A0A077YYY9_TRITR Loading...

Protein nlg c protein nlg b protein nlg a

AlphaFold DB , UniProt , Accession A0A077YYY9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 865 aa.

						>A0A077YYY9_TRITR|A0A077YYY9
MNRGAAYLILLFQLLLLDAPADGSEGDIKIVQTSFGKLRGRVVHFRHLGLPSVEQYLGVPYGTAPTGSKRFMMPQTAAKWTNVIKDATDMPPACVQLWPRSIMQKSRSEALKVVNERIHGQVKRLVAMLRDQREDCLYMNLFVPARRGKYRTIVDLFFAFPKLNFLKKPQTELMPVLVIIHGDSYNWNSGTLYDGSILAAYGKLIVVTLNYRLGVFGFLSSGDPTCKGNWALSDIVCALDVLRAMVSDFGGDPTMVTLLGWDTGAALVNLLMSSPISAPVDSRLFRRAILLGGSALSSWALVTSPSEYFYQLADGLGCQIYKQNHFGQQTLLAVEDVLECIQTDSVENITRAAALLDLPTFLTNFGPVIDGIVVNTDPAYNLENHGSLFQEIDLLVGATKHEAYDQLSTEHLQYGLDVKNRDAIYRTFVRNMYSFHRTEIFNAIVNEYNDWYNPGQHPITVRDSVLEAISDALYLAPLTKVVRLHAQGKTPGGVHRTEDGTQRGKTFFYLFSHETSGNPRYGLKGSIHAEDLPYILGYPLLNNQPPSIELNAFDFTFNKQERVISEVLMRYIANFVKSGQELTGYIEAASRDYPKVDSFYRAHEIAFWNNFLPSLESTGRTESNPEHHLLPQHFLKNSYFGVVRPYDVGKMPFPPPPLPPTPIPTELTTILQNQQPAQVKITPQKEASSGSQSSQETATNYSTILSVTIAVGCALLILNLLVFAGIYRQRERHRKGKPQENSAGLLLQETSPYDMTATYGGLIPSGSGQYSGSGMTLPPASPVTTSVRDGEAYPYMQLQQRSSVANAYAGSGSQQMIVPPEEDATFGIAMHQQPQAISPVCPRHGKLAAAAASQAPKTQLEEIQV
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.1	Low	64.9	Low	225 Å²	225	123 Å²	123	100%	1.108	64%	0.638	S	S	*	*				0	-20.8	0	-78.8	154.4	72.5	0	0	114.6	R3	M1-R3 PolarHBondContact O-N 3.4Å
2	N	55.6	Low	65	Low	149 Å²	149	124.2 Å²	124.2	80%	0.797	64%	0.635	S	S	*	*	H	α-helix	trans	-78.8	-14.3	-174.8	-72.7	-1.8	0	0	0	117.2
3	R	58	Low	65	Low	229 Å²	229	123.3 Å²	123.3	86%	0.864	63%	0.626	S	S	*	*	H	α-helix	trans	-82.3	-26.9	179.8	-73.8	-174.9	168.9	-178.7	-3.5	114	M1	M1-R3 PolarHBondContact O-N 3.4Å
4	G	65.8	Low	64.7	Low	44 Å²	44	121.8 Å²	121.8	45%	0.454	62%	0.62	S	S	.	*	H	α-helix	trans	-75	-36.2	178.8	0	0	0	0	0	113.2	Y7 L8	G4-Y7 PolarHBondContact O-N 3.48Å; G4-L8 PolarHBondContact O-N 3.44Å; G4-L8 VanDerWaalsContact O-N 3.16Å
5	A	67.1	Low	64.3	Low	54 Å²	54	122.1 Å²	122.1	45%	0.446	62%	0.623	S	S	.	*	H	α-helix	trans	-67.2	-38.6	178	0	0	0	0	0	112.3	Y7 L8 I9	A5-Y7 VanDerWaalsContact C-N 3.33Å; A5-Y7 PolarHBondContact O-N 3.46Å; A5-L8 PolarHBondContact O-N 3.4Å; A5-I9 VanDerWaalsContact O-CG1 3.28Å; A5-I9 WeakPolarHBondContact O-CG1 3.48Å; A5-I9 PolarHBondContact O-N 2.9Å
6	A	68.5	Low	63.7	Low	57 Å²	57	121.8 Å²	121.8	47%	0.471	62%	0.622	S	S	.	*	H	α-helix	trans	-63.9	-37.7	176.5	0	0	0	0	0	112.3	L10	A6-L10 WeakPolarHBondContact O-CB 3.47Å; A6-L10 PolarHBondContact O-N 3.26Å
