Å; D847-T851 VanDerWaalsContact O-CB 3.26Å; D847-T851 WeakPolarHBondContact O-CB 3.47Å; D847-T851 PolarHBondContact O-N 2.65Å; D847-T851 PolarHBondContact O-OG1 2.72Å; Y849-T851 VanDerWaalsContact C-N 3.32Å; T851-T854 WeakPolarHBondContact CA-OG1 3.47Å; T851-T854 PolarHBondContact O-N 2.86Å; T851-T854 PolarHBondContact O-OG1 2.91Å; T851-L855 WeakPolarHBondContact O-CG 3.5Å; T851-L855 PolarHBondContact O-N 2.86Å; T851-L855 VanDerWaalsContact O-N 3.07Å; T851-L937 HydrophobicContact CG2-CB 4.38Å; T851-L937 HydrophobicContact CG2-CD2 4.04Å; T851-L939 HydrophobicContact CG2-CD1 4.18Å; T851-L939 WeakPolarHBondContact OG1-CD1 3.45Å
852	V	95.3	Very high	92.4	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.9	-41.3	172.8	168.2	0	0	0	0	111	V841 A848 Y849 V850 T854 L855 L856 I865 L867 M892 V897 P1048	V841-V852 HydrophobicContact CB-CG2 4.42Å; V841-V852 HydrophobicContact CG2-CG2 4.23Å; A848-V852 WeakPolarHBondContact O-CG2 3.41Å; A848-V852 PolarHBondContact O-N 3.29Å; A848-V852 VanDerWaalsContact O-N 3.16Å; Y849-V852 PolarHBondContact O-N 2.88Å; V850-V852 PolarHBondContact O-N 3.21Å; V852-T854 VanDerWaalsContact C-N 3.35Å; V852-L855 PolarHBondContact O-N 3.01Å; V852-L856 HydrophobicContact CG1-CD1 4.19Å; V852-L856 WeakPolarHBondContact O-CG 3.47Å; V852-L856 PolarHBondContact O-N 2.88Å; V852-L856 VanDerWaalsContact O-N 3.1Å; V852-I865 HydrophobicContact CG1-CG2 4.47Å; V852-I865 HydrophobicContact CG2-CG2 4.23Å; V852-L867 HydrophobicContact CG2-CB 4.3Å; V852-L867 HydrophobicContact CG2-CD1 4.22Å; V852-L867 HydrophobicContact CG2-CD2 4.46Å; V852-M892 HydrophobicContact CG1-SD 4.47Å; V852-V897 HydrophobicContact CG1-CG1 4.17Å; V852-V897 HydrophobicContact CG1-CG2 4.23Å; V852-P1048 HydrophobicContact CB-CG 4.35Å; V852-P1048 HydrophobicContact CG1-CG 4.13Å
853	Q	94.6	Very high	92.5	Very high	33 Å²	33	26 Å²	26	15%	0.154	16%	0.159	C	C	.	.	H	α-helix	trans	-66.4	-33.5	174.3	177.7	58.7	34	0	0	112.4	Y849 V850 S857 T1046 L1047 P1048	Y849-Q853 PolarHBondContact O-N 3.3Å; Y849-Q853 VanDerWaalsContact O-N 3.08Å; V850-Q853 CarbonylContact O-C 3.59Å; V850-Q853 WeakPolarHBondContact O-CA 3.26Å; V850-Q853 WeakPolarHBondContact O-CB 3.41Å; V850-Q853 PolarHBondContact O-N 2.99Å; Q853-S857 WeakPolarHBondContact O-CB 3.25Å; Q853-S857 PolarHBondContact O-N 2.81Å; Q853-S857 PolarHBondContact O-OG 2.84Å; Q853-T1046 HydrophobicContact CG-CG2 4.15Å; Q853-L1047 PolarHBondContact OE1-O 2.93Å; Q853-P1048 HydrophobicContact CB-CG 4.4Å; Q853-P1048 VanDerWaalsContact OE1-CA 3.26Å
854	T	93.8	Very high	92.7	Very high	6 Å²	6	27.3 Å²	27.3	4%	0.037	16%	0.164	C	C	.	.	H	α-helix	trans	-62.8	-48.9	173.3	-14.5	0	0	0	0	111.2	G716 F717 V850 T851 V852 L856 S857 L858	G716-T854 WeakPolarHBondContact O-CB 3.37Å; G716-T854 WeakPolarHBondContact O-CG2 3.42Å; G716-T854 PolarHBondContact O-OG1 2.99Å; F717-T854 HydrophobicContact CD1-CG2 4.1Å; F717-T854 WeakPolarHBondContact CD1-OG1 3.19Å; F717-T854 HydrophobicContact CD2-CG2 4.08Å; F717-T854 HydrophobicContact CE1-CG2 3.86Å; F717-T854 HydrophobicContact CE2-CG2 3.83Å; F717-T854 HydrophobicContact CG-CG2 4.19Å; F717-T854 HydrophobicContact CZ-CG2 3.7Å; V850-T854 PolarHBondContact O-N 2.83Å; V850-T854 PolarHBondContact O-OG1 2.86Å; T851-T854 WeakPolarHBondContact CA-OG1 3.47Å; T851-T854 PolarHBondContact O-N 2.86Å; T851-T854 PolarHBondContact O-OG1 2.91Å; V852-T854 VanDerWaalsContact C-N 3.35Å; T854-L856 VanDerWaalsContact C-N 3.33Å; T854-L856 PolarHBondContact O-N 2.94Å; T854-S857 WeakPolarHBondContact CA-OG 3.49Å; T854-S857 CarbonylContact O-C 3.49Å; T854-S857 PolarHBondContact O-N 2.91Å; T854-S857 VanDerWaalsContact O-N 3.1Å; T854-S857 PolarHBondContact O-OG 2.95Å; T854-L858 WeakPolarHBondContact O-CB 3.37Å; T854-L858 WeakPolarHBondContact O-CG 3.24Å; T854-L858 PolarHBondContact O-N 3.15Å
855	L	94.4	Very high	93.2	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.2	-42.8	179.5	-69.6	171	0	0	0	111.5	L828 A839 V841 T851 V852 L858 G859 V860 I865 L937	L828-L855 HydrophobicContact CD1-CD2 4.06Å; L828-L855 HydrophobicContact CD2-CD2 4.21Å; A839-L855 HydrophobicContact CB-CD1 3.91Å; V841-L855 HydrophobicContact CG2-CD1 3.81Å; T851-L855 WeakPolarHBondContact O-CG 3.5Å; T851-L855 PolarHBondContact O-N 2.86Å; T851-L855 VanDerWaalsContact O-N 3.07Å; V852-L855 PolarHBondContact O-N 3.01Å; L855-L858 PolarHBondContact O-N 2.93Å; L855-G859 PolarHBondContact O-N 2.78Å; L855-V860 HydrophobicContact CB-CB 4.35Å; L855-V860 HydrophobicContact CB-CG2 4.39Å; L855-V860 HydrophobicContact CD2-CG2 4.29Å; L855-V860 VanDerWaalsContact O-CB 3.28Å; L855-V860 WeakPolarHBondContact O-CB 3.25Å; L855-V860 WeakPolarHBondContact O-CG2 3.17Å; L855-V860 PolarHBondContact O-N 3.02Å; L855-I865 HydrophobicContact CB-CD1 3.68Å; L855-I865 HydrophobicContact CB-CG1 4.48Å; L855-I865 HydrophobicContact CD1-CD1 4.47Å; L855-I865 HydrophobicContact CD1-CG2 4.25Å; L855-L937 HydrophobicContact CD1-CD1 4.28Å
856	L	93.8	Very high	93.5	Very high	42 Å²	42	24.2 Å²	24.2	22%	0.22	15%	0.146	C	C	.	.	H	α-helix	trans	-61.9	-42.8	173	-68.5	169.4	0	0	0	111.9	V852 T854 L858 G859 I865 A895 V897	V852-L856 HydrophobicContact CG1-CD1 4.19Å; V852-L856 WeakPolarHBondContact O-CG 3.47Å; V852-L856 PolarHBondContact O-N 2.88Å; V852-L856 VanDerWaalsContact O-N 3.1Å; T854-L856 VanDerWaalsContact C-N 3.33Å; T854-L856 PolarHBondContact O-N 2.94Å; L856-L858 VanDerWaalsContact C-N 3.31Å; L856-L858 PolarHBondContact O-N 3.11Å; L856-G859 PolarHBondContact O-N 2.79Å; L856-G859 VanDerWaalsContact O-N 3.09Å; L856-I865 HydrophobicContact CD2-CD1 3.86Å; L856-I865 HydrophobicContact CG-CD1 3.96Å; L856-A895 HydrophobicContact CD1-CB 4.21Å; L856-A895 HydrophobicContact CD2-CB 4.19Å; L856-V897 HydrophobicContact CD1-CG2 4.32Å; L856-V897 HydrophobicContact CD2-CG2 4.3Å
857	S	92	Very high	93.8	Very high	81 Å²	81	23.7 Å²	23.7	57%	0.566	14%	0.144	S	C	*	.	H	α-helix	trans	-71.7	-22.7	178.4	74.1	0	0	0	0	114.1	Q853 T854 G859	Q853-S857 WeakPolarHBondContact O-CB 3.25Å; Q853-S857 PolarHBondContact O-N 2.81Å; Q853-S857 PolarHBondContact O-OG 2.84Å; T854-S857 WeakPolarHBondContact CA-OG 3.49Å; T854-S857 CarbonylContact O-C 3.49Å; T854-S857 PolarHBondContact O-N 2.91Å; T854-S857 VanDerWaalsContact O-N 3.1Å; T854-S857 PolarHBondContact O-OG 2.95Å; S857-G859 PolarHBondContact O-N 3.41Å
858	L	91.7	Very high	93.9	Very high	22 Å²	22	22.8 Å²	22.8	12%	0.115	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-1.7	169.5	-72.8	171.8	0	0	0	113.1	F717 R825 L828 Q829 V833 T854 L855 L856	F717-L858 HydrophobicContact CZ-CD1 4.38Å; R825-L858 HydrophobicContact CG-CD2 4.12Å; L828-L858 HydrophobicContact CB-CD1 4.45Å; L828-L858 HydrophobicContact CD1-CD1 4.26Å; Q829-L858 HydrophobicContact CG-CD2 4.07Å; V833-L858 HydrophobicContact CG2-CB 4.34Å; T854-L858 WeakPolarHBondContact O-CB 3.37Å; T854-L858 WeakPolarHBondContact O-CG 3.24Å; T854-L858 PolarHBondContact O-N 3.15Å; L855-L858 PolarHBondContact O-N 2.93Å; L856-L858 VanDerWaalsContact C-N 3.31Å; L856-L858 PolarHBondContact O-N 3.11Å
859	G	90.9	Very high	93.8	Very high	57 Å²	57	23.6 Å²	23.6	59%	0.588	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.6	7.6	178.2	0	0	0	0	0	115.2	L855 L856 S857 Q861	L855-G859 PolarHBondContact O-N 2.78Å; L856-G859 PolarHBondContact O-N 2.79Å; L856-G859 VanDerWaalsContact O-N 3.09Å; S857-G859 PolarHBondContact O-N 3.41Å; G859-Q861 PolarHBondContact O-N 3.36Å
860	V	93.5	Very high	93.5	Very high	3 Å²	3	23.9 Å²	23.9	2%	0.018	15%	0.146	C	C	.	.			trans	-68.6	122.3	173.9	-174.6	0	0	0	0	108.9	F832 V833 L855 G862 R864 I865	F832-V860 HydrophobicContact CD1-CG2 4.36Å; F832-V860 HydrophobicContact CE1-CG1 4.02Å; F832-V860 HydrophobicContact CE1-CG2 4Å; V833-V860 HydrophobicContact CG2-CG2 4.3Å; L855-V860 HydrophobicContact CB-CB 4.35Å; L855-V860 HydrophobicContact CB-CG2 4.39Å; L855-V860 HydrophobicContact CD2-CG2 4.29Å; L855-V860 VanDerWaalsContact O-CB 3.28Å; L855-V860 WeakPolarHBondContact O-CB 3.25Å; L855-V860 WeakPolarHBondContact O-CG2 3.17Å; L855-V860 PolarHBondContact O-N 3.02Å; V860-G862 PolarHBondContact O-N 2.89Å; V860-R864 HydrophobicContact CG1-CB 4.27Å; V860-I865 HydrophobicContact CB-CD1 4.34Å; V860-I865 HydrophobicContact CG1-CD1 4.19Å; V860-I865 HydrophobicContact CG1-CG1 3.88Å
861	Q	93.2	Very high	92.8	Very high	134 Å²	134	25.5 Å²	25.5	63%	0.626	16%	0.157	S	C	*	.			trans	-59.6	127.3	176.1	-65.2	178	-5.4	0	0	109.9	G859 S863 R864	G859-Q861 PolarHBondContact O-N 3.36Å; Q861-S863 PolarHBondContact O-N 3.27Å; Q861-S863 VanDerWaalsContact O-N 3.14Å; Q861-R864 WeakPolarHBondContact O-CB 3.33Å; Q861-R864 PolarHBondContact O-N 3.45Å
862	G	92.8	Very high	91.4	Very high	8 Å²	8	30.2 Å²	30.2	8%	0.082	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-62.5	-26.1	-172.1	0	0	0	0	0	114.4	V860 R864 I865 A895 E896 V897	V860-G862 PolarHBondContact O-N 2.89Å; G862-R864 PolarHBondContact O-N 2.93Å; G862-I865 WeakPolarHBondContact O-CA 3.48Å; G862-I865 WeakPolarHBondContact O-CB 3.45Å; G862-I865 PolarHBondContact O-N 3.49Å; G862-A895 VanDerWaalsContact CA-O 3.24Å; G862-A895 WeakPolarHBondContact CA-O 3.31Å; G862-E896 CarbonylContact C-O 3.55Å; G862-V897 WeakPolarHBondContact O-CA 3.46Å
863	S	94.5	Very high	89.5	Confident	43 Å²	43	33.4 Å²	33.4	30%	0.301	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-61.6	-20.2	171.3	50	0	0	0	0	114.8	Q861 E896 Q898	Q861-S863 PolarHBondContact O-N 3.27Å; Q861-S863 VanDerWaalsContact O-N 3.14Å; S863-E896 WeakPolarHBondContact CA-O 3.38Å; S863-Q898 PolarHBondContact O-NE2 3.31Å
864	R	95.1	Very high	87.4	Confident	27 Å²	27	38.8 Å²	38.8	10%	0.102	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-84.2	-9.1	169	-66.3	168.6	58.1	-163.6	-3.9	113.4	F832 V833 L835 D837 N838 A839 V860 Q861 G862	F832-R864 VanDerWaalsContact CZ-NH2 3.3Å; F832-R864 PolarHBondContact O-NH2 3.49Å; F832-R864 VanDerWaalsContact O-NH2 3.12Å; V833-R864 PolarHBondContact O-NH1 3.49Å; V833-R864 VanDerWaalsContact O-NH1 3.09Å; L835-R864 PolarHBondContact O-NH1 2.74Å; L835-R864 PolarHBondContact O-NH2 3.28Å; D837-R864 VanDerWaalsContact O-CZ 3.27Å; D837-R864 PolarHBondContact O-NE 2.98Å; D837-R864 PolarHBondContact O-NH2 2.86Å; N838-R864 CarbonylContact C-O 3.56Å; N838-R864 VanDerWaalsContact CA-O 3.26Å; N838-R864 WeakPolarHBondContact CA-O 3.38Å; N838-R864 WeakPolarHBondContact CB-O 3.41Å; A839-R864 PolarHBondContact N-O 2.66Å; V860-R864 HydrophobicContact CG1-CB 4.27Å; Q861-R864 WeakPolarHBondContact O-CB 3.33Å; Q861-R864 PolarHBondContact O-N 3.45Å; G862-R864 PolarHBondContact O-N 2.93Å
865	I	96.7	Very high	85.4	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	121	-174.1	-53.2	176.8	0	0	0	109.8	V852 L855 L856 V860 G862 V897 Q898	V852-I865 HydrophobicContact CG1-CG2 4.47Å; V852-I865 HydrophobicContact CG2-CG2 4.23Å; L855-I865 HydrophobicContact CB-CD1 3.68Å; L855-I865 HydrophobicContact CB-CG1 4.48Å; L855-I865 HydrophobicContact CD1-CD1 4.47Å; L855-I865 HydrophobicContact CD1-CG2 4.25Å; L856-I865 HydrophobicContact CD2-CD1 3.86Å; L856-I865 HydrophobicContact CG-CD1 3.96Å; V860-I865 HydrophobicContact CB-CD1 4.34Å; V860-I865 HydrophobicContact CG1-CD1 4.19Å; V860-I865 HydrophobicContact CG1-CG1 3.88Å; G862-I865 WeakPolarHBondContact O-CA 3.48Å; G862-I865 WeakPolarHBondContact O-CB 3.45Å; G862-I865 PolarHBondContact O-N 3.49Å; I865-V897 HydrophobicContact CB-CG1 4.27Å; I865-V897 HydrophobicContact CB-CG2 4.44Å; I865-V897 HydrophobicContact CG2-CG1 4.1Å; I865-Q898 PolarHBondContact O-N 2.92Å
866	H	96.4	Very high	83.5	Confident	6 Å²	6	48 Å²	48	3%	0.028	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	104.2	176.9	-61.7	-98.5	0	0	0	110	N838 A839 V840 V841 V868 Q898 L931	N838-H866 PolarHBondContact ND2-NE2 2.93Å; N838-H866 VanDerWaalsContact ND2-NE2 3.16Å; A839-H866 PolarHBondContact O-N 2.89Å; V840-H866 WeakPolarHBondContact CA-O 3.37Å; V840-H866 HydrophobicContact CG2-CB 4.45Å; V841-H866 PolarHBondContact N-O 3.06Å; H866-V868 HydrophobicContact CB-CG2 4.48Å; H866-Q898 CarbonylContact C-O 3.52Å; H866-Q898 WeakPolarHBondContact CA-O 3.47Å; H866-Q898 PolarHBondContact CE1-NE2 2.97Å; H866-Q898 VanDerWaalsContact CE1-NE2 3.34Å; H866-Q898 PolarHBondContact CE1-OE1 2.86Å; H866-Q898 VanDerWaalsContact CE1-OE1 3.24Å; H866-L931 HydrophobicContact CB-CD1 3.69Å
867	L	95.6	Very high	82	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	110.6	170.8	177.8	61.2	0	0	0	108.9	V841 A848 Y849 V852 L869 M892 Q898 V899 H900	V841-L867 HydrophobicContact CB-CD1 4.18Å; V841-L867 HydrophobicContact CG1-CD1 4.04Å; A848-L867 HydrophobicContact CB-CD1 4.37Å; Y849-L867 HydrophobicContact CD1-CD2 4.3Å; Y849-L867 HydrophobicContact CE1-CD2 4Å; V852-L867 HydrophobicContact CG2-CB 4.3Å; V852-L867 HydrophobicContact CG2-CD1 4.22Å; V852-L867 HydrophobicContact CG2-CD2 4.46Å; L867-L869 HydrophobicContact CD1-CD2 4.01Å; L867-L869 HydrophobicContact CD2-CD2 4.05Å; L867-L869 HydrophobicContact CG-CD2 3.77Å; L867-M892 HydrophobicContact CD2-CE 4.22Å; L867-M892 HydrophobicContact CD2-SD 3.78Å; L867-Q898 PolarHBondContact N-O 3.48Å; L867-V899 HydrophobicContact CB-CG2 4.4Å; L867-V899 HydrophobicContact CD2-CG1 4.44Å; L867-V899 HydrophobicContact CD2-CG2 4.43Å; L867-V899 WeakPolarHBondContact O-CA 3.47Å; L867-H900 PolarHBondContact O-N 2.86Å
868	V	93.9	Very high	80.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	110	-177.1	-175	0	0	0	0	109.1	V840 V841 Y842 G843 H866 H900 C903 F922 L931	V840-V868 HydrophobicContact CG1-CG2 3.92Å; V841-V868 PolarHBondContact O-N 3.17Å; Y842-V868 WeakPolarHBondContact CA-O 3.47Å; Y842-V868 HydrophobicContact CD2-CB 4.03Å; Y842-V868 HydrophobicContact CD2-CG1 3.86Å; Y842-V868 VanDerWaalsContact CD2-O 3.32Å; Y842-V868 WeakPolarHBondContact CD2-O 3.29Å; Y842-V868 HydrophobicContact CE2-CG1 4.22Å; G843-V868 PolarHBondContact N-O 3.48Å; G843-V868 VanDerWaalsContact N-O 3.09Å; H866-V868 HydrophobicContact CB-CG2 4.48Å; V868-H900 HydrophobicContact CG2-CB 4.41Å; V868-C903 HydrophobicContact CG1-CB 3.37Å; V868-F922 HydrophobicContact CB-CE1 4.43Å; V868-F922 HydrophobicContact CB-CZ 4.24Å; V868-F922 HydrophobicContact CG1-CD1 3.95Å; V868-F922 HydrophobicContact CG1-CE1 3.68Å; V868-F922 HydrophobicContact CG1-CE2 4.27Å; V868-F922 HydrophobicContact CG1-CG 4.39Å; V868-F922 HydrophobicContact CG1-CZ 3.85Å; V868-F922 HydrophobicContact CG2-CE2 4.27Å; V868-F922 HydrophobicContact CG2-CZ 4.15Å; V868-L931 HydrophobicContact CG2-CD1 3.92Å
869	L	90.2	Very high	80.1	Confident	16 Å²	16	45.1 Å²	45.1	8%	0.084	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-89.4	120.3	-178.4	-52.4	-175	0	0	0	110.1	G843 N844 L867 V899 H900 Q901 N902 C903	G843-L869 WeakPolarHBondContact O-CD2 3.48Å; N844-L869 HydrophobicContact CB-CD2 4.42Å; L867-L869 HydrophobicContact CD1-CD2 4.01Å; L867-L869 HydrophobicContact CD2-CD2 4.05Å; L867-L869 HydrophobicContact CG-CD2 3.77Å; L869-V899 HydrophobicContact CD1-CG1 4.17Å; L869-V899 HydrophobicContact CG-CG1 4.33Å; L869-H900 PolarHBondContact N-O 3.23Å; L869-Q901 HydrophobicContact CD1-CG 4.35Å; L869-N902 PolarHBondContact O-N 3.19Å; L869-N902 VanDerWaalsContact O-N 3.12Å; L869-C903 PolarHBondContact O-N 2.67Å
870	P	86.3	Confident	79.2	Confident	18 Å²	18	46.4 Å²	46.4	12%	0.117	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-63.2	156.2	169.6	26.9	-34.6	0	0	0	111.4	Y842 N844 C903	Y842-P870 HydrophobicContact CE2-CB 3.99Å; Y842-P870 HydrophobicContact CE2-CG 4.42Å; N844-P870 HydrophobicContact CB-CG 4.33Å; P870-C903 WeakPolarHBondContact CA-O 3.4Å
871	P	80.9	Confident	78.7	Confident	40 Å²	40	47.6 Å²	47.6	26%	0.26	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-51	141.7	173.7	-25.9	34.1	0	0	0	111.8	A873 N902 V904	P871-A873 PolarHBondContact O-N 3.06Å; P871-N902 HydrophobicContact CG-CB 4.35Å; P871-V904 HydrophobicContact CG-CG2 3.53Å
872	P	64.6	Low	78.3	Confident	99 Å²	99	50.9 Å²	50.9	64%	0.643	29%	0.285	S	S	*	.			trans	-64.2	107	-173.9	25.2	-34.4	0	0	0	111.1	N902	P872-N902 VanDerWaalsContact CD-OD1 3.31Å; P872-N902 WeakPolarHBondContact CD-OD1 3.49Å
873	A	55.6	Low	78.1	Confident	66 Å²	66	51.4 Å²	51.4	55%	0.545	29%	0.289	S	S	.	.			trans	-61.8	173.5	169.1	0	0	0	0	0	111.2	P871 R875	P871-A873 PolarHBondContact O-N 3.06Å; A873-R875 HydrophobicContact CB-CG 4.45Å; A873-R875 PolarHBondContact O-N 3.37Å; A873-R875 VanDerWaalsContact O-O 3.1Å
874	I	50.6	Low	77.9	Confident	146 Å²	146	49.4 Å²	49.4	75%	0.749	27%	0.274	S	S	*	.	S	Bend	trans	-57.9	-12.8	174.3	-63.8	177.3	0	0	0	112.7	Q1064	I874-Q1064 PolarHBondContact O-NE2 3.48Å
875	R	51.2	Low	77.6	Confident	131 Å²	131	51.4 Å²	51.4	49%	0.494	29%	0.287	S	S	.	.	S	Bend	trans	-66.3	151.9	174.1	-63.1	-175.8	179.2	-146.3	3.3	112.2	A873 E942	A873-R875 HydrophobicContact CB-CG 4.45Å; A873-R875 PolarHBondContact O-N 3.37Å; A873-R875 VanDerWaalsContact O-O 3.1Å; R875-E942 IonicContact CZ-OE2 2.7Å; R875-E942 IonicContact NH1-OE2 3.35Å; R875-E942 PolarHBondContact NH1-OE2 3.08Å; R875-E942 IonicContact NH2-OE2 2.68Å
876	P	54.1	Low	77.4	Confident	70 Å²	70	59 Å²	59	46%	0.455	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-68.5	160.1	174.5	31.9	-38.1	0	0	0	112.2	L1063	P876-L1063 HydrophobicContact CB-CB 4.42Å; P876-L1063 HydrophobicContact CB-CD1 3.83Å; P876-L1063 HydrophobicContact CG-CD1 3.73Å
877	A	62.6	Low	77.2	Confident	57 Å²	57	58.9 Å²	58.9	47%	0.471	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-58.2	152	168.6	0	0	0	0	0	111.6	F879	A877-F879 VanDerWaalsContact C-N 3.3Å; A877-F879 PolarHBondContact O-N 3.5Å
878	P	66	Low	77.1	Confident	15 Å²	15	58.9 Å²	58.9	10%	0.097	32%	0.316	C	S	.	.	S	Bend	trans	-59.6	-40.8	-177.9	23.4	-35	0	0	0	112.1	N844 Y849	N844-P878 VanDerWaalsContact OD1-CD 3.27Å; N844-P878 WeakPolarHBondContact OD1-CD 3.34Å; N844-P878 WeakPolarHBondContact OD1-CG 3.15Å; Y849-P878 HydrophobicContact CE2-CB 4.11Å; Y849-P878 HydrophobicContact CE2-CG 3.7Å
879	F	78	Confident	77	Confident	11 Å²	11	60.9 Å²	60.9	5%	0.048	33%	0.332	C	S	.	.			trans	-103	129.4	173.7	-50.7	-65.3	0	0	0	110.4	L846 Y849 A877 D881 V884 D885 V888 L1047 F1053	L846-F879 HydrophobicContact CD1-CD1 4.42Å; L846-F879 HydrophobicContact CD1-CE1 3.58Å; L846-F879 HydrophobicContact CD1-CZ 4.12Å; Y849-F879 HydrophobicContact CD1-CE2 4.13Å; Y849-F879 HydrophobicContact CD1-CZ 4.35Å; Y849-F879 HydrophobicContact CD2-CE2 4.18Å; Y849-F879 HydrophobicContact CD2-CZ 4.2Å; Y849-F879 HydrophobicContact CE1-CE2 4.08Å; Y849-F879 HydrophobicContact CE2-CE2 4.18Å; Y849-F879 HydrophobicContact CG-CE2 4.17Å; Y849-F879 HydrophobicContact CG-CZ 4.06Å; A877-F879 VanDerWaalsContact C-N 3.3Å; A877-F879 PolarHBondContact O-N 3.5Å; F879-D881 VanDerWaalsContact C-N 3.33Å; F879-V884 HydrophobicContact CD1-CG1 3.8Å; F879-V884 HydrophobicContact CE1-CG1 4.2Å; F879-V884 HydrophobicContact CG-CG1 4.19Å; F879-D885 HydrophobicContact CB-CB 4.27Å; F879-D885 HydrophobicContact CD2-CB 4.28Å; F879-V888 HydrophobicContact CE2-CB 4.43Å; F879-V888 HydrophobicContact CE2-CG1 4.31Å; F879-V888 HydrophobicContact CE2-CG2 4.37Å; F879-V888 HydrophobicContact CZ-CG1 4.4Å; F879-V888 HydrophobicContact CZ-CG2 4.15Å; F879-L1047 HydrophobicContact CE1-CD1 3.59Å; F879-L1047 HydrophobicContact CE1-CD2 4.12Å; F879-L1047 HydrophobicContact CZ-CD1 3.98Å; F879-L1047 HydrophobicContact CZ-CD2 4.08Å; F879-F1053 HydrophobicContact CD1-CZ 4.2Å
880	S	72	Confident	77.1	Confident	85 Å²	85	62.3 Å²	62.3	59%	0.594	35%	0.347	S	S	*	.	S	Bend	trans	-76.2	-23.7	170.5	59.3	0	0	0	0	112.6	H1055	S880-H1055 PolarHBondContact OG-CE1 2.86Å
881	D	81.9	Confident	77.4	Confident	27 Å²	27	62.6 Å²	62.6	14%	0.144	35%	0.35	C	S	.	.			trans	-105.7	125.3	-173.7	-158.5	-62	0	0	0	112.4	F879 A883 V884 D885 Y1089 R1091	F879-D881 VanDerWaalsContact C-N 3.33Å; D881-A883 VanDerWaalsContact C-N 3.26Å; D881-A883 PolarHBondContact O-N 3.19Å; D881-A883 VanDerWaalsContact OD1-CB 3.26Å; D881-A883 WeakPolarHBondContact OD1-CB 3.27Å; D881-A883 PolarHBondContact OD1-N 2.87Å; D881-V884 HydrophobicContact CB-CG2 4.25Å; D881-V884 PolarHBondContact O-N 3.09Å; D881-D885 WeakPolarHBondContact O-CB 3.46Å; D881-D885 PolarHBondContact O-N 2.82Å; D881-D885 VanDerWaalsContact O-N 3.13Å; D881-Y1089 PolarHBondContact OD2-OH 3.48Å; D881-R1091 WeakPolarHBondContact OD2-CD 3.24Å; D881-R1091 IonicContact OD2-NE 3.71Å; D881-R1091 PolarHBondContact OD2-NE 3.41Å
882	R	85.9	Confident	78.1	Confident	204 Å²	204	61.1 Å²	61.1	77%	0.77	34%	0.34	S	S	*	.	H	α-helix	trans	-72.3	-12.3	-179.9	-66.9	-177.4	176.1	-176.8	-2	113.8	R886	R882-R886 WeakPolarHBondContact O-CG 3.44Å; R882-R886 PolarHBondContact O-NE 3.33Å; R882-R886 PolarHBondContact O-NH2 3.34Å
883	A	88.4	Confident	79.5	Confident	19 Å²	19	61.4 Å²	61.4	16%	0.157	34%	0.34	C	S	.	.	H	α-helix	trans	-76.2	-47.9	171.4	0	0	0	0	0	110.5	D881 R886 A887 A1084 Y1089	D881-A883 VanDerWaalsContact C-N 3.26Å; D881-A883 PolarHBondContact O-N 3.19Å; D881-A883 VanDerWaalsContact OD1-CB 3.26Å; D881-A883 WeakPolarHBondContact OD1-CB 3.27Å; D881-A883 PolarHBondContact OD1-N 2.87Å; A883-R886 PolarHBondContact O-N 2.65Å; A883-A887 PolarHBondContact O-N 3.43Å; A883-A1084 HydrophobicContact CB-CB 3.99Å; A883-A1084 WeakPolarHBondContact O-CB 3.46Å; A883-Y1089 HydrophobicContact CB-CE2 4Å
884	V	89.9	Confident	81.3	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.006	35%	0.349	C	S	.	.	H	α-helix	trans	-62	-50.6	177	178.3	0	0	0	0	110.7	F879 D881 R886 A887 V888 L1047 F1053 Y1089 T1104 L1106	F879-V884 HydrophobicContact CD1-CG1 3.8Å; F879-V884 HydrophobicContact CE1-CG1 4.2Å; F879-V884 HydrophobicContact CG-CG1 4.19Å; D881-V884 HydrophobicContact CB-CG2 4.25Å; D881-V884 PolarHBondContact O-N 3.09Å; V884-R886 VanDerWaalsContact C-N 3.33Å; V884-R886 PolarHBondContact O-N 2.73Å; V884-A887 PolarHBondContact O-N 3.18Å; V884-V888 HydrophobicContact CG1-CG2 4.26Å; V884-V888 WeakPolarHBondContact O-CG2 3.39Å; V884-V888 PolarHBondContact O-N 2.82Å; V884-L1047 HydrophobicContact CG1-CD1 4.36Å; V884-F1053 HydrophobicContact CG1-CD2 4.1Å; V884-F1053 HydrophobicContact CG1-CE2 3.94Å; V884-F1053 HydrophobicContact CG2-CE2 4.32Å; V884-Y1089 HydrophobicContact CG2-CD1 4.35Å; V884-Y1089 HydrophobicContact CG2-CE1 4.19Å; V884-T1104 HydrophobicContact CG2-CG2 4.23Å; V884-L1106 HydrophobicContact CG1-CD1 4.23Å; V884-L1106 HydrophobicContact CG1-CD2 4.25Å; V884-L1106 HydrophobicContact CG2-CB 4.44Å; V884-L1106 HydrophobicContact CG2-CD2 4.34Å
885	D	89.5	Confident	83.3	Confident	69 Å²	69	56.2 Å²	56.2	37%	0.369	33%	0.326	S	S	.	.	H	α-helix	trans	-51.2	-47.7	177.5	-178.6	55.6	0	0	0	112.7	F879 D881 A889	F879-D885 HydrophobicContact CB-CB 4.27Å; F879-D885 HydrophobicContact CD2-CB 4.28Å; D881-D885 WeakPolarHBondContact O-CB 3.46Å; D881-D885 PolarHBondContact O-N 2.82Å; D881-D885 VanDerWaalsContact O-N 3.13Å; D885-A889 VanDerWaalsContact O-CB 3.32Å; D885-A889 WeakPolarHBondContact O-CB 3.45Å; D885-A889 PolarHBondContact O-N 2.88Å
886	R	91	Very high	85.4	Confident	159 Å²	159	56.4 Å²	56.4	60%	0.6	33%	0.333	S	S	*	.	H	α-helix	trans	-70.6	-29.3	177.1	-75.7	-179.1	-66.6	153.4	5	114.1	R882 A883 V884 A890	R882-R886 WeakPolarHBondContact O-CG 3.44Å; R882-R886 PolarHBondContact O-NE 3.33Å; R882-R886 PolarHBondContact O-NH2 3.34Å; A883-R886 PolarHBondContact O-N 2.65Å; V884-R886 VanDerWaalsContact C-N 3.33Å; V884-R886 PolarHBondContact O-N 2.73Å; R886-A890 VanDerWaalsContact O-CB 3.29Å; R886-A890 WeakPolarHBondContact O-CB 3.47Å; R886-A890 PolarHBondContact O-N 3.23Å
887	A	92.9	Very high	87.4	Confident	3 Å²	3	53.6 Å²	53.6	3%	0.025	31%	0.314	C	S	.	.	H	α-helix	trans	-71.8	-45.2	175.2	0	0	0	0	0	111.4	A883 V884 A890 A891 A1084 Q1085 L1106	A883-A887 PolarHBondContact O-N 3.43Å; V884-A887 PolarHBondContact O-N 3.18Å; A887-A890 PolarHBondContact O-N 3.05Å; A887-A891 WeakPolarHBondContact O-CB 3.29Å; A887-A891 PolarHBondContact O-N 3.26Å; A887-A1084 VanDerWaalsContact CB-C 3.5Å; A887-A1084 HydrophobicContact CB-CB 3.67Å; A887-A1084 VanDerWaalsContact CB-O 3.24Å; A887-A1084 WeakPolarHBondContact CB-O 3.23Å; A887-Q1085 HydrophobicContact CB-CG 4.22Å; A887-L1106 HydrophobicContact CB-CD2 4.13Å
888	V	92.9	Very high	88.9	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	31%	0.308	C	S	.	.	H	α-helix	trans	-62.8	-43.7	175.3	176.8	0	0	0	0	110.9	Y849 F879 V884 A890 A891 M892 L1047 P1048	Y849-V888 HydrophobicContact CD1-CG1 3.65Å; Y849-V888 HydrophobicContact CE1-CG1 4.16Å; F879-V888 HydrophobicContact CE2-CB 4.43Å; F879-V888 HydrophobicContact CE2-CG1 4.31Å; F879-V888 HydrophobicContact CE2-CG2 4.37Å; F879-V888 HydrophobicContact CZ-CG1 4.4Å; F879-V888 HydrophobicContact CZ-CG2 4.15Å; V884-V888 HydrophobicContact CG1-CG2 4.26Å; V884-V888 WeakPolarHBondContact O-CG2 3.39Å; V884-V888 PolarHBondContact O-N 2.82Å; V888-A890 PolarHBondContact O-N 3.38Å; V888-A891 PolarHBondContact O-N 2.97Å; V888-M892 HydrophobicContact CG1-CE 4.3Å; V888-M892 HydrophobicContact CG1-SD 4.5Å; V888-M892 WeakPolarHBondContact O-CG 3.45Å; V888-M892 PolarHBondContact O-N 2.91Å; V888-L1047 HydrophobicContact CG2-CB 4.21Å; V888-L1047 HydrophobicContact CG2-CD1 3.87Å; V888-P1048 HydrophobicContact CG1-CB 4.23Å; V888-P1048 HydrophobicContact CG1-CG 4.05Å
889	A	91.7	Very high	90.2	Very high	41 Å²	41	56.3 Å²	56.3	34%	0.339	32%	0.319	S	S	.	.	H	α-helix	trans	-61.5	-40.6	174.7	0	0	0	0	0	112.6	D885 T893	D885-A889 VanDerWaalsContact O-CB 3.32Å; D885-A889 WeakPolarHBondContact O-CB 3.45Å; D885-A889 PolarHBondContact O-N 2.88Å; A889-T893 WeakPolarHBondContact O-CB 3.49Å; A889-T893 PolarHBondContact O-N 3.46Å; A889-T893 PolarHBondContact O-OG1 3.32Å
890	A	93.1	Very high	90.9	Very high	47 Å²	47	58.6 Å²	58.6	39%	0.388	33%	0.33	S	S	.	.	H	α-helix	trans	-66.8	-39.5	176.1	0	0	0	0	0	112.4	R886 A887 V888 T893 G894	R886-A890 VanDerWaalsContact O-CB 3.29Å; R886-A890 WeakPolarHBondContact O-CB 3.47Å; R886-A890 PolarHBondContact O-N 3.23Å; A887-A890 PolarHBondContact O-N 3.05Å; V888-A890 PolarHBondContact O-N 3.38Å; A890-T893 PolarHBondContact O-N 3.27Å; A890-G894 PolarHBondContact O-N 3.27Å
891	A	93.4	Very high	91.7	Very high	24 Å²	24	61.1 Å²	61.1	20%	0.198	33%	0.332	C	S	.	.	H	α-helix	trans	-66.9	-43.8	176.5	0	0	0	0	0	112.5	A887 V888 T893 G894 A895 P1048 F1051	A887-A891 WeakPolarHBondContact O-CB 3.29Å; A887-A891 PolarHBondContact O-N 3.26Å; V888-A891 PolarHBondContact O-N 2.97Å; A891-T893 VanDerWaalsContact C-N 3.33Å; A891-T893 PolarHBondContact O-N 2.85Å; A891-G894 PolarHBondContact O-N 2.98Å; A891-A895 WeakPolarHBondContact O-CB 3.23Å; A891-A895 PolarHBondContact O-N 3.46Å; A891-P1048 WeakPolarHBondContact CB-O 3.43Å; A891-F1051 HydrophobicContact CB-CE2 4.04Å
892	M	94.3	Very high	92	Very high	8 Å²	8	62 Å²	62	4%	0.039	34%	0.337	C	S	.	.	H	α-helix	trans	-59.6	-43.1	172.4	-71.4	-170.6	-55.3	0	0	111.8	Y849 V852 L867 V888 A895 E896 V897 V899 P1048	Y849-M892 HydrophobicContact CD1-CE 4.17Å; Y849-M892 HydrophobicContact CD1-SD 4Å; Y849-M892 HydrophobicContact CE1-CE 3.81Å; Y849-M892 HydrophobicContact CE1-SD 4.19Å; V852-M892 HydrophobicContact CG1-SD 4.47Å; L867-M892 HydrophobicContact CD2-CE 4.22Å; L867-M892 HydrophobicContact CD2-SD 3.78Å; V888-M892 HydrophobicContact CG1-CE 4.3Å; V888-M892 HydrophobicContact CG1-SD 4.5Å; V888-M892 WeakPolarHBondContact O-CG 3.45Å; V888-M892 PolarHBondContact O-N 2.91Å; M892-A895 CarbonylContact O-C 3.51Å; M892-A895 PolarHBondContact O-N 3.1Å; M892-E896 PolarHBondContact O-N 3.15Å; M892-V897 HydrophobicContact CB-CB 4.14Å; M892-V897 PolarHBondContact O-N 2.97Å; M892-V899 HydrophobicContact CE-CG2 3.98Å; M892-V899 HydrophobicContact SD-CG2 4.38Å; M892-P1048 HydrophobicContact CG-CB 3.53Å; M892-P1048 HydrophobicContact CG-CG 3.91Å; M892-P1048 HydrophobicContact SD-CB 4.44Å; M892-P1048 HydrophobicContact SD-CG 4.17Å
893	T	94.4	Very high	92.1	Very high	106 Å²	106	52.5 Å²	52.5	65%	0.65	30%	0.302	S	S	*	.	H	α-helix	trans	-62.7	-42.6	176.3	-52.7	0	0	0	0	111.5	A889 A890 A891 A895 E896	A889-T893 WeakPolarHBondContact O-CB 3.49Å; A889-T893 PolarHBondContact O-N 3.46Å; A889-T893 PolarHBondContact O-OG1 3.32Å; A890-T893 PolarHBondContact O-N 3.27Å; A891-T893 VanDerWaalsContact C-N 3.33Å; A891-T893 PolarHBondContact O-N 2.85Å; T893-A895 PolarHBondContact O-N 3Å; T893-E896 PolarHBondContact O-N 2.93Å; T893-E896 VanDerWaalsContact O-N 3.11Å
894	G	92.8	Very high	92.1	Very high	71 Å²	71	51.7 Å²	51.7	73%	0.732	30%	0.295	S	S	*	.	H	α-helix	trans	-69.5	-18	176.6	0	0	0	0	0	114.4	A890 A891	A890-G894 PolarHBondContact O-N 3.27Å; A891-G894 PolarHBondContact O-N 2.98Å
895	A	93.4	Very high	92	Very high	32 Å²	32	51.9 Å²	51.9	26%	0.264	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	7.4	171.6	0	0	0	0	0	113.3	L856 G862 A891 M892 T893 V897	L856-A895 HydrophobicContact CD1-CB 4.21Å; L856-A895 HydrophobicContact CD2-CB 4.19Å; G862-A895 VanDerWaalsContact CA-O 3.24Å; G862-A895 WeakPolarHBondContact CA-O 3.31Å; A891-A895 WeakPolarHBondContact O-CB 3.23Å; A891-A895 PolarHBondContact O-N 3.46Å; M892-A895 CarbonylContact O-C 3.51Å; M892-A895 PolarHBondContact O-N 3.1Å; T893-A895 PolarHBondContact O-N 3Å; A895-V897 HydrophobicContact CB-CG2 4.18Å; A895-V897 PolarHBondContact O-N 3.24Å
896	E	95.3	Very high	92	Very high	135 Å²	135	48.6 Å²	48.6	63%	0.631	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	17.1	-177.6	-51.9	-172.9	159.1	0	0	115.6	G862 S863 M892 T893 Q898	G862-E896 CarbonylContact C-O 3.55Å; S863-E896 WeakPolarHBondContact CA-O 3.38Å; M892-E896 PolarHBondContact O-N 3.15Å; T893-E896 PolarHBondContact O-N 2.93Å; T893-E896 VanDerWaalsContact O-N 3.11Å; E896-Q898 PolarHBondContact O-N 3.28Å
897	V	95.9	Very high	91.8	Very high	10 Å²	10	42.3 Å²	42.3	6%	0.061	26%	0.256	C	S	.	.			trans	-68.1	128.1	180	177.7	0	0	0	0	111.4	V852 L856 G862 I865 M892 A895	V852-V897 HydrophobicContact CG1-CG1 4.17Å; V852-V897 HydrophobicContact CG1-CG2 4.23Å; L856-V897 HydrophobicContact CD1-CG2 4.32Å; L856-V897 HydrophobicContact CD2-CG2 4.3Å; G862-V897 WeakPolarHBondContact O-CA 3.46Å; I865-V897 HydrophobicContact CB-CG1 4.27Å; I865-V897 HydrophobicContact CB-CG2 4.44Å; I865-V897 HydrophobicContact CG2-CG1 4.1Å; M892-V897 HydrophobicContact CB-CB 4.14Å; M892-V897 PolarHBondContact O-N 2.97Å; A895-V897 HydrophobicContact CB-CG2 4.18Å; A895-V897 PolarHBondContact O-N 3.24Å
898	Q	95	Very high	91.5	Very high	74 Å²	74	42.7 Å²	42.7	35%	0.346	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	118.6	-178.4	-56.3	-170.1	43.2	0	0	110.2	S863 I865 H866 L867 E896	S863-Q898 PolarHBondContact O-NE2 3.31Å; I865-Q898 PolarHBondContact O-N 2.92Å; H866-Q898 CarbonylContact C-O 3.52Å; H866-Q898 WeakPolarHBondContact CA-O 3.47Å; H866-Q898 PolarHBondContact CE1-NE2 2.97Å; H866-Q898 VanDerWaalsContact CE1-NE2 3.34Å; H866-Q898 PolarHBondContact CE1-OE1 2.86Å; H866-Q898 VanDerWaalsContact CE1-OE1 3.24Å; L867-Q898 PolarHBondContact N-O 3.48Å; E896-Q898 PolarHBondContact O-N 3.28Å
899	V	93.1	Very high	91.3	Very high	56 Å²	56	43.4 Å²	43.4	34%	0.339	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	119.5	-179	-173.5	0	0	0	0	110.4	L867 L869 M892	L867-V899 HydrophobicContact CB-CG2 4.4Å; L867-V899 HydrophobicContact CD2-CG1 4.44Å; L867-V899 HydrophobicContact CD2-CG2 4.43Å; L867-V899 WeakPolarHBondContact O-CA 3.47Å; L869-V899 HydrophobicContact CD1-CG1 4.17Å; L869-V899 HydrophobicContact CG-CG1 4.33Å; M892-V899 HydrophobicContact CE-CG2 3.98Å; M892-V899 HydrophobicContact SD-CG2 4.38Å
900	H	92	Very high	90.7	Very high	58 Å²	58	44 Å²	44	27%	0.269	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	134.9	-179.9	-53.8	-85.6	0	0	0	109.9	L867 V868 L869 L929	L867-H900 PolarHBondContact O-N 2.86Å; V868-H900 HydrophobicContact CG2-CB 4.41Å; L869-H900 PolarHBondContact N-O 3.23Å; H900-L929 HydrophobicContact CB-CD2 3.63Å; H900-L929 VanDerWaalsContact CG-CD2 3.44Å
901	Q	89.4	Confident	89.8	Confident	138 Å²	138	44.7 Å²	44.7	65%	0.645	27%	0.27	S	S	*	.			trans	-112.7	151.3	-173	-58.7	-167.4	-5	0	0	112.1	L869 C903	L869-Q901 HydrophobicContact CD1-CG 4.35Å; Q901-C903 VanDerWaalsContact C-N 3.31Å; Q901-C903 PolarHBondContact O-N 3.13Å; Q901-C903 PolarHBondContact O-SG 3.38Å
902	N	86.7	Confident	89.1	Confident	47 Å²	47	50.7 Å²	50.7	25%	0.251	29%	0.294	S	S	.	.	S	Bend	trans	49.6	47.1	178.4	-59.6	-12.3	0	0	0	113.2	N792 L869 P871 P872 D925	N792-N902 PolarHBondContact ND2-O 3.45Å; L869-N902 PolarHBondContact O-N 3.19Å; L869-N902 VanDerWaalsContact O-N 3.12Å; P871-N902 HydrophobicContact CG-CB 4.35Å; P872-N902 VanDerWaalsContact CD-OD1 3.31Å; P872-N902 WeakPolarHBondContact CD-OD1 3.49Å; N902-D925 VanDerWaalsContact CB-OD2 3.31Å; N902-D925 WeakPolarHBondContact CB-OD2 3.31Å; N902-D925 PolarHBondContact ND2-OD2 2.9Å
903	C	88.7	Confident	88.4	Confident	4 Å²	4	56.5 Å²	56.5	3%	0.027	32%	0.321	C	S	.	.			trans	-104.3	128	-178.4	-70.1	0	0	0	0	111	Y842 V868 L869 P870 Q901 F922 T923	Y842-C903 WeakPolarHBondContact CE2-O 3.4Å; Y842-C903 PolarHBondContact OH-O 3.36Å; V868-C903 HydrophobicContact CG1-CB 3.37Å; L869-C903 PolarHBondContact O-N 2.67Å; P870-C903 WeakPolarHBondContact CA-O 3.4Å; Q901-C903 VanDerWaalsContact C-N 3.31Å; Q901-C903 PolarHBondContact O-N 3.13Å; Q901-C903 PolarHBondContact O-SG 3.38Å; C903-F922 HydrophobicContact CB-CB 4Å; C903-F922 HydrophobicContact CB-CD1 4.11Å; C903-F922 HydrophobicContact CB-CG 4.19Å; C903-T923 CarbonylContact C-O 3.58Å; C903-T923 WeakPolarHBondContact CA-O 3.39Å
904	V	88.2	Confident	87.6	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.012	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.3	176.2	180	0	0	0	0	110	T782 L795 W799 P871 A906 F922 T923	T782-V904 HydrophobicContact CG2-CG1 3.77Å; L795-V904 HydrophobicContact CD1-CB 3.92Å; L795-V904 HydrophobicContact CD1-CG1 3.89Å; L795-V904 HydrophobicContact CD1-CG2 3.96Å; W799-V904 HydrophobicContact CD2-CG1 3.91Å; W799-V904 HydrophobicContact CE3-CG1 3.8Å; W799-V904 HydrophobicContact CH2-CB 4.44Å; W799-V904 HydrophobicContact CH2-CG1 3.7Å; W799-V904 HydrophobicContact CH2-CG2 3.99Å; W799-V904 HydrophobicContact CZ2-CB 4.38Å; W799-V904 HydrophobicContact CZ2-CG1 3.79Å; W799-V904 HydrophobicContact CZ2-CG2 3.61Å; W799-V904 HydrophobicContact CZ3-CG1 3.7Å; P871-V904 HydrophobicContact CG-CG2 3.53Å; V904-A906 PolarHBondContact O-N 2.98Å; V904-A906 VanDerWaalsContact O-N 3.07Å; V904-F922 CarbonylContact O-C 3.58Å; V904-F922 WeakPolarHBondContact O-CA 3.41Å; V904-F922 WeakPolarHBondContact O-CB 3.38Å; V904-T923 PolarHBondContact N-O 2.86Å; V904-T923 PolarHBondContact O-N 3Å
905	L	89.2	Confident	87.2	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.021	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	111.6	-179	-177.6	66	0	0	0	110.8	P779 P781 T782 Y842 I908 V920 F922 F936	P779-L905 HydrophobicContact CB-CD2 3.87Å; P779-L905 HydrophobicContact CG-CD2 3.87Å; P781-L905 WeakPolarHBondContact CA-O 3.32Å; P781-L905 HydrophobicContact CB-CG 4.34Å; P781-L905 HydrophobicContact CG-CD2 4.11Å; P781-L905 HydrophobicContact CG-CG 4.41Å; T782-L905 PolarHBondContact N-O 3.36Å; Y842-L905 HydrophobicContact CE1-CB 4.25Å; L905-I908 HydrophobicContact CD2-CG1 4.42Å; L905-V920 HydrophobicContact CD1-CB 4.19Å; L905-V920 HydrophobicContact CD1-CG1 4.38Å; L905-F922 HydrophobicContact CB-CD1 4.11Å; L905-F922 HydrophobicContact CB-CE1 4.07Å; L905-F922 HydrophobicContact CD1-CD1 4.25Å; L905-F922 HydrophobicContact CD1-CE1 3.91Å; L905-F922 HydrophobicContact CD1-CZ 4.2Å; L905-F936 HydrophobicContact CD1-CE2 4.48Å; L905-F936 HydrophobicContact CD2-CZ 4.36Å
906	A	87.8	Confident	87	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-48.9	-177	0	0	0	0	0	111.8	P781 T782 G783 V784 V786 V904 S921 T923	P781-A906 VanDerWaalsContact CB-O 3.25Å; P781-A906 WeakPolarHBondContact CB-O 3.32Å; T782-A906 PolarHBondContact N-O 3.06Å; T782-A906 WeakPolarHBondContact OG1-CA 3.5Å; G783-A906 PolarHBondContact N-O 3.3Å; V784-A906 HydrophobicContact CB-CB 4.48Å; V786-A906 HydrophobicContact CG2-CB 3.6Å; V904-A906 PolarHBondContact O-N 2.98Å; V904-A906 VanDerWaalsContact O-N 3.07Å; A906-S921 WeakPolarHBondContact CA-O 3.35Å; A906-S921 WeakPolarHBondContact CB-O 3.45Å; A906-S921 PolarHBondContact N-O 2.99Å; A906-T923 HydrophobicContact CB-CG2 4.01Å
907	Q	87.3	Confident	86.7	Confident	27 Å²	27	48.4 Å²	48.4	13%	0.126	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	147.5	-178.8	-67.8	-179.7	-22	0	0	112.3	V784 V786 N910 S921	V784-Q907 WeakPolarHBondContact O-CG 3.45Å; V784-Q907 PolarHBondContact O-NE2 3Å; V786-Q907 HydrophobicContact CG2-CB 4.47Å; V786-Q907 HydrophobicContact CG2-CG 4.23Å; Q907-N910 PolarHBondContact OE1-O 3.43Å; Q907-S921 PolarHBondContact N-O 3.25Å; Q907-S921 PolarHBondContact O-N 3.41Å
908	I	87.3	Confident	86.4	Confident	12 Å²	12	50.6 Å²	50.6	6%	0.062	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	136.4	164	-63	171.7	0	0	0	106.6	P781 L905 N910 G911 P914 I917 V920	P781-I908 HydrophobicContact CG-CD1 3.92Å; P781-I908 HydrophobicContact CG-CG1 4Å; L905-I908 HydrophobicContact CD2-CG1 4.42Å; I908-N910 PolarHBondContact O-N 2.86Å; I908-G911 PolarHBondContact O-N 3.03Å; I908-P914 HydrophobicContact CG2-CB 4.26Å; I908-I917 HydrophobicContact CG2-CB 4.5Å; I908-I917 HydrophobicContact CG2-CD1 4.35Å; I908-I917 HydrophobicContact CG2-CG1 3.85Å; I908-I917 HydrophobicContact CG2-CG2 4.3Å; I908-V920 HydrophobicContact CG1-CG1 4.36Å
909	N	87.4	Confident	86.3	Confident	15 Å²	15	47.5 Å²	47.5	8%	0.08	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	46.7	35.5	-179.1	-67.2	-13.5	0	0	0	114	G911 E912 H913 P916 A918 C919	N909-G911 PolarHBondContact O-N 3.36Å; N909-E912 VanDerWaalsContact O-CB 3.32Å; N909-E912 WeakPolarHBondContact O-CB 3.41Å; N909-E912 WeakPolarHBondContact O-CG 3.23Å; N909-E912 PolarHBondContact O-N 3.39Å; N909-H913 PolarHBondContact ND2-O 3.05Å; N909-P916 PolarHBondContact ND2-O 3.04Å; N909-A918 PolarHBondContact OD1-N 3.21Å; N909-C919 PolarHBondContact N-O 3.24Å; N909-C919 PolarHBondContact OD1-N 2.98Å; N909-C919 PolarHBondContact OD1-O 3.3Å
910	N	80.1	Confident	86.2	Confident	55 Å²	55	44.8 Å²	44.8	29%	0.294	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	57.7	21.7	-176.8	-34.2	-78.1	0	0	0	115	Q907 I908 C919 R930	Q907-N910 PolarHBondContact OE1-O 3.43Å; I908-N910 PolarHBondContact O-N 2.86Å; N910-C919 PolarHBondContact ND2-SG 2.99Å; N910-R930 PolarHBondContact ND2-NH2 3.24Å; N910-R930 PolarHBondContact OD1-NE 2.72Å; N910-R930 PolarHBondContact OD1-NH1 2.97Å; N910-R930 PolarHBondContact OD1-NH2 2.8Å
911	G	74.1	Confident	86.2	Confident	61 Å²	61	42.1 Å²	42.1	63%	0.629	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	89.2	6.1	-175.2	0	0	0	0	0	114.9	I908 N909	I908-G911 PolarHBondContact O-N 3.03Å; N909-G911 PolarHBondContact O-N 3.36Å
912	E	78.4	Confident	86.3	Confident	150 Å²	150	35.5 Å²	35.5	70%	0.701	21%	0.209	S	C	*	.	S	Bend	trans	-80.6	-161.1	171.3	-57.8	-176.2	168.7	0	0	111.5	N909	N909-E912 VanDerWaalsContact O-CB 3.32Å; N909-E912 WeakPolarHBondContact O-CB 3.41Å; N909-E912 WeakPolarHBondContact O-CG 3.23Å; N909-E912 PolarHBondContact O-N 3.39Å
913	H	79.7	Confident	86.4	Confident	130 Å²	130	33.3 Å²	33.3	60%	0.602	20%	0.197	S	C	*	.			trans	-59.4	126.8	179	-166.8	-100.1	0	0	0	110.6	N909 D915	N909-H913 PolarHBondContact ND2-O 3.05Å; H913-D915 VanDerWaalsContact C-N 3.3Å; H913-D915 PolarHBondContact CE1-O 3.35Å; H913-D915 PolarHBondContact ND1-O 2.97Å; H913-D915 PolarHBondContact O-N 3.11Å
914	P	77.9	Confident	86.2	Confident	26 Å²	26	33.6 Å²	33.6	17%	0.169	20%	0.199	C	C	.	.			trans	-80.3	-8.4	-168.3	32.5	-37.5	0	0	0	114.3	P807 P809 I908 P916	P807-P914 HydrophobicContact CG-CG 4.33Å; P809-P914 WeakPolarHBondContact CB-O 3.39Å; P809-P914 HydrophobicContact CG-CB 4.33Å; P809-P914 VanDerWaalsContact CG-O 3.28Å; P809-P914 WeakPolarHBondContact CG-O 3.41Å; I908-P914 HydrophobicContact CG2-CB 4.26Å; P914-P916 CarbonylContact O-C 3.22Å
915	D	85.3	Confident	85.9	Confident	59 Å²	59	38 Å²	38	32%	0.316	22%	0.223	S	C	.	.	S	Bend	trans	-127.8	129.2	-171	-177.4	43.4	0	0	0	112.2	P809 A810 H913	P809-D915 WeakPolarHBondContact CA-OD1 3.36Å; P809-D915 HydrophobicContact CB-CB 4.27Å; A810-D915 WeakPolarHBondContact CB-OD1 3.25Å; A810-D915 PolarHBondContact N-OD1 3.27Å; H913-D915 VanDerWaalsContact C-N 3.3Å; H913-D915 PolarHBondContact CE1-O 3.35Å; H913-D915 PolarHBondContact ND1-O 2.97Å; H913-D915 PolarHBondContact O-N 3.11Å
916	P	87.3	Confident	85.4	Confident	85 Å²	85	42.3 Å²	42.3	55%	0.552	25%	0.253	S	S	*	.	S	Bend	cis	-65.3	157.8	-15.9	31.1	-35.8	0	0	0	111.1	N909 P914 A918	N909-P916 PolarHBondContact ND2-O 3.04Å; P914-P916 CarbonylContact O-C 3.22Å; P916-A918 PolarHBondContact O-N 2.94Å
917	I	90.1	Very high	85.2	Confident	4 Å²	4	50 Å²	50	2%	0.021	29%	0.289	C	S	.	.			trans	-65.3	126.9	167	-57.1	-179.7	0	0	0	107.6	P809 N811 L812 I908 V920 C933 F936	P809-I917 HydrophobicContact CB-CD1 4.08Å; P809-I917 HydrophobicContact CB-CG1 3.68Å; P809-I917 HydrophobicContact CG-CD1 4.15Å; P809-I917 HydrophobicContact CG-CG1 3.97Å; N811-I917 PolarHBondContact ND2-O 2.88Å; N811-I917 WeakPolarHBondContact OD1-CB 3.42Å; N811-I917 PolarHBondContact OD1-N 3.49Å; L812-I917 HydrophobicContact CB-CD1 3.95Å; L812-I917 HydrophobicContact CD1-CD1 4.21Å; L812-I917 HydrophobicContact CG-CD1 4.19Å; I908-I917 HydrophobicContact CG2-CB 4.5Å; I908-I917 HydrophobicContact CG2-CD1 4.35Å; I908-I917 HydrophobicContact CG2-CG1 3.85Å; I908-I917 HydrophobicContact CG2-CG2 4.3Å; I917-V920 HydrophobicContact CG2-CG1 3.67Å; I917-C933 HydrophobicContact CG2-CB 3.98Å; I917-F936 HydrophobicContact CD1-CB 3.81Å; I917-F936 HydrophobicContact CD1-CG 4.33Å
918	A	90.3	Very high	85	Confident	56 Å²	56	51.1 Å²	51.1	46%	0.463	30%	0.298	S	S	.	.			trans	-114.7	-34.3	170.9	0	0	0	0	0	111.2	N909 P916 Q932 C933	N909-A918 PolarHBondContact OD1-N 3.21Å; P916-A918 PolarHBondContact O-N 2.94Å; A918-Q932 WeakPolarHBondContact O-CA 3.46Å; A918-Q932 PolarHBondContact O-OE1 3.48Å; A918-C933 PolarHBondContact O-N 2.86Å
919	C	91.1	Very high	85.1	Confident	8 Å²	8	51.8 Å²	51.8	5%	0.054	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	151.8	171.5	64.5	0	0	0	0	112.9	N909 N910 L931	N909-C919 PolarHBondContact N-O 3.24Å; N909-C919 PolarHBondContact OD1-N 2.98Å; N909-C919 PolarHBondContact OD1-O 3.3Å; N910-C919 PolarHBondContact ND2-SG 2.99Å; C919-L931 CarbonylContact C-O 3.56Å; C919-L931 WeakPolarHBondContact CA-O 3.25Å; C919-L931 VanDerWaalsContact CB-O 3.26Å; C919-L931 WeakPolarHBondContact CB-O 3.33Å
920	V	92.6	Very high	85.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	141.1	176	-72.1	0	0	0	0	110.3	V840 L905 I908 I917 F922 L931 C933 F936	V840-V920 HydrophobicContact CG1-CG2 4.33Å; V840-V920 HydrophobicContact CG2-CG2 4.09Å; L905-V920 HydrophobicContact CD1-CB 4.19Å; L905-V920 HydrophobicContact CD1-CG1 4.38Å; I908-V920 HydrophobicContact CG1-CG1 4.36Å; I917-V920 HydrophobicContact CG2-CG1 3.67Å; V920-F922 HydrophobicContact CB-CE2 4.14Å; V920-F922 HydrophobicContact CB-CZ 4.45Å; V920-F922 HydrophobicContact CG2-CE2 3.68Å; V920-F922 HydrophobicContact CG2-CZ 4.1Å; V920-L931 HydrophobicContact CG2-CB 4.23Å; V920-L931 PolarHBondContact N-O 3.46Å; V920-L931 PolarHBondContact O-N 3.31Å; V920-C933 HydrophobicContact CG2-CB 4.13Å; V920-F936 HydrophobicContact CB-CD2 4.48Å; V920-F936 HydrophobicContact CB-CE2 4.29Å; V920-F936 HydrophobicContact CG1-CD2 3.8Å; V920-F936 HydrophobicContact CG1-CE2 3.93Å; V920-F936 HydrophobicContact CG2-CD2 4.18Å; V920-F936 HydrophobicContact CG2-CE2 4.12Å
921	S	91.6	Very high	85.8	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.007	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	129.3	-173.1	-58.9	0	0	0	0	109.6	A906 Q907 L929	A906-S921 WeakPolarHBondContact CA-O 3.35Å; A906-S921 WeakPolarHBondContact CB-O 3.45Å; A906-S921 PolarHBondContact N-O 2.99Å; Q907-S921 PolarHBondContact N-O 3.25Å; Q907-S921 PolarHBondContact O-N 3.41Å; S921-L929 CarbonylContact C-O 3.55Å; S921-L929 WeakPolarHBondContact CA-O 3.48Å
922	F	90.6	Very high	86.7	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	141.3	-175.3	-55.8	-99.7	0	0	0	110.9	V840 Y842 V868 C903 V904 L905 V920 P928 L929 L931 F936	V840-F922 HydrophobicContact CG1-CZ 4.12Å; Y842-F922 AromaticContact CD2-CE1 3.84Å; Y842-F922 HydrophobicContact CD2-CE1 3.84Å; Y842-F922 HydrophobicContact CE2-CD1 4.35Å; Y842-F922 AromaticContact CE2-CE1 3.92Å; Y842-F922 HydrophobicContact CE2-CE1 3.92Å; Y842-F922 HydrophobicContact CG-CE1 4.32Å; V868-F922 HydrophobicContact CB-CE1 4.43Å; V868-F922 HydrophobicContact CB-CZ 4.24Å; V868-F922 HydrophobicContact CG1-CD1 3.95Å; V868-F922 HydrophobicContact CG1-CE1 3.68Å; V868-F922 HydrophobicContact CG1-CE2 4.27Å; V868-F922 HydrophobicContact CG1-CG 4.39Å; V868-F922 HydrophobicContact CG1-CZ 3.85Å; V868-F922 HydrophobicContact CG2-CE2 4.27Å; V868-F922 HydrophobicContact CG2-CZ 4.15Å; C903-F922 HydrophobicContact CB-CB 4Å; C903-F922 HydrophobicContact CB-CD1 4.11Å; C903-F922 HydrophobicContact CB-CG 4.19Å; V904-F922 CarbonylContact O-C 3.58Å; V904-F922 WeakPolarHBondContact O-CA 3.41Å; V904-F922 WeakPolarHBondContact O-CB 3.38Å; L905-F922 HydrophobicContact CB-CD1 4.11Å; L905-F922 HydrophobicContact CB-CE1 4.07Å; L905-F922 HydrophobicContact CD1-CD1 4.25Å; L905-F922 HydrophobicContact CD1-CE1 3.91Å; L905-F922 HydrophobicContact CD1-CZ 4.2Å; V920-F922 HydrophobicContact CB-CE2 4.14Å; V920-F922 HydrophobicContact CB-CZ 4.45Å; V920-F922 HydrophobicContact CG2-CE2 3.68Å; V920-F922 HydrophobicContact CG2-CZ 4.1Å; F922-P928 CarbonylContact O-C 3.56Å; F922-P928 WeakPolarHBondContact O-CA 3.32Å; F922-L929 HydrophobicContact CB-CB 4.38Å; F922-L929 HydrophobicContact CD2-CD2 4.3Å; F922-L929 HydrophobicContact CD2-CG 4.49Å; F922-L929 PolarHBondContact N-O 2.95Å; F922-L929 PolarHBondContact O-N 2.88Å; F922-L931 HydrophobicContact CE2-CD1 4.26Å; F922-F936 AromaticContact CZ-CE2 4Å; F922-F936 HydrophobicContact CZ-CE2 4Å; F922-F936 HydrophobicContact CZ-CZ 4.45Å
923	T	88.8	Confident	87.4	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	154	160	59.1	0	0	0	0	109.7	V784 V790 N792 L795 C903 V904 A906	V784-T923 HydrophobicContact CG1-CG2 4.27Å; V790-T923 WeakPolarHBondContact O-CG2 3.32Å; N792-T923 PolarHBondContact OD1-O 2.84Å; N792-T923 PolarHBondContact OD1-OG1 3.12Å; L795-T923 HydrophobicContact CD2-CG2 4.32Å; C903-T923 CarbonylContact C-O 3.58Å; C903-T923 WeakPolarHBondContact CA-O 3.39Å; V904-T923 PolarHBondContact N-O 2.86Å; V904-T923 PolarHBondContact O-N 3Å; A906-T923 HydrophobicContact CB-CG2 4.01Å
924	S	85.2	Confident	88	Confident	9 Å²	9	45.9 Å²	45.9	6%	0.063	25%	0.254	C	S	.	.			trans	-134.3	-172.6	175.5	82.5	0	0	0	0	110.6	T791 N792 S926 E927	T791-S924 WeakPolarHBondContact CA-O 3.43Å; N792-S924 PolarHBondContact N-O 2.97Å; S924-S926 PolarHBondContact OG-N 3.13Å; S924-E927 PolarHBondContact OG-N 3.39Å; S924-E927 PolarHBondContact OG-O 3.46Å
925	D	80.9	Confident	88.8	Confident	96 Å²	96	44.6 Å²	44.6	51%	0.513	25%	0.246	S	C	.	.	S	Bend	trans	-77.8	-8	170.1	-60.6	-23.2	0	0	0	112.8	N792 N902	N792-D925 PolarHBondContact ND2-N 3.31Å; N792-D925 PolarHBondContact ND2-OD1 3.31Å; N902-D925 VanDerWaalsContact CB-OD2 3.31Å; N902-D925 WeakPolarHBondContact CB-OD2 3.31Å; N902-D925 PolarHBondContact ND2-OD2 2.9Å
926	S	80.4	Confident	89.2	Confident	93 Å²	93	41.9 Å²	41.9	65%	0.65	23%	0.231	S	C	*	.	S	Bend	trans	-133.8	-111.7	-179.3	61.4	0	0	0	0	111.8	S924	S924-S926 PolarHBondContact OG-N 3.13Å
927	E	82.1	Confident	89.6	Confident	163 Å²	163	37.9 Å²	37.9	76%	0.762	21%	0.205	S	C	*	.	S	Bend	trans	-85.6	144	176.9	-69.3	-174	177.2	0	0	110.9	S924	S924-E927 PolarHBondContact OG-N 3.39Å; S924-E927 PolarHBondContact OG-O 3.46Å
928	P	84.1	Confident	89.7	Confident	49 Å²	49	37.8 Å²	37.8	32%	0.318	21%	0.205	S	C	.	.	P	Polyproline II helix	trans	-66.3	139.2	179	25.5	-32.8	0	0	0	112.2	V786 F922	V786-P928 HydrophobicContact CG1-CB 3.29Å; V786-P928 HydrophobicContact CG1-CG 3.95Å; F922-P928 CarbonylContact O-C 3.56Å; F922-P928 WeakPolarHBondContact O-CA 3.32Å
929	L	88.9	Confident	89.7	Confident	27 Å²	27	35.2 Å²	35.2	14%	0.141	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	124	-179.3	176.4	68.8	0	0	0	110.1	H900 S921 F922 L931	H900-L929 HydrophobicContact CB-CD2 3.63Å; H900-L929 VanDerWaalsContact CG-CD2 3.44Å; S921-L929 CarbonylContact C-O 3.55Å; S921-L929 WeakPolarHBondContact CA-O 3.48Å; F922-L929 HydrophobicContact CB-CB 4.38Å; F922-L929 HydrophobicContact CD2-CD2 4.3Å; F922-L929 HydrophobicContact CD2-CG 4.49Å; F922-L929 PolarHBondContact N-O 2.95Å; F922-L929 PolarHBondContact O-N 2.88Å; L929-L931 HydrophobicContact CD1-CD2 3.96Å; L929-L931 HydrophobicContact CD1-CG 4.34Å; L929-L931 HydrophobicContact CD2-CD1 4.23Å; L929-L931 HydrophobicContact CD2-CG 4.32Å; L929-L931 HydrophobicContact CG-CD2 4.29Å; L929-L931 HydrophobicContact CG-CG 4.12Å
930	R	90.5	Very high	89.4	Confident	143 Å²	143	36.2 Å²	36.2	54%	0.54	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	124.4	172.8	-178.4	172.8	176.1	177.7	-0.4	110.5	N910	N910-R930 PolarHBondContact ND2-NH2 3.24Å; N910-R930 PolarHBondContact OD1-NE 2.72Å; N910-R930 PolarHBondContact OD1-NH1 2.97Å; N910-R930 PolarHBondContact OD1-NH2 2.8Å
931	L	92.4	Very high	89	Confident	12 Å²	12	37.6 Å²	37.6	6%	0.063	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	140.8	-179.7	-61.1	178.7	0	0	0	110.6	V840 H866 V868 C919 V920 F922 L929	V840-L931 HydrophobicContact CG1-CD1 4.43Å; V840-L931 HydrophobicContact CG2-CB 4.38Å; V840-L931 HydrophobicContact CG2-CD1 4.09Å; H866-L931 HydrophobicContact CB-CD1 3.69Å; V868-L931 HydrophobicContact CG2-CD1 3.92Å; C919-L931 CarbonylContact C-O 3.56Å; C919-L931 WeakPolarHBondContact CA-O 3.25Å; C919-L931 VanDerWaalsContact CB-O 3.26Å; C919-L931 WeakPolarHBondContact CB-O 3.33Å; V920-L931 HydrophobicContact CG2-CB 4.23Å; V920-L931 PolarHBondContact N-O 3.46Å; V920-L931 PolarHBondContact O-N 3.31Å; F922-L931 HydrophobicContact CE2-CD1 4.26Å; L929-L931 HydrophobicContact CD1-CD2 3.96Å; L929-L931 HydrophobicContact CD1-CG 4.34Å; L929-L931 HydrophobicContact CD2-CD1 4.23Å; L929-L931 HydrophobicContact CD2-CG 4.32Å; L929-L931 HydrophobicContact CG-CD2 4.29Å; L929-L931 HydrophobicContact CG-CG 4.12Å
932	Q	92.9	Very high	88.7	Confident	114 Å²	114	40.6 Å²	40.6	53%	0.533	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	149.9	158.1	-54.3	-61.2	-8.7	0	0	108.5	N838 A918	N838-Q932 WeakPolarHBondContact CB-O 3.2Å; A918-Q932 WeakPolarHBondContact O-CA 3.46Å; A918-Q932 PolarHBondContact O-OE1 3.48Å
933	C	92.8	Very high	88.5	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.02	22%	0.22	C	C	.	.			trans	-152.6	113.7	-169	175.3	0	0	0	0	110.8	V840 I917 A918 V920 V935	V840-C933 HydrophobicContact CG2-CB 3.89Å; I917-C933 HydrophobicContact CG2-CB 3.98Å; A918-C933 PolarHBondContact O-N 2.86Å; V920-C933 HydrophobicContact CG2-CB 4.13Å; C933-V935 PolarHBondContact SG-O 3.26Å; C933-V935 VanDerWaalsContact SG-O 3.35Å
934	G	91.5	Very high	88.5	Confident	14 Å²	14	42 Å²	42	14%	0.144	23%	0.225	C	C	.	.	S	Bend	trans	-89.8	-25.4	169.6	0	0	0	0	0	113.3	N811 N838	N811-G934 WeakPolarHBondContact CB-O 3.48Å; N811-G934 PolarHBondContact ND2-O 3.29Å; N838-G934 PolarHBondContact O-N 3.41Å
935	V	94.9	Very high	88.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	137	171.5	65	0	0	0	0	111.2	L813 W827 L828 F832 N838 A839 V840 C933 L937	L813-V935 HydrophobicContact CD1-CG2 3.92Å; L813-V935 HydrophobicContact CG-CG2 4.24Å; W827-V935 HydrophobicContact CE3-CG2 4.38Å; W827-V935 HydrophobicContact CH2-CB 4.3Å; W827-V935 HydrophobicContact CH2-CG2 4.16Å; W827-V935 HydrophobicContact CZ3-CB 3.92Å; W827-V935 HydrophobicContact CZ3-CG2 3.58Å; L828-V935 HydrophobicContact CD2-CB 4.36Å; L828-V935 HydrophobicContact CD2-CG1 3.94Å; L828-V935 HydrophobicContact CD2-CG2 4.04Å; F832-V935 HydrophobicContact CD1-CG1 3.99Å; F832-V935 HydrophobicContact CD2-CB 4.12Å; F832-V935 HydrophobicContact CD2-CG1 3.76Å; F832-V935 HydrophobicContact CE1-CG1 3.96Å; F832-V935 HydrophobicContact CE2-CB 4.4Å; F832-V935 HydrophobicContact CE2-CG1 3.72Å; F832-V935 HydrophobicContact CG-CB 4.4Å; F832-V935 HydrophobicContact CG-CG1 3.91Å; F832-V935 HydrophobicContact CZ-CG1 3.83Å; N838-V935 PolarHBondContact O-N 3.26Å; A839-V935 HydrophobicContact CB-CG1 3.75Å; V840-V935 PolarHBondContact N-O 3.33Å; C933-V935 PolarHBondContact SG-O 3.26Å; C933-V935 VanDerWaalsContact SG-O 3.35Å; V935-L937 HydrophobicContact CG1-CD1 4.14Å; V935-L937 HydrophobicContact CG2-CD1 4.13Å; V935-L937 HydrophobicContact CG2-CG 4.42Å
936	F	94.8	Very high	88.9	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.009	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	112.5	178.1	-166.6	-78.6	0	0	0	110.2	P779 N811 L812 L813 V840 Y842 L905 I917 V920 F922 N938	P779-F936 HydrophobicContact CG-CE1 4.03Å; N811-F936 PolarHBondContact O-N 3.3Å; L812-F936 CarbonylContact C-O 3.57Å; L812-F936 WeakPolarHBondContact CA-O 3.35Å; L812-F936 HydrophobicContact CD2-CD1 4.46Å; L812-F936 HydrophobicContact CG-CB 4.42Å; L812-F936 HydrophobicContact CG-CD1 4.09Å; L813-F936 PolarHBondContact N-O 3.34Å; V840-F936 HydrophobicContact CB-CD2 3.94Å; V840-F936 HydrophobicContact CB-CE2 4.36Å; V840-F936 HydrophobicContact CG1-CD2 3.87Å; V840-F936 HydrophobicContact CG1-CE2 3.77Å; V840-F936 CarbonylContact O-C 3.6Å; V840-F936 WeakPolarHBondContact O-CA 3.46Å; Y842-F936 HydrophobicContact CD1-CE1 4.24Å; Y842-F936 AromaticContact CD1-CZ 3.93Å; Y842-F936 HydrophobicContact CD1-CZ 3.93Å; Y842-F936 HydrophobicContact CG-CE1 4.42Å; Y842-F936 AromaticContact CG-CZ 3.93Å; Y842-F936 HydrophobicContact CG-CZ 3.93Å; L905-F936 HydrophobicContact CD1-CE2 4.48Å; L905-F936 HydrophobicContact CD2-CZ 4.36Å; I917-F936 HydrophobicContact CD1-CB 3.81Å; I917-F936 HydrophobicContact CD1-CG 4.33Å; V920-F936 HydrophobicContact CB-CD2 4.48Å; V920-F936 HydrophobicContact CB-CE2 4.29Å; V920-F936 HydrophobicContact CG1-CD2 3.8Å; V920-F936 HydrophobicContact CG1-CE2 3.93Å; V920-F936 HydrophobicContact CG2-CD2 4.18Å; V920-F936 HydrophobicContact CG2-CE2 4.12Å; F922-F936 AromaticContact CZ-CE2 4Å; F922-F936 HydrophobicContact CZ-CE2 4Å; F922-F936 HydrophobicContact CZ-CZ 4.45Å; F936-N938 HydrophobicContact CD1-CB 4.33Å; F936-N938 HydrophobicContact CE1-CB 4Å
937	L	94.8	Very high	89.2	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	115.8	176.1	-62.8	110.2	0	0	0	109.8	F717 L813 I815 V840 V841 Y842 T851 L855 V935	F717-L937 HydrophobicContact CE1-CD2 4.37Å; L813-L937 HydrophobicContact CB-CD2 4.19Å; L813-L937 HydrophobicContact CB-CG 4.28Å; L813-L937 HydrophobicContact CD1-CD2 4.15Å; L813-L937 HydrophobicContact CD1-CG 4.49Å; L813-L937 WeakPolarHBondContact O-CA 3.31Å; I815-L937 HydrophobicContact CD1-CD2 3.95Å; V840-L937 PolarHBondContact O-N 2.83Å; V841-L937 HydrophobicContact CG2-CD1 4.25Å; Y842-L937 PolarHBondContact N-O 3.37Å; T851-L937 HydrophobicContact CG2-CB 4.38Å; T851-L937 HydrophobicContact CG2-CD2 4.04Å; L855-L937 HydrophobicContact CD1-CD1 4.28Å; V935-L937 HydrophobicContact CG1-CD1 4.14Å; V935-L937 HydrophobicContact CG2-CD1 4.13Å; V935-L937 HydrophobicContact CG2-CG 4.42Å
938	N	92.2	Very high	89.6	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	114	-179.3	-171	47.6	0	0	0	113.1	R777 P779 L812 L813 T814 Y842 F936 S940	R777-N938 PolarHBondContact O-ND2 2.9Å; P779-N938 WeakPolarHBondContact CD-ND2 3.26Å; P779-N938 HydrophobicContact CG-CB 4.2Å; L812-N938 HydrophobicContact CD2-CB 4.42Å; L813-N938 PolarHBondContact O-N 2.61Å; T814-N938 HydrophobicContact CG2-CB 4.1Å; Y842-N938 VanDerWaalsContact CD1-OD1 3.23Å; Y842-N938 WeakPolarHBondContact CD1-OD1 3.41Å; Y842-N938 PolarHBondContact O-OD1 3.32Å; F936-N938 HydrophobicContact CD1-CB 4.33Å; F936-N938 HydrophobicContact CE1-CB 4Å; N938-S940 PolarHBondContact ND2-OG 3.24Å; N938-S940 WeakPolarHBondContact OD1-CB 3.34Å; N938-S940 PolarHBondContact OD1-N 3.42Å; N938-S940 PolarHBondContact OD1-OG 3.4Å