7	Y	67.7	Low	62.8	Low	175 Å²	175	123 Å²	123	69%	0.686	63%	0.629	S	S	*	*	H	α-helix	trans	-69.1	-39.3	176.9	-113.2	-86.2	0	0	0	112.7	G4 A5 L10 L11	G4-Y7 PolarHBondContact O-N 3.48Å; A5-Y7 VanDerWaalsContact C-N 3.33Å; A5-Y7 PolarHBondContact O-N 3.46Å; Y7-L10 PolarHBondContact O-N 3.28Å; Y7-L11 WeakPolarHBondContact O-CB 3.46Å; Y7-L11 PolarHBondContact O-N 3.23Å
8	L	70.1	Confident	61.6	Low	121 Å²	121	123.9 Å²	123.9	63%	0.634	64%	0.636	S	S	*	*	H	α-helix	trans	-66.7	-39.7	175.9	-90.3	157.6	0	0	0	112.1	G4 A5 L11 F12	G4-L8 PolarHBondContact O-N 3.44Å; G4-L8 VanDerWaalsContact O-N 3.16Å; A5-L8 PolarHBondContact O-N 3.4Å; L8-L11 PolarHBondContact O-N 2.96Å; L8-F12 WeakPolarHBondContact O-CB 3.43Å; L8-F12 PolarHBondContact O-N 2.86Å
9	I	73	Confident	60.7	Low	101 Å²	101	121.3 Å²	121.3	52%	0.518	63%	0.634	S	S	.	*	H	α-helix	trans	-67.1	-39.8	175.8	-66	165.6	0	0	0	110.8	A5 F12 Q13	A5-I9 VanDerWaalsContact O-CG1 3.28Å; A5-I9 WeakPolarHBondContact O-CG1 3.48Å; A5-I9 PolarHBondContact O-N 2.9Å; I9-F12 PolarHBondContact O-N 3.26Å; I9-Q13 WeakPolarHBondContact O-CB 3.48Å; I9-Q13 WeakPolarHBondContact O-CG 3.28Å; I9-Q13 PolarHBondContact O-N 2.83Å
10	L	69.4	Low	59.8	Low	103 Å²	103	120 Å²	120	54%	0.539	63%	0.634	S	S	.	*	H	α-helix	trans	-65.4	-40.7	175.9	-134.5	99.2	0	0	0	111.8	A6 Y7 Q13 L14	A6-L10 WeakPolarHBondContact O-CB 3.47Å; A6-L10 PolarHBondContact O-N 3.26Å; Y7-L10 PolarHBondContact O-N 3.28Å; L10-Q13 PolarHBondContact O-N 3.03Å; L10-L14 HydrophobicContact CD2-CD1 4.35Å; L10-L14 WeakPolarHBondContact O-CB 3.37Å; L10-L14 PolarHBondContact O-N 2.86Å
11	L	66.6	Low	58.7	Low	95 Å²	95	118.9 Å²	118.9	50%	0.497	64%	0.641	S	S	.	*	H	α-helix	trans	-64.9	-39.8	174.4	-90.3	157.5	0	0	0	111.9	Y7 L8 L14 L15	Y7-L11 WeakPolarHBondContact O-CB 3.46Å; Y7-L11 PolarHBondContact O-N 3.23Å; L8-L11 PolarHBondContact O-N 2.96Å; L11-L14 PolarHBondContact O-N 3.33Å; L11-L15 WeakPolarHBondContact O-CB 3.49Å; L11-L15 WeakPolarHBondContact O-CD1 3.41Å; L11-L15 WeakPolarHBondContact O-CG 3.46Å; L11-L15 PolarHBondContact O-N 3.01Å
12	F	66.6	Low	57.7	Low	137 Å²	137	116.7 Å²	116.7	60%	0.601	63%	0.634	S	S	*	*	H	α-helix	trans	-70.2	-35.9	177.1	-139.4	-93.6	0	0	0	111.9	L8 I9 L15 L16	L8-F12 WeakPolarHBondContact O-CB 3.43Å; L8-F12 PolarHBondContact O-N 2.86Å; I9-F12 PolarHBondContact O-N 3.26Å; F12-L15 PolarHBondContact O-N 3.06Å; F12-L16 HydrophobicContact CD1-CD1 3.66Å; F12-L16 HydrophobicContact CD1-CG 4.29Å; F12-L16 HydrophobicContact CE1-CD1 4.04Å; F12-L16 WeakPolarHBondContact O-CB 3.27Å; F12-L16 WeakPolarHBondContact O-CD1 3.45Å; F12-L16 VanDerWaalsContact O-CG 3.3Å; F12-L16 WeakPolarHBondContact O-CG 3.49Å; F12-L16 PolarHBondContact O-N 3.36Å