939	L	90.6	Very high	89.9	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	29.6	177.6	-62.1	167.7	0	0	0	110.7	Y776 Y842 T845 D847 A848 T851	Y776-L939 HydrophobicContact CD1-CB 4.4Å; Y776-L939 HydrophobicContact CD1-CD2 4.19Å; Y776-L939 HydrophobicContact CD2-CD2 3.67Å; Y776-L939 VanDerWaalsContact CE1-C 3.41Å; Y776-L939 VanDerWaalsContact CE1-CA 3.49Å; Y776-L939 HydrophobicContact CE1-CB 3.99Å; Y776-L939 HydrophobicContact CE1-CD2 4.12Å; Y776-L939 WeakPolarHBondContact CE1-O 3.38Å; Y776-L939 HydrophobicContact CE2-CD2 3.58Å; Y776-L939 HydrophobicContact CG-CD2 3.95Å; Y842-L939 CarbonylContact O-C 3.58Å; Y842-L939 PolarHBondContact O-N 3.1Å; T845-L939 WeakPolarHBondContact CG2-O 3.39Å; T845-L939 PolarHBondContact OG1-O 3.13Å; D847-L939 HydrophobicContact CB-CD1 4.44Å; A848-L939 HydrophobicContact CB-CB 4.29Å; A848-L939 HydrophobicContact CB-CD1 4.39Å; T851-L939 HydrophobicContact CG2-CD1 4.18Å; T851-L939 WeakPolarHBondContact OG1-CD1 3.45Å
940	S	85.8	Confident	89.9	Confident	30 Å²	30	38 Å²	38	21%	0.21	18%	0.184	C	C	.	.	S	Bend	trans	-87.6	-32.7	-172.4	60.1	0	0	0	0	115.2	Y842 N938	Y842-S940 PolarHBondContact O-N 3.06Å; Y842-S940 VanDerWaalsContact O-N 3.11Å; N938-S940 PolarHBondContact ND2-OG 3.24Å; N938-S940 WeakPolarHBondContact OD1-CB 3.34Å; N938-S940 PolarHBondContact OD1-N 3.42Å; N938-S940 PolarHBondContact OD1-OG 3.4Å
941	S	82.4	Confident	90	Very high	28 Å²	28	31.3 Å²	31.3	20%	0.196	16%	0.16	C	C	.	.			trans	-151.9	122.7	176.8	72.1	0	0	0	0	114.4	R777	R777-S941 PolarHBondContact N-O 3.31Å; R777-S941 PolarHBondContact NE-OG 3.25Å; R777-S941 PolarHBondContact NH2-OG 2.86Å
942	E	86.3	Confident	90	Very high	65 Å²	65	30.8 Å²	30.8	30%	0.304	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	150.3	166.8	-42.1	140	109.3	0	0	110.5	L774 Q775 Y776 R875	L774-E942 HydrophobicContact CB-CB 3.91Å; L774-E942 HydrophobicContact CD1-CB 4.42Å; Q775-E942 CarbonylContact O-C 3.51Å; Q775-E942 VanDerWaalsContact O-CA 3.25Å; Q775-E942 WeakPolarHBondContact O-CA 3.25Å; Y776-E942 HydrophobicContact CD1-CG 4.16Å; Y776-E942 HydrophobicContact CE1-CG 3.86Å; Y776-E942 HydrophobicContact CE2-CG 4.47Å; R875-E942 IonicContact CZ-OE2 2.7Å; R875-E942 IonicContact NH1-OE2 3.35Å; R875-E942 PolarHBondContact NH1-OE2 3.08Å; R875-E942 IonicContact NH2-OE2 2.68Å
943	G	87.1	Confident	89.9	Confident	12 Å²	12	27.4 Å²	27.4	12%	0.124	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	-175.7	167	0	0	0	0	0	111.9	L774 Q775	L774-G943 CarbonylContact C-O 3.58Å; L774-G943 VanDerWaalsContact CA-O 3.31Å; L774-G943 WeakPolarHBondContact CA-O 3.46Å; Q775-G943 PolarHBondContact N-O 3.37Å; Q775-G943 PolarHBondContact O-N 3.47Å
944	V	88.8	Confident	89.8	Confident	19 Å²	19	29.5 Å²	29.5	12%	0.115	17%	0.168	C	C	.	.			trans	-70.8	135.2	174.3	-174.3	0	0	0	0	109.4	L774 C948 F949 F959 L982	L774-V944 HydrophobicContact CD2-CG2 3.93Å; V944-C948 HydrophobicContact CG1-CB 4.26Å; V944-F949 HydrophobicContact CG1-CB 4.18Å; V944-F959 HydrophobicContact CB-CZ 4.32Å; V944-F959 HydrophobicContact CG1-CE2 4.49Å; V944-F959 HydrophobicContact CG2-CE2 4.15Å; V944-F959 HydrophobicContact CG2-CZ 3.95Å; V944-L982 HydrophobicContact CB-CD1 4.42Å; V944-L982 HydrophobicContact CG1-CD1 3.67Å; V944-L982 HydrophobicContact CG2-CD1 3.82Å
945	D	87.8	Confident	89.8	Confident	23 Å²	23	29.2 Å²	29.2	12%	0.123	16%	0.164	C	C	.	.			trans	-50.5	146.4	172	166.4	69.8	0	0	0	112	K744 Q775 D947 C948 F949	K744-D945 IonicContact NZ-OD1 3.5Å; K744-D945 PolarHBondContact NZ-OD1 2.83Å; Q775-D945 PolarHBondContact OE1-OD1 3.04Å; D945-D947 PolarHBondContact OD2-N 3.3Å; D945-D947 VanDerWaalsContact OD2-N 3.12Å; D945-C948 HydrophobicContact CB-CB 3.85Å; D945-C948 VanDerWaalsContact OD2-CB 3.31Å; D945-C948 WeakPolarHBondContact OD2-CB 3.35Å; D945-C948 PolarHBondContact OD2-N 3.4Å; D945-F949 VanDerWaalsContact O-CB 3.25Å; D945-F949 WeakPolarHBondContact O-CB 3.27Å; D945-F949 PolarHBondContact O-N 3.28Å
946	Y	86	Confident	89.6	Confident	116 Å²	116	37.6 Å²	37.6	46%	0.455	20%	0.2	S	C	.	.	H	α-helix	trans	-66.9	-45.6	-173.8	-178.1	-93.6	0	0	0	112.6	F949 H950	Y946-F949 PolarHBondContact O-N 2.88Å; Y946-H950 VanDerWaalsContact O-CB 3.3Å; Y946-H950 WeakPolarHBondContact O-CB 3.46Å; Y946-H950 PolarHBondContact O-N 2.99Å
947	D	87.7	Confident	89.5	Confident	55 Å²	55	37.8 Å²	37.8	29%	0.294	20%	0.202	S	C	.	.	H	α-helix	trans	-71.7	-36.6	-176.3	-54.2	-48.6	0	0	0	110.7	K744 I745 D945 S951	K744-D947 WeakPolarHBondContact CD-OD2 3.44Å; K744-D947 IonicContact NZ-OD2 3.62Å; I745-D947 CarbonylContact O-C 3.59Å; I745-D947 WeakPolarHBondContact O-CB 3.3Å; D945-D947 PolarHBondContact OD2-N 3.3Å; D945-D947 VanDerWaalsContact OD2-N 3.12Å; D947-S951 VanDerWaalsContact O-CB 3.22Å; D947-S951 WeakPolarHBondContact O-CB 3.38Å; D947-S951 PolarHBondContact O-N 3.37Å; D947-S951 PolarHBondContact O-OG 2.59Å
948	C	89.4	Confident	89.3	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.014	22%	0.221	C	C	.	.	H	α-helix	trans	-59.7	-52.6	168.5	-176.6	0	0	0	0	112.1	I745 T772 V944 D945 H950 S951 I952	I745-C948 HydrophobicContact CD1-CB 4.46Å; I745-C948 HydrophobicContact CG1-CB 4.48Å; T772-C948 PolarHBondContact OG1-SG 3.43Å; V944-C948 HydrophobicContact CG1-CB 4.26Å; D945-C948 HydrophobicContact CB-CB 3.85Å; D945-C948 VanDerWaalsContact OD2-CB 3.31Å; D945-C948 WeakPolarHBondContact OD2-CB 3.35Å; D945-C948 PolarHBondContact OD2-N 3.4Å; C948-H950 VanDerWaalsContact C-N 3.33Å; C948-H950 PolarHBondContact O-N 3.36Å; C948-S951 WeakPolarHBondContact O-CB 3.46Å; C948-S951 PolarHBondContact O-N 2.87Å; C948-I952 VanDerWaalsContact O-CG1 3.3Å; C948-I952 WeakPolarHBondContact O-CG1 3.02Å; C948-I952 PolarHBondContact O-N 2.82Å
949	F	90.1	Very high	89.2	Confident	52 Å²	52	43.4 Å²	43.4	23%	0.228	23%	0.232	C	C	.	.	H	α-helix	trans	-58.7	-43.6	176.9	163.3	-103.5	0	0	0	112	V944 D945 Y946 S953 F959	V944-F949 HydrophobicContact CG1-CB 4.18Å; D945-F949 VanDerWaalsContact O-CB 3.25Å; D945-F949 WeakPolarHBondContact O-CB 3.27Å; D945-F949 PolarHBondContact O-N 3.28Å; Y946-F949 PolarHBondContact O-N 2.88Å; F949-S953 WeakPolarHBondContact CE2-OG 3.21Å; F949-S953 VanDerWaalsContact O-CB 3.31Å; F949-S953 WeakPolarHBondContact O-CB 3.25Å; F949-S953 PolarHBondContact O-N 3.45Å; F949-S953 PolarHBondContact O-OG 2.88Å; F949-F959 AromaticContact CD2-CD1 3.94Å; F949-F959 HydrophobicContact CD2-CD1 3.94Å; F949-F959 HydrophobicContact CD2-CD2 4.5Å; F949-F959 AromaticContact CD2-CE1 3.53Å; F949-F959 HydrophobicContact CD2-CE1 3.53Å; F949-F959 HydrophobicContact CD2-CE2 4.14Å; F949-F959 HydrophobicContact CD2-CG 4.41Å; F949-F959 AromaticContact CD2-CZ 3.65Å; F949-F959 HydrophobicContact CD2-CZ 3.65Å; F949-F959 AromaticContact CE2-CD1 3.75Å; F949-F959 HydrophobicContact CE2-CD1 3.75Å; F949-F959 AromaticContact CE2-CE1 3.62Å; F949-F959 HydrophobicContact CE2-CE1 3.62Å; F949-F959 HydrophobicContact CE2-CG 4.45Å; F949-F959 HydrophobicContact CE2-CZ 4.23Å
950	H	90.1	Very high	89	Confident	104 Å²	104	47.1 Å²	47.1	48%	0.481	25%	0.252	S	S	.	.	H	α-helix	trans	-66.5	-40.1	177.2	-175.1	-98.2	0	0	0	111.7	Y946 C948 G954	Y946-H950 VanDerWaalsContact O-CB 3.3Å; Y946-H950 WeakPolarHBondContact O-CB 3.46Å; Y946-H950 PolarHBondContact O-N 2.99Å; C948-H950 VanDerWaalsContact C-N 3.33Å; C948-H950 PolarHBondContact O-N 3.36Å; H950-G954 WeakPolarHBondContact O-CA 3.07Å; H950-G954 PolarHBondContact O-N 2.83Å
951	S	91.9	Very high	88.8	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-45.1	175	-66.6	0	0	0	0	112.9	I745 V746 R747 D947 C948 C955	I745-S951 PolarHBondContact O-OG 3.48Å; V746-S951 PolarHBondContact O-OG 3.21Å; R747-S951 PolarHBondContact N-OG 3.16Å; D947-S951 VanDerWaalsContact O-CB 3.22Å; D947-S951 WeakPolarHBondContact O-CB 3.38Å; D947-S951 PolarHBondContact O-N 3.37Å; D947-S951 PolarHBondContact O-OG 2.59Å; C948-S951 WeakPolarHBondContact O-CB 3.46Å; C948-S951 PolarHBondContact O-N 2.87Å; S951-C955 PolarHBondContact O-N 2.83Å; S951-C955 PolarHBondContact O-SG 2.83Å
952	I	93.1	Very high	89.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-68.2	-47.1	179.6	-69.1	169.4	0	0	0	110.6	L770 C948 C955 F956 L957 F959 L963 L982	L770-I952 HydrophobicContact CD1-CD1 4.22Å; L770-I952 HydrophobicContact CD1-CG1 4.09Å; C948-I952 VanDerWaalsContact O-CG1 3.3Å; C948-I952 WeakPolarHBondContact O-CG1 3.02Å; C948-I952 PolarHBondContact O-N 2.82Å; I952-C955 PolarHBondContact O-N 3.47Å; I952-C955 PolarHBondContact O-SG 3.08Å; I952-F956 PolarHBondContact O-N 2.74Å; I952-L957 HydrophobicContact CG2-CB 3.95Å; I952-L957 PolarHBondContact O-N 2.79Å; I952-F959 HydrophobicContact CG2-CD2 4.07Å; I952-L963 HydrophobicContact CG2-CD1 3.92Å; I952-L982 HydrophobicContact CD1-CD1 4.34Å; I952-L982 HydrophobicContact CD1-CD2 4.47Å
953	S	90.9	Very high	89.6	Confident	44 Å²	44	47.3 Å²	47.3	31%	0.308	26%	0.26	S	S	.	.	H	α-helix	trans	-65.1	-42.8	179.1	-54.7	0	0	0	0	111.4	F949 C955 F956	F949-S953 WeakPolarHBondContact CE2-OG 3.21Å; F949-S953 VanDerWaalsContact O-CB 3.31Å; F949-S953 WeakPolarHBondContact O-CB 3.25Å; F949-S953 PolarHBondContact O-N 3.45Å; F949-S953 PolarHBondContact O-OG 2.88Å; S953-C955 PolarHBondContact O-N 3.14Å; S953-F956 PolarHBondContact O-N 2.83Å; S953-F956 VanDerWaalsContact O-N 3.07Å
954	G	89.3	Confident	89.9	Confident	47 Å²	47	48.1 Å²	48.1	49%	0.485	26%	0.262	S	S	.	.	H	α-helix	trans	-69.2	-12.4	179.9	0	0	0	0	0	115.1	H950	H950-G954 WeakPolarHBondContact O-CA 3.07Å; H950-G954 PolarHBondContact O-N 2.83Å
955	C	91.2	Very high	90.1	Very high	8 Å²	8	47.4 Å²	47.4	5%	0.054	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	12.3	171	74.6	0	0	0	0	113.5	I748 R750 S951 I952 S953 L957	I748-C955 HydrophobicContact CB-CB 4.12Å; I748-C955 HydrophobicContact CG2-CB 4.45Å; I748-C955 WeakPolarHBondContact O-CB 3.45Å; R750-C955 WeakPolarHBondContact CD-O 3.33Å; R750-C955 HydrophobicContact CG-CB 4.18Å; R750-C955 PolarHBondContact NH1-O 2.95Å; S951-C955 PolarHBondContact O-N 2.83Å; S951-C955 PolarHBondContact O-SG 2.83Å; I952-C955 PolarHBondContact O-N 3.47Å; I952-C955 PolarHBondContact O-SG 3.08Å; S953-C955 PolarHBondContact O-N 3.14Å; C955-L957 VanDerWaalsContact C-N 3.32Å; C955-L957 PolarHBondContact O-N 2.92Å
956	F	91.2	Very high	90.1	Very high	175 Å²	175	48.8 Å²	48.8	77%	0.768	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	40.1	176	-50.2	-84.6	0	0	0	113.7	R750 I952 S953	R750-F956 PolarHBondContact NH1-O 2.91Å; I952-F956 PolarHBondContact O-N 2.74Å; S953-F956 PolarHBondContact O-N 2.83Å; S953-F956 VanDerWaalsContact O-N 3.07Å
957	L	92.9	Very high	90.2	Very high	7 Å²	7	43.9 Å²	43.9	4%	0.037	25%	0.248	C	C	.	.			trans	-85.3	136.5	164.7	-67.5	177.2	0	0	0	109.4	L770 I952 C955 F959 L963 S972 D973 I976	L770-L957 HydrophobicContact CD1-CD1 4.47Å; I952-L957 HydrophobicContact CG2-CB 3.95Å; I952-L957 PolarHBondContact O-N 2.79Å; C955-L957 VanDerWaalsContact C-N 3.32Å; C955-L957 PolarHBondContact O-N 2.92Å; L957-F959 PolarHBondContact O-N 3.34Å; L957-L963 HydrophobicContact CB-CD1 4.15Å; L957-L963 HydrophobicContact CD1-CD1 4.41Å; L957-S972 WeakPolarHBondContact CD2-OG 3.41Å; L957-D973 HydrophobicContact CD2-CB 4.16Å; L957-I976 HydrophobicContact CD1-CD1 4.19Å; L957-I976 HydrophobicContact CD1-CG2 4.09Å
958	P	91.8	Very high	90.2	Very high	62 Å²	62	45.8 Å²	45.8	40%	0.403	25%	0.251	S	S	.	.			trans	-61.6	130.2	-179.4	-24	33.4	0	0	0	112.6	V964 S972	P958-V964 HydrophobicContact CB-CB 4.16Å; P958-V964 HydrophobicContact CB-CG2 4.32Å; P958-V964 PolarHBondContact O-N 3.33Å; P958-S972 WeakPolarHBondContact CD-OG 3.48Å
959	F	89.7	Confident	90.3	Very high	57 Å²	57	45.9 Å²	45.9	25%	0.25	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-137.7	117.4	-176.3	-171.2	-84.7	0	0	0	110.2	V944 F949 I952 L957 G961 R962	V944-F959 HydrophobicContact CB-CZ 4.32Å; V944-F959 HydrophobicContact CG1-CE2 4.49Å; V944-F959 HydrophobicContact CG2-CE2 4.15Å; V944-F959 HydrophobicContact CG2-CZ 3.95Å; F949-F959 AromaticContact CD2-CD1 3.94Å; F949-F959 HydrophobicContact CD2-CD1 3.94Å; F949-F959 HydrophobicContact CD2-CD2 4.5Å; F949-F959 AromaticContact CD2-CE1 3.53Å; F949-F959 HydrophobicContact CD2-CE1 3.53Å; F949-F959 HydrophobicContact CD2-CE2 4.14Å; F949-F959 HydrophobicContact CD2-CG 4.41Å; F949-F959 AromaticContact CD2-CZ 3.65Å; F949-F959 HydrophobicContact CD2-CZ 3.65Å; F949-F959 AromaticContact CE2-CD1 3.75Å; F949-F959 HydrophobicContact CE2-CD1 3.75Å; F949-F959 AromaticContact CE2-CE1 3.62Å; F949-F959 HydrophobicContact CE2-CE1 3.62Å; F949-F959 HydrophobicContact CE2-CG 4.45Å; F949-F959 HydrophobicContact CE2-CZ 4.23Å; I952-F959 HydrophobicContact CG2-CD2 4.07Å; L957-F959 PolarHBondContact O-N 3.34Å; F959-G961 VanDerWaalsContact CZ-O 3.29Å; F959-G961 WeakPolarHBondContact CZ-O 3.3Å; F959-R962 CarbonylContact C-O 3.59Å; F959-R962 WeakPolarHBondContact CA-O 3.41Å; F959-R962 VanDerWaalsContact CD2-C 3.44Å
960	D	85.1	Confident	90.4	Very high	80 Å²	80	44.7 Å²	44.7	43%	0.428	25%	0.247	S	C	.	.	S	Bend	trans	-124	77.2	178.5	173.1	44.6	0	0	0	109.1	R962 V964 R984	D960-R962 PolarHBondContact N-O 3.44Å; D960-R962 PolarHBondContact O-N 3.15Å; D960-V964 HydrophobicContact CB-CG2 4.17Å; D960-R984 IonicContact OD2-CZ 3.7Å; D960-R984 IonicContact OD2-NE 3.88Å; D960-R984 IonicContact OD2-NH1 2.77Å; D960-R984 PolarHBondContact OD2-NH1 2.97Å
961	G	83.3	Confident	90.5	Very high	60 Å²	60	40.5 Å²	40.5	62%	0.619	23%	0.229	S	C	*	.	S	Bend	trans	65.9	-18.8	-167.3	0	0	0	0	0	115.1	F959	F959-G961 VanDerWaalsContact CZ-O 3.29Å; F959-G961 WeakPolarHBondContact CZ-O 3.3Å
962	R	90.8	Very high	90.5	Very high	67 Å²	67	43.7 Å²	43.7	25%	0.253	25%	0.251	S	S	.	.	S	Bend	trans	-148.7	162.2	179.9	-73	-166.9	-166.2	-161.9	9.9	109.7	F959 D960 V964 P981 L982 T983 R984 S995	F959-R962 CarbonylContact C-O 3.59Å; F959-R962 WeakPolarHBondContact CA-O 3.41Å; F959-R962 VanDerWaalsContact CD2-C 3.44Å; D960-R962 PolarHBondContact N-O 3.44Å; D960-R962 PolarHBondContact O-N 3.15Å; R962-V964 PolarHBondContact O-N 2.77Å; R962-P981 PolarHBondContact NH1-O 2.77Å; R962-L982 VanDerWaalsContact CB-O 3.22Å; R962-L982 WeakPolarHBondContact CB-O 3.5Å; R962-T983 WeakPolarHBondContact CD-O 3.45Å; R962-R984 HydrophobicContact CB-CB 4.01Å; R962-S995 PolarHBondContact NH1-OG 3.42Å; R962-S995 VanDerWaalsContact NH1-OG 3.16Å
963	L	93.3	Very high	90.4	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	125.9	175.9	174.8	63.1	0	0	0	110.4	L770 I952 L957 T971 L982 T983 R984	L770-L963 HydrophobicContact CB-CD2 4.15Å; L770-L963 HydrophobicContact CD1-CD2 3.82Å; I952-L963 HydrophobicContact CG2-CD1 3.92Å; L957-L963 HydrophobicContact CB-CD1 4.15Å; L957-L963 HydrophobicContact CD1-CD1 4.41Å; L963-T971 HydrophobicContact CD1-CG2 3.94Å; L963-T971 HydrophobicContact CD2-CG2 4.05Å; L963-T971 HydrophobicContact CG-CG2 4.16Å; L963-L982 HydrophobicContact CB-CG 4.11Å; L963-L982 HydrophobicContact CD2-CD2 4.04Å; L963-L982 PolarHBondContact N-O 2.84Å; L963-T983 HydrophobicContact CB-CG2 4.21Å; L963-T983 HydrophobicContact CD2-CG2 4.25Å; L963-T983 HydrophobicContact CG-CG2 4.37Å; L963-T983 CarbonylContact O-C 3.55Å; L963-T983 WeakPolarHBondContact O-CA 3.26Å; L963-T983 WeakPolarHBondContact O-CB 3.42Å; L963-R984 PolarHBondContact O-N 3.19Å
964	V	93.1	Very high	90.2	Very high	29 Å²	29	46.7 Å²	46.7	18%	0.176	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	131.3	-177.9	-174.1	0	0	0	0	110.9	P958 D960 R962 R984	P958-V964 HydrophobicContact CB-CB 4.16Å; P958-V964 HydrophobicContact CB-CG2 4.32Å; P958-V964 PolarHBondContact O-N 3.33Å; D960-V964 HydrophobicContact CB-CG2 4.17Å; R962-V964 PolarHBondContact O-N 2.77Å; V964-R984 WeakPolarHBondContact CA-O 3.39Å
965	I	92.6	Very high	90.3	Very high	4 Å²	4	45 Å²	45	2%	0.021	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	164.2	-179.5	57.6	166	0	0	0	112.7	F969 L970 T971 T983 R984 F985 S986 H996	I965-F969 HydrophobicContact CD1-CD1 4.44Å; I965-L970 CarbonylContact C-O 3.52Å; I965-L970 VanDerWaalsContact CA-O 3.27Å; I965-L970 WeakPolarHBondContact CA-O 3.36Å; I965-T971 HydrophobicContact CG2-CG2 4.24Å; I965-T983 HydrophobicContact CD1-CG2 4.25Å; I965-T983 HydrophobicContact CG2-CG2 3.97Å; I965-R984 WeakPolarHBondContact CG1-O 3.48Å; I965-R984 PolarHBondContact N-O 3.33Å; I965-F985 HydrophobicContact CD1-CD1 4.12Å; I965-F985 HydrophobicContact CD1-CE1 3.99Å; I965-F985 HydrophobicContact CG1-CD1 4.1Å; I965-F985 HydrophobicContact CG1-CE1 4.47Å; I965-S986 PolarHBondContact O-N 3.33Å; I965-H996 WeakPolarHBondContact CD1-CE1 3.47Å
966	N	89.6	Confident	90.5	Very high	53 Å²	53	44.6 Å²	44.6	28%	0.283	25%	0.253	S	S	.	.			trans	-91.3	-179.3	167.5	78.4	4.5	0	0	0	112.6	R968 F969 L970 Y989	N966-R968 PolarHBondContact O-N 2.83Å; N966-R968 VanDerWaalsContact O-N 3.17Å; N966-R968 VanDerWaalsContact OD1-C 3.25Å; N966-R968 WeakPolarHBondContact OD1-CA 3.43Å; N966-R968 PolarHBondContact OD1-N 3.21Å; N966-F969 PolarHBondContact O-N 3.18Å; N966-F969 PolarHBondContact OD1-N 3.36Å; N966-L970 PolarHBondContact N-O 2.84Å; N966-L970 PolarHBondContact OD1-N 3.19Å; N966-Y989 HydrophobicContact CB-CE2 4.35Å
967	S	86.3	Confident	90.8	Very high	13 Å²	13	36.3 Å²	36.3	9%	0.091	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-13.6	179	48.4	0	0	0	0	115	Y989 E1031 L1033	S967-Y989 PolarHBondContact N-OH 3.45Å; S967-Y989 PolarHBondContact OG-OH 2.92Å; S967-E1031 PolarHBondContact OG-O 2.89Å; S967-L1033 WeakPolarHBondContact CB-O 3.4Å
968	R	89	Confident	90.9	Very high	95 Å²	95	36 Å²	36	36%	0.358	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	30.3	175.7	-65.5	-179	70.9	-161	3.2	112.3	N966 L970 V1011 E1014	N966-R968 PolarHBondContact O-N 2.83Å; N966-R968 VanDerWaalsContact O-N 3.17Å; N966-R968 VanDerWaalsContact OD1-C 3.25Å; N966-R968 WeakPolarHBondContact OD1-CA 3.43Å; N966-R968 PolarHBondContact OD1-N 3.21Å; R968-L970 PolarHBondContact O-N 3.33Å; R968-V1011 HydrophobicContact CB-CG1 4.27Å; R968-V1011 HydrophobicContact CB-CG2 4.48Å; R968-E1014 IonicContact CZ-OE2 3.03Å; R968-E1014 IonicContact NE-OE2 3.77Å; R968-E1014 IonicContact NH2-OE2 3.12Å; R968-E1014 PolarHBondContact NH2-OE2 3.15Å
969	F	91.8	Very high	91	Very high	3 Å²	3	33 Å²	33	1%	0.013	20%	0.196	C	C	.	.	S	Bend	trans	62.8	1.9	175.2	-45.5	-82.1	0	0	0	116.3	I965 N966 Y977 G978 H996 V1004 D1007 V1008 V1011 P1035	I965-F969 HydrophobicContact CD1-CD1 4.44Å; N966-F969 PolarHBondContact O-N 3.18Å; N966-F969 PolarHBondContact OD1-N 3.36Å; F969-Y977 HydrophobicContact CB-CD1 4.21Å; F969-Y977 CarbonylContact O-C 3.59Å; F969-Y977 VanDerWaalsContact O-CA 3.27Å; F969-Y977 WeakPolarHBondContact O-CA 3.36Å; F969-G978 PolarHBondContact O-N 3.03Å; F969-H996 AromaticContact CD1-CE1 3.64Å; F969-H996 AromaticContact CD1-NE2 3.88Å; F969-H996 AromaticContact CE1-CE1 3.72Å; F969-H996 AromaticContact CE1-NE2 3.53Å; F969-V1004 HydrophobicContact CE1-CG1 4.17Å; F969-D1007 HydrophobicContact CE2-CB 3.7Å; F969-D1007 HydrophobicContact CZ-CB 3.58Å; F969-V1008 HydrophobicContact CB-CG2 4.01Å; F969-V1008 HydrophobicContact CD1-CG2 3.58Å; F969-V1008 HydrophobicContact CD2-CB 4.45Å; F969-V1008 HydrophobicContact CD2-CG2 3.75Å; F969-V1008 HydrophobicContact CE1-CG2 3.95Å; F969-V1008 HydrophobicContact CE2-CG2 4.11Å; F969-V1008 HydrophobicContact CG-CG2 3.48Å; F969-V1008 VanDerWaalsContact CG-CG2 3.48Å; F969-V1008 HydrophobicContact CZ-CG2 4.21Å; F969-V1011 HydrophobicContact CD2-CG2 4.19Å; F969-V1011 HydrophobicContact CE2-CG2 4.24Å; F969-P1035 HydrophobicContact CZ-CG 4.46Å
970	L	91.7	Very high	91.2	Very high	28 Å²	28	30.3 Å²	30.3	15%	0.147	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-75.6	142.3	179.6	-73.8	163	0	0	0	110.9	I965 N966 R968 Y977	I965-L970 CarbonylContact C-O 3.52Å; I965-L970 VanDerWaalsContact CA-O 3.27Å; I965-L970 WeakPolarHBondContact CA-O 3.36Å; N966-L970 PolarHBondContact N-O 2.84Å; N966-L970 PolarHBondContact OD1-N 3.19Å; R968-L970 PolarHBondContact O-N 3.33Å; L970-Y977 HydrophobicContact CD2-CD1 3.85Å; L970-Y977 HydrophobicContact CD2-CD2 4.22Å; L970-Y977 HydrophobicContact CD2-CE1 3.41Å; L970-Y977 VanDerWaalsContact CD2-CE1 3.41Å; L970-Y977 HydrophobicContact CD2-CE2 3.78Å; L970-Y977 HydrophobicContact CD2-CG 4.24Å; L970-Y977 HydrophobicContact CG-CD1 4.11Å; L970-Y977 HydrophobicContact CG-CE1 3.71Å
971	T	93.1	Very high	91.5	Very high	16 Å²	16	28 Å²	28	10%	0.098	17%	0.174	C	C	.	.			trans	-83.8	-163.4	168.2	67.3	0	0	0	0	110.5	L963 I965 D973 I976	L963-T971 HydrophobicContact CD1-CG2 3.94Å; L963-T971 HydrophobicContact CD2-CG2 4.05Å; L963-T971 HydrophobicContact CG-CG2 4.16Å; I965-T971 HydrophobicContact CG2-CG2 4.24Å; T971-D973 PolarHBondContact O-N 3.4Å; T971-D973 PolarHBondContact OG1-N 2.81Å; T971-D973 VanDerWaalsContact OG1-N 3.15Å; T971-D973 PolarHBondContact OG1-O 3.49Å; T971-I976 WeakPolarHBondContact CB-O 3.29Å; T971-I976 HydrophobicContact CG2-CG2 4.24Å; T971-I976 WeakPolarHBondContact CG2-O 3.07Å; T971-I976 PolarHBondContact N-O 2.94Å; T971-I976 PolarHBondContact OG1-O 2.92Å
972	S	90.1	Very high	91.9	Very high	69 Å²	69	25.2 Å²	25.2	48%	0.483	14%	0.144	S	C	.	.	S	Bend	trans	-67.6	-2.5	167.1	61.8	0	0	0	0	114.3	L957 P958	L957-S972 WeakPolarHBondContact CD2-OG 3.41Å; P958-S972 WeakPolarHBondContact CD-OG 3.48Å
973	D	90.9	Very high	92	Very high	27 Å²	27	22 Å²	22	14%	0.144	13%	0.133	C	C	.	.	S	Bend	trans	-116.9	125	176.8	-160	-67.4	0	0	0	110.4	R750 L957 T971 S975 I976	R750-D973 IonicContact CZ-OD2 3.53Å; R750-D973 VanDerWaalsContact CZ-OD2 3.24Å; R750-D973 IonicContact NE-OD2 3.53Å; R750-D973 PolarHBondContact NE-OD2 3.09Å; R750-D973 IonicContact NH2-OD2 3.54Å; R750-D973 PolarHBondContact NH2-OD2 3.1Å; L957-D973 HydrophobicContact CD2-CB 4.16Å; T971-D973 PolarHBondContact O-N 3.4Å; T971-D973 PolarHBondContact OG1-N 2.81Å; T971-D973 VanDerWaalsContact OG1-N 3.15Å; T971-D973 PolarHBondContact OG1-O 3.49Å; D973-S975 PolarHBondContact O-N 3.43Å; D973-S975 VanDerWaalsContact O-N 3.09Å; D973-S975 PolarHBondContact OD1-N 3Å; D973-S975 PolarHBondContact OD1-OG 3.39Å; D973-I976 HydrophobicContact CB-CB 4.1Å; D973-I976 HydrophobicContact CB-CD1 4.13Å; D973-I976 HydrophobicContact CB-CG1 4.03Å; D973-I976 PolarHBondContact O-N 2.92Å; D973-I976 VanDerWaalsContact O-O 3.11Å
974	A	88.4	Confident	91.9	Very high	81 Å²	81	25.5 Å²	25.5	67%	0.669	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-14.9	-178.6	0	0	0	0	0	113.7
975	S	91.6	Very high	91.7	Very high	11 Å²	11	24.3 Å²	24.3	8%	0.077	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-1	175.7	65.3	0	0	0	0	114.5	L768 D973	L768-S975 PolarHBondContact N-O 3.44Å; D973-S975 PolarHBondContact O-N 3.43Å; D973-S975 VanDerWaalsContact O-N 3.09Å; D973-S975 PolarHBondContact OD1-N 3Å; D973-S975 PolarHBondContact OD1-OG 3.39Å
976	I	95.3	Very high	91.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	120.6	-177.1	-51.1	178.7	0	0	0	110.9	I748 R750 Y765 L768 L770 L957 T971 D973	I748-I976 HydrophobicContact CG2-CD1 4.26Å; R750-I976 HydrophobicContact CG-CD1 3.83Å; Y765-I976 HydrophobicContact CE2-CG1 4.31Å; L768-I976 HydrophobicContact CB-CG1 4.23Å; L768-I976 HydrophobicContact CB-CG2 4.45Å; L768-I976 HydrophobicContact CD2-CD1 4.21Å; L768-I976 HydrophobicContact CD2-CG1 4.22Å; L768-I976 HydrophobicContact CD2-CG2 4.18Å; L768-I976 HydrophobicContact CG-CG2 4.36Å; L768-I976 WeakPolarHBondContact O-CA 3.04Å; L770-I976 HydrophobicContact CD1-CG2 4.04Å; L770-I976 HydrophobicContact CG-CG2 4.27Å; L957-I976 HydrophobicContact CD1-CD1 4.19Å; L957-I976 HydrophobicContact CD1-CG2 4.09Å; T971-I976 WeakPolarHBondContact CB-O 3.29Å; T971-I976 HydrophobicContact CG2-CG2 4.24Å; T971-I976 WeakPolarHBondContact CG2-O 3.07Å; T971-I976 PolarHBondContact N-O 2.94Å; T971-I976 PolarHBondContact OG1-O 2.92Å; D973-I976 HydrophobicContact CB-CB 4.1Å; D973-I976 HydrophobicContact CB-CD1 4.13Å; D973-I976 HydrophobicContact CB-CG1 4.03Å; D973-I976 PolarHBondContact O-N 2.92Å; D973-I976 VanDerWaalsContact O-O 3.11Å
977	Y	95.9	Very high	91.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	152.3	178	-62.9	-104.5	0	0	0	110.2	F767 L768 L770 F969 L970 V1011 L1012 Q1015	F767-Y977 HydrophobicContact CD1-CE2 4.07Å; L768-Y977 PolarHBondContact O-N 3.03Å; L770-Y977 PolarHBondContact N-O 2.86Å; F969-Y977 HydrophobicContact CB-CD1 4.21Å; F969-Y977 CarbonylContact O-C 3.59Å; F969-Y977 VanDerWaalsContact O-CA 3.27Å; F969-Y977 WeakPolarHBondContact O-CA 3.36Å; L970-Y977 HydrophobicContact CD2-CD1 3.85Å; L970-Y977 HydrophobicContact CD2-CD2 4.22Å; L970-Y977 HydrophobicContact CD2-CE1 3.41Å; L970-Y977 VanDerWaalsContact CD2-CE1 3.41Å; L970-Y977 HydrophobicContact CD2-CE2 3.78Å; L970-Y977 HydrophobicContact CD2-CG 4.24Å; L970-Y977 HydrophobicContact CG-CD1 4.11Å; L970-Y977 HydrophobicContact CG-CE1 3.71Å; Y977-V1011 HydrophobicContact CE1-CG1 4.08Å; Y977-L1012 HydrophobicContact CD2-CD2 4.2Å; Y977-L1012 HydrophobicContact CE1-CD2 4.25Å; Y977-L1012 HydrophobicContact CE2-CD2 3.67Å; Y977-Q1015 PolarHBondContact OH-NE2 3.32Å; Y977-Q1015 PolarHBondContact OH-OE1 3.38Å
978	G	95.1	Very high	90.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	138.3	172.4	0	0	0	0	0	111.1	F969 T983	F969-G978 PolarHBondContact O-N 3.03Å; G978-T983 VanDerWaalsContact C-CG2 3.43Å
979	A	95.1	Very high	90.5	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.162	C	C	.	.			trans	-144.8	165.8	-178.9	0	0	0	0	0	113.3	T679 L770 V1004 V1008	T679-A979 HydrophobicContact CG2-CB 3.66Å; L770-A979 PolarHBondContact O-N 2.93Å; A979-V1004 HydrophobicContact CB-CG1 4.27Å; A979-V1008 HydrophobicContact CB-CG2 3.72Å
980	G	92.7	Very high	89.9	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.01	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	69	-167	177.8	0	0	0	0	0	113.8	L982 T983 H996	G980-L982 PolarHBondContact O-N 3.01Å; G980-T983 PolarHBondContact O-N 2.78Å; G980-T983 VanDerWaalsContact O-N 3.16Å; G980-T983 PolarHBondContact O-OG1 3.31Å; G980-T983 VanDerWaalsContact O-OG1 3.05Å; G980-H996 PolarHBondContact N-ND1 3.18Å; G980-H996 WeakPolarHBondContact O-CB 3.33Å; G980-H996 PolarHBondContact O-ND1 2.79Å
981	P	91.3	Very high	89.1	Confident	32 Å²	32	34.7 Å²	34.7	21%	0.208	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-57.3	-17.9	-173.1	-30	37.9	0	0	0	116.5	L774 R962 T983 A997	L774-P981 HydrophobicContact CD1-CB 3.99Å; L774-P981 HydrophobicContact CG-CB 3.94Å; R962-P981 PolarHBondContact NH1-O 2.77Å; P981-T983 PolarHBondContact O-N 3.01Å; P981-A997 HydrophobicContact CB-CB 4.17Å; P981-A997 HydrophobicContact CG-CB 4.45Å
982	L	93.1	Very high	88.1	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-56.8	-27.3	174.3	176.5	64.6	0	0	0	113.4	L770 V944 I952 R962 L963 G980	L770-L982 HydrophobicContact CB-CD2 3.74Å; V944-L982 HydrophobicContact CB-CD1 4.42Å; V944-L982 HydrophobicContact CG1-CD1 3.67Å; V944-L982 HydrophobicContact CG2-CD1 3.82Å; I952-L982 HydrophobicContact CD1-CD1 4.34Å; I952-L982 HydrophobicContact CD1-CD2 4.47Å; R962-L982 VanDerWaalsContact CB-O 3.22Å; R962-L982 WeakPolarHBondContact CB-O 3.5Å; L963-L982 HydrophobicContact CB-CG 4.11Å; L963-L982 HydrophobicContact CD2-CD2 4.04Å; L963-L982 PolarHBondContact N-O 2.84Å; G980-L982 PolarHBondContact O-N 3.01Å
983	T	92.4	Very high	87.4	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	161.8	-163.5	61	0	0	0	0	116.2	R962 L963 I965 G978 G980 P981 S995 H996	R962-T983 WeakPolarHBondContact CD-O 3.45Å; L963-T983 HydrophobicContact CB-CG2 4.21Å; L963-T983 HydrophobicContact CD2-CG2 4.25Å; L963-T983 HydrophobicContact CG-CG2 4.37Å; L963-T983 CarbonylContact O-C 3.55Å; L963-T983 WeakPolarHBondContact O-CA 3.26Å; L963-T983 WeakPolarHBondContact O-CB 3.42Å; I965-T983 HydrophobicContact CD1-CG2 4.25Å; I965-T983 HydrophobicContact CG2-CG2 3.97Å; G978-T983 VanDerWaalsContact C-CG2 3.43Å; G980-T983 PolarHBondContact O-N 2.78Å; G980-T983 VanDerWaalsContact O-N 3.16Å; G980-T983 PolarHBondContact O-OG1 3.31Å; G980-T983 VanDerWaalsContact O-OG1 3.05Å; P981-T983 PolarHBondContact O-N 3.01Å; T983-S995 PolarHBondContact O-OG 2.97Å; T983-H996 PolarHBondContact OG1-CE1 3.2Å; T983-H996 PolarHBondContact OG1-ND1 3.03Å
984	R	90.9	Very high	86.7	Confident	72 Å²	72	41 Å²	41	27%	0.272	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	141	169.7	-170.6	-164.4	-176.3	133.7	7.8	108.9	D960 R962 L963 V964 I965 D992	D960-R984 IonicContact OD2-CZ 3.7Å; D960-R984 IonicContact OD2-NE 3.88Å; D960-R984 IonicContact OD2-NH1 2.77Å; D960-R984 PolarHBondContact OD2-NH1 2.97Å; R962-R984 HydrophobicContact CB-CB 4.01Å; L963-R984 PolarHBondContact O-N 3.19Å; V964-R984 WeakPolarHBondContact CA-O 3.39Å; I965-R984 WeakPolarHBondContact CG1-O 3.48Å; I965-R984 PolarHBondContact N-O 3.33Å; R984-D992 IonicContact CZ-OD1 2.88Å; R984-D992 IonicContact NE-OD1 3.41Å; R984-D992 PolarHBondContact NE-OD1 3.34Å; R984-D992 IonicContact NH2-OD1 3.56Å; R984-D992 PolarHBondContact NH2-OD1 2.84Å
985	F	89.2	Confident	86.5	Confident	4 Å²	4	38 Å²	38	2%	0.018	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	149.1	168.7	-64	-65.9	0	0	0	110.7	I965 Y989 W994 H996 F999 I1034	I965-F985 HydrophobicContact CD1-CD1 4.12Å; I965-F985 HydrophobicContact CD1-CE1 3.99Å; I965-F985 HydrophobicContact CG1-CD1 4.1Å; I965-F985 HydrophobicContact CG1-CE1 4.47Å; F985-Y989 HydrophobicContact CB-CD2 4.42Å; F985-W994 HydrophobicContact CD2-CB 4.44Å; F985-W994 WeakPolarHBondContact CD2-O 3.42Å; F985-W994 HydrophobicContact CE2-CB 4.47Å; F985-H996 AromaticContact CE1-NE2 3.89Å; F985-H996 AromaticContact CZ-CD2 3.93Å; F985-H996 AromaticContact CZ-NE2 3.48Å; F985-H996 WeakPolarHBondContact CZ-NE2 3.37Å; F985-F999 HydrophobicContact CE2-CE2 4.31Å; F985-I1034 HydrophobicContact CB-CG2 4.46Å; F985-I1034 HydrophobicContact CD1-CG2 4Å; F985-I1034 HydrophobicContact CD2-CD1 4.34Å; F985-I1034 HydrophobicContact CD2-CG2 3.96Å; F985-I1034 HydrophobicContact CE1-CG2 4.21Å; F985-I1034 HydrophobicContact CE2-CB 4.26Å; F985-I1034 HydrophobicContact CE2-CD1 4.14Å; F985-I1034 HydrophobicContact CE2-CG2 4.16Å; F985-I1034 HydrophobicContact CG-CG2 3.88Å; F985-I1034 HydrophobicContact CZ-CB 4.29Å; F985-I1034 HydrophobicContact CZ-CG2 4.28Å
986	S	86.6	Confident	86.3	Confident	37 Å²	37	37.7 Å²	37.7	26%	0.259	19%	0.189	S	C	.	.			trans	-54.6	138.4	172.4	171.6	0	0	0	0	111.7	I965 S988 Y989	I965-S986 PolarHBondContact O-N 3.33Å; S986-S988 WeakPolarHBondContact CB-OG 3.46Å; S986-S988 PolarHBondContact O-N 3.34Å; S986-S988 PolarHBondContact OG-N 3.19Å; S986-S988 PolarHBondContact OG-OG 2.97Å; S986-Y989 VanDerWaalsContact O-CD2 3.32Å; S986-Y989 WeakPolarHBondContact O-CD2 3.49Å; S986-Y989 PolarHBondContact O-N 3.49Å
987	C	83	Confident	85.8	Confident	67 Å²	67	38.7 Å²	38.7	45%	0.453	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-60.9	-16.2	179.1	-45.8	0	0	0	0	112.8	Y989 Y990	C987-Y989 PolarHBondContact O-N 3.26Å; C987-Y990 PolarHBondContact O-N 3.19Å
988	S	81.2	Confident	85.1	Confident	57 Å²	57	40.5 Å²	40.5	40%	0.399	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-55.6	-26.3	169.9	58.1	0	0	0	0	114	S986 Y990 M1032	S986-S988 WeakPolarHBondContact CB-OG 3.46Å; S986-S988 PolarHBondContact O-N 3.34Å; S986-S988 PolarHBondContact OG-N 3.19Å; S986-S988 PolarHBondContact OG-OG 2.97Å; S988-Y990 VanDerWaalsContact C-N 3.29Å; S988-Y990 WeakPolarHBondContact O-CD2 3.5Å; S988-Y990 WeakPolarHBondContact O-CE2 3.38Å; S988-M1032 WeakPolarHBondContact O-CE 3.14Å
989	Y	81.1	Confident	84.7	Confident	38 Å²	38	40.8 Å²	40.8	15%	0.149	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-80.8	-6.1	177.1	-67.8	-83.4	0	0	0	113.5	N966 S967 F985 S986 C987 A991 E1031 I1034	N966-Y989 HydrophobicContact CB-CE2 4.35Å; S967-Y989 PolarHBondContact N-OH 3.45Å; S967-Y989 PolarHBondContact OG-OH 2.92Å; F985-Y989 HydrophobicContact CB-CD2 4.42Å; S986-Y989 VanDerWaalsContact O-CD2 3.32Å; S986-Y989 WeakPolarHBondContact O-CD2 3.49Å; S986-Y989 PolarHBondContact O-N 3.49Å; C987-Y989 PolarHBondContact O-N 3.26Å; Y989-A991 PolarHBondContact O-N 3.31Å; Y989-E1031 WeakPolarHBondContact CE1-O 3.13Å; Y989-I1034 HydrophobicContact CD1-CG2 4.01Å; Y989-I1034 HydrophobicContact CG-CG2 4.12Å
990	Y	79	Confident	84.5	Confident	202 Å²	202	41.3 Å²	41.3	79%	0.792	21%	0.211	S	C	*	.	S	Bend	trans	51.4	27.3	-172.9	-58.3	-85.8	0	0	0	113.7	C987 S988	C987-Y990 PolarHBondContact O-N 3.19Å; S988-Y990 VanDerWaalsContact C-N 3.29Å; S988-Y990 WeakPolarHBondContact O-CD2 3.5Å; S988-Y990 WeakPolarHBondContact O-CE2 3.38Å
991	A	75.2	Confident	84.4	Confident	14 Å²	14	42.6 Å²	42.6	12%	0.116	22%	0.22	C	C	.	.			trans	-110.2	31.1	-166.9	0	0	0	0	0	112.7	Y989 E993 W994 I1034	Y989-A991 PolarHBondContact O-N 3.31Å; A991-E993 PolarHBondContact O-N 3.03Å; A991-W994 PolarHBondContact O-N 3.02Å; A991-I1034 HydrophobicContact CB-CD1 4.05Å; A991-I1034 HydrophobicContact CB-CG2 4.34Å
992	D	73.1	Confident	84.4	Confident	85 Å²	85	44.9 Å²	44.9	46%	0.455	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-23.3	-170.1	-71.9	-53.7	0	0	0	115.5	R984	R984-D992 IonicContact CZ-OD1 2.88Å; R984-D992 IonicContact NE-OD1 3.41Å; R984-D992 PolarHBondContact NE-OD1 3.34Å; R984-D992 IonicContact NH2-OD1 3.56Å; R984-D992 PolarHBondContact NH2-OD1 2.84Å
993	E	73.8	Confident	84.3	Confident	92 Å²	92	45.5 Å²	45.5	43%	0.43	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-31.2	172.4	-58.8	-169.7	176.2	0	0	112.1	A991 N998 P1061 T1065	A991-E993 PolarHBondContact O-N 3.03Å; E993-N998 PolarHBondContact O-ND2 2.94Å; E993-N998 VanDerWaalsContact O-ND2 3.17Å; E993-P1061 HydrophobicContact CB-CB 3.71Å; E993-T1065 VanDerWaalsContact CD-OG1 3.28Å; E993-T1065 PolarHBondContact OE1-OG1 2.7Å; E993-T1065 WeakPolarHBondContact OE2-CB 3.39Å; E993-T1065 WeakPolarHBondContact OE2-CG2 3.25Å; E993-T1065 PolarHBondContact OE2-OG1 3.27Å
994	W	77	Confident	84.3	Confident	68 Å²	68	45.5 Å²	45.5	26%	0.258	23%	0.228	S	C	.	.			trans	-83.4	123.7	-175.9	-59.7	96.2	0	0	0	111.7	F985 A991 F999 I1034 L1036 P1061	F985-W994 HydrophobicContact CD2-CB 4.44Å; F985-W994 WeakPolarHBondContact CD2-O 3.42Å; F985-W994 HydrophobicContact CE2-CB 4.47Å; A991-W994 PolarHBondContact O-N 3.02Å; W994-F999 HydrophobicContact CB-CZ 4.5Å; W994-F999 HydrophobicContact CD2-CZ 4.47Å; W994-F999 AromaticContact CE3-CE1 3.5Å; W994-F999 HydrophobicContact CE3-CE1 3.5Å; W994-F999 VanDerWaalsContact CE3-CE1 3.5Å; W994-F999 AromaticContact CE3-CZ 3.62Å; W994-F999 HydrophobicContact CE3-CZ 3.62Å; W994-F999 AromaticContact CZ3-CE1 3.75Å; W994-F999 HydrophobicContact CZ3-CE1 3.75Å; W994-F999 HydrophobicContact CZ3-CZ 4.25Å; W994-I1034 HydrophobicContact CB-CD1 3.45Å; W994-I1034 VanDerWaalsContact CB-CD1 3.45Å; W994-I1034 HydrophobicContact CD2-CD1 3.88Å; W994-I1034 HydrophobicContact CG-CD1 3.37Å; W994-L1036 HydrophobicContact CH2-CD2 3.62Å; W994-L1036 HydrophobicContact CZ2-CD2 3.84Å; W994-L1036 HydrophobicContact CZ3-CD2 4.04Å; W994-P1061 HydrophobicContact CD2-CB 3.69Å; W994-P1061 HydrophobicContact CD2-CG 4.48Å; W994-P1061 HydrophobicContact CE3-CB 4.02Å; W994-P1061 HydrophobicContact CG-CB 4.12Å; W994-P1061 HydrophobicContact CH2-CB 4.4Å; W994-P1061 HydrophobicContact CH2-CG 4.2Å; W994-P1061 HydrophobicContact CZ2-CB 4.06Å; W994-P1061 HydrophobicContact CZ2-CG 3.96Å; W994-P1061 HydrophobicContact CZ3-CB 4.36Å
995	S	83.4	Confident	84.4	Confident	16 Å²	16	42.1 Å²	42.1	11%	0.112	22%	0.215	C	C	.	.			trans	-140.3	152.6	171.2	173.9	0	0	0	0	109.2	R962 T983 A997 N998	R962-S995 PolarHBondContact NH1-OG 3.42Å; R962-S995 VanDerWaalsContact NH1-OG 3.16Å; T983-S995 PolarHBondContact O-OG 2.97Å; S995-A997 PolarHBondContact O-N 3.41Å; S995-A997 PolarHBondContact OG-N 3.5Å; S995-N998 WeakPolarHBondContact O-CB 3.05Å; S995-N998 PolarHBondContact O-N 3.47Å
996	H	87.8	Confident	84.6	Confident	6 Å²	6	47.1 Å²	47.1	3%	0.028	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-54.6	-23.4	172.2	-60.9	156.8	0	0	0	113.5	I965 F969 G980 T983 F985 N998 F999 V1004	I965-H996 WeakPolarHBondContact CD1-CE1 3.47Å; F969-H996 AromaticContact CD1-CE1 3.64Å; F969-H996 AromaticContact CD1-NE2 3.88Å; F969-H996 AromaticContact CE1-CE1 3.72Å; F969-H996 AromaticContact CE1-NE2 3.53Å; G980-H996 PolarHBondContact N-ND1 3.18Å; G980-H996 WeakPolarHBondContact O-CB 3.33Å; G980-H996 PolarHBondContact O-ND1 2.79Å; T983-H996 PolarHBondContact OG1-CE1 3.2Å; T983-H996 PolarHBondContact OG1-ND1 3.03Å; F985-H996 AromaticContact CE1-NE2 3.89Å; F985-H996 AromaticContact CZ-CD2 3.93Å; F985-H996 AromaticContact CZ-NE2 3.48Å; F985-H996 WeakPolarHBondContact CZ-NE2 3.37Å; H996-N998 PolarHBondContact O-N 2.79Å; H996-F999 AromaticContact CD2-CD2 3.84Å; H996-F999 PolarHBondContact O-N 2.73Å; H996-F999 VanDerWaalsContact O-N 3.1Å; H996-V1004 HydrophobicContact CB-CG1 4.3Å; H996-V1004 HydrophobicContact CB-CG2 4.25Å
997	A	84.7	Confident	84.9	Confident	20 Å²	20	47.9 Å²	47.9	17%	0.165	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-64.2	-5.2	171.8	0	0	0	0	0	114.5	P981 S995 R1041	P981-A997 HydrophobicContact CB-CB 4.17Å; P981-A997 HydrophobicContact CG-CB 4.45Å; S995-A997 PolarHBondContact O-N 3.41Å; S995-A997 PolarHBondContact OG-N 3.5Å; A997-R1041 PolarHBondContact O-NH1 3Å; A997-R1041 PolarHBondContact O-NH2 3.41Å; A997-R1041 VanDerWaalsContact O-NH2 3.09Å
998	N	82.4	Confident	85.4	Confident	38 Å²	38	44.7 Å²	44.7	20%	0.203	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-106.8	-8.1	175.3	-58.9	-22.4	0	0	0	113.4	E993 S995 H996 S1060 P1061	E993-N998 PolarHBondContact O-ND2 2.94Å; E993-N998 VanDerWaalsContact O-ND2 3.17Å; S995-N998 WeakPolarHBondContact O-CB 3.05Å; S995-N998 PolarHBondContact O-N 3.47Å; H996-N998 PolarHBondContact O-N 2.79Å; N998-S1060 WeakPolarHBondContact CB-O 3.31Å; N998-P1061 PolarHBondContact ND2-O 2.89Å
999	F	86.9	Confident	86	Confident	6 Å²	6	42 Å²	42	3%	0.026	19%	0.194	C	C	.	.	S	Bend	trans	-103.2	176.4	-174.9	-56.9	-37.4	0	0	0	112	F985 W994 H996 V1004 Y1037 P1059	F985-F999 HydrophobicContact CE2-CE2 4.31Å; W994-F999 HydrophobicContact CB-CZ 4.5Å; W994-F999 HydrophobicContact CD2-CZ 4.47Å; W994-F999 AromaticContact CE3-CE1 3.5Å; W994-F999 HydrophobicContact CE3-CE1 3.5Å; W994-F999 VanDerWaalsContact CE3-CE1 3.5Å; W994-F999 AromaticContact CE3-CZ 3.62Å; W994-F999 HydrophobicContact CE3-CZ 3.62Å; W994-F999 AromaticContact CZ3-CE1 3.75Å; W994-F999 HydrophobicContact CZ3-CE1 3.75Å; W994-F999 HydrophobicContact CZ3-CZ 4.25Å; H996-F999 AromaticContact CD2-CD2 3.84Å; H996-F999 PolarHBondContact O-N 2.73Å; H996-F999 VanDerWaalsContact O-N 3.1Å; F999-V1004 HydrophobicContact CB-CG2 3.91Å; F999-V1004 HydrophobicContact CD2-CG2 4.14Å; F999-Y1037 HydrophobicContact CB-CD2 3.83Å; F999-Y1037 HydrophobicContact CB-CE2 4.44Å; F999-Y1037 HydrophobicContact CB-CG 4.12Å; F999-Y1037 AromaticContact CD1-CD2 3.57Å; F999-Y1037 HydrophobicContact CD1-CD2 3.57Å; F999-Y1037 HydrophobicContact CD1-CG 4.19Å; F999-Y1037 AromaticContact CD2-CD2 3.18Å; F999-Y1037 HydrophobicContact CD2-CD2 3.18Å; F999-Y1037 AromaticContact CD2-CE2 3.33Å; F999-Y1037 HydrophobicContact CD2-CE2 3.33Å; F999-Y1037 HydrophobicContact CD2-CG 4.27Å; F999-Y1037 AromaticContact CE1-CD2 3.8Å; F999-Y1037 HydrophobicContact CE1-CD2 3.8Å; F999-Y1037 AromaticContact CE2-CD2 3.47Å; F999-Y1037 HydrophobicContact CE2-CD2 3.47Å; F999-Y1037 VanDerWaalsContact CE2-CD2 3.47Å; F999-Y1037 AromaticContact CE2-CE2 3.53Å; F999-Y1037 HydrophobicContact CE2-CE2 3.53Å; F999-Y1037 AromaticContact CG-CD2 3.26Å; F999-Y1037 HydrophobicContact CG-CD2 3.26Å; F999-Y1037 AromaticContact CG-CE2 3.9Å; F999-Y1037 HydrophobicContact CG-CE2 3.9Å; F999-Y1037 AromaticContact CG-CG 3.98Å; F999-Y1037 HydrophobicContact CG-CG 3.98Å; F999-Y1037 AromaticContact CZ-CD2 3.76Å; F999-Y1037 HydrophobicContact CZ-CD2 3.76Å; F999-Y1037 HydrophobicContact CZ-CE2 4.2Å; F999-P1059 HydrophobicContact CD1-CB 3.99Å
1000	S	89.4	Confident	86.5	Confident	11 Å²	11	41.7 Å²	41.7	8%	0.077	20%	0.2	C	C	.	.			trans	-77.6	123.3	167.3	-175.5	0	0	0	0	109.9	R1002 D1003 V1004	S1000-R1002 PolarHBondContact O-N 2.94Å; S1000-R1002 VanDerWaalsContact O-N 3.11Å; S1000-D1003 PolarHBondContact O-N 2.93Å; S1000-D1003 VanDerWaalsContact O-N 3.07Å; S1000-V1004 PolarHBondContact O-N 2.78Å
1001	S	91.5	Very high	87	Confident	28 Å²	28	32.7 Å²	32.7	20%	0.196	17%	0.166	C	C	.	.	H	α-helix	trans	-52.9	-31.9	176.3	-55	0	0	0	0	113	G1005	S1001-G1005 PolarHBondContact O-N 3.15Å
1002	R	90.4	Very high	87.7	Confident	80 Å²	80	32 Å²	32	30%	0.302	16%	0.16	S	C	.	.	H	α-helix	trans	-72.2	-35.4	-179.9	-150.4	179.1	-172.5	163.9	-3.3	112.8	S682 E685 V723 S1000 R1006	S682-R1002 WeakPolarHBondContact OG-CA 2.96Å; S682-R1002 WeakPolarHBondContact OG-CG 3.19Å; S682-R1002 PolarHBondContact OG-O 3.47Å; E685-R1002 IonicContact OE1-CZ 3.5Å; E685-R1002 IonicContact OE1-NH2 3.28Å; E685-R1002 PolarHBondContact OE1-NH2 3.46Å; E685-R1002 IonicContact OE2-CZ 2.75Å; E685-R1002 IonicContact OE2-NE 3.77Å; E685-R1002 PolarHBondContact OE2-NE 2.63Å; E685-R1002 IonicContact OE2-NH2 3.89Å; E685-R1002 PolarHBondContact OE2-NH2 3.11Å; V723-R1002 HydrophobicContact CG1-CB 3.81Å; V723-R1002 HydrophobicContact CG1-CG 3.97Å; S1000-R1002 PolarHBondContact O-N 2.94Å; S1000-R1002 VanDerWaalsContact O-N 3.11Å; R1002-R1006 WeakPolarHBondContact O-CB 3.29Å; R1002-R1006 PolarHBondContact O-N 3.08Å; R1002-R1006 VanDerWaalsContact O-N 3.12Å
1003	D	90.8	Very high	88.6	Confident	14 Å²	14	28.2 Å²	28.2	8%	0.075	14%	0.14	C	C	.	.	H	α-helix	trans	-73.2	-42.1	175.5	-68.4	0.3	0	0	0	110.6	S1000 G1005 R1006 D1007 Y1037 R1039	S1000-D1003 PolarHBondContact O-N 2.93Å; S1000-D1003 VanDerWaalsContact O-N 3.07Å; D1003-G1005 PolarHBondContact O-N 2.99Å; D1003-R1006 WeakPolarHBondContact O-CB 3.05Å; D1003-R1006 PolarHBondContact O-N 3.47Å; D1003-D1007 PolarHBondContact O-N 3.12Å; D1003-Y1037 HydrophobicContact CB-CD1 3.27Å; D1003-Y1037 HydrophobicContact CB-CE1 3.53Å; D1003-Y1037 HydrophobicContact CB-CG 4.31Å; D1003-R1039 WeakPolarHBondContact OD1-CD 3.09Å; D1003-R1039 VanDerWaalsContact OD1-CG 3.31Å; D1003-R1039 WeakPolarHBondContact OD1-CG 3.49Å; D1003-R1039 IonicContact OD1-CZ 3.65Å; D1003-R1039 IonicContact OD1-NE 2.71Å; D1003-R1039 IonicContact OD1-NH1 2.72Å; D1003-R1039 PolarHBondContact OD1-NH1 3.31Å; D1003-R1039 VanDerWaalsContact OD2-CB 3.24Å; D1003-R1039 WeakPolarHBondContact OD2-CB 3.3Å; D1003-R1039 WeakPolarHBondContact OD2-CG 3.26Å; D1003-R1039 PolarHBondContact OD2-N 2.83Å
1004	V	92.3	Very high	89.2	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-61.4	-42.7	177.3	178.5	0	0	0	0	111.2	T679 F969 A979 H996 F999 S1000 V1008 Y1037	T679-V1004 HydrophobicContact CG2-CB 4.2Å; T679-V1004 HydrophobicContact CG2-CG1 3.79Å; F969-V1004 HydrophobicContact CE1-CG1 4.17Å; A979-V1004 HydrophobicContact CB-CG1 4.27Å; H996-V1004 HydrophobicContact CB-CG1 4.3Å; H996-V1004 HydrophobicContact CB-CG2 4.25Å; F999-V1004 HydrophobicContact CB-CG2 3.91Å; F999-V1004 HydrophobicContact CD2-CG2 4.14Å; S1000-V1004 PolarHBondContact O-N 2.78Å; V1004-V1008 WeakPolarHBondContact O-CG2 3.42Å; V1004-V1008 PolarHBondContact O-N 3.09Å; V1004-Y1037 HydrophobicContact CG2-CE2 4.21Å
1005	G	93.9	Very high	89.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.1	-39.5	175.7	0	0	0	0	0	112.9	T679 L683 S1001 D1003 A1009	T679-G1005 WeakPolarHBondContact O-CA 3.36Å; L683-G1005 WeakPolarHBondContact CA-O 3.48Å; S1001-G1005 PolarHBondContact O-N 3.15Å; D1003-G1005 PolarHBondContact O-N 2.99Å; G1005-A1009 PolarHBondContact O-N 3.46Å
1006	R	93	Very high	89.6	Confident	109 Å²	109	30 Å²	30	41%	0.411	15%	0.15	S	C	.	.	H	α-helix	trans	-65.5	-40.5	177.1	-176	174.5	-158.9	-123.2	-6.9	113.3	E686 R1002 D1003 A1009 A1010	E686-R1006 HydrophobicContact CG-CG 4.12Å; E686-R1006 WeakPolarHBondContact OE2-CD 3.38Å; E686-R1006 WeakPolarHBondContact OE2-CG 3.26Å; E686-R1006 IonicContact OE2-CZ 3.48Å; E686-R1006 IonicContact OE2-NE 3.18Å; E686-R1006 PolarHBondContact OE2-NE 2.73Å; E686-R1006 IonicContact OE2-NH2 3.52Å; R1002-R1006 WeakPolarHBondContact O-CB 3.29Å; R1002-R1006 PolarHBondContact O-N 3.08Å; R1002-R1006 VanDerWaalsContact O-N 3.12Å; D1003-R1006 WeakPolarHBondContact O-CB 3.05Å; D1003-R1006 PolarHBondContact O-N 3.47Å; R1006-A1009 WeakPolarHBondContact O-CB 3.23Å; R1006-A1009 PolarHBondContact O-N 3.33Å; R1006-A1010 PolarHBondContact O-N 2.78Å
1007	D	92.3	Very high	89.4	Confident	53 Å²	53	30.4 Å²	30.4	28%	0.283	15%	0.152	S	C	.	.	H	α-helix	trans	-70.5	-37.9	178.5	-75.9	5.4	0	0	0	111.7	F969 D1003 A1009 A1010 V1011 Y1037	F969-D1007 HydrophobicContact CE2-CB 3.7Å; F969-D1007 HydrophobicContact CZ-CB 3.58Å; D1003-D1007 PolarHBondContact O-N 3.12Å; D1007-A1009 VanDerWaalsContact C-N 3.29Å; D1007-A1009 PolarHBondContact O-N 2.8Å; D1007-A1010 WeakPolarHBondContact O-CB 3.46Å; D1007-A1010 PolarHBondContact O-N 3.33Å; D1007-A1010 VanDerWaalsContact O-N 3.13Å; D1007-V1011 WeakPolarHBondContact O-CG2 3.41Å; D1007-V1011 PolarHBondContact O-N 2.77Å; D1007-Y1037 WeakPolarHBondContact OD2-CE1 3.16Å; D1007-Y1037 PolarHBondContact OD2-OH 3.46Å
1008	V	93.8	Very high	88.9	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.3	-41.9	171.2	176.1	0	0	0	0	110.5	L683 V769 F969 A979 V1004 V1011 L1012	L683-V1008 HydrophobicContact CD1-CB 4.49Å; L683-V1008 HydrophobicContact CD1-CG1 4.08Å; L683-V1008 HydrophobicContact CD2-CG1 4.05Å; V769-V1008 HydrophobicContact CG1-CG1 4.02Å; F969-V1008 HydrophobicContact CB-CG2 4.01Å; F969-V1008 HydrophobicContact CD1-CG2 3.58Å; F969-V1008 HydrophobicContact CD2-CB 4.45Å; F969-V1008 HydrophobicContact CD2-CG2 3.75Å; F969-V1008 HydrophobicContact CE1-CG2 3.95Å; F969-V1008 HydrophobicContact CE2-CG2 4.11Å; F969-V1008 HydrophobicContact CG-CG2 3.48Å; F969-V1008 VanDerWaalsContact CG-CG2 3.48Å; F969-V1008 HydrophobicContact CZ-CG2 4.21Å; A979-V1008 HydrophobicContact CB-CG2 3.72Å; V1004-V1008 WeakPolarHBondContact O-CG2 3.42Å; V1004-V1008 PolarHBondContact O-N 3.09Å; V1008-V1011 PolarHBondContact O-N 2.96Å; V1008-L1012 HydrophobicContact CG1-CD1 4.2Å; V1008-L1012 WeakPolarHBondContact O-CG 3.37Å; V1008-L1012 PolarHBondContact O-N 3.47Å
1009	A	94.1	Very high	88.4	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.8	-43.2	172.9	0	0	0	0	0	111.5	L683 E686 L687 G1005 R1006 D1007 V1011 L1012 L1013	L683-A1009 HydrophobicContact CD1-CB 3.69Å; E686-A1009 HydrophobicContact CB-CB 3.8Å; E686-A1009 HydrophobicContact CG-CB 4.03Å; L687-A1009 HydrophobicContact CD2-CB 4.2Å; L687-A1009 HydrophobicContact CG-CB 4.21Å; G1005-A1009 PolarHBondContact O-N 3.46Å; R1006-A1009 WeakPolarHBondContact O-CB 3.23Å; R1006-A1009 PolarHBondContact O-N 3.33Å; D1007-A1009 VanDerWaalsContact C-N 3.29Å; D1007-A1009 PolarHBondContact O-N 2.8Å; A1009-V1011 PolarHBondContact O-N 3.01Å; A1009-L1012 PolarHBondContact O-N 2.9Å; A1009-L1013 WeakPolarHBondContact O-CB 3.4Å; A1009-L1013 WeakPolarHBondContact O-CD1 3.41Å; A1009-L1013 WeakPolarHBondContact O-CG 3.38Å; A1009-L1013 PolarHBondContact O-N 2.74Å
1010	A	91.1	Very high	87.6	Confident	32 Å²	32	40.7 Å²	40.7	26%	0.264	20%	0.202	S	C	.	.	H	α-helix	trans	-61.5	-42.4	178.8	0	0	0	0	0	112.8	R1006 D1007 L1013 E1014 R1020	R1006-A1010 PolarHBondContact O-N 2.78Å; D1007-A1010 WeakPolarHBondContact O-CB 3.46Å; D1007-A1010 PolarHBondContact O-N 3.33Å; D1007-A1010 VanDerWaalsContact O-N 3.13Å; A1010-L1013 PolarHBondContact O-N 3.16Å; A1010-E1014 WeakPolarHBondContact O-CG 3.23Å; A1010-E1014 PolarHBondContact O-N 3.27Å; A1010-E1014 VanDerWaalsContact O-N 3.1Å; A1010-R1020 PolarHBondContact O-NH1 2.86Å
1011	V	90.5	Very high	85.9	Confident	13 Å²	13	49.1 Å²	49.1	8%	0.079	24%	0.24	C	C	.	.	H	α-helix	trans	-68.3	-36.1	176.7	172.2	0	0	0	0	112.3	R968 F969 Y977 D1007 V1008 A1009 E1014	R968-V1011 HydrophobicContact CB-CG1 4.27Å; R968-V1011 HydrophobicContact CB-CG2 4.48Å; F969-V1011 HydrophobicContact CD2-CG2 4.19Å; F969-V1011 HydrophobicContact CE2-CG2 4.24Å; Y977-V1011 HydrophobicContact CE1-CG1 4.08Å; D1007-V1011 WeakPolarHBondContact O-CG2 3.41Å; D1007-V1011 PolarHBondContact O-N 2.77Å; V1008-V1011 PolarHBondContact O-N 2.96Å; A1009-V1011 PolarHBondContact O-N 3.01Å; V1011-E1014 PolarHBondContact O-N 3.28Å
1012	L	90.6	Very high	83.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-68.1	-39.8	172.4	-73.8	167.5	0	0	0	111.4	L683 F767 V769 Y977 V1008 A1009 E1014 Q1015 L1016	L683-L1012 HydrophobicContact CD1-CD1 3.98Å; F767-L1012 HydrophobicContact CB-CD2 4.47Å; F767-L1012 HydrophobicContact CD1-CD2 4.17Å; F767-L1012 HydrophobicContact CG-CD2 4.4Å; V769-L1012 HydrophobicContact CG2-CD1 4.14Å; Y977-L1012 HydrophobicContact CD2-CD2 4.2Å; Y977-L1012 HydrophobicContact CE1-CD2 4.25Å; Y977-L1012 HydrophobicContact CE2-CD2 3.67Å; V1008-L1012 HydrophobicContact CG1-CD1 4.2Å; V1008-L1012 WeakPolarHBondContact O-CG 3.37Å; V1008-L1012 PolarHBondContact O-N 3.47Å; A1009-L1012 PolarHBondContact O-N 2.9Å; L1012-E1014 VanDerWaalsContact C-N 3.28Å; L1012-E1014 PolarHBondContact O-N 3.38Å; L1012-Q1015 PolarHBondContact O-N 3.08Å; L1012-L1016 HydrophobicContact CB-CD1 4.34Å; L1012-L1016 WeakPolarHBondContact O-CB 3.43Å; L1012-L1016 VanDerWaalsContact O-CG 3.31Å; L1012-L1016 WeakPolarHBondContact O-CG 3.42Å; L1012-L1016 PolarHBondContact O-N 3Å; L1012-L1016 VanDerWaalsContact O-N 3.11Å
1013	L	90.4	Very high	82.1	Confident	6 Å²	6	52.1 Å²	52.1	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-30.6	176.5	-72.8	164.9	0	0	0	112.7	L687 L693 F695 A1009 A1010 Q1015 L1016 D1017 R1020	L687-L1013 HydrophobicContact CD2-CD1 4.44Å; L687-L1013 HydrophobicContact CD2-CD2 4.19Å; L687-L1013 HydrophobicContact CD2-CG 4.04Å; L693-L1013 HydrophobicContact CD1-CD2 3.35Å; F695-L1013 HydrophobicContact CZ-CD2 3.86Å; A1009-L1013 WeakPolarHBondContact O-CB 3.4Å; A1009-L1013 WeakPolarHBondContact O-CD1 3.41Å; A1009-L1013 WeakPolarHBondContact O-CG 3.38Å; A1009-L1013 PolarHBondContact O-N 2.74Å; A1010-L1013 PolarHBondContact O-N 3.16Å; L1013-Q1015 PolarHBondContact O-N 2.82Å; L1013-L1016 PolarHBondContact O-N 2.62Å; L1013-D1017 VanDerWaalsContact O-CB 3.24Å; L1013-D1017 WeakPolarHBondContact O-CB 3.27Å; L1013-D1017 PolarHBondContact O-N 3.4Å; L1013-R1020 VanDerWaalsContact CB-CZ 3.45Å
1014	E	86.6	Confident	80	Confident	100 Å²	100	58.2 Å²	58.2	47%	0.467	31%	0.312	S	S	.	.	H	α-helix	trans	-62	-18	170.9	-70.5	164.7	-178.8	0	0	114.1	R968 A1010 V1011 L1012	R968-E1014 IonicContact CZ-OE2 3.03Å; R968-E1014 IonicContact NE-OE2 3.77Å; R968-E1014 IonicContact NH2-OE2 3.12Å; R968-E1014 PolarHBondContact NH2-OE2 3.15Å; A1010-E1014 WeakPolarHBondContact O-CG 3.23Å; A1010-E1014 PolarHBondContact O-N 3.27Å; A1010-E1014 VanDerWaalsContact O-N 3.1Å; V1011-E1014 PolarHBondContact O-N 3.28Å; L1012-E1014 VanDerWaalsContact C-N 3.28Å; L1012-E1014 PolarHBondContact O-N 3.38Å
1015	Q	82.6	Confident	77.8	Confident	92 Å²	92	64.5 Å²	64.5	43%	0.43	35%	0.346	S	S	.	.	H	α-helix	trans	-106.3	-18.4	177.8	-61.5	176.7	26	0	0	113.1	Y977 L1012 L1013	Y977-Q1015 PolarHBondContact OH-NE2 3.32Å; Y977-Q1015 PolarHBondContact OH-OE1 3.38Å; L1012-Q1015 PolarHBondContact O-N 3.08Å; L1013-Q1015 PolarHBondContact O-N 2.82Å
1016	L	86	Confident	75.7	Confident	20 Å²	20	69.4 Å²	69.4	11%	0.105	38%	0.378	C	S	.	.	H	α-helix	trans	-114	-16.7	-169.6	-64.4	173.5	0	0	0	114.3	V667 A669 I671 F695 F767 L1012 L1013 P1018	V667-L1016 HydrophobicContact CG1-CB 4.31Å; V667-L1016 HydrophobicContact CG1-CD1 4.4Å; V667-L1016 HydrophobicContact CG1-CD2 4.1Å; A669-L1016 HydrophobicContact CB-CD2 4.11Å; I671-L1016 HydrophobicContact CD1-CD1 3.75Å; F695-L1016 HydrophobicContact CE1-CD1 4.17Å; F767-L1016 HydrophobicContact CE2-CD2 3.74Å; F767-L1016 HydrophobicContact CZ-CD2 4.1Å; L1012-L1016 HydrophobicContact CB-CD1 4.34Å; L1012-L1016 WeakPolarHBondContact O-CB 3.43Å; L1012-L1016 VanDerWaalsContact O-CG 3.31Å; L1012-L1016 WeakPolarHBondContact O-CG 3.42Å; L1012-L1016 PolarHBondContact O-N 3Å; L1012-L1016 VanDerWaalsContact O-N 3.11Å; L1013-L1016 PolarHBondContact O-N 2.62Å; L1016-P1018 WeakPolarHBondContact O-CD 3.35Å
1017	D	83.9	Confident	73.7	Confident	15 Å²	15	68.3 Å²	68.3	8%	0.08	39%	0.385	C	S	.	.			trans	-98.6	105.7	179.2	-173.5	-1.2	0	0	0	111.2	H692 L693 L1013 N1019 R1020	H692-D1017 IonicContact CD2-OD1 3.77Å; H692-D1017 IonicContact CD2-OD2 3Å; H692-D1017 IonicContact CE1-OD2 2.72Å; H692-D1017 PolarHBondContact CE1-OD2 3.02Å; H692-D1017 VanDerWaalsContact NE2-CG 3.29Å; H692-D1017 IonicContact NE2-OD1 3.4Å; H692-D1017 PolarHBondContact NE2-OD1 2.58Å; H692-D1017 IonicContact NE2-OD2 3.28Å; H692-D1017 PolarHBondContact NE2-OD2 2.72Å; L693-D1017 HydrophobicContact CD1-CB 4.2Å; L1013-D1017 VanDerWaalsContact O-CB 3.24Å; L1013-D1017 WeakPolarHBondContact O-CB 3.27Å; L1013-D1017 PolarHBondContact O-N 3.4Å; D1017-N1019 PolarHBondContact O-N 3.32Å; D1017-N1019 VanDerWaalsContact O-N 3.16Å; D1017-N1019 WeakPolarHBondContact OD1-CB 3.31Å; D1017-N1019 PolarHBondContact OD1-N 3.02Å; D1017-N1019 PolarHBondContact OD1-ND2 3.5Å; D1017-R1020 HydrophobicContact CB-CG 4Å; D1017-R1020 PolarHBondContact O-N 3.26Å; D1017-R1020 IonicContact OD2-NE 3.85Å
1018	P	75.1	Confident	71.6	Confident	78 Å²	78	71.9 Å²	71.9	51%	0.506	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-8.6	-179.7	31.3	-36.6	0	0	0	113.4	V665 L1016	V665-P1018 HydrophobicContact CG1-CG 3.8Å; V665-P1018 HydrophobicContact CG2-CG 4.25Å; L1016-P1018 WeakPolarHBondContact O-CD 3.35Å
1019	N	71.9	Confident	69.6	Low	102 Å²	102	79.1 Å²	79.1	55%	0.545	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-3.5	176.5	-51.5	-73.7	0	0	0	113	D1017	D1017-N1019 PolarHBondContact O-N 3.32Å; D1017-N1019 VanDerWaalsContact O-N 3.16Å; D1017-N1019 WeakPolarHBondContact OD1-CB 3.31Å; D1017-N1019 PolarHBondContact OD1-N 3.02Å; D1017-N1019 PolarHBondContact OD1-ND2 3.5Å
1020	R	69.1	Low	67.8	Low	101 Å²	101	84.3 Å²	84.3	38%	0.381	48%	0.482	S	S	.	.	S	Bend	trans	-80.9	118.2	171.9	-75.3	-177.3	178.5	-158	-1.5	109.5	A1010 L1013 D1017 A1022	A1010-R1020 PolarHBondContact O-NH1 2.86Å; L1013-R1020 VanDerWaalsContact CB-CZ 3.45Å; D1017-R1020 HydrophobicContact CB-CG 4Å; D1017-R1020 PolarHBondContact O-N 3.26Å; D1017-R1020 IonicContact OD2-NE 3.85Å; R1020-A1022 PolarHBondContact O-N 3.25Å
1021	E	53.7	Low	66.4	Low	188 Å²	188	88.6 Å²	88.6	88%	0.879	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-57.3	123.2	168.3	-68.1	174.4	-173	0	0	109
1022	A	50.4	Low	65.2	Low	71 Å²	71	93 Å²	93	59%	0.587	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-64.1	139.4	171.1	0	0	0	0	0	108.9	R1020 V1024	R1020-A1022 PolarHBondContact O-N 3.25Å; A1022-V1024 PolarHBondContact O-N 3.39Å
1023	P	51.8	Low	64.5	Low	100 Å²	100	99.9 Å²	99.9	65%	0.649	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-56.2	128.4	177.8	23	-33	0	0	0	109.9	D1025	P1023-D1025 PolarHBondContact O-N 2.98Å
1024	V	47.8	Very low	63.9	Low	141 Å²	141	100.8 Å²	100.8	86%	0.855	56%	0.558	S	S	*	*	S	Bend	trans	-54.7	-40.6	-168.2	178.9	0	0	0	0	111.7	A1022	A1022-V1024 PolarHBondContact O-N 3.39Å
1025	D	44.9	Very low	63.5	Low	134 Å²	134	97.5 Å²	97.5	72%	0.717	55%	0.545	S	S	*	.	S	Bend	trans	-117.2	127	168	-65.8	-69.7	0	0	0	109.3	P1023	P1023-D1025 PolarHBondContact O-N 2.98Å
1026	P	49.3	Very low	63.3	Low	102 Å²	102	99.1 Å²	99.1	66%	0.662	56%	0.556	S	S	*	*			trans	-69.1	141	165.1	30.1	-32.7	0	0	0	109.4	S1028	P1026-S1028 PolarHBondContact O-N 2.74Å
1027	P	52	Low	63.1	Low	87 Å²	87	99.4 Å²	99.4	57%	0.565	56%	0.556	S	S	*	*			trans	-59.3	129.5	-179.7	23.9	-33.2	0	0	0	110.8	E1029 E1031	P1027-E1029 PolarHBondContact O-N 2.89Å; P1027-E1031 HydrophobicContact CG-CG 4.48Å