13	Q	64.3	Low	56.6	Low	113 Å²	113	112.4 Å²	112.4	53%	0.528	63%	0.626	S	S	.	*	H	α-helix	trans	-68.4	-40.5	172.6	-78.6	-178.4	-29.4	0	0	112.1	I9 L10 L15 L16 L17	I9-Q13 WeakPolarHBondContact O-CB 3.48Å; I9-Q13 WeakPolarHBondContact O-CG 3.28Å; I9-Q13 PolarHBondContact O-N 2.83Å; L10-Q13 PolarHBondContact O-N 3.03Å; Q13-L15 VanDerWaalsContact C-N 3.34Å; Q13-L16 PolarHBondContact O-N 3.31Å; Q13-L17 WeakPolarHBondContact O-CB 3.42Å; Q13-L17 WeakPolarHBondContact O-CD1 3.4Å; Q13-L17 PolarHBondContact O-N 3.04Å
14	L	60.9	Low	55.5	Low	102 Å²	102	107.7 Å²	107.7	53%	0.534	63%	0.627	S	S	.	*	H	α-helix	trans	-65.7	-33.8	173.5	-89.7	151.1	0	0	0	112.6	L10 L11	L10-L14 HydrophobicContact CD2-CD1 4.35Å; L10-L14 WeakPolarHBondContact O-CB 3.37Å; L10-L14 PolarHBondContact O-N 2.86Å; L11-L14 PolarHBondContact O-N 3.33Å
15	L	58.8	Low	54.4	Low	127 Å²	127	114 Å²	114	67%	0.665	65%	0.645	S	S	*	*	H	α-helix	trans	-75.5	-25.4	174.9	-79.7	161.1	0	0	0	113.4	L11 F12 Q13	L11-L15 WeakPolarHBondContact O-CB 3.49Å; L11-L15 WeakPolarHBondContact O-CD1 3.41Å; L11-L15 WeakPolarHBondContact O-CG 3.46Å; L11-L15 PolarHBondContact O-N 3.01Å; F12-L15 PolarHBondContact O-N 3.06Å; Q13-L15 VanDerWaalsContact C-N 3.34Å
16	L	54.4	Low	53.9	Low	117 Å²	117	113.8 Å²	113.8	61%	0.613	65%	0.649	S	S	*	*	H	α-helix	trans	-86.3	-21	176	-76.4	166.5	0	0	0	113.3	F12 Q13 D18	F12-L16 HydrophobicContact CD1-CD1 3.66Å; F12-L16 HydrophobicContact CD1-CG 4.29Å; F12-L16 HydrophobicContact CE1-CD1 4.04Å; F12-L16 WeakPolarHBondContact O-CB 3.27Å; F12-L16 WeakPolarHBondContact O-CD1 3.45Å; F12-L16 VanDerWaalsContact O-CG 3.3Å; F12-L16 WeakPolarHBondContact O-CG 3.49Å; F12-L16 PolarHBondContact O-N 3.36Å; Q13-L16 PolarHBondContact O-N 3.31Å; L16-D18 VanDerWaalsContact C-N 3.26Å; L16-D18 PolarHBondContact O-N 3.44Å
17	L	47.9	Very low	54.4	Low	142 Å²	142	115.7 Å²	115.7	74%	0.743	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-10.5	175.9	-93	149	0	0	0	113.9	Q13	Q13-L17 WeakPolarHBondContact O-CB 3.42Å; Q13-L17 WeakPolarHBondContact O-CD1 3.4Å; Q13-L17 PolarHBondContact O-N 3.04Å
18	D	42.7	Very low	55.4	Low	140 Å²	140	112.4 Å²	112.4	75%	0.749	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	13.1	177.5	-95.9	-21.5	0	0	0	113.6	L16 P20	L16-D18 VanDerWaalsContact C-N 3.26Å; L16-D18 PolarHBondContact O-N 3.44Å; D18-P20 WeakPolarHBondContact O-CD 3.27Å
19	A	43.1	Very low	56.4	Low	73 Å²	73	110.5 Å²	110.5	60%	0.603	63%	0.631	S	S	*	*			trans	-72.6	111.9	168.2	0	0	0	0	0	109	A21	A19-A21 PolarHBondContact O-N 3.47Å; A19-A21 VanDerWaalsContact O-N 3.1Å
20	P	42.5	Very low	57.4	Low	96 Å²	96	109.6 Å²	109.6	62%	0.623	63%	0.626	S	S	*	*			trans	-67	117.8	176.5	27.8	-30	0	0	0	107.8	D18 D22	D18-P20 WeakPolarHBondContact O-CD 3.27Å; P20-D22 PolarHBondContact O-N 3.46Å
21	A	37.7	Very low	58.5	Low	96 Å²	96	105.6 Å²	105.6	79%	0.793	61%	0.605	S	S	*	*			trans	-53.1	129.8	171.7	0	0	0	0	0	109.6	A19 G23	A19-A21 PolarHBondContact O-N 3.47Å; A19-A21 VanDerWaalsContact O-N 3.1Å; A21-G23 PolarHBondContact O-N 2.9Å
22	D	30.4	Very low	59.8	Low	179 Å²	179	106.3 Å²	106.3	96%	0.957	61%	0.606	S	S	*	*			trans	-68.8	97.6	173.3	-154.3	13.4	0	0	0	107.3	P20	P20-D22 PolarHBondContact O-N 3.46Å
23	G	32.3	Very low	61	Low	60 Å²	60	100.2 Å²	100.2	62%	0.619	58%	0.58	S	S	*	*			trans	-142.6	103.3	-170.6	0	0	0	0	0	110.8	A21 E25	A21-G23 PolarHBondContact O-N 2.9Å; G23-E25 PolarHBondContact O-N 3.44Å; G23-E25 VanDerWaalsContact O-N 3.1Å
24	S	35	Very low	62.2	Low	129 Å²	129	97 Å²	97	90%	0.902	57%	0.57	S	S	*	*			trans	-72.8	84.6	-178.4	55.3	0	0	0	0	112.8
25	E	42.6	Very low	63.7	Low	177 Å²	177	92.6 Å²	92.6	83%	0.827	55%	0.547	S	S	*	.	S	Bend	trans	-162.7	113.2	156.2	-148.5	168.4	-170.9	0	0	106.1	G23 D27	G23-E25 PolarHBondContact O-N 3.44Å; G23-E25 VanDerWaalsContact O-N 3.1Å; E25-D27 PolarHBondContact O-N 3.03Å
26	G	57.8	Low	65.4	Low	50 Å²	50	86.7 Å²	86.7	52%	0.515	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-51.4	122.9	-163.8	0	0	0	0	0	113.4	I28	G26-I28 PolarHBondContact O-N 3.38Å; G26-I28 VanDerWaalsContact O-N 3.08Å
27	D	79.5	Confident	67.4	Low	97 Å²	97	85.9 Å²	85.9	52%	0.519	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-46.9	117.6	-175.5	-79.5	-21.6	0	0	0	110.9	E25 R41 V42 H44	E25-D27 PolarHBondContact O-N 3.03Å; D27-R41 CarbonylContact O-C 3.59Å; D27-V42 HydrophobicContact CB-CB 3.99Å; D27-V42 HydrophobicContact CB-CG2 4.25Å; D27-V42 WeakPolarHBondContact O-CB 3.45Å; D27-V42 WeakPolarHBondContact O-CG2 3.29Å; D27-V42 PolarHBondContact O-N 3.25Å; D27-H44 IonicContact OD2-NE2 3.68Å
28	I	87.7	Confident	69.6	Low	105 Å²	105	79.1 Å²	79.1	54%	0.538	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	134.1	-178.5	-63.9	175.9	0	0	0	109.6	G26 R39	G26-I28 PolarHBondContact O-N 3.38Å; G26-I28 VanDerWaalsContact O-N 3.08Å; I28-R39 HydrophobicContact CG2-CG 3.49Å; I28-R39 VanDerWaalsContact CG2-CG 3.49Å