1028	S	49	Very low	62.8	Low	127 Å²	127	103.5 Å²	103.5	89%	0.888	59%	0.586	S	S	*	*	S	Bend	trans	-73	-14	-174.1	49.3	0	0	0	0	114.1	P1026	P1026-S1028 PolarHBondContact O-N 2.74Å
1029	E	51.4	Low	63.3	Low	153 Å²	153	104.7 Å²	104.7	72%	0.715	58%	0.58	S	S	*	*	S	Bend	trans	-124.6	148	172.3	-64.1	-170.8	164.6	0	0	109.3	P1027 E1031	P1027-E1029 PolarHBondContact O-N 2.89Å; E1029-E1031 PolarHBondContact O-N 3.03Å
1030	P	56.3	Low	64.1	Low	109 Å²	109	100.7 Å²	100.7	71%	0.708	56%	0.559	S	S	*	*			trans	-63.7	130.7	174.6	27.8	-34.1	0	0	0	110	M1032	P1030-M1032 PolarHBondContact O-N 2.81Å
1031	E	60.1	Low	65	Low	122 Å²	122	99.6 Å²	99.6	57%	0.57	56%	0.555	S	S	*	*			trans	-62.4	102.6	178.7	-65.9	-178.1	138.8	0	0	110.7	S967 Y989 P1027 E1029 L1033	S967-E1031 PolarHBondContact OG-O 2.89Å; Y989-E1031 WeakPolarHBondContact CE1-O 3.13Å; P1027-E1031 HydrophobicContact CG-CG 4.48Å; E1029-E1031 PolarHBondContact O-N 3.03Å; E1031-L1033 PolarHBondContact O-N 2.92Å; E1031-L1033 VanDerWaalsContact O-N 3.17Å
1032	M	65.4	Low	66.7	Low	105 Å²	105	92 Å²	92	52%	0.517	52%	0.52	S	S	.	.			trans	-75.4	9	178.1	-69.6	-71.7	-68.5	0	0	113.4	S988 P1030	S988-M1032 WeakPolarHBondContact O-CE 3.14Å; P1030-M1032 PolarHBondContact O-N 2.81Å
1033	L	75.7	Confident	68.6	Low	144 Å²	144	91.9 Å²	91.9	75%	0.754	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-100.3	143.9	178.1	-60.8	178.3	0	0	0	110.2	S967 E1031	S967-L1033 WeakPolarHBondContact CB-O 3.4Å; E1031-L1033 PolarHBondContact O-N 2.92Å; E1031-L1033 VanDerWaalsContact O-N 3.17Å
1034	I	78.9	Confident	70.5	Confident	25 Å²	25	87.1 Å²	87.1	13%	0.128	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-96.3	153.8	170.3	54.8	160.4	0	0	0	110.3	F985 Y989 A991 W994	F985-I1034 HydrophobicContact CB-CG2 4.46Å; F985-I1034 HydrophobicContact CD1-CG2 4Å; F985-I1034 HydrophobicContact CD2-CD1 4.34Å; F985-I1034 HydrophobicContact CD2-CG2 3.96Å; F985-I1034 HydrophobicContact CE1-CG2 4.21Å; F985-I1034 HydrophobicContact CE2-CB 4.26Å; F985-I1034 HydrophobicContact CE2-CD1 4.14Å; F985-I1034 HydrophobicContact CE2-CG2 4.16Å; F985-I1034 HydrophobicContact CG-CG2 3.88Å; F985-I1034 HydrophobicContact CZ-CB 4.29Å; F985-I1034 HydrophobicContact CZ-CG2 4.28Å; Y989-I1034 HydrophobicContact CD1-CG2 4.01Å; Y989-I1034 HydrophobicContact CG-CG2 4.12Å; A991-I1034 HydrophobicContact CB-CD1 4.05Å; A991-I1034 HydrophobicContact CB-CG2 4.34Å; W994-I1034 HydrophobicContact CB-CD1 3.45Å; W994-I1034 VanDerWaalsContact CB-CD1 3.45Å; W994-I1034 HydrophobicContact CD2-CD1 3.88Å; W994-I1034 HydrophobicContact CG-CD1 3.37Å
1035	P	77.9	Confident	72.6	Confident	31 Å²	31	80.9 Å²	80.9	20%	0.201	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-56.6	137.6	171.8	-25.8	35.5	0	0	0	112.5	F969 Y1037	F969-P1035 HydrophobicContact CZ-CG 4.46Å; P1035-Y1037 HydrophobicContact CB-CE2 3.82Å; P1035-Y1037 WeakPolarHBondContact CB-OH 3.37Å
1036	L	78.3	Confident	74.8	Confident	127 Å²	127	76.6 Å²	76.6	67%	0.665	42%	0.416	S	S	*	.			trans	-114.5	121.6	176.4	-69.2	-179.6	0	0	0	110.5	W994	W994-L1036 HydrophobicContact CH2-CD2 3.62Å; W994-L1036 HydrophobicContact CZ2-CD2 3.84Å; W994-L1036 HydrophobicContact CZ3-CD2 4.04Å
1037	Y	81.9	Confident	76.9	Confident	25 Å²	25	71.8 Å²	71.8	10%	0.098	38%	0.384	C	S	.	.			trans	-94.8	140.7	-171.1	-68	-74.1	0	0	0	113.5	F999 D1003 V1004 D1007 P1035	F999-Y1037 HydrophobicContact CB-CD2 3.83Å; F999-Y1037 HydrophobicContact CB-CE2 4.44Å; F999-Y1037 HydrophobicContact CB-CG 4.12Å; F999-Y1037 AromaticContact CD1-CD2 3.57Å; F999-Y1037 HydrophobicContact CD1-CD2 3.57Å; F999-Y1037 HydrophobicContact CD1-CG 4.19Å; F999-Y1037 AromaticContact CD2-CD2 3.18Å; F999-Y1037 HydrophobicContact CD2-CD2 3.18Å; F999-Y1037 AromaticContact CD2-CE2 3.33Å; F999-Y1037 HydrophobicContact CD2-CE2 3.33Å; F999-Y1037 HydrophobicContact CD2-CG 4.27Å; F999-Y1037 AromaticContact CE1-CD2 3.8Å; F999-Y1037 HydrophobicContact CE1-CD2 3.8Å; F999-Y1037 AromaticContact CE2-CD2 3.47Å; F999-Y1037 HydrophobicContact CE2-CD2 3.47Å; F999-Y1037 VanDerWaalsContact CE2-CD2 3.47Å; F999-Y1037 AromaticContact CE2-CE2 3.53Å; F999-Y1037 HydrophobicContact CE2-CE2 3.53Å; F999-Y1037 AromaticContact CG-CD2 3.26Å; F999-Y1037 HydrophobicContact CG-CD2 3.26Å; F999-Y1037 AromaticContact CG-CE2 3.9Å; F999-Y1037 HydrophobicContact CG-CE2 3.9Å; F999-Y1037 AromaticContact CG-CG 3.98Å; F999-Y1037 HydrophobicContact CG-CG 3.98Å; F999-Y1037 AromaticContact CZ-CD2 3.76Å; F999-Y1037 HydrophobicContact CZ-CD2 3.76Å; F999-Y1037 HydrophobicContact CZ-CE2 4.2Å; D1003-Y1037 HydrophobicContact CB-CD1 3.27Å; D1003-Y1037 HydrophobicContact CB-CE1 3.53Å; D1003-Y1037 HydrophobicContact CB-CG 4.31Å; V1004-Y1037 HydrophobicContact CG2-CE2 4.21Å; D1007-Y1037 WeakPolarHBondContact OD2-CE1 3.16Å; D1007-Y1037 PolarHBondContact OD2-OH 3.46Å; P1035-Y1037 HydrophobicContact CB-CE2 3.82Å; P1035-Y1037 WeakPolarHBondContact CB-OH 3.37Å
1038	S	77.3	Confident	78.8	Confident	101 Å²	101	67.6 Å²	67.6	71%	0.706	36%	0.358	S	S	*	.			trans	-111.5	-24.3	-175.2	62	0	0	0	0	114.2	F1120	S1038-F1120 WeakPolarHBondContact O-CE1 3.39Å
1039	R	85.9	Confident	80.7	Confident	104 Å²	104	63.6 Å²	63.6	39%	0.392	34%	0.336	S	S	.	.	S	Bend	trans	-68.2	149.6	171.6	-68.4	-158.4	-178.6	126.8	-16.9	110.8	D1003 P1059	D1003-R1039 WeakPolarHBondContact OD1-CD 3.09Å; D1003-R1039 VanDerWaalsContact OD1-CG 3.31Å; D1003-R1039 WeakPolarHBondContact OD1-CG 3.49Å; D1003-R1039 IonicContact OD1-CZ 3.65Å; D1003-R1039 IonicContact OD1-NE 2.71Å; D1003-R1039 IonicContact OD1-NH1 2.72Å; D1003-R1039 PolarHBondContact OD1-NH1 3.31Å; D1003-R1039 VanDerWaalsContact OD2-CB 3.24Å; D1003-R1039 WeakPolarHBondContact OD2-CB 3.3Å; D1003-R1039 WeakPolarHBondContact OD2-CG 3.26Å; D1003-R1039 PolarHBondContact OD2-N 2.83Å; R1039-P1059 WeakPolarHBondContact O-CD 3.3Å; R1039-P1059 WeakPolarHBondContact O-CG 3.23Å
1040	P	87.9	Confident	82.5	Confident	17 Å²	17	57.5 Å²	57.5	11%	0.11	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-70	155.6	179.3	29.1	-33.8	0	0	0	112.3	I1042 V1056 T1057 F1120	P1040-I1042 HydrophobicContact CG-CG1 4.47Å; P1040-V1056 HydrophobicContact CB-CG1 3.37Å; P1040-V1056 HydrophobicContact CG-CG1 3.59Å; P1040-T1057 CarbonylContact C-O 3.6Å; P1040-T1057 VanDerWaalsContact CA-O 3.22Å; P1040-T1057 WeakPolarHBondContact CA-O 3.33Å; P1040-T1057 WeakPolarHBondContact CB-O 3.37Å; P1040-F1120 HydrophobicContact CB-CD1 3.99Å; P1040-F1120 HydrophobicContact CB-CD2 3.79Å; P1040-F1120 HydrophobicContact CB-CE1 4.01Å; P1040-F1120 HydrophobicContact CB-CE2 3.81Å; P1040-F1120 HydrophobicContact CB-CG 3.88Å; P1040-F1120 HydrophobicContact CB-CZ 3.92Å; P1040-F1120 HydrophobicContact CG-CB 4.22Å; P1040-F1120 HydrophobicContact CG-CD1 3.82Å; P1040-F1120 HydrophobicContact CG-CD2 4.21Å; P1040-F1120 HydrophobicContact CG-CE1 4.24Å; P1040-F1120 HydrophobicContact CG-CG 3.79Å
1041	R	87.9	Confident	84.2	Confident	79 Å²	79	53 Å²	53	30%	0.298	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	132.1	155.9	-173.9	-178.7	-173.3	156.7	13.8	109	A997 T1057	A997-R1041 PolarHBondContact O-NH1 3Å; A997-R1041 PolarHBondContact O-NH2 3.41Å; A997-R1041 VanDerWaalsContact O-NH2 3.09Å; R1041-T1057 PolarHBondContact N-O 2.88Å; R1041-T1057 PolarHBondContact O-N 3.29Å; R1041-T1057 PolarHBondContact O-OG1 2.73Å
1042	I	90.6	Very high	85.8	Confident	28 Å²	28	48.9 Å²	48.9	14%	0.144	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	145.4	-178.7	-54.3	161.1	0	0	0	108.6	S721 H722 P1040 L1054 V1056 L1117	S721-I1042 WeakPolarHBondContact O-CB 3.4Å; S721-I1042 WeakPolarHBondContact O-CG2 3.43Å; H722-I1042 HydrophobicContact CB-CG2 4.29Å; P1040-I1042 HydrophobicContact CG-CG1 4.47Å; I1042-L1054 HydrophobicContact CG2-CD1 3.94Å; I1042-V1056 HydrophobicContact CG1-CG1 4.39Å; I1042-L1117 HydrophobicContact CD1-CD1 3.81Å; I1042-L1117 HydrophobicContact CD1-CD2 3.47Å; I1042-L1117 VanDerWaalsContact CD1-CD2 3.47Å; I1042-L1117 HydrophobicContact CD1-CG 4.3Å; I1042-L1117 HydrophobicContact CG1-CD2 3.59Å; I1042-L1117 HydrophobicContact CG2-CD2 4.19Å
1043	R	89.9	Confident	87.1	Confident	69 Å²	69	44.4 Å²	44.4	26%	0.26	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	122.3	164.6	-66.4	-179.7	177.1	174.5	-3.4	108.5	T720 L846 H1055	T720-R1043 WeakPolarHBondContact O-CA 3.36Å; L846-R1043 HydrophobicContact CD2-CB 4.09Å; R1043-H1055 PolarHBondContact N-O 3.24Å; R1043-H1055 PolarHBondContact O-N 2.94Å
1044	G	91.4	Very high	88	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	160.7	165.3	0	0	0	0	0	111.6	S719 T720 F1053	S719-G1044 WeakPolarHBondContact CA-O 3.34Å; S719-G1044 WeakPolarHBondContact CB-O 3.44Å; T720-G1044 PolarHBondContact N-O 3.48Å; T720-G1044 PolarHBondContact O-N 3.36Å; T720-G1044 WeakPolarHBondContact OG1-CA 3.3Å; T720-G1044 PolarHBondContact OG1-N 2.79Å; T720-G1044 PolarHBondContact OG1-O 3.47Å; G1044-F1053 CarbonylContact C-O 3.56Å; G1044-F1053 WeakPolarHBondContact CA-O 3.44Å
1045	A	91.6	Very high	88.6	Confident	10 Å²	10	37.4 Å²	37.4	8%	0.083	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	154.3	178.3	0	0	0	0	0	111.2	L846 V850 L1047 F1053	L846-A1045 HydrophobicContact CD1-CB 4.14Å; L846-A1045 HydrophobicContact CD2-CB 4.13Å; L846-A1045 HydrophobicContact CG-CB 4.09Å; V850-A1045 HydrophobicContact CG2-CB 3.61Å; A1045-L1047 HydrophobicContact CB-CD2 3.74Å; A1045-L1047 HydrophobicContact CB-CG 4.12Å; A1045-F1053 HydrophobicContact CB-CB 4.39Å; A1045-F1053 HydrophobicContact CB-CD1 4.17Å; A1045-F1053 PolarHBondContact N-O 3.25Å; A1045-F1053 PolarHBondContact O-N 3.47Å
1046	T	92.2	Very high	89.3	Confident	44 Å²	44	35.9 Å²	35.9	27%	0.27	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	116.4	159.8	-51.8	0	0	0	0	107.8	Q853 F1051	Q853-T1046 HydrophobicContact CG-CG2 4.15Å; T1046-F1051 WeakPolarHBondContact CA-O 3.29Å
1047	L	92.7	Very high	89.8	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	160.8	-169.4	-63.9	-178.6	0	0	0	112.7	L846 V850 Q853 F879 V884 V888 A1045 G1049 G1050 F1051 F1053 L1106	L846-L1047 HydrophobicContact CD1-CD2 3.86Å; V850-L1047 HydrophobicContact CG2-CD2 4.35Å; Q853-L1047 PolarHBondContact OE1-O 2.93Å; F879-L1047 HydrophobicContact CE1-CD1 3.59Å; F879-L1047 HydrophobicContact CE1-CD2 4.12Å; F879-L1047 HydrophobicContact CZ-CD1 3.98Å; F879-L1047 HydrophobicContact CZ-CD2 4.08Å; V884-L1047 HydrophobicContact CG1-CD1 4.36Å; V888-L1047 HydrophobicContact CG2-CB 4.21Å; V888-L1047 HydrophobicContact CG2-CD1 3.87Å; A1045-L1047 HydrophobicContact CB-CD2 3.74Å; A1045-L1047 HydrophobicContact CB-CG 4.12Å; L1047-G1049 PolarHBondContact O-N 3.12Å; L1047-G1050 PolarHBondContact O-N 3.13Å; L1047-F1051 HydrophobicContact CB-CB 4.45Å; L1047-F1051 PolarHBondContact N-O 3.5Å; L1047-F1051 PolarHBondContact O-N 2.93Å; L1047-F1053 HydrophobicContact CD1-CB 3.52Å; L1047-F1053 HydrophobicContact CD1-CD1 4.23Å; L1047-F1053 HydrophobicContact CD1-CD2 4.1Å; L1047-F1053 HydrophobicContact CD1-CG 3.72Å; L1047-F1053 HydrophobicContact CG-CB 3.89Å; L1047-F1053 HydrophobicContact CG-CG 4.47Å; L1047-L1106 HydrophobicContact CD1-CD1 3.99Å
1048	P	92.3	Very high	90	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.1	124.9	177.7	-32	37.3	0	0	0	112.8	Y849 V852 Q853 V888 A891 M892 F1051	Y849-P1048 WeakPolarHBondContact O-CD 3.46Å; Y849-P1048 WeakPolarHBondContact O-CG 3.28Å; V852-P1048 HydrophobicContact CB-CG 4.35Å; V852-P1048 HydrophobicContact CG1-CG 4.13Å; Q853-P1048 HydrophobicContact CB-CG 4.4Å; Q853-P1048 VanDerWaalsContact OE1-CA 3.26Å; V888-P1048 HydrophobicContact CG1-CB 4.23Å; V888-P1048 HydrophobicContact CG1-CG 4.05Å; A891-P1048 WeakPolarHBondContact CB-O 3.43Å; M892-P1048 HydrophobicContact CG-CB 3.53Å; M892-P1048 HydrophobicContact CG-CG 3.91Å; M892-P1048 HydrophobicContact SD-CB 4.44Å; M892-P1048 HydrophobicContact SD-CG 4.17Å; P1048-F1051 WeakPolarHBondContact O-CD2 3.25Å
1049	G	88.3	Confident	90.2	Very high	43 Å²	43	31.4 Å²	31.4	44%	0.443	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	99.4	3	-170.8	0	0	0	0	0	114.5	L1047	L1047-G1049 PolarHBondContact O-N 3.12Å
1050	G	89.1	Confident	89.5	Confident	24 Å²	24	28.3 Å²	28.3	25%	0.247	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.6	23.2	179.2	0	0	0	0	0	114.2	L1047	L1047-G1050 PolarHBondContact O-N 3.13Å
1051	F	93.1	Very high	88.2	Confident	14 Å²	14	28.9 Å²	28.9	6%	0.061	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	121.9	178.8	-59.1	-70.7	0	0	0	111.5	A891 T1046 L1047 P1048 F1053 L1106 C1107 L1108	A891-F1051 HydrophobicContact CB-CE2 4.04Å; T1046-F1051 WeakPolarHBondContact CA-O 3.29Å; L1047-F1051 HydrophobicContact CB-CB 4.45Å; L1047-F1051 PolarHBondContact N-O 3.5Å; L1047-F1051 PolarHBondContact O-N 2.93Å; P1048-F1051 WeakPolarHBondContact O-CD2 3.25Å; F1051-F1053 PolarHBondContact O-N 3.35Å; F1051-L1106 HydrophobicContact CB-CD1 3.51Å; F1051-L1106 HydrophobicContact CB-CG 3.89Å; F1051-L1106 HydrophobicContact CD1-CD2 4.49Å; F1051-L1106 HydrophobicContact CD1-CG 4.28Å; F1051-L1106 HydrophobicContact CG-CD1 4.15Å; F1051-L1106 HydrophobicContact CG-CD2 4.33Å; F1051-L1106 HydrophobicContact CG-CG 4.11Å; F1051-C1107 CarbonylContact C-O 3.53Å; F1051-C1107 WeakPolarHBondContact CA-O 3.47Å; F1051-L1108 HydrophobicContact CD1-CD2 3.63Å; F1051-L1108 HydrophobicContact CD1-CG 3.77Å; F1051-L1108 HydrophobicContact CE1-CD1 4.21Å; F1051-L1108 HydrophobicContact CE1-CD2 3.73Å; F1051-L1108 HydrophobicContact CE1-CG 3.76Å; F1051-L1108 HydrophobicContact CG-CD2 4.41Å
1052	H	93.1	Very high	86.6	Confident	36 Å²	36	26.6 Å²	26.6	17%	0.167	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	120.3	163.7	-58.2	-95.7	0	0	0	109	L1106 C1107 K1109 L1111	H1052-L1106 WeakPolarHBondContact O-CA 3.33Å; H1052-C1107 PolarHBondContact N-O 3.02Å; H1052-C1107 PolarHBondContact O-N 3.3Å; H1052-K1109 PolarHBondContact CD2-O 3.39Å; H1052-K1109 VanDerWaalsContact CD2-O 3.26Å; H1052-L1111 HydrophobicContact CB-CD1 4.14Å; H1052-L1111 HydrophobicContact CB-CG 4.07Å
1053	F	93.8	Very high	84.5	Confident	12 Å²	12	29.6 Å²	29.6	5%	0.053	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	135.5	-179.9	173.2	-108.5	0	0	0	110.2	L846 F879 V884 G1044 A1045 L1047 F1051 H1055 T1104 C1105 L1106	L846-F1053 HydrophobicContact CD1-CD1 4.42Å; L846-F1053 HydrophobicContact CD1-CE1 4.28Å; L846-F1053 HydrophobicContact CD2-CE1 4.3Å; F879-F1053 HydrophobicContact CD1-CZ 4.2Å; V884-F1053 HydrophobicContact CG1-CD2 4.1Å; V884-F1053 HydrophobicContact CG1-CE2 3.94Å; V884-F1053 HydrophobicContact CG2-CE2 4.32Å; G1044-F1053 CarbonylContact C-O 3.56Å; G1044-F1053 WeakPolarHBondContact CA-O 3.44Å; A1045-F1053 HydrophobicContact CB-CB 4.39Å; A1045-F1053 HydrophobicContact CB-CD1 4.17Å; A1045-F1053 PolarHBondContact N-O 3.25Å; A1045-F1053 PolarHBondContact O-N 3.47Å; L1047-F1053 HydrophobicContact CD1-CB 3.52Å; L1047-F1053 HydrophobicContact CD1-CD1 4.23Å; L1047-F1053 HydrophobicContact CD1-CD2 4.1Å; L1047-F1053 HydrophobicContact CD1-CG 3.72Å; L1047-F1053 HydrophobicContact CG-CB 3.89Å; L1047-F1053 HydrophobicContact CG-CG 4.47Å; F1051-F1053 PolarHBondContact O-N 3.35Å; F1053-H1055 HydrophobicContact CE1-CB 3.79Å; F1053-H1055 HydrophobicContact CE2-CB 4.2Å; F1053-H1055 HydrophobicContact CZ-CB 3.51Å; F1053-T1104 HydrophobicContact CE2-CG2 3.81Å; F1053-C1105 WeakPolarHBondContact CA-O 3.48Å; F1053-L1106 HydrophobicContact CB-CD1 3.93Å; F1053-L1106 HydrophobicContact CD2-CD1 4.02Å; F1053-L1106 HydrophobicContact CG-CD1 4.44Å
1054	L	93.8	Very high	82.2	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	127.1	170.8	177.8	67.5	0	0	0	109.6	I1042 V1056 L1103 T1104 C1105 L1111 V1113 Y1116	I1042-L1054 HydrophobicContact CG2-CD1 3.94Å; L1054-V1056 HydrophobicContact CD1-CG2 4.14Å; L1054-V1056 HydrophobicContact CD2-CG2 4.32Å; L1054-V1056 HydrophobicContact CG-CG2 4Å; L1054-L1103 HydrophobicContact CD2-CD1 4.25Å; L1054-T1104 CarbonylContact O-C 3.58Å; L1054-T1104 WeakPolarHBondContact O-CA 3.29Å; L1054-C1105 HydrophobicContact CB-CB 4.3Å; L1054-C1105 PolarHBondContact N-O 3Å; L1054-C1105 PolarHBondContact O-N 3.43Å; L1054-L1111 HydrophobicContact CB-CD1 3.66Å; L1054-V1113 HydrophobicContact CD1-CG1 3.95Å; L1054-V1113 HydrophobicContact CD2-CB 4.46Å; L1054-V1113 HydrophobicContact CD2-CG1 4.07Å; L1054-V1113 HydrophobicContact CD2-CG2 4.33Å; L1054-Y1116 HydrophobicContact CD2-CD2 4.14Å
1055	H	92.4	Very high	79.7	Confident	20 Å²	20	32.6 Å²	32.6	9%	0.093	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	120.9	178.2	-178.9	73.8	0	0	0	110	S880 R1043 F1053 T1057 T1104	S880-H1055 PolarHBondContact OG-CE1 2.86Å; R1043-H1055 PolarHBondContact N-O 3.24Å; R1043-H1055 PolarHBondContact O-N 2.94Å; F1053-H1055 HydrophobicContact CE1-CB 3.79Å; F1053-H1055 HydrophobicContact CE2-CB 4.2Å; F1053-H1055 HydrophobicContact CZ-CB 3.51Å; H1055-T1057 WeakPolarHBondContact NE2-CG2 3.45Å; H1055-T1104 PolarHBondContact ND1-OG1 2.69Å
1056	V	91.6	Very high	77.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	124.3	-175.1	-169	0	0	0	0	107.7	P1040 I1042 L1054 S1102 L1103 L1117 F1120	P1040-V1056 HydrophobicContact CB-CG1 3.37Å; P1040-V1056 HydrophobicContact CG-CG1 3.59Å; I1042-V1056 HydrophobicContact CG1-CG1 4.39Å; L1054-V1056 HydrophobicContact CD1-CG2 4.14Å; L1054-V1056 HydrophobicContact CD2-CG2 4.32Å; L1054-V1056 HydrophobicContact CG-CG2 4Å; V1056-S1102 CarbonylContact O-C 3.47Å; V1056-S1102 WeakPolarHBondContact O-CA 3.15Å; V1056-S1102 VanDerWaalsContact O-CB 3.25Å; V1056-S1102 WeakPolarHBondContact O-CB 3.11Å; V1056-L1103 HydrophobicContact CB-CD1 4.47Å; V1056-L1103 HydrophobicContact CB-CD2 3.81Å; V1056-L1103 HydrophobicContact CB-CG 3.78Å; V1056-L1103 HydrophobicContact CG1-CD2 4.37Å; V1056-L1103 HydrophobicContact CG2-CD1 3.92Å; V1056-L1103 HydrophobicContact CG2-CD2 3.88Å; V1056-L1103 HydrophobicContact CG2-CG 3.78Å; V1056-L1103 PolarHBondContact N-O 3.39Å; V1056-L1103 PolarHBondContact O-N 2.76Å; V1056-L1117 HydrophobicContact CG1-CD2 4.05Å; V1056-L1117 HydrophobicContact CG2-CD2 3.77Å; V1056-F1120 HydrophobicContact CG1-CD2 4.17Å
1057	T	88.3	Confident	74.7	Confident	36 Å²	36	39.8 Å²	39.8	22%	0.221	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	146.6	-173.1	45.3	0	0	0	0	111.9	P1040 R1041 H1055	P1040-T1057 CarbonylContact C-O 3.6Å; P1040-T1057 VanDerWaalsContact CA-O 3.22Å; P1040-T1057 WeakPolarHBondContact CA-O 3.33Å; P1040-T1057 WeakPolarHBondContact CB-O 3.37Å; R1041-T1057 PolarHBondContact N-O 2.88Å; R1041-T1057 PolarHBondContact O-N 3.29Å; R1041-T1057 PolarHBondContact O-OG1 2.73Å; H1055-T1057 WeakPolarHBondContact NE2-CG2 3.45Å
1058	K	86.3	Confident	72	Confident	110 Å²	110	49.3 Å²	49.3	48%	0.478	25%	0.252	S	S	.	.			trans	-60.8	141.5	168	-178.8	-176.1	169.7	-179.8	0	111.3	E1101 F1120	K1058-E1101 HydrophobicContact CB-CG 4.02Å; K1058-E1101 HydrophobicContact CD-CG 3.84Å; K1058-E1101 WeakPolarHBondContact CD-OE1 3.38Å; K1058-E1101 WeakPolarHBondContact CE-OE1 3.37Å; K1058-E1101 PolarHBondContact N-O 2.84Å; K1058-E1101 IonicContact NZ-OE1 3.19Å; K1058-E1101 PolarHBondContact NZ-OE1 2.88Å; K1058-F1120 HydrophobicContact CB-CE2 4.18Å; K1058-F1120 HydrophobicContact CB-CZ 3.89Å; K1058-F1120 HydrophobicContact CG-CZ 4.47Å
1059	P	82.4	Confident	69.4	Low	12 Å²	12	56.3 Å²	56.3	8%	0.078	28%	0.282	C	S	.	.			trans	-59.2	144	173.1	-22.5	33.9	0	0	0	112.5	F999 R1039	F999-P1059 HydrophobicContact CD1-CB 3.99Å; R1039-P1059 WeakPolarHBondContact O-CD 3.3Å; R1039-P1059 WeakPolarHBondContact O-CG 3.23Å
1060	S	71.3	Confident	67.1	Low	39 Å²	39	60 Å²	60	27%	0.273	29%	0.288	S	S	.	.			trans	-148.4	149.6	179	49.7	0	0	0	0	111.8	N998	N998-S1060 WeakPolarHBondContact CB-O 3.31Å
1061	P	59.4	Low	64.5	Low	30 Å²	30	66.1 Å²	66.1	20%	0.195	31%	0.314	C	S	.	.	S	Bend	trans	-63.7	-52.7	-177.6	20.2	-29	0	0	0	112.1	E993 W994 N998	E993-P1061 HydrophobicContact CB-CB 3.71Å; W994-P1061 HydrophobicContact CD2-CB 3.69Å; W994-P1061 HydrophobicContact CD2-CG 4.48Å; W994-P1061 HydrophobicContact CE3-CB 4.02Å; W994-P1061 HydrophobicContact CG-CB 4.12Å; W994-P1061 HydrophobicContact CH2-CB 4.4Å; W994-P1061 HydrophobicContact CH2-CG 4.2Å; W994-P1061 HydrophobicContact CZ2-CB 4.06Å; W994-P1061 HydrophobicContact CZ2-CG 3.96Å; W994-P1061 HydrophobicContact CZ3-CB 4.36Å; N998-P1061 PolarHBondContact ND2-O 2.89Å
1062	S	55.8	Low	61.8	Low	31 Å²	31	71.2 Å²	71.2	22%	0.217	35%	0.346	C	S	.	.			trans	-149.8	149.5	166	98.3	0	0	0	0	112.7	Q1064 T1065 S1066	S1062-Q1064 PolarHBondContact O-N 3.13Å; S1062-Q1064 PolarHBondContact OG-N 3.4Å; S1062-Q1064 VanDerWaalsContact OG-N 3.13Å; S1062-T1065 WeakPolarHBondContact CB-OG1 3.41Å; S1062-T1065 PolarHBondContact O-N 3.49Å; S1062-T1065 PolarHBondContact O-OG1 3.5Å; S1062-T1065 PolarHBondContact OG-N 3.46Å; S1062-T1065 VanDerWaalsContact OG-N 3.08Å; S1062-T1065 PolarHBondContact OG-OG1 3.41Å; S1062-S1066 PolarHBondContact O-N 2.99Å; S1062-S1066 PolarHBondContact O-OG 3.01Å; S1062-S1066 VanDerWaalsContact O-OG 3.08Å
1063	L	46.7	Very low	59.2	Low	91 Å²	91	71.7 Å²	71.7	48%	0.476	36%	0.357	S	S	.	.	H	α-helix	trans	-66	-14.8	172.5	-87.7	155.1	0	0	0	113.3	P876 R1067	P876-L1063 HydrophobicContact CB-CB 4.42Å; P876-L1063 HydrophobicContact CB-CD1 3.83Å; P876-L1063 HydrophobicContact CG-CD1 3.73Å; L1063-R1067 WeakPolarHBondContact O-CG 3.42Å; L1063-R1067 PolarHBondContact O-N 2.85Å; L1063-R1067 VanDerWaalsContact O-N 3.1Å
1064	Q	40.2	Very low	56.6	Low	108 Å²	108	75.6 Å²	75.6	51%	0.505	38%	0.383	S	S	.	.	H	α-helix	trans	-80	-40.1	173.4	-58.3	-160.5	-1.6	0	0	111.6	I874 S1062 R1067 R1068	I874-Q1064 PolarHBondContact O-NE2 3.48Å; S1062-Q1064 PolarHBondContact O-N 3.13Å; S1062-Q1064 PolarHBondContact OG-N 3.4Å; S1062-Q1064 VanDerWaalsContact OG-N 3.13Å; Q1064-R1067 PolarHBondContact O-N 2.78Å; Q1064-R1068 PolarHBondContact O-N 2.92Å; Q1064-R1068 VanDerWaalsContact O-N 3.15Å
1065	T	38.9	Very low	54.5	Low	24 Å²	24	84.8 Å²	84.8	15%	0.147	43%	0.426	C	S	.	.	H	α-helix	trans	-65.3	-42	170.1	-4.7	0	0	0	0	110	E993 S1062 R1067 R1068 F1069	E993-T1065 VanDerWaalsContact CD-OG1 3.28Å; E993-T1065 PolarHBondContact OE1-OG1 2.7Å; E993-T1065 WeakPolarHBondContact OE2-CB 3.39Å; E993-T1065 WeakPolarHBondContact OE2-CG2 3.25Å; E993-T1065 PolarHBondContact OE2-OG1 3.27Å; S1062-T1065 WeakPolarHBondContact CB-OG1 3.41Å; S1062-T1065 PolarHBondContact O-N 3.49Å; S1062-T1065 PolarHBondContact O-OG1 3.5Å; S1062-T1065 PolarHBondContact OG-N 3.46Å; S1062-T1065 VanDerWaalsContact OG-N 3.08Å; S1062-T1065 PolarHBondContact OG-OG1 3.41Å; T1065-R1067 VanDerWaalsContact C-N 3.32Å; T1065-R1067 PolarHBondContact O-N 3.24Å; T1065-R1068 WeakPolarHBondContact O-CB 3.41Å; T1065-R1068 PolarHBondContact O-N 2.83Å; T1065-F1069 HydrophobicContact CG2-CD2 4.4Å; T1065-F1069 HydrophobicContact CG2-CE2 4.07Å; T1065-F1069 VanDerWaalsContact O-CD2 3.31Å; T1065-F1069 WeakPolarHBondContact O-CD2 3.34Å; T1065-F1069 PolarHBondContact O-N 2.81Å
1066	S	42.4	Very low	52.7	Low	31 Å²	31	86.3 Å²	86.3	22%	0.217	44%	0.435	C	S	.	.	H	α-helix	trans	-56.3	-42.4	171.8	-56.4	0	0	0	0	112.5	S1062 R1068 F1069 Q1070	S1062-S1066 PolarHBondContact O-N 2.99Å; S1062-S1066 PolarHBondContact O-OG 3.01Å; S1062-S1066 VanDerWaalsContact O-OG 3.08Å; S1066-R1068 VanDerWaalsContact C-N 3.33Å; S1066-R1068 PolarHBondContact O-N 3.14Å; S1066-F1069 PolarHBondContact O-N 3.08Å; S1066-Q1070 VanDerWaalsContact O-CB 3.3Å; S1066-Q1070 WeakPolarHBondContact O-CB 3.49Å; S1066-Q1070 VanDerWaalsContact O-CG 3.24Å; S1066-Q1070 WeakPolarHBondContact O-CG 3.42Å; S1066-Q1070 PolarHBondContact O-N 3.31Å
1067	R	37.3	Very low	52	Low	174 Å²	174	88.7 Å²	88.7	66%	0.657	45%	0.446	S	S	*	.	H	α-helix	trans	-64.1	-32.3	173.9	-80.5	-178.1	178.3	-178.1	2	113.7	L1063 Q1064 T1065	L1063-R1067 WeakPolarHBondContact O-CG 3.42Å; L1063-R1067 PolarHBondContact O-N 2.85Å; L1063-R1067 VanDerWaalsContact O-N 3.1Å; Q1064-R1067 PolarHBondContact O-N 2.78Å; T1065-R1067 VanDerWaalsContact C-N 3.32Å; T1065-R1067 PolarHBondContact O-N 3.24Å
1068	R	35.9	Very low	51.9	Low	200 Å²	200	89.5 Å²	89.5	76%	0.755	45%	0.451	S	S	*	.	H	α-helix	trans	-71.8	-38.5	174.4	-75.8	-178.5	171	169.3	-1.6	112.2	Q1064 T1065 S1066	Q1064-R1068 PolarHBondContact O-N 2.92Å; Q1064-R1068 VanDerWaalsContact O-N 3.15Å; T1065-R1068 WeakPolarHBondContact O-CB 3.41Å; T1065-R1068 PolarHBondContact O-N 2.83Å; S1066-R1068 VanDerWaalsContact C-N 3.33Å; S1066-R1068 PolarHBondContact O-N 3.14Å
1069	F	38.3	Very low	52.1	Low	146 Å²	146	84.4 Å²	84.4	64%	0.64	43%	0.429	S	S	*	.	H	α-helix	trans	-78.3	-28.6	176.5	-74.5	-70.4	0	0	0	113.5	T1065 S1066 L1071 V1072 A1073	T1065-F1069 HydrophobicContact CG2-CD2 4.4Å; T1065-F1069 HydrophobicContact CG2-CE2 4.07Å; T1065-F1069 VanDerWaalsContact O-CD2 3.31Å; T1065-F1069 WeakPolarHBondContact O-CD2 3.34Å; T1065-F1069 PolarHBondContact O-N 2.81Å; S1066-F1069 PolarHBondContact O-N 3.08Å; F1069-L1071 PolarHBondContact O-N 3.18Å; F1069-L1071 VanDerWaalsContact O-N 3.17Å; F1069-V1072 PolarHBondContact O-N 2.88Å; F1069-A1073 PolarHBondContact O-N 2.61Å
1070	Q	38.2	Very low	52.5	Low	120 Å²	120	86.2 Å²	86.2	56%	0.561	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-17.4	172.2	-82.7	175.2	-23	0	0	114	S1066	S1066-Q1070 VanDerWaalsContact O-CB 3.3Å; S1066-Q1070 WeakPolarHBondContact O-CB 3.49Å; S1066-Q1070 VanDerWaalsContact O-CG 3.24Å; S1066-Q1070 WeakPolarHBondContact O-CG 3.42Å; S1066-Q1070 PolarHBondContact O-N 3.31Å
1071	L	35.8	Very low	53.5	Low	154 Å²	154	84.8 Å²	84.8	81%	0.806	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-4.7	171.5	-74	161.9	0	0	0	113.4	F1069	F1069-L1071 PolarHBondContact O-N 3.18Å; F1069-L1071 VanDerWaalsContact O-N 3.17Å
1072	V	34.8	Very low	54.9	Low	120 Å²	120	85.1 Å²	85.1	73%	0.727	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.5	-15.9	-175.6	-169.2	0	0	0	0	112.6	F1069	F1069-V1072 PolarHBondContact O-N 2.88Å
1073	A	38.8	Very low	56.5	Low	47 Å²	47	85.8 Å²	85.8	39%	0.388	45%	0.445	S	S	.	.	S	Bend	trans	-61.3	138.5	172.5	0	0	0	0	0	111.3	F1069	F1069-A1073 PolarHBondContact O-N 2.61Å
1074	P	40.2	Very low	58.5	Low	94 Å²	94	81.7 Å²	81.7	61%	0.61	43%	0.425	S	S	*	.			trans	-60.8	160.6	164.2	30.3	-34.8	0	0	0	109.6	D1076	P1074-D1076 PolarHBondContact O-N 2.79Å
1075	Q	49.2	Very low	60.7	Low	193 Å²	193	83.3 Å²	83.3	90%	0.902	43%	0.432	S	S	*	.			trans	-56.7	104	-176.3	-68.9	178.4	-24.9	0	0	111.7	E1077	Q1075-E1077 PolarHBondContact O-N 3.12Å
1076	D	55.7	Low	63	Low	52 Å²	52	85.4 Å²	85.4	28%	0.278	45%	0.448	S	S	.	.			trans	-54.7	131	171.8	-69.6	-26.1	0	0	0	109.4	P1074 V1078 Q1093	P1074-D1076 PolarHBondContact O-N 2.79Å; D1076-V1078 VanDerWaalsContact C-N 3.33Å; D1076-V1078 HydrophobicContact CB-CG2 4.46Å; D1076-V1078 PolarHBondContact O-N 3.49Å; D1076-Q1093 HydrophobicContact CB-CG 4.07Å; D1076-Q1093 PolarHBondContact OD2-NE2 3.25Å
1077	E	76.3	Confident	65.1	Low	50 Å²	50	84.2 Å²	84.2	23%	0.234	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	86.7	-177.4	-67.1	-179	132.3	0	0	109.3	Q1075 L1094 L1131 R1135	Q1075-E1077 PolarHBondContact O-N 3.12Å; E1077-L1094 HydrophobicContact CB-CB 4.31Å; E1077-L1094 HydrophobicContact CB-CD1 4.44Å; E1077-L1094 PolarHBondContact O-N 2.98Å; E1077-L1094 VanDerWaalsContact O-N 3.12Å; E1077-L1131 HydrophobicContact CB-CD1 4.05Å; E1077-L1131 HydrophobicContact CG-CD1 4.39Å; E1077-L1131 WeakPolarHBondContact OE2-CD2 3.2Å; E1077-R1135 IonicContact OE1-CZ 3.34Å; E1077-R1135 IonicContact OE1-NH1 3.75Å; E1077-R1135 PolarHBondContact OE1-NH1 3.12Å; E1077-R1135 IonicContact OE1-NH2 3.78Å; E1077-R1135 PolarHBondContact OE1-NH2 3.02Å
1078	V	85.7	Confident	67.7	Low	54 Å²	54	79 Å²	79	33%	0.327	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	124.4	176.7	-175.9	0	0	0	0	110.2	D1076 V1080 R1091 L1092 Q1093	D1076-V1078 VanDerWaalsContact C-N 3.33Å; D1076-V1078 HydrophobicContact CB-CG2 4.46Å; D1076-V1078 PolarHBondContact O-N 3.49Å; V1078-V1080 HydrophobicContact CG1-CG2 3.89Å; V1078-R1091 HydrophobicContact CG1-CG 3.87Å; V1078-L1092 WeakPolarHBondContact CA-O 3.34Å; V1078-Q1093 HydrophobicContact CG2-CB 4.24Å; V1078-Q1093 HydrophobicContact CG2-CG 3.96Å
1079	M	89.8	Confident	70.5	Confident	2 Å²	2	70 Å²	70	1%	0.01	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	135.6	172	-61.7	176.6	-77	0	0	109	R1091 L1092 L1094 L1130 L1131 Y1134	M1079-R1091 WeakPolarHBondContact O-CA 3.42Å; M1079-L1092 HydrophobicContact CE-CD2 3.66Å; M1079-L1092 PolarHBondContact N-O 3.05Å; M1079-L1092 PolarHBondContact O-N 3.32Å; M1079-L1094 HydrophobicContact CE-CD1 3.94Å; M1079-L1094 HydrophobicContact CE-CD2 4.37Å; M1079-L1094 HydrophobicContact CE-CG 3.99Å; M1079-L1130 HydrophobicContact CE-CD2 3.83Å; M1079-L1130 HydrophobicContact CE-CG 3.91Å; M1079-L1130 HydrophobicContact SD-CG 4Å; M1079-L1131 HydrophobicContact SD-CD1 4.42Å; M1079-Y1134 HydrophobicContact CB-CD1 4.09Å; M1079-Y1134 HydrophobicContact CB-CD2 4.2Å; M1079-Y1134 HydrophobicContact CB-CE1 3.96Å; M1079-Y1134 HydrophobicContact CB-CE2 4.09Å; M1079-Y1134 HydrophobicContact CB-CG 4.2Å; M1079-Y1134 HydrophobicContact CG-CD1 3.55Å; M1079-Y1134 HydrophobicContact CG-CD2 4.37Å; M1079-Y1134 HydrophobicContact CG-CE1 3.8Å; M1079-Y1134 HydrophobicContact CG-CG 3.85Å; M1079-Y1134 HydrophobicContact SD-CD1 4.09Å; M1079-Y1134 HydrophobicContact SD-CG 3.92Å
1080	V	91.9	Very high	73.1	Confident	50 Å²	50	63.1 Å²	63.1	30%	0.303	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	134.4	-178.5	-172.6	0	0	0	0	109.9	V1078 Y1089 F1090 R1091 Y1134	V1078-V1080 HydrophobicContact CG1-CG2 3.89Å; V1080-Y1089 HydrophobicContact CG1-CD2 4.18Å; V1080-Y1089 HydrophobicContact CG1-CE2 3.47Å; V1080-Y1089 VanDerWaalsContact CG1-CE2 3.47Å; V1080-F1090 CarbonylContact C-O 3.55Å; V1080-F1090 WeakPolarHBondContact CA-O 3.35Å; V1080-R1091 HydrophobicContact CG2-CB 4.45Å; V1080-R1091 HydrophobicContact CG2-CG 4.22Å; V1080-Y1134 PolarHBondContact N-OH 3.37Å; V1080-Y1134 PolarHBondContact O-OH 3.04Å
1081	T	91.5	Very high	75.8	Confident	9 Å²	9	59.2 Å²	59.2	6%	0.055	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	155.8	171	61.2	0	0	0	0	111.4	F1090 Y1134 P1140 L1142	T1081-F1090 PolarHBondContact N-O 2.81Å; T1081-F1090 PolarHBondContact O-N 2.67Å; T1081-Y1134 HydrophobicContact CG2-CE2 4Å; T1081-P1140 WeakPolarHBondContact CG2-O 3.39Å; T1081-L1142 HydrophobicContact CG2-CD1 4.19Å; T1081-L1142 HydrophobicContact CG2-CG 3.88Å; T1081-L1142 PolarHBondContact OG1-N 3.24Å
1082	G	89.7	Confident	78.5	Confident	38 Å²	38	51.9 Å²	51.9	39%	0.392	30%	0.304	S	S	.	.	S	Bend	trans	64.1	-167.2	-174.2	0	0	0	0	0	114	D1088	G1082-D1088 WeakPolarHBondContact CA-O 3.44Å; G1082-D1088 VanDerWaalsContact CA-OD2 3.24Å; G1082-D1088 WeakPolarHBondContact CA-OD2 3.26Å
1083	A	90.1	Very high	81.2	Confident	44 Å²	44	47.2 Å²	47.2	36%	0.364	27%	0.274	S	S	.	.			trans	-138.8	139.5	176.7	0	0	0	0	0	112.3	Q1085 S1086 G1087 D1088	A1083-Q1085 PolarHBondContact O-N 3.02Å; A1083-S1086 PolarHBondContact O-N 3.13Å; A1083-S1086 PolarHBondContact O-OG 3.25Å; A1083-G1087 PolarHBondContact O-N 2.99Å; A1083-D1088 PolarHBondContact N-OD1 2.94Å
1084	A	87.7	Confident	83.6	Confident	6 Å²	6	45 Å²	45	5%	0.05	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-25	-173.6	0	0	0	0	0	113.5	A883 A887 Y1089 L1106	A883-A1084 HydrophobicContact CB-CB 3.99Å; A883-A1084 WeakPolarHBondContact O-CB 3.46Å; A887-A1084 VanDerWaalsContact CB-C 3.5Å; A887-A1084 HydrophobicContact CB-CB 3.67Å; A887-A1084 VanDerWaalsContact CB-O 3.24Å; A887-A1084 WeakPolarHBondContact CB-O 3.23Å; A1084-Y1089 HydrophobicContact CB-CD1 4.5Å; A1084-Y1089 HydrophobicContact CB-CD2 4.24Å; A1084-Y1089 HydrophobicContact CB-CG 4.06Å; A1084-L1106 HydrophobicContact CB-CD2 3.94Å
1085	Q	87.6	Confident	85.7	Confident	141 Å²	141	41.3 Å²	41.3	66%	0.659	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-21.9	178.5	-67.7	172.7	-31.5	0	0	113.7	A887 A1083	A887-Q1085 HydrophobicContact CB-CG 4.22Å; A1083-Q1085 PolarHBondContact O-N 3.02Å
1086	S	86.6	Confident	87.2	Confident	68 Å²	68	36.2 Å²	36.2	48%	0.476	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-7.4	178	32.8	0	0	0	0	113.6	A1083 D1088	A1083-S1086 PolarHBondContact O-N 3.13Å; A1083-S1086 PolarHBondContact O-OG 3.25Å; S1086-D1088 WeakPolarHBondContact CB-OD1 3.44Å; S1086-D1088 PolarHBondContact OG-OD1 2.88Å
1087	G	86.6	Confident	88.5	Confident	6 Å²	6	40 Å²	40	6%	0.062	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	32.4	178.6	0	0	0	0	0	113.9	A1083 L1106 C1107 L1108	A1083-G1087 PolarHBondContact O-N 2.99Å; G1087-L1106 CarbonylContact C-O 3.53Å; G1087-C1107 VanDerWaalsContact O-CA 3.24Å; G1087-C1107 WeakPolarHBondContact O-CA 3.28Å; G1087-C1107 PolarHBondContact O-SG 3.27Å; G1087-L1108 PolarHBondContact O-N 2.97Å
1088	D	91.4	Very high	89	Confident	64 Å²	64	40.4 Å²	40.4	34%	0.342	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	21.9	178.4	67	-31.7	0	0	0	112.1	G1082 A1083 S1086 Y1143	G1082-D1088 WeakPolarHBondContact CA-O 3.44Å; G1082-D1088 VanDerWaalsContact CA-OD2 3.24Å; G1082-D1088 WeakPolarHBondContact CA-OD2 3.26Å; A1083-D1088 PolarHBondContact N-OD1 2.94Å; S1086-D1088 WeakPolarHBondContact CB-OD1 3.44Å; S1086-D1088 PolarHBondContact OG-OD1 2.88Å; D1088-Y1143 WeakPolarHBondContact O-CE2 3.42Å
1089	Y	94.1	Very high	89.1	Confident	13 Å²	13	40.9 Å²	40.9	5%	0.051	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	122.4	-167.5	-179	-99	0	0	0	113.9	D881 A883 V884 V1080 A1084 R1091 C1105 L1106 Y1143	D881-Y1089 PolarHBondContact OD2-OH 3.48Å; A883-Y1089 HydrophobicContact CB-CE2 4Å; V884-Y1089 HydrophobicContact CG2-CD1 4.35Å; V884-Y1089 HydrophobicContact CG2-CE1 4.19Å; V1080-Y1089 HydrophobicContact CG1-CD2 4.18Å; V1080-Y1089 HydrophobicContact CG1-CE2 3.47Å; V1080-Y1089 VanDerWaalsContact CG1-CE2 3.47Å; A1084-Y1089 HydrophobicContact CB-CD1 4.5Å; A1084-Y1089 HydrophobicContact CB-CD2 4.24Å; A1084-Y1089 HydrophobicContact CB-CG 4.06Å; Y1089-R1091 HydrophobicContact CE1-CB 3.94Å; Y1089-C1105 WeakPolarHBondContact O-CA 3.47Å; Y1089-L1106 HydrophobicContact CD1-CB 4.33Å; Y1089-L1106 PolarHBondContact N-O 3.37Å; Y1089-L1106 VanDerWaalsContact N-O 3.12Å; Y1089-L1106 PolarHBondContact O-N 3.39Å; Y1089-Y1143 PolarHBondContact O-OH 3.32Å
1090	F	94.7	Very high	89.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	125.2	173	-155	-57.1	0	0	0	109.6	V1080 T1081 L1092 L1103 Y1116 L1142 Y1143 F1146	V1080-F1090 CarbonylContact C-O 3.55Å; V1080-F1090 WeakPolarHBondContact CA-O 3.35Å; T1081-F1090 PolarHBondContact N-O 2.81Å; T1081-F1090 PolarHBondContact O-N 2.67Å; F1090-L1092 HydrophobicContact CD1-CB 4.48Å; F1090-L1092 HydrophobicContact CE1-CB 4.2Å; F1090-L1092 HydrophobicContact CE1-CD1 4.32Å; F1090-L1103 HydrophobicContact CE1-CB 4.42Å; F1090-Y1116 HydrophobicContact CE2-CD1 4.25Å; F1090-Y1116 AromaticContact CE2-CE1 3.98Å; F1090-Y1116 HydrophobicContact CE2-CE1 3.98Å; F1090-Y1116 HydrophobicContact CZ-CD1 4.37Å; F1090-L1142 HydrophobicContact CB-CB 3.88Å; F1090-L1142 HydrophobicContact CB-CD1 4.05Å; F1090-L1142 HydrophobicContact CD1-CB 3.94Å; F1090-L1142 HydrophobicContact CD1-CD1 3.57Å; F1090-L1142 HydrophobicContact CD1-CG 4.37Å; F1090-L1142 HydrophobicContact CD2-CB 3.83Å; F1090-L1142 HydrophobicContact CE1-CB 4.46Å; F1090-L1142 HydrophobicContact CE1-CD1 4.28Å; F1090-L1142 HydrophobicContact CE2-CB 4.35Å; F1090-L1142 HydrophobicContact CG-CB 3.62Å; F1090-L1142 HydrophobicContact CG-CD1 3.96Å; F1090-L1142 HydrophobicContact CG-CG 4.43Å; F1090-Y1143 HydrophobicContact CB-CD2 4.12Å; F1090-Y1143 HydrophobicContact CB-CE2 3.72Å; F1090-Y1143 AromaticContact CD2-CD1 3.96Å; F1090-Y1143 HydrophobicContact CD2-CD1 3.96Å; F1090-Y1143 HydrophobicContact CD2-CD2 4.01Å; F1090-Y1143 AromaticContact CD2-CE1 3.8Å; F1090-Y1143 HydrophobicContact CD2-CE1 3.8Å; F1090-Y1143 AromaticContact CD2-CE2 3.86Å; F1090-Y1143 HydrophobicContact CD2-CE2 3.86Å; F1090-Y1143 HydrophobicContact CD2-CG 4.05Å; F1090-Y1143 AromaticContact CD2-CZ 3.76Å; F1090-Y1143 HydrophobicContact CE2-CD1 4.41Å; F1090-Y1143 HydrophobicContact CE2-CE1 4.32Å; F1090-Y1143 HydrophobicContact CG-CE2 4.29Å; F1090-F1146 HydrophobicContact CE1-CE2 4.17Å; F1090-F1146 AromaticContact CE2-CD2 3.93Å; F1090-F1146 HydrophobicContact CE2-CD2 3.93Å; F1090-F1146 HydrophobicContact CE2-CE2 4.21Å; F1090-F1146 AromaticContact CZ-CD2 3.87Å; F1090-F1146 HydrophobicContact CZ-CD2 3.87Å; F1090-F1146 AromaticContact CZ-CE2 3.72Å; F1090-F1146 HydrophobicContact CZ-CE2 3.72Å
1091	R	93.6	Very high	89	Confident	39 Å²	39	40.7 Å²	40.7	15%	0.147	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.4	169.4	175.6	-177.6	-176	-73.2	-2.7	110	D881 V1078 M1079 V1080 Y1089 Q1093 L1103 T1104	D881-R1091 WeakPolarHBondContact OD2-CD 3.24Å; D881-R1091 IonicContact OD2-NE 3.71Å; D881-R1091 PolarHBondContact OD2-NE 3.41Å; V1078-R1091 HydrophobicContact CG1-CG 3.87Å; M1079-R1091 WeakPolarHBondContact O-CA 3.42Å; V1080-R1091 HydrophobicContact CG2-CB 4.45Å; V1080-R1091 HydrophobicContact CG2-CG 4.22Å; Y1089-R1091 HydrophobicContact CE1-CB 3.94Å; R1091-Q1093 VanDerWaalsContact CZ-OE1 3.31Å; R1091-L1103 CarbonylContact O-C 3.52Å; R1091-L1103 VanDerWaalsContact O-CA 3.27Å; R1091-L1103 WeakPolarHBondContact O-CA 3.25Å; R1091-T1104 PolarHBondContact N-O 3.5Å; R1091-T1104 PolarHBondContact O-N 2.82Å
1092	L	92.7	Very high	89	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135	173.5	-167.3	151.4	0	0	0	109.5	V1078 M1079 F1090 L1094 V1100 L1130 L1142 F1146	V1078-L1092 WeakPolarHBondContact CA-O 3.34Å; M1079-L1092 HydrophobicContact CE-CD2 3.66Å; M1079-L1092 PolarHBondContact N-O 3.05Å; M1079-L1092 PolarHBondContact O-N 3.32Å; F1090-L1092 HydrophobicContact CD1-CB 4.48Å; F1090-L1092 HydrophobicContact CE1-CB 4.2Å; F1090-L1092 HydrophobicContact CE1-CD1 4.32Å; L1092-L1094 HydrophobicContact CD2-CD2 3.69Å; L1092-L1094 HydrophobicContact CD2-CG 4.2Å; L1092-V1100 HydrophobicContact CD1-CG1 4.3Å; L1092-V1100 HydrophobicContact CD1-CG2 4.38Å; L1092-V1100 HydrophobicContact CD2-CG1 4.16Å; L1092-V1100 HydrophobicContact CD2-CG2 4.06Å; L1092-V1100 HydrophobicContact CG-CG1 4.1Å; L1092-L1130 HydrophobicContact CD1-CD2 4.34Å; L1092-L1142 HydrophobicContact CB-CD1 4.44Å; L1092-F1146 HydrophobicContact CD1-CE2 4.31Å; L1092-F1146 HydrophobicContact CD1-CZ 4.08Å
1093	Q	90.9	Very high	89.1	Confident	22 Å²	22	38.9 Å²	38.9	10%	0.103	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.5	-179.5	178.9	172.9	-11	0	0	110.5	D1076 V1078 R1091 E1101 S1102	D1076-Q1093 HydrophobicContact CB-CG 4.07Å; D1076-Q1093 PolarHBondContact OD2-NE2 3.25Å; V1078-Q1093 HydrophobicContact CG2-CB 4.24Å; V1078-Q1093 HydrophobicContact CG2-CG 3.96Å; R1091-Q1093 VanDerWaalsContact CZ-OE1 3.31Å; Q1093-E1101 PolarHBondContact O-N 3.3Å; Q1093-S1102 WeakPolarHBondContact CB-OG 3.36Å; Q1093-S1102 PolarHBondContact N-O 2.84Å; Q1093-S1102 PolarHBondContact O-N 2.9Å; Q1093-S1102 PolarHBondContact OE1-OG 2.92Å
1094	L	89.2	Confident	89.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	141.8	171.5	-57.7	179.5	0	0	0	110.6	E1077 M1079 L1092 L1099 V1100 Q1124 L1131	E1077-L1094 HydrophobicContact CB-CB 4.31Å; E1077-L1094 HydrophobicContact CB-CD1 4.44Å; E1077-L1094 PolarHBondContact O-N 2.98Å; E1077-L1094 VanDerWaalsContact O-N 3.12Å; M1079-L1094 HydrophobicContact CE-CD1 3.94Å; M1079-L1094 HydrophobicContact CE-CD2 4.37Å; M1079-L1094 HydrophobicContact CE-CG 3.99Å; L1092-L1094 HydrophobicContact CD2-CD2 3.69Å; L1092-L1094 HydrophobicContact CD2-CG 4.2Å; L1094-L1099 WeakPolarHBondContact CA-O 3.21Å; L1094-V1100 HydrophobicContact CD2-CG2 4.04Å; L1094-Q1124 HydrophobicContact CD1-CB 3.82Å; L1094-Q1124 HydrophobicContact CD1-CG 4.13Å; L1094-Q1124 HydrophobicContact CD2-CB 4.27Å; L1094-L1131 HydrophobicContact CD1-CB 4.31Å; L1094-L1131 HydrophobicContact CD1-CD1 4.31Å; L1094-L1131 HydrophobicContact CD1-CD2 4.45Å
1095	S	85.1	Confident	89.6	Confident	16 Å²	16	36.6 Å²	36.6	11%	0.112	20%	0.203	C	C	.	.			trans	-69.3	168.4	166	59.2	0	0	0	0	111.9	L1097 Q1098 L1099 E1101	S1095-L1097 PolarHBondContact O-N 2.87Å; S1095-L1097 PolarHBondContact OG-N 3.07Å; S1095-Q1098 WeakPolarHBondContact O-CA 3.47Å; S1095-Q1098 PolarHBondContact O-N 2.95Å; S1095-L1099 PolarHBondContact N-O 3.49Å; S1095-L1099 PolarHBondContact OG-N 2.95Å; S1095-L1099 VanDerWaalsContact OG-N 3.13Å; S1095-L1099 PolarHBondContact OG-O 3.31Å; S1095-E1101 WeakPolarHBondContact CA-OE2 3.34Å; S1095-E1101 WeakPolarHBondContact CB-OE2 3.46Å
1096	A	80.5	Confident	89.9	Confident	87 Å²	87	29.9 Å²	29.9	72%	0.719	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-10.3	169.2	0	0	0	0	0	114.9
1097	L	83.4	Confident	90.2	Very high	131 Å²	131	27.2 Å²	27.2	69%	0.686	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.5	14.5	171.6	-62.3	179	0	0	0	112.7	S1095 L1099 H1123	S1095-L1097 PolarHBondContact O-N 2.87Å; S1095-L1097 PolarHBondContact OG-N 3.07Å; L1097-L1099 HydrophobicContact CB-CD1 4.39Å; L1097-L1099 HydrophobicContact CB-CG 4.22Å; L1097-L1099 PolarHBondContact O-N 2.65Å; L1097-H1123 PolarHBondContact O-CD2 2.83Å
1098	Q	86.1	Confident	90.5	Very high	58 Å²	58	31.5 Å²	31.5	27%	0.271	17%	0.174	S	C	.	.	S	Bend	trans	54.1	21.5	-175.9	-66.2	-170.7	-6.5	0	0	115	S1095 H1123 Q1124	S1095-Q1098 WeakPolarHBondContact O-CA 3.47Å; S1095-Q1098 PolarHBondContact O-N 2.95Å; Q1098-H1123 WeakPolarHBondContact O-CA 3.27Å; Q1098-H1123 PolarHBondContact O-CD2 2.78Å; Q1098-Q1124 HydrophobicContact CB-CG 3.81Å; Q1098-Q1124 HydrophobicContact CG-CG 4.3Å; Q1098-Q1124 PolarHBondContact O-N 3.37Å
1099	L	88.6	Confident	90.4	Very high	64 Å²	64	35.8 Å²	35.8	34%	0.335	19%	0.19	S	C	.	.	B	Isolated β-bridge	trans	-88.6	140.4	169.5	-54.4	176.6	0	0	0	110.2	L1094 S1095 L1097 E1101 R1122 H1123	L1094-L1099 WeakPolarHBondContact CA-O 3.21Å; S1095-L1099 PolarHBondContact N-O 3.49Å; S1095-L1099 PolarHBondContact OG-N 2.95Å; S1095-L1099 VanDerWaalsContact OG-N 3.13Å; S1095-L1099 PolarHBondContact OG-O 3.31Å; L1097-L1099 HydrophobicContact CB-CD1 4.39Å; L1097-L1099 HydrophobicContact CB-CG 4.22Å; L1097-L1099 PolarHBondContact O-N 2.65Å; L1099-E1101 PolarHBondContact O-N 3.02Å; L1099-R1122 CarbonylContact C-O 3.53Å; L1099-R1122 VanDerWaalsContact CA-O 3.3Å; L1099-R1122 WeakPolarHBondContact CA-O 3.32Å; L1099-H1123 HydrophobicContact CD2-CB 3.89Å
1100	V	90.6	Very high	90.2	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	116.4	174.2	-176.5	0	0	0	0	110.7	L1092 L1094 L1119 G1121 R1122 L1127	L1092-V1100 HydrophobicContact CD1-CG1 4.3Å; L1092-V1100 HydrophobicContact CD1-CG2 4.38Å; L1092-V1100 HydrophobicContact CD2-CG1 4.16Å; L1092-V1100 HydrophobicContact CD2-CG2 4.06Å; L1092-V1100 HydrophobicContact CG-CG1 4.1Å; L1094-V1100 HydrophobicContact CD2-CG2 4.04Å; V1100-L1119 WeakPolarHBondContact CB-O 3.36Å; V1100-L1119 WeakPolarHBondContact CG2-O 3.46Å; V1100-G1121 PolarHBondContact O-N 3.25Å; V1100-R1122 PolarHBondContact N-O 3.46Å; V1100-L1127 HydrophobicContact CG2-CD1 3.82Å
1101	E	89.4	Confident	89.9	Confident	46 Å²	46	40.7 Å²	40.7	22%	0.215	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	-22.5	-174.5	-176.1	161.3	-144.7	0	0	113.4	K1058 Q1093 S1095 L1099 F1120	K1058-E1101 HydrophobicContact CB-CG 4.02Å; K1058-E1101 HydrophobicContact CD-CG 3.84Å; K1058-E1101 WeakPolarHBondContact CD-OE1 3.38Å; K1058-E1101 WeakPolarHBondContact CE-OE1 3.37Å; K1058-E1101 PolarHBondContact N-O 2.84Å; K1058-E1101 IonicContact NZ-OE1 3.19Å; K1058-E1101 PolarHBondContact NZ-OE1 2.88Å; Q1093-E1101 PolarHBondContact O-N 3.3Å; S1095-E1101 WeakPolarHBondContact CA-OE2 3.34Å; S1095-E1101 WeakPolarHBondContact CB-OE2 3.46Å; L1099-E1101 PolarHBondContact O-N 3.02Å; E1101-F1120 WeakPolarHBondContact O-CE2 3.27Å
1102	S	90.3	Very high	89.8	Confident	10 Å²	10	40.1 Å²	40.1	7%	0.07	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	157	159.1	64.8	0	0	0	0	113	V1056 Q1093	V1056-S1102 CarbonylContact O-C 3.47Å; V1056-S1102 WeakPolarHBondContact O-CA 3.15Å; V1056-S1102 VanDerWaalsContact O-CB 3.25Å; V1056-S1102 WeakPolarHBondContact O-CB 3.11Å; Q1093-S1102 WeakPolarHBondContact CB-OG 3.36Å; Q1093-S1102 PolarHBondContact N-O 2.84Å; Q1093-S1102 PolarHBondContact O-N 2.9Å; Q1093-S1102 PolarHBondContact OE1-OG 2.92Å
1103	L	93	Very high	89.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	153.1	164.6	70.2	111.3	0	0	0	110.6	L1054 V1056 F1090 R1091	L1054-L1103 HydrophobicContact CD2-CD1 4.25Å; V1056-L1103 HydrophobicContact CB-CD1 4.47Å; V1056-L1103 HydrophobicContact CB-CD2 3.81Å; V1056-L1103 HydrophobicContact CB-CG 3.78Å; V1056-L1103 HydrophobicContact CG1-CD2 4.37Å; V1056-L1103 HydrophobicContact CG2-CD1 3.92Å; V1056-L1103 HydrophobicContact CG2-CD2 3.88Å; V1056-L1103 HydrophobicContact CG2-CG 3.78Å; V1056-L1103 PolarHBondContact N-O 3.39Å; V1056-L1103 PolarHBondContact O-N 2.76Å; F1090-L1103 HydrophobicContact CE1-CB 4.42Å; R1091-L1103 CarbonylContact O-C 3.52Å; R1091-L1103 VanDerWaalsContact O-CA 3.27Å; R1091-L1103 WeakPolarHBondContact O-CA 3.25Å
1104	T	93.4	Very high	89.4	Confident	1 Å²	1	41 Å²	41	1%	0.006	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	116.8	177.3	-54.3	0	0	0	0	109.1	V884 F1053 L1054 H1055 R1091	V884-T1104 HydrophobicContact CG2-CG2 4.23Å; F1053-T1104 HydrophobicContact CE2-CG2 3.81Å; L1054-T1104 CarbonylContact O-C 3.58Å; L1054-T1104 WeakPolarHBondContact O-CA 3.29Å; H1055-T1104 PolarHBondContact ND1-OG1 2.69Å; R1091-T1104 PolarHBondContact N-O 3.5Å; R1091-T1104 PolarHBondContact O-N 2.82Å
1105	C	94.2	Very high	89.5	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	139.3	-177.1	-60.7	0	0	0	0	109.1	F1053 L1054 Y1089 L1111 Y1143	F1053-C1105 WeakPolarHBondContact CA-O 3.48Å; L1054-C1105 HydrophobicContact CB-CB 4.3Å; L1054-C1105 PolarHBondContact N-O 3Å; L1054-C1105 PolarHBondContact O-N 3.43Å; Y1089-C1105 WeakPolarHBondContact O-CA 3.47Å; C1105-L1111 HydrophobicContact CB-CD1 3.96Å; C1105-L1111 HydrophobicContact CB-CD2 4.22Å; C1105-Y1143 WeakPolarHBondContact CB-OH 3.31Å
1106	L	93.9	Very high	89.9	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	107.2	172.7	-172.5	78.7	0	0	0	108.7	V884 A887 L1047 F1051 H1052 F1053 A1084 G1087 Y1089 Y1143	V884-L1106 HydrophobicContact CG1-CD1 4.23Å; V884-L1106 HydrophobicContact CG1-CD2 4.25Å; V884-L1106 HydrophobicContact CG2-CB 4.44Å; V884-L1106 HydrophobicContact CG2-CD2 4.34Å; A887-L1106 HydrophobicContact CB-CD2 4.13Å; L1047-L1106 HydrophobicContact CD1-CD1 3.99Å; F1051-L1106 HydrophobicContact CB-CD1 3.51Å; F1051-L1106 HydrophobicContact CB-CG 3.89Å; F1051-L1106 HydrophobicContact CD1-CD2 4.49Å; F1051-L1106 HydrophobicContact CD1-CG 4.28Å; F1051-L1106 HydrophobicContact CG-CD1 4.15Å; F1051-L1106 HydrophobicContact CG-CD2 4.33Å; F1051-L1106 HydrophobicContact CG-CG 4.11Å; H1052-L1106 WeakPolarHBondContact O-CA 3.33Å; F1053-L1106 HydrophobicContact CB-CD1 3.93Å; F1053-L1106 HydrophobicContact CD2-CD1 4.02Å; F1053-L1106 HydrophobicContact CG-CD1 4.44Å; A1084-L1106 HydrophobicContact CB-CD2 3.94Å; G1087-L1106 CarbonylContact C-O 3.53Å; Y1089-L1106 HydrophobicContact CD1-CB 4.33Å; Y1089-L1106 PolarHBondContact N-O 3.37Å; Y1089-L1106 VanDerWaalsContact N-O 3.12Å; Y1089-L1106 PolarHBondContact O-N 3.39Å; L1106-Y1143 PolarHBondContact N-OH 3.33Å
1107	C	93.2	Very high	90.3	Very high	13 Å²	13	38.8 Å²	38.8	9%	0.088	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	150.6	-174	-164.8	0	0	0	0	113.3	F1051 H1052 G1087 K1109 L1111 Y1143	F1051-C1107 CarbonylContact C-O 3.53Å; F1051-C1107 WeakPolarHBondContact CA-O 3.47Å; H1052-C1107 PolarHBondContact N-O 3.02Å; H1052-C1107 PolarHBondContact O-N 3.3Å; G1087-C1107 VanDerWaalsContact O-CA 3.24Å; G1087-C1107 WeakPolarHBondContact O-CA 3.28Å; G1087-C1107 PolarHBondContact O-SG 3.27Å; C1107-K1109 PolarHBondContact O-N 2.93Å; C1107-K1109 PolarHBondContact SG-N 2.83Å; C1107-K1109 VanDerWaalsContact SG-N 3.42Å; C1107-L1111 HydrophobicContact CB-CD2 3.7Å; C1107-Y1143 HydrophobicContact CB-CE1 4.47Å
1108	L	91.6	Very high	90.6	Very high	95 Å²	95	33.2 Å²	33.2	50%	0.497	18%	0.18	S	C	.	.	S	Bend	trans	-82.3	4.3	170.1	-73.6	167.4	0	0	0	113.5	F1051 G1087	F1051-L1108 HydrophobicContact CD1-CD2 3.63Å; F1051-L1108 HydrophobicContact CD1-CG 3.77Å; F1051-L1108 HydrophobicContact CE1-CD1 4.21Å; F1051-L1108 HydrophobicContact CE1-CD2 3.73Å; F1051-L1108 HydrophobicContact CE1-CG 3.76Å; F1051-L1108 HydrophobicContact CG-CD2 4.41Å; G1087-L1108 PolarHBondContact O-N 2.97Å
1109	K	90.4	Very high	90.8	Very high	154 Å²	154	30.5 Å²	30.5	67%	0.67	17%	0.167	S	C	*	.	S	Bend	trans	-117.1	152.8	172.8	-62.1	-179.4	-178.2	177.7	0	109.6	H1052 C1107 L1111	H1052-K1109 PolarHBondContact CD2-O 3.39Å; H1052-K1109 VanDerWaalsContact CD2-O 3.26Å; C1107-K1109 PolarHBondContact O-N 2.93Å; C1107-K1109 PolarHBondContact SG-N 2.83Å; C1107-K1109 VanDerWaalsContact SG-N 3.42Å; K1109-L1111 PolarHBondContact O-N 2.82Å
1110	P	88.8	Confident	90.9	Very high	98 Å²	98	29.1 Å²	29.1	64%	0.636	16%	0.159	S	C	*	.			trans	-51	139.5	168	-27.8	35.7	0	0	0	111.6
1111	L	90.1	Very high	90.8	Very high	19 Å²	19	30.9 Å²	30.9	10%	0.099	18%	0.177	C	C	.	.			trans	-98.1	132.9	-177.2	-64.8	172.3	0	0	0	109.4	H1052 L1054 C1105 C1107 K1109 V1113 Y1116 Y1143	H1052-L1111 HydrophobicContact CB-CD1 4.14Å; H1052-L1111 HydrophobicContact CB-CG 4.07Å; L1054-L1111 HydrophobicContact CB-CD1 3.66Å; C1105-L1111 HydrophobicContact CB-CD1 3.96Å; C1105-L1111 HydrophobicContact CB-CD2 4.22Å; C1107-L1111 HydrophobicContact CB-CD2 3.7Å; K1109-L1111 PolarHBondContact O-N 2.82Å; L1111-V1113 HydrophobicContact CB-CG2 4.33Å; L1111-V1113 WeakPolarHBondContact O-CG2 3.44Å; L1111-V1113 PolarHBondContact O-N 2.89Å; L1111-Y1116 HydrophobicContact CB-CE2 4.24Å; L1111-Y1116 HydrophobicContact CD2-CE2 4.15Å; L1111-Y1143 HydrophobicContact CD2-CE1 3.67Å
1112	P	89.7	Confident	90.7	Very high	27 Å²	27	31 Å²	31	18%	0.175	18%	0.175	C	C	.	.			trans	-73.5	79.5	171.2	29.5	-35.9	0	0	0	111	E628 G1114 N1115 Y1116	E628-P1112 HydrophobicContact CB-CB 3.78Å; E628-P1112 VanDerWaalsContact CD-CA 3.43Å; E628-P1112 VanDerWaalsContact CD-CB 3.49Å; E628-P1112 HydrophobicContact CG-CB 4.27Å; E628-P1112 VanDerWaalsContact OE1-C 3.28Å; E628-P1112 WeakPolarHBondContact OE1-CA 2.94Å; E628-P1112 VanDerWaalsContact OE2-CA 3.26Å; E628-P1112 WeakPolarHBondContact OE2-CA 3.47Å; E628-P1112 WeakPolarHBondContact OE2-CB 3.39Å; P1112-G1114 VanDerWaalsContact C-N 3.3Å; P1112-G1114 PolarHBondContact O-N 2.7Å; P1112-N1115 HydrophobicContact CB-CB 4.23Å; P1112-N1115 WeakPolarHBondContact O-CB 3.14Å; P1112-N1115 PolarHBondContact O-N 3.39Å; P1112-Y1116 HydrophobicContact CG-CD2 4.49Å; P1112-Y1116 HydrophobicContact CG-CE1 4.29Å; P1112-Y1116 HydrophobicContact CG-CE2 3.76Å; P1112-Y1116 WeakPolarHBondContact O-CD2 3.38Å; P1112-Y1116 PolarHBondContact O-N 2.94Å
1113	V	89.4	Confident	90.6	Very high	23 Å²	23	33.2 Å²	33.2	14%	0.139	19%	0.185	C	C	.	.	H	α-helix	trans	-59	-42.4	-169.9	-179.7	0	0	0	0	110.7	E628 H722 L1054 L1111 N1115 Y1116 L1117	E628-V1113 PolarHBondContact OE1-N 2.87Å; H722-V1113 HydrophobicContact CB-CG1 4.24Å; L1054-V1113 HydrophobicContact CD1-CG1 3.95Å; L1054-V1113 HydrophobicContact CD2-CB 4.46Å; L1054-V1113 HydrophobicContact CD2-CG1 4.07Å; L1054-V1113 HydrophobicContact CD2-CG2 4.33Å; L1111-V1113 HydrophobicContact CB-CG2 4.33Å; L1111-V1113 WeakPolarHBondContact O-CG2 3.44Å; L1111-V1113 PolarHBondContact O-N 2.89Å; V1113-N1115 VanDerWaalsContact C-N 3.32Å; V1113-N1115 PolarHBondContact O-N 3.14Å; V1113-Y1116 PolarHBondContact O-N 2.61Å; V1113-L1117 HydrophobicContact CG1-CD1 3.9Å; V1113-L1117 HydrophobicContact CG1-CG 4.01Å; V1113-L1117 VanDerWaalsContact O-CG 3.31Å; V1113-L1117 WeakPolarHBondContact O-CG 3.42Å; V1113-L1117 PolarHBondContact O-N 2.87Å
1114	G	87.4	Confident	90.3	Very high	18 Å²	18	33.5 Å²	33.5	19%	0.186	19%	0.186	C	C	.	.	H	α-helix	trans	-57.3	-45.6	179.2	0	0	0	0	0	112.2	Q625 P1112 Y1116 L1117 S1118	Q625-G1114 PolarHBondContact NE2-O 3.29Å; P1112-G1114 VanDerWaalsContact C-N 3.3Å; P1112-G1114 PolarHBondContact O-N 2.7Å; G1114-Y1116 PolarHBondContact O-N 3.16Å; G1114-L1117 PolarHBondContact O-N 3.02Å; G1114-S1118 PolarHBondContact O-N 3Å
1115	N	91.3	Very high	89.9	Confident	7 Å²	7	38.8 Å²	38.8	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-60.4	-48.1	177.1	-66.9	-4.4	0	0	0	111	E628 P1112 V1113 L1117 S1118 F1155	E628-N1115 PolarHBondContact N-OD1 2.81Å; E628-N1115 PolarHBondContact O-ND2 3.08Å; P1112-N1115 HydrophobicContact CB-CB 4.23Å; P1112-N1115 WeakPolarHBondContact O-CB 3.14Å; P1112-N1115 PolarHBondContact O-N 3.39Å; V1113-N1115 VanDerWaalsContact C-N 3.32Å; V1113-N1115 PolarHBondContact O-N 3.14Å; N1115-L1117 PolarHBondContact O-N 2.83Å; N1115-S1118 PolarHBondContact O-N 3.11Å; N1115-S1118 PolarHBondContact O-OG 3.37Å; N1115-F1155 HydrophobicContact CB-CB 4.45Å; N1115-F1155 HydrophobicContact CB-CD1 4.37Å; N1115-F1155 HydrophobicContact CB-CD2 3.61Å; N1115-F1155 HydrophobicContact CB-CE2 3.86Å; N1115-F1155 HydrophobicContact CB-CG 3.9Å; N1115-F1155 HydrophobicContact CB-CZ 4.35Å; N1115-F1155 VanDerWaalsContact CG-CD2 3.42Å
1116	Y	92.1	Very high	89.3	Confident	9 Å²	9	39.5 Å²	39.5	4%	0.035	21%	0.214	C	C	.	.	H	α-helix	trans	-71	-30.7	-176.9	-58.5	-35.7	0	0	0	114.1	L1054 F1090 L1111 P1112 V1113 G1114 S1118 L1119 Y1143 F1146	L1054-Y1116 HydrophobicContact CD2-CD2 4.14Å; F1090-Y1116 HydrophobicContact CE2-CD1 4.25Å; F1090-Y1116 AromaticContact CE2-CE1 3.98Å; F1090-Y1116 HydrophobicContact CE2-CE1 3.98Å; F1090-Y1116 HydrophobicContact CZ-CD1 4.37Å; L1111-Y1116 HydrophobicContact CB-CE2 4.24Å; L1111-Y1116 HydrophobicContact CD2-CE2 4.15Å; P1112-Y1116 HydrophobicContact CG-CD2 4.49Å; P1112-Y1116 HydrophobicContact CG-CE1 4.29Å; P1112-Y1116 HydrophobicContact CG-CE2 3.76Å; P1112-Y1116 WeakPolarHBondContact O-CD2 3.38Å; P1112-Y1116 PolarHBondContact O-N 2.94Å; V1113-Y1116 PolarHBondContact O-N 2.61Å; G1114-Y1116 PolarHBondContact O-N 3.16Å; Y1116-S1118 PolarHBondContact O-N 3.25Å; Y1116-L1119 HydrophobicContact CD1-CD1 4.09Å; Y1116-L1119 WeakPolarHBondContact O-CB 3.42Å; Y1116-L1119 PolarHBondContact O-N 3.23Å; Y1116-Y1143 HydrophobicContact CE2-CE1 4.37Å; Y1116-Y1143 WeakPolarHBondContact OH-CD1 3.46Å; Y1116-F1146 HydrophobicContact CE1-CB 4.23Å
1117	L	90	Very high	88.9	Confident	39 Å²	39	39.6 Å²	39.6	20%	0.204	22%	0.215	C	C	.	.	H	α-helix	trans	-62.1	-33.7	173.4	-69.9	178.5	0	0	0	112.2	I1042 V1056 V1113 G1114 N1115 L1119 F1120	I1042-L1117 HydrophobicContact CD1-CD1 3.81Å; I1042-L1117 HydrophobicContact CD1-CD2 3.47Å; I1042-L1117 VanDerWaalsContact CD1-CD2 3.47Å; I1042-L1117 HydrophobicContact CD1-CG 4.3Å; I1042-L1117 HydrophobicContact CG1-CD2 3.59Å; I1042-L1117 HydrophobicContact CG2-CD2 4.19Å; V1056-L1117 HydrophobicContact CG1-CD2 4.05Å; V1056-L1117 HydrophobicContact CG2-CD2 3.77Å; V1113-L1117 HydrophobicContact CG1-CD1 3.9Å; V1113-L1117 HydrophobicContact CG1-CG 4.01Å; V1113-L1117 VanDerWaalsContact O-CG 3.31Å; V1113-L1117 WeakPolarHBondContact O-CG 3.42Å; V1113-L1117 PolarHBondContact O-N 2.87Å; G1114-L1117 PolarHBondContact O-N 3.02Å; N1115-L1117 PolarHBondContact O-N 2.83Å; L1117-L1119 PolarHBondContact O-N 3.11Å; L1117-F1120 PolarHBondContact O-N 3.33Å
1118	S	88.9	Confident	88.4	Confident	15 Å²	15	40 Å²	40	11%	0.105	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-15.2	-179.9	79.4	0	0	0	0	114.7	G1114 N1115 Y1116 R1122 F1155	G1114-S1118 PolarHBondContact O-N 3Å; N1115-S1118 PolarHBondContact O-N 3.11Å; N1115-S1118 PolarHBondContact O-OG 3.37Å; Y1116-S1118 PolarHBondContact O-N 3.25Å; S1118-R1122 VanDerWaalsContact O-CG 3.29Å; S1118-R1122 WeakPolarHBondContact O-CG 3.45Å; S1118-R1122 PolarHBondContact O-NE 2.95Å; S1118-F1155 WeakPolarHBondContact OG-CA 3.29Å; S1118-F1155 VanDerWaalsContact OG-CD1 3.23Å; S1118-F1155 WeakPolarHBondContact OG-CD1 3.32Å