29	K	91.7	Very high	72.2	Confident	82 Å²	82	77 Å²	77	36%	0.357	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	132.9	176.2	-174	71	178.4	-130	0	111.2	R39 G40 V42 E54 Y56	K29-R39 CarbonylContact O-C 3.58Å; K29-R39 WeakPolarHBondContact O-CA 3.39Å; K29-G40 PolarHBondContact N-O 2.71Å; K29-G40 PolarHBondContact O-N 3.21Å; K29-V42 HydrophobicContact CB-CG2 4.07Å; K29-E54 VanDerWaalsContact CE-OE1 3.3Å; K29-E54 WeakPolarHBondContact CE-OE1 3.4Å; K29-E54 HydrophobicContact CG-CG 4.41Å; K29-E54 IonicContact NZ-OE1 3.88Å; K29-E54 PolarHBondContact NZ-OE1 3.21Å; K29-E54 IonicContact NZ-OE2 2.7Å; K29-Y56 VanDerWaalsContact CG-OH 3.24Å; K29-Y56 WeakPolarHBondContact CG-OH 3.34Å
30	I	92.8	Very high	74.7	Confident	82 Å²	82	73.5 Å²	73.5	42%	0.421	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	129.2	173.2	-59.4	174.5	0	0	0	109.3	K37 L38 I84	I30-K37 HydrophobicContact CG2-CB 4.4Å; I30-L38 VanDerWaalsContact CA-O 3.29Å; I30-L38 WeakPolarHBondContact CA-O 3.12Å; I30-I84 HydrophobicContact CD1-CD1 4.38Å
31	V	92.8	Very high	77.2	Confident	18 Å²	18	71.9 Å²	71.9	11%	0.109	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	138.4	173.1	68.3	0	0	0	0	109.8	T33 K37 L38 Y56 F249	V31-T33 HydrophobicContact CG1-CG2 4.05Å; V31-K37 WeakPolarHBondContact O-CA 3.33Å; V31-L38 HydrophobicContact CG1-CB 3.91Å; V31-L38 PolarHBondContact N-O 2.94Å; V31-L38 PolarHBondContact O-N 2.99Å; V31-Y56 HydrophobicContact CB-CE1 4.16Å; V31-Y56 HydrophobicContact CG1-CD1 4.14Å; V31-Y56 HydrophobicContact CG1-CE1 3.42Å; V31-Y56 VanDerWaalsContact CG1-CE1 3.42Å; V31-F249 HydrophobicContact CG1-CD1 4.2Å; V31-F249 HydrophobicContact CG1-CE1 3.56Å; V31-F249 HydrophobicContact CG1-CZ 3.98Å; V31-F249 HydrophobicContact CG2-CD1 4.47Å
32	Q	93.5	Very high	79.8	Confident	111 Å²	111	68.3 Å²	68.3	52%	0.519	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	119.9	172.1	177	64.3	57.9	0	0	108.1
33	T	92.7	Very high	82.8	Confident	8 Å²	8	61.1 Å²	61.1	5%	0.049	34%	0.338	C	S	.	.			trans	-111.3	171.4	174.7	78.2	0	0	0	0	112.3	V31 F35 G36 L38 D248 F249	V31-T33 HydrophobicContact CG1-CG2 4.05Å; T33-F35 PolarHBondContact O-N 3.47Å; T33-F35 PolarHBondContact OG1-N 2.99Å; T33-G36 PolarHBondContact N-O 2.93Å; T33-G36 PolarHBondContact O-N 3.36Å; T33-G36 PolarHBondContact OG1-N 2.8Å; T33-G36 PolarHBondContact OG1-O 2.77Å; T33-L38 HydrophobicContact CG2-CD1 3.8Å; T33-L38 HydrophobicContact CG2-CG 4.47Å; T33-D248 WeakPolarHBondContact CA-OD2 3.33Å; T33-D248 HydrophobicContact CG2-CB 4.3Å; T33-F249 HydrophobicContact CG2-CE2 3.77Å; T33-F249 HydrophobicContact CG2-CZ 3.78Å
34	S	90.2	Very high	85.6	Confident	46 Å²	46	61.8 Å²	61.8	32%	0.322	33%	0.325	S	S	.	.	S	Bend	trans	-61.9	-15.6	171.7	66.4	0	0	0	0	115	K79 A244 D248	S34-K79 PolarHBondContact O-NZ 3.25Å; S34-A244 WeakPolarHBondContact CB-O 3.29Å; S34-A244 PolarHBondContact OG-O 3.36Å; S34-D248 PolarHBondContact N-OD2 2.92Å
35	F	92.3	Very high	88	Confident	10 Å²	10	56 Å²	56	4%	0.044	28%	0.283	C	S	.	.	S	Bend	trans	-100.7	-25.1	176	-74.6	-100.1	0	0	0	113.3	T33 T76 K79 W80 V241 A244 M245	T33-F35 PolarHBondContact O-N 3.47Å; T33-F35 PolarHBondContact OG1-N 2.99Å; F35-T76 HydrophobicContact CE1-CG2 4.08Å; F35-T76 HydrophobicContact CZ-CG2 4.26Å; F35-K79 HydrophobicContact CD1-CG 3.88Å; F35-K79 HydrophobicContact CE1-CG 4.45Å; F35-K79 HydrophobicContact CG-CG 4.44Å; F35-K79 CarbonylContact O-C 3.59Å; F35-K79 WeakPolarHBondContact O-CA 2.99Å; F35-K79 WeakPolarHBondContact O-CB 3.4Å; F35-W80 HydrophobicContact CB-CD2 4.22Å; F35-W80 HydrophobicContact CB-CE3 4.22Å; F35-W80 HydrophobicContact CB-CH2 3.55Å; F35-W80 HydrophobicContact CB-CZ2 3.54Å; F35-W80 HydrophobicContact CB-CZ3 3.89Å; F35-W80 HydrophobicContact CD1-CH2 4.29Å; F35-W80 HydrophobicContact CD1-CZ3 4.13Å; F35-W80 HydrophobicContact CG-CH2 4.06Å; F35-W80 HydrophobicContact CG-CZ2 4.48Å; F35-W80 HydrophobicContact CG-CZ3 4.31Å; F35-W80 CarbonylContact O-C 3.32Å; F35-W80 PolarHBondContact O-N 2.88Å; F35-V241 HydrophobicContact CE2-CG1 3.95Å; F35-V241 HydrophobicContact CZ-CB 4.45Å; F35-V241 HydrophobicContact CZ-CG1 3.95Å; F35-V241 HydrophobicContact CZ-CG2 4.13Å; F35-A244 HydrophobicContact CE2-CB 4.2Å; F35-M245 HydrophobicContact CD2-CB 4.42Å
36	G	93.9	Very high	90	Very high	3 Å²	3	55.8 Å²	55.8	3%	0.031	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.7	-168.3	179.7	0	0	0	0	0	112.3	T33 W80	T33-G36 PolarHBondContact N-O 2.93Å; T33-G36 PolarHBondContact O-N 3.36Å; T33-G36 PolarHBondContact OG1-N 2.8Å; T33-G36 PolarHBondContact OG1-O 2.77Å; G36-W80 WeakPolarHBondContact CA-O 3.26Å
37	K	95.9	Very high	91.2	Very high	99 Å²	99	59.4 Å²	59.4	43%	0.43	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	133.5	176.6	-69.7	179.6	-178	177.1	0	110.3	I30 V31 W80 I84 K85	I30-K37 HydrophobicContact CG2-CB 4.4Å; V31-K37 WeakPolarHBondContact O-CA 3.33Å; K37-W80 PolarHBondContact O-NE1 2.83Å; K37-I84 HydrophobicContact CB-CB 4.35Å; K37-I84 HydrophobicContact CB-CG1 3.93Å; K37-I84 HydrophobicContact CB-CG2 4.24Å; K37-I84 HydrophobicContact CD-CG1 4.16Å; K37-K85 PolarHBondContact O-N 3.31Å