1119	L	90.4	Very high	88	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-24.9	175.5	-66	173.9	0	0	0	112.7	V1100 Y1116 L1117 G1121 R1122 L1127 F1146 F1155	V1100-L1119 WeakPolarHBondContact CB-O 3.36Å; V1100-L1119 WeakPolarHBondContact CG2-O 3.46Å; Y1116-L1119 HydrophobicContact CD1-CD1 4.09Å; Y1116-L1119 WeakPolarHBondContact O-CB 3.42Å; Y1116-L1119 PolarHBondContact O-N 3.23Å; L1117-L1119 PolarHBondContact O-N 3.11Å; L1119-G1121 PolarHBondContact O-N 2.84Å; L1119-R1122 WeakPolarHBondContact O-CB 3.34Å; L1119-R1122 VanDerWaalsContact O-CG 3.32Å; L1119-R1122 WeakPolarHBondContact O-CG 3.42Å; L1119-R1122 PolarHBondContact O-N 3.06Å; L1119-L1127 HydrophobicContact CD2-CD1 4.23Å; L1119-L1127 HydrophobicContact CD2-CD2 3.59Å; L1119-F1146 HydrophobicContact CD1-CD1 4.12Å; L1119-F1146 HydrophobicContact CD1-CD2 4.08Å; L1119-F1146 HydrophobicContact CD1-CE1 3.88Å; L1119-F1146 HydrophobicContact CD1-CE2 3.83Å; L1119-F1146 HydrophobicContact CD1-CG 4.24Å; L1119-F1146 HydrophobicContact CD1-CZ 3.73Å; L1119-F1146 HydrophobicContact CD2-CD1 3.97Å; L1119-F1146 HydrophobicContact CD2-CE1 3.57Å; L1119-F1146 HydrophobicContact CD2-CZ 4.12Å; L1119-F1146 HydrophobicContact CG-CE1 4.41Å; L1119-F1155 HydrophobicContact CD2-CE1 3.89Å; L1119-F1155 HydrophobicContact CG-CE1 4.31Å
1120	F	90.3	Very high	87.9	Confident	35 Å²	35	33.1 Å²	33.1	15%	0.154	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	136.6	-177.1	-177.8	-89.6	0	0	0	111.4	S1038 P1040 V1056 K1058 E1101 L1117 R1122	S1038-F1120 WeakPolarHBondContact O-CE1 3.39Å; P1040-F1120 HydrophobicContact CB-CD1 3.99Å; P1040-F1120 HydrophobicContact CB-CD2 3.79Å; P1040-F1120 HydrophobicContact CB-CE1 4.01Å; P1040-F1120 HydrophobicContact CB-CE2 3.81Å; P1040-F1120 HydrophobicContact CB-CG 3.88Å; P1040-F1120 HydrophobicContact CB-CZ 3.92Å; P1040-F1120 HydrophobicContact CG-CB 4.22Å; P1040-F1120 HydrophobicContact CG-CD1 3.82Å; P1040-F1120 HydrophobicContact CG-CD2 4.21Å; P1040-F1120 HydrophobicContact CG-CE1 4.24Å; P1040-F1120 HydrophobicContact CG-CG 3.79Å; V1056-F1120 HydrophobicContact CG1-CD2 4.17Å; K1058-F1120 HydrophobicContact CB-CE2 4.18Å; K1058-F1120 HydrophobicContact CB-CZ 3.89Å; K1058-F1120 HydrophobicContact CG-CZ 4.47Å; E1101-F1120 WeakPolarHBondContact O-CE2 3.27Å; L1117-F1120 PolarHBondContact O-N 3.33Å; F1120-R1122 PolarHBondContact O-N 2.95Å
1121	G	88.3	Confident	87.9	Confident	39 Å²	39	28.7 Å²	28.7	40%	0.402	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	5.2	-177.9	0	0	0	0	0	115.5	V1100 L1119	V1100-G1121 PolarHBondContact O-N 3.25Å; L1119-G1121 PolarHBondContact O-N 2.84Å
1122	R	88.2	Confident	87.7	Confident	48 Å²	48	31 Å²	31	18%	0.181	17%	0.173	C	C	.	.			trans	-81.3	149.1	173.4	-55.4	-53.8	-173.2	175.9	5	111.2	L1099 V1100 S1118 L1119 F1120 L1126 L1127 I1154	L1099-R1122 CarbonylContact C-O 3.53Å; L1099-R1122 VanDerWaalsContact CA-O 3.3Å; L1099-R1122 WeakPolarHBondContact CA-O 3.32Å; V1100-R1122 PolarHBondContact N-O 3.46Å; S1118-R1122 VanDerWaalsContact O-CG 3.29Å; S1118-R1122 WeakPolarHBondContact O-CG 3.45Å; S1118-R1122 PolarHBondContact O-NE 2.95Å; L1119-R1122 WeakPolarHBondContact O-CB 3.34Å; L1119-R1122 VanDerWaalsContact O-CG 3.32Å; L1119-R1122 WeakPolarHBondContact O-CG 3.42Å; L1119-R1122 PolarHBondContact O-N 3.06Å; F1120-R1122 PolarHBondContact O-N 2.95Å; R1122-L1126 HydrophobicContact CB-CD2 4.3Å; R1122-L1127 HydrophobicContact CB-CD2 4.14Å; R1122-L1127 HydrophobicContact CB-CG 4.46Å; R1122-I1154 HydrophobicContact CG-CG2 4.49Å
1123	H	88.3	Confident	87.7	Confident	58 Å²	58	34.1 Å²	34.1	27%	0.269	18%	0.181	S	C	.	.	B	Isolated β-bridge	trans	-81.1	142.1	175.2	-166.7	-121.2	0	0	0	111.2	L1097 Q1098 L1099 E1125 L1126 L1127	L1097-H1123 PolarHBondContact O-CD2 2.83Å; Q1098-H1123 WeakPolarHBondContact O-CA 3.27Å; Q1098-H1123 PolarHBondContact O-CD2 2.78Å; L1099-H1123 HydrophobicContact CD2-CB 3.89Å; H1123-E1125 IonicContact CE1-OE2 3.27Å; H1123-E1125 PolarHBondContact CE1-OE2 3.16Å; H1123-E1125 IonicContact ND1-OE2 4Å; H1123-E1125 PolarHBondContact ND1-OE2 3.26Å; H1123-E1125 VanDerWaalsContact ND1-OE2 3.13Å; H1123-E1125 PolarHBondContact O-N 2.91Å; H1123-E1125 VanDerWaalsContact O-N 3.16Å; H1123-L1126 VanDerWaalsContact O-CB 3.23Å; H1123-L1126 WeakPolarHBondContact O-CB 3.39Å; H1123-L1126 PolarHBondContact O-N 3.24Å; H1123-L1127 PolarHBondContact O-N 3.06Å
1124	Q	86.7	Confident	87.7	Confident	5 Å²	5	36.4 Å²	36.4	2%	0.023	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-28	-175.8	69.5	83.6	10.7	0	0	114.5	L1094 Q1098 L1127 Q1129 L1130 L1131	L1094-Q1124 HydrophobicContact CD1-CB 3.82Å; L1094-Q1124 HydrophobicContact CD1-CG 4.13Å; L1094-Q1124 HydrophobicContact CD2-CB 4.27Å; Q1098-Q1124 HydrophobicContact CB-CG 3.81Å; Q1098-Q1124 HydrophobicContact CG-CG 4.3Å; Q1098-Q1124 PolarHBondContact O-N 3.37Å; Q1124-L1127 CarbonylContact O-C 3.55Å; Q1124-L1127 PolarHBondContact O-N 2.84Å; Q1124-Q1129 WeakPolarHBondContact O-CA 3.42Å; Q1124-Q1129 PolarHBondContact O-N 3Å; Q1124-Q1129 VanDerWaalsContact O-N 3.17Å; Q1124-L1130 PolarHBondContact O-N 2.84Å; Q1124-L1130 VanDerWaalsContact O-N 3.16Å; Q1124-L1131 HydrophobicContact CB-CB 4.46Å; Q1124-L1131 HydrophobicContact CG-CB 4.14Å
1125	E	84.6	Confident	87.7	Confident	113 Å²	113	43 Å²	43	53%	0.528	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-39.3	173.1	-65.7	-178.7	131.8	0	0	112.5	H1123 L1127 G1128 Q1129	H1123-E1125 IonicContact CE1-OE2 3.27Å; H1123-E1125 PolarHBondContact CE1-OE2 3.16Å; H1123-E1125 IonicContact ND1-OE2 4Å; H1123-E1125 PolarHBondContact ND1-OE2 3.26Å; H1123-E1125 VanDerWaalsContact ND1-OE2 3.13Å; H1123-E1125 PolarHBondContact O-N 2.91Å; H1123-E1125 VanDerWaalsContact O-N 3.16Å; E1125-L1127 PolarHBondContact O-N 3.04Å; E1125-G1128 WeakPolarHBondContact O-CA 3.26Å; E1125-G1128 PolarHBondContact O-N 3.12Å; E1125-Q1129 PolarHBondContact O-N 3.38Å
1126	L	82.6	Confident	87.6	Confident	14 Å²	14	48.9 Å²	48.9	7%	0.073	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-32.3	177.2	-164.9	70.1	0	0	0	110.7	R1122 H1123 G1128 I1154 F1159 L1181	R1122-L1126 HydrophobicContact CB-CD2 4.3Å; H1123-L1126 VanDerWaalsContact O-CB 3.23Å; H1123-L1126 WeakPolarHBondContact O-CB 3.39Å; H1123-L1126 PolarHBondContact O-N 3.24Å; L1126-G1128 PolarHBondContact O-N 3.17Å; L1126-I1154 VanDerWaalsContact O-CD1 3.25Å; L1126-I1154 WeakPolarHBondContact O-CD1 3.37Å; L1126-F1159 HydrophobicContact CD1-CE1 4.12Å; L1126-F1159 HydrophobicContact CD1-CZ 4Å; L1126-F1159 HydrophobicContact CD2-CE1 3.95Å; L1126-F1159 HydrophobicContact CG-CE1 4.11Å; L1126-F1159 HydrophobicContact CG-CZ 4.33Å; L1126-L1181 HydrophobicContact CD1-CD2 4.05Å
1127	L	84.9	Confident	87.4	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.01	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	22.2	170.8	-50.8	-175.3	0	0	0	112.6	V1100 L1119 R1122 H1123 Q1124 E1125 L1130 F1145 I1154	V1100-L1127 HydrophobicContact CG2-CD1 3.82Å; L1119-L1127 HydrophobicContact CD2-CD1 4.23Å; L1119-L1127 HydrophobicContact CD2-CD2 3.59Å; R1122-L1127 HydrophobicContact CB-CD2 4.14Å; R1122-L1127 HydrophobicContact CB-CG 4.46Å; H1123-L1127 PolarHBondContact O-N 3.06Å; Q1124-L1127 CarbonylContact O-C 3.55Å; Q1124-L1127 PolarHBondContact O-N 2.84Å; E1125-L1127 PolarHBondContact O-N 3.04Å; L1127-L1130 HydrophobicContact CB-CB 4Å; L1127-L1130 HydrophobicContact CB-CD2 4.25Å; L1127-L1130 HydrophobicContact CD1-CD2 3.94Å; L1127-F1145 WeakPolarHBondContact O-CZ 3.32Å; L1127-I1154 HydrophobicContact CD2-CD1 3.92Å; L1127-I1154 HydrophobicContact CD2-CG2 4.25Å
1128	G	82.9	Confident	87.3	Confident	23 Å²	23	54.7 Å²	54.7	24%	0.237	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	23.5	173.3	0	0	0	0	0	115.6	E1125 L1126 R1133	E1125-G1128 WeakPolarHBondContact O-CA 3.26Å; E1125-G1128 PolarHBondContact O-N 3.12Å; L1126-G1128 PolarHBondContact O-N 3.17Å; G1128-R1133 PolarHBondContact O-NE 3.49Å; G1128-R1133 PolarHBondContact O-NH2 3.42Å
1129	Q	83.7	Confident	87.3	Confident	103 Å²	103	54.3 Å²	54.3	48%	0.481	28%	0.279	S	S	.	.	S	Bend	trans	65.3	48.4	-168.1	-52.9	175	-62	0	0	111.6	Q1124 E1125 L1131 D1132 R1133	Q1124-Q1129 WeakPolarHBondContact O-CA 3.42Å; Q1124-Q1129 PolarHBondContact O-N 3Å; Q1124-Q1129 VanDerWaalsContact O-N 3.17Å; E1125-Q1129 PolarHBondContact O-N 3.38Å; Q1129-L1131 VanDerWaalsContact C-N 3.28Å; Q1129-L1131 PolarHBondContact O-N 3.16Å; Q1129-D1132 PolarHBondContact O-N 3.05Å; Q1129-R1133 WeakPolarHBondContact O-CG 3.41Å; Q1129-R1133 PolarHBondContact O-N 2.96Å; Q1129-R1133 VanDerWaalsContact O-N 3.1Å
1130	L	87.4	Confident	87	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-53.8	-43.3	-171.9	176.4	57.9	0	0	0	112.6	M1079 L1092 Q1124 L1127 R1133 Y1134 V1139 L1142 F1145 F1146	M1079-L1130 HydrophobicContact CE-CD2 3.83Å; M1079-L1130 HydrophobicContact CE-CG 3.91Å; M1079-L1130 HydrophobicContact SD-CG 4Å; L1092-L1130 HydrophobicContact CD1-CD2 4.34Å; Q1124-L1130 PolarHBondContact O-N 2.84Å; Q1124-L1130 VanDerWaalsContact O-N 3.16Å; L1127-L1130 HydrophobicContact CB-CB 4Å; L1127-L1130 HydrophobicContact CB-CD2 4.25Å; L1127-L1130 HydrophobicContact CD1-CD2 3.94Å; L1130-R1133 PolarHBondContact O-N 2.6Å; L1130-Y1134 VanDerWaalsContact O-CB 3.32Å; L1130-Y1134 WeakPolarHBondContact O-CB 3.37Å; L1130-Y1134 PolarHBondContact O-N 2.77Å; L1130-V1139 HydrophobicContact CD1-CG1 4.32Å; L1130-V1139 HydrophobicContact CD1-CG2 4.23Å; L1130-L1142 HydrophobicContact CD1-CD2 3.88Å; L1130-L1142 HydrophobicContact CD2-CD2 4.46Å; L1130-F1145 HydrophobicContact CD1-CD1 3.99Å; L1130-F1145 HydrophobicContact CD1-CE1 3.73Å; L1130-F1145 HydrophobicContact CD1-CZ 4.06Å; L1130-F1146 HydrophobicContact CD2-CZ 3.98Å
1131	L	88.1	Confident	87	Confident	5 Å²	5	59.7 Å²	59.7	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-62	-46.9	-178.1	177.3	66.5	0	0	0	112.4	E1077 M1079 L1094 Q1124 Q1129 Y1134 R1135	E1077-L1131 HydrophobicContact CB-CD1 4.05Å; E1077-L1131 HydrophobicContact CG-CD1 4.39Å; E1077-L1131 WeakPolarHBondContact OE2-CD2 3.2Å; M1079-L1131 HydrophobicContact SD-CD1 4.42Å; L1094-L1131 HydrophobicContact CD1-CB 4.31Å; L1094-L1131 HydrophobicContact CD1-CD1 4.31Å; L1094-L1131 HydrophobicContact CD1-CD2 4.45Å; Q1124-L1131 HydrophobicContact CB-CB 4.46Å; Q1124-L1131 HydrophobicContact CG-CB 4.14Å; Q1129-L1131 VanDerWaalsContact C-N 3.28Å; Q1129-L1131 PolarHBondContact O-N 3.16Å; L1131-Y1134 PolarHBondContact O-N 2.99Å; L1131-R1135 WeakPolarHBondContact O-CB 3.16Å; L1131-R1135 WeakPolarHBondContact O-CG 3.45Å; L1131-R1135 PolarHBondContact O-N 3.17Å
1132	D	87.1	Confident	87.2	Confident	67 Å²	67	57.8 Å²	57.8	36%	0.358	30%	0.296	S	S	.	.	H	α-helix	trans	-70.4	-39.5	-178.6	-63.1	-41	0	0	0	111	Q1129 R1135 L1136	Q1129-D1132 PolarHBondContact O-N 3.05Å; D1132-R1135 PolarHBondContact O-N 2.92Å; D1132-L1136 WeakPolarHBondContact O-CB 3.21Å; D1132-L1136 VanDerWaalsContact O-CG 3.25Å; D1132-L1136 WeakPolarHBondContact O-CG 3.18Å; D1132-L1136 PolarHBondContact O-N 2.79Å
1133	R	88.2	Confident	87.3	Confident	94 Å²	94	57 Å²	57	36%	0.355	29%	0.293	S	S	.	.	H	α-helix	trans	-65.2	-40.1	175.1	-66.1	-170.7	-164.2	-165	10	112.3	G1128 Q1129 L1130 L1136 G1137 L1138 V1139	G1128-R1133 PolarHBondContact O-NE 3.49Å; G1128-R1133 PolarHBondContact O-NH2 3.42Å; Q1129-R1133 WeakPolarHBondContact O-CG 3.41Å; Q1129-R1133 PolarHBondContact O-N 2.96Å; Q1129-R1133 VanDerWaalsContact O-N 3.1Å; L1130-R1133 PolarHBondContact O-N 2.6Å; R1133-L1136 CarbonylContact O-C 3.57Å; R1133-L1136 PolarHBondContact O-N 3.34Å; R1133-G1137 PolarHBondContact O-N 3.43Å; R1133-L1138 HydrophobicContact CB-CB 4.15Å; R1133-L1138 WeakPolarHBondContact O-CB 3.33Å; R1133-L1138 PolarHBondContact O-N 3.36Å; R1133-V1139 HydrophobicContact CB-CG2 3.69Å
1134	Y	89.4	Confident	87.3	Confident	71 Å²	71	57.1 Å²	57.1	28%	0.278	30%	0.301	S	S	.	.	H	α-helix	trans	-63.2	-46.3	174.3	-179	-98.5	0	0	0	111.2	M1079 V1080 T1081 L1130 L1131 L1136 G1137 V1139	M1079-Y1134 HydrophobicContact CB-CD1 4.09Å; M1079-Y1134 HydrophobicContact CB-CD2 4.2Å; M1079-Y1134 HydrophobicContact CB-CE1 3.96Å; M1079-Y1134 HydrophobicContact CB-CE2 4.09Å; M1079-Y1134 HydrophobicContact CB-CG 4.2Å; M1079-Y1134 HydrophobicContact CG-CD1 3.55Å; M1079-Y1134 HydrophobicContact CG-CD2 4.37Å; M1079-Y1134 HydrophobicContact CG-CE1 3.8Å; M1079-Y1134 HydrophobicContact CG-CG 3.85Å; M1079-Y1134 HydrophobicContact SD-CD1 4.09Å; M1079-Y1134 HydrophobicContact SD-CG 3.92Å; V1080-Y1134 PolarHBondContact N-OH 3.37Å; V1080-Y1134 PolarHBondContact O-OH 3.04Å; T1081-Y1134 HydrophobicContact CG2-CE2 4Å; L1130-Y1134 VanDerWaalsContact O-CB 3.32Å; L1130-Y1134 WeakPolarHBondContact O-CB 3.37Å; L1130-Y1134 PolarHBondContact O-N 2.77Å; L1131-Y1134 PolarHBondContact O-N 2.99Å; Y1134-L1136 PolarHBondContact O-N 2.69Å; Y1134-G1137 PolarHBondContact O-N 2.93Å; Y1134-V1139 HydrophobicContact CD2-CB 4.44Å
1135	R	88.1	Confident	87.5	Confident	155 Å²	155	57.1 Å²	57.1	59%	0.585	30%	0.301	S	S	*	.	H	α-helix	trans	-58.3	-32.6	173.7	-78.5	175.8	159.2	140.5	6.3	113.8	E1077 L1131 D1132 G1137	E1077-R1135 IonicContact OE1-CZ 3.34Å; E1077-R1135 IonicContact OE1-NH1 3.75Å; E1077-R1135 PolarHBondContact OE1-NH1 3.12Å; E1077-R1135 IonicContact OE1-NH2 3.78Å; E1077-R1135 PolarHBondContact OE1-NH2 3.02Å; L1131-R1135 WeakPolarHBondContact O-CB 3.16Å; L1131-R1135 WeakPolarHBondContact O-CG 3.45Å; L1131-R1135 PolarHBondContact O-N 3.17Å; D1132-R1135 PolarHBondContact O-N 2.92Å; R1135-G1137 VanDerWaalsContact C-N 3.33Å
1136	L	90.4	Very high	87.7	Confident	131 Å²	131	51.9 Å²	51.9	69%	0.686	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	2	176	-68.6	169.7	0	0	0	114	D1132 R1133 Y1134 L1138	D1132-L1136 WeakPolarHBondContact O-CB 3.21Å; D1132-L1136 VanDerWaalsContact O-CG 3.25Å; D1132-L1136 WeakPolarHBondContact O-CG 3.18Å; D1132-L1136 PolarHBondContact O-N 2.79Å; R1133-L1136 CarbonylContact O-C 3.57Å; R1133-L1136 PolarHBondContact O-N 3.34Å; Y1134-L1136 PolarHBondContact O-N 2.69Å; L1136-L1138 HydrophobicContact CB-CD1 4.04Å; L1136-L1138 HydrophobicContact CB-CG 3.95Å; L1136-L1138 HydrophobicContact CD1-CD1 4.27Å; L1136-L1138 PolarHBondContact O-N 2.77Å
1137	G	86.6	Confident	87.9	Confident	56 Å²	56	53.1 Å²	53.1	58%	0.577	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	13.5	-177.8	0	0	0	0	0	114.7	R1133 Y1134 R1135 V1139	R1133-G1137 PolarHBondContact O-N 3.43Å; Y1134-G1137 PolarHBondContact O-N 2.93Å; R1135-G1137 VanDerWaalsContact C-N 3.33Å; G1137-V1139 VanDerWaalsContact C-N 3.29Å
1138	L	88.1	Confident	87.9	Confident	115 Å²	115	57.5 Å²	57.5	60%	0.602	31%	0.305	S	S	*	.			trans	-83.2	-4.4	-179.7	-57.1	175	0	0	0	113.1	R1133 L1136	R1133-L1138 HydrophobicContact CB-CB 4.15Å; R1133-L1138 WeakPolarHBondContact O-CB 3.33Å; R1133-L1138 PolarHBondContact O-N 3.36Å; L1136-L1138 HydrophobicContact CB-CD1 4.04Å; L1136-L1138 HydrophobicContact CB-CG 3.95Å; L1136-L1138 HydrophobicContact CD1-CD1 4.27Å; L1136-L1138 PolarHBondContact O-N 2.77Å
1139	V	88.5	Confident	87.9	Confident	6 Å²	6	62.1 Å²	62.1	4%	0.036	32%	0.315	C	S	.	.			trans	-122.3	82	175	-176	0	0	0	0	108	L1130 R1133 Y1134 G1137 D1141 L1142 F1145	L1130-V1139 HydrophobicContact CD1-CG1 4.32Å; L1130-V1139 HydrophobicContact CD1-CG2 4.23Å; R1133-V1139 HydrophobicContact CB-CG2 3.69Å; Y1134-V1139 HydrophobicContact CD2-CB 4.44Å; G1137-V1139 VanDerWaalsContact C-N 3.29Å; V1139-D1141 VanDerWaalsContact C-N 3.3Å; V1139-L1142 HydrophobicContact CG1-CD2 3.86Å; V1139-L1142 HydrophobicContact CG1-CG 4.36Å; V1139-F1145 HydrophobicContact CG1-CB 3.98Å; V1139-F1145 HydrophobicContact CG1-CD2 4.18Å; V1139-F1145 HydrophobicContact CG1-CG 4.08Å; V1139-F1145 HydrophobicContact CG2-CD2 3.78Å; V1139-F1145 HydrophobicContact CG2-CE2 3.95Å; V1139-F1145 HydrophobicContact CG2-CG 4.43Å
1140	P	84.9	Confident	87.6	Confident	107 Å²	107	59 Å²	59	70%	0.695	31%	0.311	S	S	*	.	S	Bend	trans	-72.4	-26.7	179.6	29.9	-35.2	0	0	0	112.4	T1081	T1081-P1140 WeakPolarHBondContact CG2-O 3.39Å
1141	D	90.3	Very high	87.5	Confident	41 Å²	41	59.3 Å²	59.3	22%	0.219	31%	0.313	C	S	.	.			trans	-144.8	134.9	178.7	162.6	44.1	0	0	0	109.7	V1139 Y1143 S1144 F1145	V1139-D1141 VanDerWaalsContact C-N 3.3Å; D1141-Y1143 WeakPolarHBondContact OD1-CB 3.34Å; D1141-Y1143 WeakPolarHBondContact OD1-CD2 3.38Å; D1141-Y1143 PolarHBondContact OD1-N 2.85Å; D1141-S1144 WeakPolarHBondContact OD2-CB 3.39Å; D1141-S1144 PolarHBondContact OD2-N 3.41Å; D1141-S1144 PolarHBondContact OD2-OG 2.85Å; D1141-F1145 WeakPolarHBondContact O-CB 3.42Å; D1141-F1145 PolarHBondContact O-N 3.11Å
1142	L	91.6	Very high	87.4	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.315	C	S	.	.	S	Bend	trans	-78.7	-28.7	177.4	-71.9	165.2	0	0	0	112.6	T1081 F1090 L1092 L1130 V1139 F1145 F1146	T1081-L1142 HydrophobicContact CG2-CD1 4.19Å; T1081-L1142 HydrophobicContact CG2-CG 3.88Å; T1081-L1142 PolarHBondContact OG1-N 3.24Å; F1090-L1142 HydrophobicContact CB-CB 3.88Å; F1090-L1142 HydrophobicContact CB-CD1 4.05Å; F1090-L1142 HydrophobicContact CD1-CB 3.94Å; F1090-L1142 HydrophobicContact CD1-CD1 3.57Å; F1090-L1142 HydrophobicContact CD1-CG 4.37Å; F1090-L1142 HydrophobicContact CD2-CB 3.83Å; F1090-L1142 HydrophobicContact CE1-CB 4.46Å; F1090-L1142 HydrophobicContact CE1-CD1 4.28Å; F1090-L1142 HydrophobicContact CE2-CB 4.35Å; F1090-L1142 HydrophobicContact CG-CB 3.62Å; F1090-L1142 HydrophobicContact CG-CD1 3.96Å; F1090-L1142 HydrophobicContact CG-CG 4.43Å; L1092-L1142 HydrophobicContact CB-CD1 4.44Å; L1130-L1142 HydrophobicContact CD1-CD2 3.88Å; L1130-L1142 HydrophobicContact CD2-CD2 4.46Å; V1139-L1142 HydrophobicContact CG1-CD2 3.86Å; V1139-L1142 HydrophobicContact CG1-CG 4.36Å; L1142-F1145 PolarHBondContact O-N 3.01Å; L1142-F1146 HydrophobicContact CB-CD2 4.35Å; L1142-F1146 HydrophobicContact CB-CE2 4.19Å; L1142-F1146 HydrophobicContact CD2-CE2 4.03Å; L1142-F1146 HydrophobicContact CD2-CZ 4.45Å; L1142-F1146 WeakPolarHBondContact O-CD2 3.49Å; L1142-F1146 PolarHBondContact O-N 2.94Å
1143	Y	91.1	Very high	87.3	Confident	30 Å²	30	56.8 Å²	56.8	12%	0.118	30%	0.299	C	S	.	.	H	α-helix	trans	-62.8	-55.6	177.9	-72.5	-78.6	0	0	0	111	D1088 Y1089 F1090 C1105 L1106 C1107 L1111 Y1116 D1141 F1145 F1146 T1147	D1088-Y1143 WeakPolarHBondContact O-CE2 3.42Å; Y1089-Y1143 PolarHBondContact O-OH 3.32Å; F1090-Y1143 HydrophobicContact CB-CD2 4.12Å; F1090-Y1143 HydrophobicContact CB-CE2 3.72Å; F1090-Y1143 AromaticContact CD2-CD1 3.96Å; F1090-Y1143 HydrophobicContact CD2-CD1 3.96Å; F1090-Y1143 HydrophobicContact CD2-CD2 4.01Å; F1090-Y1143 AromaticContact CD2-CE1 3.8Å; F1090-Y1143 HydrophobicContact CD2-CE1 3.8Å; F1090-Y1143 AromaticContact CD2-CE2 3.86Å; F1090-Y1143 HydrophobicContact CD2-CE2 3.86Å; F1090-Y1143 HydrophobicContact CD2-CG 4.05Å; F1090-Y1143 AromaticContact CD2-CZ 3.76Å; F1090-Y1143 HydrophobicContact CE2-CD1 4.41Å; F1090-Y1143 HydrophobicContact CE2-CE1 4.32Å; F1090-Y1143 HydrophobicContact CG-CE2 4.29Å; C1105-Y1143 WeakPolarHBondContact CB-OH 3.31Å; L1106-Y1143 PolarHBondContact N-OH 3.33Å; C1107-Y1143 HydrophobicContact CB-CE1 4.47Å; L1111-Y1143 HydrophobicContact CD2-CE1 3.67Å; Y1116-Y1143 HydrophobicContact CE2-CE1 4.37Å; Y1116-Y1143 WeakPolarHBondContact OH-CD1 3.46Å; D1141-Y1143 WeakPolarHBondContact OD1-CB 3.34Å; D1141-Y1143 WeakPolarHBondContact OD1-CD2 3.38Å; D1141-Y1143 PolarHBondContact OD1-N 2.85Å; Y1143-F1145 PolarHBondContact O-N 3Å; Y1143-F1146 PolarHBondContact O-N 2.9Å; Y1143-T1147 PolarHBondContact O-N 3.35Å
1144	S	88.6	Confident	87.2	Confident	61 Å²	61	52.4 Å²	52.4	43%	0.427	28%	0.283	S	S	.	.	H	α-helix	trans	-72.6	-8	175.1	59.7	0	0	0	0	114.5	D1141 Q1148	D1141-S1144 WeakPolarHBondContact OD2-CB 3.39Å; D1141-S1144 PolarHBondContact OD2-N 3.41Å; D1141-S1144 PolarHBondContact OD2-OG 2.85Å; S1144-Q1148 VanDerWaalsContact O-CG 3.26Å; S1144-Q1148 WeakPolarHBondContact O-CG 3.29Å; S1144-Q1148 PolarHBondContact O-NE2 2.88Å
1145	F	89.8	Confident	87.2	Confident	6 Å²	6	49.2 Å²	49.2	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-80.2	-43.1	165	-178.1	-94	0	0	0	111.6	L1127 L1130 V1139 D1141 L1142 Y1143 Q1148 C1151	L1127-F1145 WeakPolarHBondContact O-CZ 3.32Å; L1130-F1145 HydrophobicContact CD1-CD1 3.99Å; L1130-F1145 HydrophobicContact CD1-CE1 3.73Å; L1130-F1145 HydrophobicContact CD1-CZ 4.06Å; V1139-F1145 HydrophobicContact CG1-CB 3.98Å; V1139-F1145 HydrophobicContact CG1-CD2 4.18Å; V1139-F1145 HydrophobicContact CG1-CG 4.08Å; V1139-F1145 HydrophobicContact CG2-CD2 3.78Å; V1139-F1145 HydrophobicContact CG2-CE2 3.95Å; V1139-F1145 HydrophobicContact CG2-CG 4.43Å; D1141-F1145 WeakPolarHBondContact O-CB 3.42Å; D1141-F1145 PolarHBondContact O-N 3.11Å; L1142-F1145 PolarHBondContact O-N 3.01Å; Y1143-F1145 PolarHBondContact O-N 3Å; F1145-Q1148 VanDerWaalsContact O-CB 3.29Å; F1145-Q1148 WeakPolarHBondContact O-CB 3.42Å; F1145-Q1148 VanDerWaalsContact O-CG 3.3Å; F1145-Q1148 WeakPolarHBondContact O-CG 3.48Å; F1145-Q1148 PolarHBondContact O-N 2.8Å; F1145-C1151 PolarHBondContact O-SG 3.04Å
1146	F	90	Very high	87.1	Confident	3 Å²	3	42.9 Å²	42.9	1%	0.013	25%	0.247	C	C	.	.	H	α-helix	trans	-77.3	-18.6	-177.8	-72	-54.2	0	0	0	114.1	F1090 L1092 Y1116 L1119 L1130 L1142 Y1143 Q1148 C1151 F1155	F1090-F1146 HydrophobicContact CE1-CE2 4.17Å; F1090-F1146 AromaticContact CE2-CD2 3.93Å; F1090-F1146 HydrophobicContact CE2-CD2 3.93Å; F1090-F1146 HydrophobicContact CE2-CE2 4.21Å; F1090-F1146 AromaticContact CZ-CD2 3.87Å; F1090-F1146 HydrophobicContact CZ-CD2 3.87Å; F1090-F1146 AromaticContact CZ-CE2 3.72Å; F1090-F1146 HydrophobicContact CZ-CE2 3.72Å; L1092-F1146 HydrophobicContact CD1-CE2 4.31Å; L1092-F1146 HydrophobicContact CD1-CZ 4.08Å; Y1116-F1146 HydrophobicContact CE1-CB 4.23Å; L1119-F1146 HydrophobicContact CD1-CD1 4.12Å; L1119-F1146 HydrophobicContact CD1-CD2 4.08Å; L1119-F1146 HydrophobicContact CD1-CE1 3.88Å; L1119-F1146 HydrophobicContact CD1-CE2 3.83Å; L1119-F1146 HydrophobicContact CD1-CG 4.24Å; L1119-F1146 HydrophobicContact CD1-CZ 3.73Å; L1119-F1146 HydrophobicContact CD2-CD1 3.97Å; L1119-F1146 HydrophobicContact CD2-CE1 3.57Å; L1119-F1146 HydrophobicContact CD2-CZ 4.12Å; L1119-F1146 HydrophobicContact CG-CE1 4.41Å; L1130-F1146 HydrophobicContact CD2-CZ 3.98Å; L1142-F1146 HydrophobicContact CB-CD2 4.35Å; L1142-F1146 HydrophobicContact CB-CE2 4.19Å; L1142-F1146 HydrophobicContact CD2-CE2 4.03Å; L1142-F1146 HydrophobicContact CD2-CZ 4.45Å; L1142-F1146 WeakPolarHBondContact O-CD2 3.49Å; L1142-F1146 PolarHBondContact O-N 2.94Å; Y1143-F1146 PolarHBondContact O-N 2.9Å; F1146-Q1148 VanDerWaalsContact C-N 3.27Å; F1146-Q1148 PolarHBondContact O-N 2.92Å; F1146-C1151 HydrophobicContact CD1-CB 4.44Å; F1146-C1151 WeakPolarHBondContact O-CB 3.37Å; F1146-F1155 HydrophobicContact CB-CZ 4.13Å; F1146-F1155 HydrophobicContact CD1-CZ 4.34Å; F1146-F1155 WeakPolarHBondContact O-CE2 3.39Å; F1146-F1155 WeakPolarHBondContact O-CZ 3.48Å
1147	T	86.8	Confident	86.9	Confident	40 Å²	40	38.9 Å²	38.9	25%	0.245	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-9.9	166.7	56.9	0	0	0	0	114	P630 E633 Y1143	P630-T1147 HydrophobicContact CB-CG2 4.48Å; P630-T1147 HydrophobicContact CG-CG2 4.29Å; E633-T1147 PolarHBondContact OE2-OG1 2.91Å; Y1143-T1147 PolarHBondContact O-N 3.35Å
1148	Q	85.3	Confident	86.8	Confident	94 Å²	94	39.1 Å²	39.1	44%	0.439	21%	0.21	S	C	.	.	S	Bend	trans	-65.9	146.3	-178.5	-61.6	-177.2	16.6	0	0	112.4	S1144 F1145 F1146 G1150 C1151 L1152	S1144-Q1148 VanDerWaalsContact O-CG 3.26Å; S1144-Q1148 WeakPolarHBondContact O-CG 3.29Å; S1144-Q1148 PolarHBondContact O-NE2 2.88Å; F1145-Q1148 VanDerWaalsContact O-CB 3.29Å; F1145-Q1148 WeakPolarHBondContact O-CB 3.42Å; F1145-Q1148 VanDerWaalsContact O-CG 3.3Å; F1145-Q1148 WeakPolarHBondContact O-CG 3.48Å; F1145-Q1148 PolarHBondContact O-N 2.8Å; F1146-Q1148 VanDerWaalsContact C-N 3.27Å; F1146-Q1148 PolarHBondContact O-N 2.92Å; Q1148-G1150 PolarHBondContact O-N 3.47Å; Q1148-C1151 WeakPolarHBondContact O-CB 3.46Å; Q1148-C1151 PolarHBondContact O-N 3.43Å; Q1148-L1152 PolarHBondContact O-N 3.09Å
1149	R	81.1	Confident	86.7	Confident	120 Å²	120	34 Å²	34	45%	0.453	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-25.5	-176.9	-57.9	-180	-171.7	-168.9	-2.8	114.7	L634 N637 P1153	L634-R1149 HydrophobicContact CD2-CG 3.84Å; N637-R1149 PolarHBondContact ND2-NH1 2.9Å; N637-R1149 VanDerWaalsContact ND2-NH1 3.19Å; N637-R1149 PolarHBondContact ND2-NH2 2.89Å; N637-R1149 VanDerWaalsContact ND2-NH2 3.13Å; N637-R1149 PolarHBondContact OD1-NH1 3.35Å; R1149-P1153 WeakPolarHBondContact O-CD 3.46Å
1150	G	79.1	Confident	86.4	Confident	37 Å²	37	36 Å²	36	38%	0.381	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-20.6	175.4	0	0	0	0	0	114.5	Q1148 M1185	Q1148-G1150 PolarHBondContact O-N 3.47Å; G1150-M1185 WeakPolarHBondContact O-CE 3.43Å
1151	C	83.9	Confident	86.2	Confident	7 Å²	7	34.6 Å²	34.6	5%	0.047	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-36.8	-177.8	-62.1	0	0	0	0	112.2	F1145 F1146 Q1148 P1153 I1154 F1155	F1145-C1151 PolarHBondContact O-SG 3.04Å; F1146-C1151 HydrophobicContact CD1-CB 4.44Å; F1146-C1151 WeakPolarHBondContact O-CB 3.37Å; Q1148-C1151 WeakPolarHBondContact O-CB 3.46Å; Q1148-C1151 PolarHBondContact O-N 3.43Å; C1151-P1153 VanDerWaalsContact C-N 3.33Å; C1151-P1153 VanDerWaalsContact O-N 3.16Å; C1151-I1154 VanDerWaalsContact O-CB 3.26Å; C1151-I1154 WeakPolarHBondContact O-CB 3.24Å; C1151-I1154 WeakPolarHBondContact O-CG1 3.24Å; C1151-I1154 PolarHBondContact O-N 3.49Å; C1151-F1155 HydrophobicContact CB-CZ 4.06Å
1152	L	86.5	Confident	85.8	Confident	15 Å²	15	35 Å²	35	8%	0.079	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-49.6	-39.3	-178.1	-59.8	175.3	0	0	0	115.3	Y629 L634 Q1148 I1154 F1155	Y629-L1152 HydrophobicContact CD1-CD1 4.24Å; L634-L1152 HydrophobicContact CD1-CD1 3.94Å; L634-L1152 HydrophobicContact CD2-CD1 3.88Å; L634-L1152 HydrophobicContact CG-CD1 4.48Å; Q1148-L1152 PolarHBondContact O-N 3.09Å; L1152-I1154 PolarHBondContact O-N 3.41Å; L1152-F1155 HydrophobicContact CD2-CD2 4.12Å; L1152-F1155 HydrophobicContact CD2-CE2 4.03Å; L1152-F1155 PolarHBondContact O-N 2.87Å
1153	P	84.4	Confident	85.2	Confident	4 Å²	4	37.6 Å²	37.6	3%	0.026	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-55.7	-32.9	174.5	-30.3	38	0	0	0	115.1	R1149 C1151 F1155 H1156 F1159 F1188 I1189	R1149-P1153 WeakPolarHBondContact O-CD 3.46Å; C1151-P1153 VanDerWaalsContact C-N 3.33Å; C1151-P1153 VanDerWaalsContact O-N 3.16Å; P1153-F1155 PolarHBondContact O-N 3.37Å; P1153-H1156 PolarHBondContact O-N 2.91Å; P1153-F1159 HydrophobicContact CB-CD2 4.35Å; P1153-F1159 HydrophobicContact CB-CE2 4.32Å; P1153-F1159 VanDerWaalsContact O-CB 3.31Å; P1153-F1159 WeakPolarHBondContact O-CB 3.43Å; P1153-F1159 WeakPolarHBondContact O-CD2 3.27Å; P1153-F1159 WeakPolarHBondContact O-CG 3.44Å; P1153-F1188 HydrophobicContact CB-CD1 3.94Å; P1153-F1188 HydrophobicContact CB-CE1 4.07Å; P1153-I1189 HydrophobicContact CG-CD1 3.96Å; P1153-I1189 HydrophobicContact CG-CG1 3.39Å
1154	I	86.3	Confident	84.7	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.01	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-69.7	-24.6	-173.6	-52	175.1	0	0	0	110.7	R1122 L1126 L1127 C1151 L1152 F1159 M1185	R1122-I1154 HydrophobicContact CG-CG2 4.49Å; L1126-I1154 VanDerWaalsContact O-CD1 3.25Å; L1126-I1154 WeakPolarHBondContact O-CD1 3.37Å; L1127-I1154 HydrophobicContact CD2-CD1 3.92Å; L1127-I1154 HydrophobicContact CD2-CG2 4.25Å; C1151-I1154 VanDerWaalsContact O-CB 3.26Å; C1151-I1154 WeakPolarHBondContact O-CB 3.24Å; C1151-I1154 WeakPolarHBondContact O-CG1 3.24Å; C1151-I1154 PolarHBondContact O-N 3.49Å; L1152-I1154 PolarHBondContact O-N 3.41Å; I1154-F1159 HydrophobicContact CB-CD1 4.37Å; I1154-F1159 HydrophobicContact CB-CE1 4.15Å; I1154-F1159 HydrophobicContact CG1-CE1 4.04Å; I1154-F1159 HydrophobicContact CG1-CZ 3.98Å; I1154-F1159 HydrophobicContact CG2-CD1 4.19Å; I1154-F1159 HydrophobicContact CG2-CE1 3.94Å; I1154-M1185 HydrophobicContact CG1-CE 4.5Å
1155	F	88.9	Confident	84.1	Confident	3 Å²	3	45.8 Å²	45.8	1%	0.013	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-82.4	-17	-177.7	-49.5	-22.2	0	0	0	113	V627 N1115 S1118 L1119 F1146 C1151 L1152 P1153	V627-F1155 HydrophobicContact CB-CB 4.47Å; V627-F1155 HydrophobicContact CG1-CB 4.01Å; V627-F1155 HydrophobicContact CG1-CD2 4.16Å; V627-F1155 VanDerWaalsContact CG2-C 3.49Å; V627-F1155 HydrophobicContact CG2-CB 3.77Å; V627-F1155 WeakPolarHBondContact CG2-O 3.46Å; N1115-F1155 HydrophobicContact CB-CB 4.45Å; N1115-F1155 HydrophobicContact CB-CD1 4.37Å; N1115-F1155 HydrophobicContact CB-CD2 3.61Å; N1115-F1155 HydrophobicContact CB-CE2 3.86Å; N1115-F1155 HydrophobicContact CB-CG 3.9Å; N1115-F1155 HydrophobicContact CB-CZ 4.35Å; N1115-F1155 VanDerWaalsContact CG-CD2 3.42Å; S1118-F1155 WeakPolarHBondContact OG-CA 3.29Å; S1118-F1155 VanDerWaalsContact OG-CD1 3.23Å; S1118-F1155 WeakPolarHBondContact OG-CD1 3.32Å; L1119-F1155 HydrophobicContact CD2-CE1 3.89Å; L1119-F1155 HydrophobicContact CG-CE1 4.31Å; F1146-F1155 HydrophobicContact CB-CZ 4.13Å; F1146-F1155 HydrophobicContact CD1-CZ 4.34Å; F1146-F1155 WeakPolarHBondContact O-CE2 3.39Å; F1146-F1155 WeakPolarHBondContact O-CZ 3.48Å; C1151-F1155 HydrophobicContact CB-CZ 4.06Å; L1152-F1155 HydrophobicContact CD2-CD2 4.12Å; L1152-F1155 HydrophobicContact CD2-CE2 4.03Å; L1152-F1155 PolarHBondContact O-N 2.87Å; P1153-F1155 PolarHBondContact O-N 3.37Å
1156	H	87.4	Confident	83.4	Confident	22 Å²	22	45.7 Å²	45.7	10%	0.102	22%	0.223	C	C	.	.	S	Bend	trans	-73.8	130.5	-178.7	-168.7	-15.3	0	0	0	111	V627 P1153 R1158 F1159	V627-H1156 HydrophobicContact CG2-CB 4.27Å; P1153-H1156 PolarHBondContact O-N 2.91Å; H1156-R1158 PolarHBondContact CE1-NE 3.42Å; H1156-R1158 VanDerWaalsContact CE1-NE 3.31Å; H1156-R1158 PolarHBondContact NE2-NE 3.07Å; H1156-R1158 PolarHBondContact NE2-NH2 3.29Å; H1156-R1158 PolarHBondContact O-N 3.1Å; H1156-R1158 VanDerWaalsContact O-N 3.09Å; H1156-F1159 WeakPolarHBondContact O-CB 3.36Å; H1156-F1159 PolarHBondContact O-N 2.84Å
1157	D	85.9	Confident	82.7	Confident	47 Å²	47	49.3 Å²	49.3	25%	0.251	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-37	-179.9	71.8	-31.9	0	0	0	115.3	R624 Q625 F1159 P1160	R624-D1157 VanDerWaalsContact CD-OD2 3.26Å; R624-D1157 WeakPolarHBondContact CD-OD2 3.42Å; R624-D1157 VanDerWaalsContact CG-OD2 3.28Å; R624-D1157 WeakPolarHBondContact CG-OD2 3.43Å; R624-D1157 IonicContact CZ-OD2 3.51Å; R624-D1157 IonicContact NE-OD2 4Å; R624-D1157 IonicContact NH1-OD2 2.74Å; R624-D1157 PolarHBondContact NH1-OD2 2.84Å; Q625-D1157 HydrophobicContact CB-CB 4.48Å; D1157-F1159 VanDerWaalsContact C-N 3.34Å; D1157-F1159 PolarHBondContact O-N 2.82Å; D1157-P1160 VanDerWaalsContact O-CD 3.25Å; D1157-P1160 WeakPolarHBondContact O-CD 3.4Å; D1157-P1160 VanDerWaalsContact O-CG 3.27Å; D1157-P1160 WeakPolarHBondContact O-CG 3.37Å
1158	R	84.1	Confident	82	Confident	62 Å²	62	52.1 Å²	52.1	23%	0.234	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-8.3	178.2	-64.2	-177.4	-61.5	-170.8	-0.4	114.9	D547 H1156 D1161 L1162	D547-R1158 IonicContact OD2-NH1 3.38Å; D547-R1158 PolarHBondContact OD2-NH1 3.47Å; H1156-R1158 PolarHBondContact CE1-NE 3.42Å; H1156-R1158 VanDerWaalsContact CE1-NE 3.31Å; H1156-R1158 PolarHBondContact NE2-NE 3.07Å; H1156-R1158 PolarHBondContact NE2-NH2 3.29Å; H1156-R1158 PolarHBondContact O-N 3.1Å; H1156-R1158 VanDerWaalsContact O-N 3.09Å; R1158-D1161 WeakPolarHBondContact O-CB 3.28Å; R1158-D1161 PolarHBondContact O-N 2.92Å; R1158-L1162 PolarHBondContact O-N 3.4Å; R1158-L1162 VanDerWaalsContact O-N 3.11Å
1159	F	85.8	Confident	81.3	Confident	8 Å²	8	53 Å²	53	4%	0.035	26%	0.26	C	S	.	.	H	α-helix	trans	-62.3	-44.4	179.6	-172.9	-102.6	0	0	0	115	L1126 P1153 I1154 H1156 D1157 D1161 L1162 H1163 F1188	L1126-F1159 HydrophobicContact CD1-CE1 4.12Å; L1126-F1159 HydrophobicContact CD1-CZ 4Å; L1126-F1159 HydrophobicContact CD2-CE1 3.95Å; L1126-F1159 HydrophobicContact CG-CE1 4.11Å; L1126-F1159 HydrophobicContact CG-CZ 4.33Å; P1153-F1159 HydrophobicContact CB-CD2 4.35Å; P1153-F1159 HydrophobicContact CB-CE2 4.32Å; P1153-F1159 VanDerWaalsContact O-CB 3.31Å; P1153-F1159 WeakPolarHBondContact O-CB 3.43Å; P1153-F1159 WeakPolarHBondContact O-CD2 3.27Å; P1153-F1159 WeakPolarHBondContact O-CG 3.44Å; I1154-F1159 HydrophobicContact CB-CD1 4.37Å; I1154-F1159 HydrophobicContact CB-CE1 4.15Å; I1154-F1159 HydrophobicContact CG1-CE1 4.04Å; I1154-F1159 HydrophobicContact CG1-CZ 3.98Å; I1154-F1159 HydrophobicContact CG2-CD1 4.19Å; I1154-F1159 HydrophobicContact CG2-CE1 3.94Å; H1156-F1159 WeakPolarHBondContact O-CB 3.36Å; H1156-F1159 PolarHBondContact O-N 2.84Å; D1157-F1159 VanDerWaalsContact C-N 3.34Å; D1157-F1159 PolarHBondContact O-N 2.82Å; F1159-D1161 VanDerWaalsContact C-N 3.31Å; F1159-D1161 PolarHBondContact O-N 3.34Å; F1159-L1162 PolarHBondContact O-N 3.46Å; F1159-H1163 WeakPolarHBondContact O-CB 3.49Å; F1159-H1163 PolarHBondContact O-N 3.1Å; F1159-F1188 HydrophobicContact CD2-CE1 4.27Å
1160	P	83.1	Confident	80.6	Confident	46 Å²	46	48.4 Å²	48.4	30%	0.299	24%	0.244	S	C	.	.	H	α-helix	trans	-54.9	-42.2	172.4	16.8	-31.3	0	0	0	113.6	D1157 H1163 Q1164	D1157-P1160 VanDerWaalsContact O-CD 3.25Å; D1157-P1160 WeakPolarHBondContact O-CD 3.4Å; D1157-P1160 VanDerWaalsContact O-CG 3.27Å; D1157-P1160 WeakPolarHBondContact O-CG 3.37Å; P1160-H1163 PolarHBondContact O-N 3.42Å; P1160-Q1164 WeakPolarHBondContact O-CB 3.34Å; P1160-Q1164 PolarHBondContact O-N 2.81Å
1161	D	80.9	Confident	79.8	Confident	79 Å²	79	51.8 Å²	51.8	42%	0.422	26%	0.258	S	S	.	.	H	α-helix	trans	-61.3	-47.7	175.6	-100.7	43.2	0	0	0	112.1	R1158 F1159 H1163 Q1164 R1165	R1158-D1161 WeakPolarHBondContact O-CB 3.28Å; R1158-D1161 PolarHBondContact O-N 2.92Å; F1159-D1161 VanDerWaalsContact C-N 3.31Å; F1159-D1161 PolarHBondContact O-N 3.34Å; D1161-H1163 VanDerWaalsContact C-N 3.33Å; D1161-H1163 PolarHBondContact O-N 2.68Å; D1161-Q1164 PolarHBondContact O-N 2.71Å; D1161-R1165 WeakPolarHBondContact O-CB 3.38Å; D1161-R1165 VanDerWaalsContact O-CG 3.25Å; D1161-R1165 WeakPolarHBondContact O-CG 3.37Å; D1161-R1165 PolarHBondContact O-N 3.01Å; D1161-R1165 IonicContact OD2-CZ 2.8Å; D1161-R1165 IonicContact OD2-NH2 3.24Å; D1161-R1165 PolarHBondContact OD2-NH2 3.45Å
1162	L	81.7	Confident	78.6	Confident	50 Å²	50	59.4 Å²	59.4	26%	0.262	29%	0.292	S	S	.	.	H	α-helix	trans	-59.4	-45.1	176.1	177.7	64.7	0	0	0	111.1	R1158 F1159 R1165 A1166 M1184 F1188	R1158-L1162 PolarHBondContact O-N 3.4Å; R1158-L1162 VanDerWaalsContact O-N 3.11Å; F1159-L1162 PolarHBondContact O-N 3.46Å; L1162-R1165 PolarHBondContact O-N 3.26Å; L1162-A1166 WeakPolarHBondContact O-CB 3.43Å; L1162-A1166 PolarHBondContact O-N 2.89Å; L1162-M1184 HydrophobicContact CD1-CE 4.19Å; L1162-F1188 HydrophobicContact CD2-CB 4.16Å; L1162-F1188 HydrophobicContact CD2-CD1 3.94Å; L1162-F1188 HydrophobicContact CD2-CD2 3.53Å; L1162-F1188 HydrophobicContact CD2-CE1 4.16Å; L1162-F1188 HydrophobicContact CD2-CE2 3.78Å; L1162-F1188 HydrophobicContact CD2-CG 3.62Å; L1162-F1188 HydrophobicContact CD2-CZ 4.09Å
1163	H	79.6	Confident	77	Confident	54 Å²	54	68.5 Å²	68.5	25%	0.25	33%	0.325	C	S	.	.	H	α-helix	trans	-63.2	-43.9	178.1	179.6	-119.4	0	0	0	111.9	F1159 P1160 D1161 A1166 L1167	F1159-H1163 WeakPolarHBondContact O-CB 3.49Å; F1159-H1163 PolarHBondContact O-N 3.1Å; P1160-H1163 PolarHBondContact O-N 3.42Å; D1161-H1163 VanDerWaalsContact C-N 3.33Å; D1161-H1163 PolarHBondContact O-N 2.68Å; H1163-A1166 PolarHBondContact O-N 2.94Å; H1163-L1167 WeakPolarHBondContact O-CG 3.48Å; H1163-L1167 PolarHBondContact O-N 3.26Å
1164	Q	79.5	Confident	75.2	Confident	114 Å²	114	75.8 Å²	75.8	53%	0.533	36%	0.363	S	S	.	.	H	α-helix	trans	-64.6	-42.5	176.5	-173.5	175.1	1.2	0	0	112	P1160 D1161 L1167 Q1168	P1160-Q1164 WeakPolarHBondContact O-CB 3.34Å; P1160-Q1164 PolarHBondContact O-N 2.81Å; D1161-Q1164 PolarHBondContact O-N 2.71Å; Q1164-L1167 PolarHBondContact O-N 2.99Å; Q1164-Q1168 WeakPolarHBondContact O-CG 3.43Å; Q1164-Q1168 PolarHBondContact O-N 3.3Å
1165	R	76.8	Confident	73.4	Confident	149 Å²	149	85.1 Å²	85.1	56%	0.562	40%	0.404	S	S	*	.	H	α-helix	trans	-64.2	-40.5	175.1	-68.3	171.9	-159.7	-167.4	9.9	111.6	D1161 L1162 Q1168 L1169	D1161-R1165 WeakPolarHBondContact O-CB 3.38Å; D1161-R1165 VanDerWaalsContact O-CG 3.25Å; D1161-R1165 WeakPolarHBondContact O-CG 3.37Å; D1161-R1165 PolarHBondContact O-N 3.01Å; D1161-R1165 IonicContact OD2-CZ 2.8Å; D1161-R1165 IonicContact OD2-NH2 3.24Å; D1161-R1165 PolarHBondContact OD2-NH2 3.45Å; L1162-R1165 PolarHBondContact O-N 3.26Å; R1165-Q1168 PolarHBondContact O-N 3.38Å; R1165-L1169 VanDerWaalsContact O-CG 3.31Å; R1165-L1169 WeakPolarHBondContact O-CG 3.4Å; R1165-L1169 PolarHBondContact O-N 3.31Å
1166	A	75.2	Confident	71.6	Confident	4 Å²	4	88.4 Å²	88.4	3%	0.033	42%	0.424	C	S	.	.	H	α-helix	trans	-61.5	-45.8	174.3	0	0	0	0	0	111.7	L1162 H1163 Q1168 L1169 L1170 L1181 M1184	L1162-A1166 WeakPolarHBondContact O-CB 3.43Å; L1162-A1166 PolarHBondContact O-N 2.89Å; H1163-A1166 PolarHBondContact O-N 2.94Å; A1166-Q1168 PolarHBondContact O-N 3.46Å; A1166-L1169 PolarHBondContact O-N 2.85Å; A1166-L1170 WeakPolarHBondContact O-CB 3.39Å; A1166-L1170 VanDerWaalsContact O-CG 3.26Å; A1166-L1170 WeakPolarHBondContact O-CG 3.46Å; A1166-L1170 PolarHBondContact O-N 2.85Å; A1166-L1181 HydrophobicContact CB-CD1 4.41Å; A1166-M1184 HydrophobicContact CB-CE 3.79Å; A1166-M1184 HydrophobicContact CB-SD 3.93Å
1167	L	73.9	Confident	69.8	Low	79 Å²	79	92.1 Å²	92.1	41%	0.414	45%	0.448	S	S	.	.	H	α-helix	trans	-60.8	-41.7	175.3	-72.6	173.8	0	0	0	112.2	H1163 Q1164 L1170 T1171	H1163-L1167 WeakPolarHBondContact O-CG 3.48Å; H1163-L1167 PolarHBondContact O-N 3.26Å; Q1164-L1167 PolarHBondContact O-N 2.99Å; L1167-L1170 PolarHBondContact O-N 3.21Å; L1167-T1171 PolarHBondContact O-N 3.28Å; L1167-T1171 PolarHBondContact O-OG1 3.44Å
1168	Q	72.5	Confident	68.1	Low	99 Å²	99	94.7 Å²	94.7	46%	0.463	47%	0.47	S	S	.	.	H	α-helix	trans	-61.6	-46.5	175.1	-74.1	170.3	-12.8	0	0	112.1	Q1164 R1165 A1166 L1170 T1171 H1172	Q1164-Q1168 WeakPolarHBondContact O-CG 3.43Å; Q1164-Q1168 PolarHBondContact O-N 3.3Å; R1165-Q1168 PolarHBondContact O-N 3.38Å; A1166-Q1168 PolarHBondContact O-N 3.46Å; Q1168-L1170 VanDerWaalsContact C-N 3.33Å; Q1168-L1170 PolarHBondContact O-N 3.03Å; Q1168-T1171 WeakPolarHBondContact CA-OG1 3.22Å; Q1168-T1171 PolarHBondContact O-N 3.34Å; Q1168-T1171 PolarHBondContact O-OG1 2.83Å; Q1168-H1172 PolarHBondContact O-CD2 2.85Å; Q1168-H1172 VanDerWaalsContact O-CD2 3.31Å; Q1168-H1172 PolarHBondContact O-N 2.92Å; Q1168-H1172 VanDerWaalsContact O-N 3.1Å
1169	L	71.2	Confident	66.5	Low	113 Å²	113	94.6 Å²	94.6	59%	0.592	48%	0.479	S	S	*	.	H	α-helix	trans	-63.3	-36.9	176.3	-70	169.5	0	0	0	112.3	R1165 A1166 H1172 R1173	R1165-L1169 VanDerWaalsContact O-CG 3.31Å; R1165-L1169 WeakPolarHBondContact O-CG 3.4Å; R1165-L1169 PolarHBondContact O-N 3.31Å; A1166-L1169 PolarHBondContact O-N 2.85Å; L1169-H1172 PolarHBondContact O-N 2.88Å; L1169-R1173 PolarHBondContact O-N 2.84Å; L1169-R1173 VanDerWaalsContact O-N 3.1Å
1170	L	64.9	Low	64.9	Low	22 Å²	22	97.8 Å²	97.8	12%	0.115	50%	0.495	C	S	.	.	H	α-helix	trans	-71.3	-37.3	175.6	-73.4	167.4	0	0	0	112.6	A1166 L1167 Q1168 H1172 R1173 L1180 L1181	A1166-L1170 WeakPolarHBondContact O-CB 3.39Å; A1166-L1170 VanDerWaalsContact O-CG 3.26Å; A1166-L1170 WeakPolarHBondContact O-CG 3.46Å; A1166-L1170 PolarHBondContact O-N 2.85Å; L1167-L1170 PolarHBondContact O-N 3.21Å; Q1168-L1170 VanDerWaalsContact C-N 3.33Å; Q1168-L1170 PolarHBondContact O-N 3.03Å; L1170-H1172 VanDerWaalsContact C-N 3.26Å; L1170-H1172 PolarHBondContact O-N 2.81Å; L1170-R1173 CarbonylContact O-C 3.57Å; L1170-R1173 PolarHBondContact O-N 2.88Å; L1170-R1173 VanDerWaalsContact O-O 3.08Å; L1170-L1180 HydrophobicContact CD2-CB 4.5Å; L1170-L1180 HydrophobicContact CD2-CD2 4.38Å; L1170-L1181 HydrophobicContact CD1-CD1 4.23Å
1171	T	64.3	Low	63.5	Low	109 Å²	109	97.2 Å²	97.2	67%	0.669	49%	0.49	S	S	*	.	H	α-helix	trans	-65.9	-29.5	171.8	42.8	0	0	0	0	112.6	L1167 Q1168 R1173	L1167-T1171 PolarHBondContact O-N 3.28Å; L1167-T1171 PolarHBondContact O-OG1 3.44Å; Q1168-T1171 WeakPolarHBondContact CA-OG1 3.22Å; Q1168-T1171 PolarHBondContact O-N 3.34Å; Q1168-T1171 PolarHBondContact O-OG1 2.83Å; T1171-R1173 VanDerWaalsContact C-N 3.34Å
1172	H	57.8	Low	62.1	Low	167 Å²	167	101.1 Å²	101.1	77%	0.773	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-11.8	169.3	-78.3	-64.8	0	0	0	114.2	Q1168 L1169 L1170	Q1168-H1172 PolarHBondContact O-CD2 2.85Å; Q1168-H1172 VanDerWaalsContact O-CD2 3.31Å; Q1168-H1172 PolarHBondContact O-N 2.92Å; Q1168-H1172 VanDerWaalsContact O-N 3.1Å; L1169-H1172 PolarHBondContact O-N 2.88Å; L1170-H1172 VanDerWaalsContact C-N 3.26Å; L1170-H1172 PolarHBondContact O-N 2.81Å
1173	R	53	Low	60.7	Low	205 Å²	205	104.1 Å²	104.1	77%	0.774	51%	0.513	S	S	*	.	S	Bend	trans	-133.9	77.2	179.7	-69.5	-170	175.5	-169.3	1.5	111.5	L1169 L1170 T1171 K1175	L1169-R1173 PolarHBondContact O-N 2.84Å; L1169-R1173 VanDerWaalsContact O-N 3.1Å; L1170-R1173 CarbonylContact O-C 3.57Å; L1170-R1173 PolarHBondContact O-N 2.88Å; L1170-R1173 VanDerWaalsContact O-O 3.08Å; T1171-R1173 VanDerWaalsContact C-N 3.34Å; R1173-K1175 PolarHBondContact O-N 3.36Å
1174	L	47.2	Very low	59.6	Low	158 Å²	158	104.3 Å²	104.3	83%	0.827	51%	0.514	S	S	*	.			trans	-49	135.7	176.1	-80.3	168.9	0	0	0	112.7
1175	K	47.7	Very low	58.3	Low	197 Å²	197	100.7 Å²	100.7	86%	0.857	50%	0.498	S	S	*	.	S	Bend	trans	74.1	82.3	179.8	-52.4	173.6	-178.3	176.5	0	115.3	R1173	R1173-K1175 PolarHBondContact O-N 3.36Å
1176	V	50.9	Low	57	Low	73 Å²	73	98.2 Å²	98.2	44%	0.442	49%	0.493	S	S	.	.				171.4	107	110	158.6	0	0	0	0	107.3	S1179	V1176-S1179 WeakPolarHBondContact CG1-OG 3.26Å
1177	V	50.2	Low	55.8	Low	100 Å²	100	100.4 Å²	100.4	61%	0.606	51%	0.511	S	S	*	.	S	Bend	trans	-83.4	-47	-170.1	-177.7	0	0	0	0	112.2	L1181	V1177-L1181 WeakPolarHBondContact O-CB 3.2Å; V1177-L1181 PolarHBondContact O-N 2.92Å
1178	S	50.1	Low	54.6	Low	101 Å²	101	97.6 Å²	97.6	71%	0.706	50%	0.495	S	S	*	.	H	α-helix	trans	-79	-45.8	-165.7	52.4	0	0	0	0	115.3	R1182	S1178-R1182 WeakPolarHBondContact O-CB 3.29Å; S1178-R1182 PolarHBondContact O-N 2.96Å
1179	S	50.3	Low	53.5	Low	60 Å²	60	94.6 Å²	94.6	42%	0.42	48%	0.482	S	S	.	.	H	α-helix	trans	-74.8	-28.8	-177.9	66.3	0	0	0	0	113.2	V1176 R1182 M1183	V1176-S1179 WeakPolarHBondContact CG1-OG 3.26Å; S1179-R1182 PolarHBondContact O-N 3.35Å; S1179-M1183 WeakPolarHBondContact O-CG 3.49Å; S1179-M1183 PolarHBondContact O-N 3.18Å
1180	L	52.6	Low	52.1	Low	74 Å²	74	96 Å²	96	39%	0.387	48%	0.484	S	S	.	.	H	α-helix	trans	-77.6	-40.1	-179.2	-150.8	147.9	0	0	0	111.1	L1170 R1182 M1183 M1184	L1170-L1180 HydrophobicContact CD2-CB 4.5Å; L1170-L1180 HydrophobicContact CD2-CD2 4.38Å; L1180-R1182 VanDerWaalsContact C-N 3.27Å; L1180-R1182 PolarHBondContact O-N 3.24Å; L1180-M1183 HydrophobicContact CG-CE 4.34Å; L1180-M1183 PolarHBondContact O-N 3Å; L1180-M1184 HydrophobicContact CD2-CG 4.26Å; L1180-M1184 HydrophobicContact CD2-SD 3.94Å; L1180-M1184 WeakPolarHBondContact O-CG 3.26Å; L1180-M1184 PolarHBondContact O-N 3.45Å
1181	L	53.6	Low	51.1	Low	35 Å²	35	98.1 Å²	98.1	18%	0.183	49%	0.494	C	S	.	.	H	α-helix	trans	-60.9	-38.5	170.1	-147	99.2	0	0	0	111.4	L1126 A1166 L1170 V1177 M1184 M1185	L1126-L1181 HydrophobicContact CD1-CD2 4.05Å; A1166-L1181 HydrophobicContact CB-CD1 4.41Å; L1170-L1181 HydrophobicContact CD1-CD1 4.23Å; V1177-L1181 WeakPolarHBondContact O-CB 3.2Å; V1177-L1181 PolarHBondContact O-N 2.92Å; L1181-M1184 PolarHBondContact O-N 2.96Å; L1181-M1185 WeakPolarHBondContact O-CG 3.47Å; L1181-M1185 PolarHBondContact O-N 3.33Å
1182	R	50.5	Low	50.2	Low	161 Å²	161	95 Å²	95	61%	0.608	47%	0.473	S	S	*	.	H	α-helix	trans	-65.3	-45.8	175.5	-177.7	173.1	175.6	162.8	1.5	112.8	S1178 S1179 L1180 M1184 M1185 E1186	S1178-R1182 WeakPolarHBondContact O-CB 3.29Å; S1178-R1182 PolarHBondContact O-N 2.96Å; S1179-R1182 PolarHBondContact O-N 3.35Å; L1180-R1182 VanDerWaalsContact C-N 3.27Å; L1180-R1182 PolarHBondContact O-N 3.24Å; R1182-M1184 VanDerWaalsContact C-N 3.28Å; R1182-M1184 PolarHBondContact O-N 3.28Å; R1182-M1185 PolarHBondContact O-N 3.09Å; R1182-E1186 HydrophobicContact CG-CG 4.49Å; R1182-E1186 WeakPolarHBondContact CG-OE1 3.35Å; R1182-E1186 IonicContact CZ-OE1 2.77Å; R1182-E1186 IonicContact NE-OE1 3.01Å; R1182-E1186 PolarHBondContact NE-OE1 3.44Å; R1182-E1186 IonicContact NH2-OE1 3.66Å; R1182-E1186 PolarHBondContact NH2-OE1 3.32Å; R1182-E1186 WeakPolarHBondContact O-CB 3.47Å; R1182-E1186 WeakPolarHBondContact O-CG 3.1Å; R1182-E1186 PolarHBondContact O-N 3.34Å
1183	M	53.1	Low	49.3	Very low	112 Å²	112	90.4 Å²	90.4	55%	0.552	46%	0.455	S	S	*	.	H	α-helix	trans	-61.2	-37.1	172.4	-76	-173.5	-64.8	0	0	111.9	S1179 L1180 E1186 A1187	S1179-M1183 WeakPolarHBondContact O-CG 3.49Å; S1179-M1183 PolarHBondContact O-N 3.18Å; L1180-M1183 HydrophobicContact CG-CE 4.34Å; L1180-M1183 PolarHBondContact O-N 3Å; M1183-E1186 PolarHBondContact O-N 2.98Å; M1183-A1187 WeakPolarHBondContact O-CB 3.41Å; M1183-A1187 PolarHBondContact O-N 2.85Å
1184	M	55.6	Low	48.5	Very low	58 Å²	58	85.3 Å²	85.3	29%	0.286	44%	0.442	S	S	.	.	H	α-helix	trans	-67.7	-36.3	174.5	-72.1	-177.2	73.7	0	0	112.6	L1162 A1166 L1180 L1181 R1182 F1188	L1162-M1184 HydrophobicContact CD1-CE 4.19Å; A1166-M1184 HydrophobicContact CB-CE 3.79Å; A1166-M1184 HydrophobicContact CB-SD 3.93Å; L1180-M1184 HydrophobicContact CD2-CG 4.26Å; L1180-M1184 HydrophobicContact CD2-SD 3.94Å; L1180-M1184 WeakPolarHBondContact O-CG 3.26Å; L1180-M1184 PolarHBondContact O-N 3.45Å; L1181-M1184 PolarHBondContact O-N 2.96Å; R1182-M1184 VanDerWaalsContact C-N 3.28Å; R1182-M1184 PolarHBondContact O-N 3.28Å; M1184-F1188 WeakPolarHBondContact O-CB 3.48Å; M1184-F1188 PolarHBondContact O-N 2.98Å
1185	M	52.9	Low	48	Very low	38 Å²	38	80.2 Å²	80.2	19%	0.187	43%	0.427	C	S	.	.	H	α-helix	trans	-67.3	-46.1	171.8	-74.1	-178.2	73.1	0	0	111.7	G1150 I1154 L1181 R1182 A1187 F1188 I1189	G1150-M1185 WeakPolarHBondContact O-CE 3.43Å; I1154-M1185 HydrophobicContact CG1-CE 4.5Å; L1181-M1185 WeakPolarHBondContact O-CG 3.47Å; L1181-M1185 PolarHBondContact O-N 3.33Å; R1182-M1185 PolarHBondContact O-N 3.09Å; M1185-A1187 VanDerWaalsContact C-N 3.33Å; M1185-A1187 PolarHBondContact O-N 3.42Å; M1185-F1188 PolarHBondContact O-N 3.47Å; M1185-I1189 WeakPolarHBondContact O-CB 3.18Å; M1185-I1189 WeakPolarHBondContact O-CD1 3.49Å; M1185-I1189 WeakPolarHBondContact O-CG1 3.24Å; M1185-I1189 PolarHBondContact O-N 3.36Å
1186	E	49.7	Very low	47.4	Very low	98 Å²	98	74.2 Å²	74.2	46%	0.458	40%	0.404	S	S	.	.	H	α-helix	trans	-63.4	-39.1	178.3	-71.2	170.5	-172.5	0	0	111.1	R1182 M1183 F1190	R1182-E1186 HydrophobicContact CG-CG 4.49Å; R1182-E1186 WeakPolarHBondContact CG-OE1 3.35Å; R1182-E1186 IonicContact CZ-OE1 2.77Å; R1182-E1186 IonicContact NE-OE1 3.01Å; R1182-E1186 PolarHBondContact NE-OE1 3.44Å; R1182-E1186 IonicContact NH2-OE1 3.66Å; R1182-E1186 PolarHBondContact NH2-OE1 3.32Å; R1182-E1186 WeakPolarHBondContact O-CB 3.47Å; R1182-E1186 WeakPolarHBondContact O-CG 3.1Å; R1182-E1186 PolarHBondContact O-N 3.34Å; M1183-E1186 PolarHBondContact O-N 2.98Å; E1186-F1190 WeakPolarHBondContact O-CB 3.39Å; E1186-F1190 PolarHBondContact O-N 3.19Å; E1186-F1190 VanDerWaalsContact O-N 3.1Å
1187	A	49.2	Very low	46.7	Very low	49 Å²	49	73.1 Å²	73.1	41%	0.405	40%	0.398	S	S	.	.	H	α-helix	trans	-68.2	-44.8	171.8	0	0	0	0	0	112.8	M1183 M1185 I1189 F1190 L1191	M1183-A1187 WeakPolarHBondContact O-CB 3.41Å; M1183-A1187 PolarHBondContact O-N 2.85Å; M1185-A1187 VanDerWaalsContact C-N 3.33Å; M1185-A1187 PolarHBondContact O-N 3.42Å; A1187-I1189 VanDerWaalsContact C-N 3.34Å; A1187-I1189 PolarHBondContact O-N 3.25Å; A1187-F1190 WeakPolarHBondContact O-CA 3.46Å; A1187-F1190 WeakPolarHBondContact O-CB 3.28Å; A1187-F1190 PolarHBondContact O-N 3.03Å; A1187-F1190 VanDerWaalsContact O-N 3.08Å; A1187-L1191 VanDerWaalsContact O-CG 3.22Å; A1187-L1191 WeakPolarHBondContact O-CG 3.41Å; A1187-L1191 PolarHBondContact O-N 3.16Å
1188	F	50.2	Low	46.4	Very low	20 Å²	20	73.5 Å²	73.5	9%	0.088	39%	0.393	C	S	.	.	H	α-helix	trans	-65.6	-36.3	179.1	-176.4	-111	0	0	0	111.9	P1153 F1159 L1162 M1184 M1185 L1191 L1192	P1153-F1188 HydrophobicContact CB-CD1 3.94Å; P1153-F1188 HydrophobicContact CB-CE1 4.07Å; F1159-F1188 HydrophobicContact CD2-CE1 4.27Å; L1162-F1188 HydrophobicContact CD2-CB 4.16Å; L1162-F1188 HydrophobicContact CD2-CD1 3.94Å; L1162-F1188 HydrophobicContact CD2-CD2 3.53Å; L1162-F1188 HydrophobicContact CD2-CE1 4.16Å; L1162-F1188 HydrophobicContact CD2-CE2 3.78Å; L1162-F1188 HydrophobicContact CD2-CG 3.62Å; L1162-F1188 HydrophobicContact CD2-CZ 4.09Å; M1184-F1188 WeakPolarHBondContact O-CB 3.48Å; M1184-F1188 PolarHBondContact O-N 2.98Å; M1185-F1188 PolarHBondContact O-N 3.47Å; F1188-L1191 PolarHBondContact O-N 2.83Å; F1188-L1192 HydrophobicContact CD1-CD1 3.77Å; F1188-L1192 HydrophobicContact CE1-CD1 3.39Å; F1188-L1192 HydrophobicContact CE2-CD1 4.36Å; F1188-L1192 HydrophobicContact CG-CD1 4.41Å; F1188-L1192 HydrophobicContact CZ-CD1 3.73Å; F1188-L1192 WeakPolarHBondContact O-CB 3.38Å; F1188-L1192 PolarHBondContact O-N 3.11Å
1189	I	48.8	Very low	45.4	Very low	36 Å²	36	76.9 Å²	76.9	19%	0.185	40%	0.395	C	S	.	.	H	α-helix	trans	-58.4	-48	168	-71.9	163.1	0	0	0	110.3	P1153 M1185 A1187 L1191 L1192 L1193	P1153-I1189 HydrophobicContact CG-CD1 3.96Å; P1153-I1189 HydrophobicContact CG-CG1 3.39Å; M1185-I1189 WeakPolarHBondContact O-CB 3.18Å; M1185-I1189 WeakPolarHBondContact O-CD1 3.49Å; M1185-I1189 WeakPolarHBondContact O-CG1 3.24Å; M1185-I1189 PolarHBondContact O-N 3.36Å; A1187-I1189 VanDerWaalsContact C-N 3.34Å; A1187-I1189 PolarHBondContact O-N 3.25Å; I1189-L1191 VanDerWaalsContact C-N 3.35Å; I1189-L1191 PolarHBondContact O-N 3.03Å; I1189-L1192 PolarHBondContact O-N 3.12Å; I1189-L1193 HydrophobicContact CG2-CD1 3.66Å; I1189-L1193 HydrophobicContact CG2-CG 4.26Å; I1189-L1193 WeakPolarHBondContact O-CB 3.47Å; I1189-L1193 VanDerWaalsContact O-CG 3.23Å; I1189-L1193 WeakPolarHBondContact O-CG 3.35Å; I1189-L1193 PolarHBondContact O-N 3.21Å
1190	F	41.2	Very low	44.2	Very low	143 Å²	143	83.6 Å²	83.6	63%	0.627	42%	0.42	S	S	*	.	H	α-helix	trans	-62.5	-39.5	179.3	-160.9	-102.2	0	0	0	112.6	E1186 A1187 L1194	E1186-F1190 WeakPolarHBondContact O-CB 3.39Å; E1186-F1190 PolarHBondContact O-N 3.19Å; E1186-F1190 VanDerWaalsContact O-N 3.1Å; A1187-F1190 WeakPolarHBondContact O-CA 3.46Å; A1187-F1190 WeakPolarHBondContact O-CB 3.28Å; A1187-F1190 PolarHBondContact O-N 3.03Å; A1187-F1190 VanDerWaalsContact O-N 3.08Å; F1190-L1194 HydrophobicContact CD1-CD1 3.73Å; F1190-L1194 HydrophobicContact CE1-CD1 3.48Å; F1190-L1194 VanDerWaalsContact CE1-CD1 3.48Å; F1190-L1194 HydrophobicContact CG-CD1 4.42Å; F1190-L1194 HydrophobicContact CZ-CD1 3.98Å; F1190-L1194 WeakPolarHBondContact O-CG 3.39Å; F1190-L1194 PolarHBondContact O-N 3.4Å
1191	L	44.2	Very low	43	Very low	66 Å²	66	89.8 Å²	89.8	35%	0.346	44%	0.443	S	S	.	.	H	α-helix	trans	-70.8	-36.1	177.1	-63.8	162.7	0	0	0	112.3	A1187 F1188 I1189 G1195 L1196	A1187-L1191 VanDerWaalsContact O-CG 3.22Å; A1187-L1191 WeakPolarHBondContact O-CG 3.41Å; A1187-L1191 PolarHBondContact O-N 3.16Å; F1188-L1191 PolarHBondContact O-N 2.83Å; I1189-L1191 VanDerWaalsContact C-N 3.35Å; I1189-L1191 PolarHBondContact O-N 3.03Å; L1191-G1195 CarbonylContact O-C 3.55Å; L1191-G1195 PolarHBondContact O-N 3.4Å; L1191-L1196 WeakPolarHBondContact CD2-O 3.17Å; L1191-L1196 PolarHBondContact O-N 3.2Å
1192	L	45.6	Very low	42.4	Very low	43 Å²	43	92.5 Å²	92.5	23%	0.225	46%	0.456	C	S	.	.	H	α-helix	trans	-65.7	-48.8	172.7	-109.5	145	0	0	0	111.9	F1188 I1189 L1194 G1195	F1188-L1192 HydrophobicContact CD1-CD1 3.77Å; F1188-L1192 HydrophobicContact CE1-CD1 3.39Å; F1188-L1192 HydrophobicContact CE2-CD1 4.36Å; F1188-L1192 HydrophobicContact CG-CD1 4.41Å; F1188-L1192 HydrophobicContact CZ-CD1 3.73Å; F1188-L1192 WeakPolarHBondContact O-CB 3.38Å; F1188-L1192 PolarHBondContact O-N 3.11Å; I1189-L1192 PolarHBondContact O-N 3.12Å; L1192-L1194 PolarHBondContact O-N 2.85Å; L1192-G1195 PolarHBondContact O-N 2.87Å
1193	L	38.6	Very low	42	Very low	72 Å²	72	88.9 Å²	88.9	38%	0.377	45%	0.449	S	S	.	.	H	α-helix	trans	-64.7	-24.9	-177	-72.2	175	0	0	0	113.4	N637 I1189	N637-L1193 HydrophobicContact CB-CD2 3.88Å; N637-L1193 WeakPolarHBondContact O-CD2 3.24Å; I1189-L1193 HydrophobicContact CG2-CD1 3.66Å; I1189-L1193 HydrophobicContact CG2-CG 4.26Å; I1189-L1193 WeakPolarHBondContact O-CB 3.47Å; I1189-L1193 VanDerWaalsContact O-CG 3.23Å; I1189-L1193 WeakPolarHBondContact O-CG 3.35Å; I1189-L1193 PolarHBondContact O-N 3.21Å
1194	L	36	Very low	41.4	Very low	97 Å²	97	87.6 Å²	87.6	51%	0.508	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-6.3	175.4	-64	170.9	0	0	0	113.1	F1190 L1192 L1196	F1190-L1194 HydrophobicContact CD1-CD1 3.73Å; F1190-L1194 HydrophobicContact CE1-CD1 3.48Å; F1190-L1194 VanDerWaalsContact CE1-CD1 3.48Å; F1190-L1194 HydrophobicContact CG-CD1 4.42Å; F1190-L1194 HydrophobicContact CZ-CD1 3.98Å; F1190-L1194 WeakPolarHBondContact O-CG 3.39Å; F1190-L1194 PolarHBondContact O-N 3.4Å; L1192-L1194 PolarHBondContact O-N 2.85Å; L1194-L1196 HydrophobicContact CB-CB 4.12Å; L1194-L1196 HydrophobicContact CB-CD1 3.8Å; L1194-L1196 HydrophobicContact CB-CG 3.73Å; L1194-L1196 HydrophobicContact CD1-CD1 4.05Å; L1194-L1196 PolarHBondContact O-N 2.92Å; L1194-L1196 VanDerWaalsContact O-N 3.15Å
1195	G	36.1	Very low	40.6	Very low	51 Å²	51	89.4 Å²	89.4	53%	0.526	45%	0.452	S	S	.	.	S	Bend	trans	69.4	-5.4	-167.2	0	0	0	0	0	114.5	L1191 L1192 V1197	L1191-G1195 CarbonylContact O-C 3.55Å; L1191-G1195 PolarHBondContact O-N 3.4Å; L1192-G1195 PolarHBondContact O-N 2.87Å; G1195-V1197 PolarHBondContact O-N 3.14Å
1196	L	35.6	Very low	39.8	Very low	71 Å²	71	92.6 Å²	92.6	37%	0.372	47%	0.469	S	S	.	.			trans	-79.5	51.3	-170.9	-60.1	176.8	0	0	0	113.6	L1191 L1194 E1198	L1191-L1196 WeakPolarHBondContact CD2-O 3.17Å; L1191-L1196 PolarHBondContact O-N 3.2Å; L1194-L1196 HydrophobicContact CB-CB 4.12Å; L1194-L1196 HydrophobicContact CB-CD1 3.8Å; L1194-L1196 HydrophobicContact CB-CG 3.73Å; L1194-L1196 HydrophobicContact CD1-CD1 4.05Å; L1194-L1196 PolarHBondContact O-N 2.92Å; L1194-L1196 VanDerWaalsContact O-N 3.15Å; L1196-E1198 HydrophobicContact CB-CG 4.44Å; L1196-E1198 HydrophobicContact CD2-CG 4.21Å; L1196-E1198 WeakPolarHBondContact CD2-OE1 3.33Å; L1196-E1198 PolarHBondContact O-N 3.09Å
1197	V	36	Very low	39.1	Very low	50 Å²	50	92.2 Å²	92.2	30%	0.303	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	58.9	166.1	-168.1	0	0	0	0	109.2	G1195	G1195-V1197 PolarHBondContact O-N 3.14Å
1198	E	44.8	Very low	38.4	Very low	108 Å²	108	95.3 Å²	95.3	51%	0.505	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112	-37.7	-161.6	-80.1	-168.6	177.1	0	0	115	L1196	L1196-E1198 HydrophobicContact CB-CG 4.44Å; L1196-E1198 HydrophobicContact CD2-CG 4.21Å; L1196-E1198 WeakPolarHBondContact CD2-OE1 3.33Å; L1196-E1198 PolarHBondContact O-N 3.09Å
1199	K	28.6	Very low	37.5	Very low	173 Å²	173	101.1 Å²	101.1	75%	0.752	50%	0.504	S	S	*	.			trans	-142.5	82	-159.9	-73.6	168.4	-172.2	116.5	0	113.5
1200	E	25.2	Very low	36.6	Very low	201 Å²	201	106.5 Å²	106.5	94%	0.939	53%	0.53	S	S	*	.			trans	-152.8	135.4	148.3	-123.5	171.2	-155.9	0	0	110.7
1201	K	26.9	Very low	36.1	Very low	203 Å²	203	103.2 Å²	103.2	88%	0.883	52%	0.521	S	S	*	.			trans	-158.4	0	-176.4	-156.9	-152.7	-176.2	-165	0	111.4	N45	N45-K1201 VanDerWaalsContact CG-NZ 3.3Å; N45-K1201 PolarHBondContact OD1-NZ 3.32Å

Retrieved 1,201 of 1,201 residues in 567.7 ms (Link to these results)

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