38	L	95.6	Very high	91.5	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	135.9	173.5	-73.2	166.4	0	0	0	109.9	I30 V31 T33 Y56 V59 W80 K85 A87 F249	I30-L38 VanDerWaalsContact CA-O 3.29Å; I30-L38 WeakPolarHBondContact CA-O 3.12Å; V31-L38 HydrophobicContact CG1-CB 3.91Å; V31-L38 PolarHBondContact N-O 2.94Å; V31-L38 PolarHBondContact O-N 2.99Å; T33-L38 HydrophobicContact CG2-CD1 3.8Å; T33-L38 HydrophobicContact CG2-CG 4.47Å; L38-Y56 HydrophobicContact CB-CD1 4.1Å; L38-Y56 HydrophobicContact CB-CE1 4.43Å; L38-V59 HydrophobicContact CD1-CG1 4.02Å; L38-V59 HydrophobicContact CD1-CG2 4.07Å; L38-V59 HydrophobicContact CD2-CG1 4.43Å; L38-V59 HydrophobicContact CD2-CG2 4.29Å; L38-W80 HydrophobicContact CD1-CZ2 4.25Å; L38-W80 HydrophobicContact CD2-CZ2 3.95Å; L38-W80 HydrophobicContact CG-CZ2 4.16Å; L38-K85 WeakPolarHBondContact CA-O 3.24Å; L38-K85 HydrophobicContact CD2-CB 3.79Å; L38-K85 HydrophobicContact CD2-CG 3.86Å; L38-A87 HydrophobicContact CD2-CB 4.14Å; L38-F249 HydrophobicContact CD1-CZ 3.79Å
39	R	96.3	Very high	91.5	Very high	96 Å²	96	55.6 Å²	55.6	36%	0.362	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	116.4	170.8	176	-176.6	-87.8	-176.7	-8.8	108.5	I28 K29 I84 K85 A87 T88	I28-R39 HydrophobicContact CG2-CG 3.49Å; I28-R39 VanDerWaalsContact CG2-CG 3.49Å; K29-R39 CarbonylContact O-C 3.58Å; K29-R39 WeakPolarHBondContact O-CA 3.39Å; R39-I84 HydrophobicContact CB-CG2 3.81Å; R39-K85 PolarHBondContact N-O 3.08Å; R39-A87 CarbonylContact O-C 3.5Å; R39-A87 VanDerWaalsContact O-C 3.29Å; R39-A87 VanDerWaalsContact O-CA 3.27Å; R39-A87 WeakPolarHBondContact O-CA 3.16Å; R39-A87 WeakPolarHBondContact O-CB 3.22Å; R39-A87 PolarHBondContact O-N 2.98Å; R39-T88 HydrophobicContact CG-CG2 4.25Å
40	G	95.6	Very high	91.4	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	-175.6	172.7	0	0	0	0	0	111.9	K29 Q55	K29-G40 PolarHBondContact N-O 2.71Å; K29-G40 PolarHBondContact O-N 3.21Å; G40-Q55 CarbonylContact C-O 3.56Å; G40-Q55 WeakPolarHBondContact CA-O 3.37Å
41	R	94.4	Very high	91.4	Very high	61 Å²	61	51.4 Å²	51.4	23%	0.23	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	152.5	179.1	66.7	-175.4	-168.7	172.9	11.7	111.2	D27 Q55 T88 S547	D27-R41 CarbonylContact O-C 3.59Å; R41-Q55 HydrophobicContact CG-CB 3.99Å; R41-Q55 VanDerWaalsContact CZ-OE1 3.27Å; R41-Q55 PolarHBondContact N-O 2.95Å; R41-Q55 PolarHBondContact O-N 3.48Å; R41-T88 HydrophobicContact CB-CG2 4.34Å; R41-S547 PolarHBondContact NH2-O 2.51Å
42	V	94	Very high	91.4	Very high	22 Å²	22	52 Å²	52	13%	0.133	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	132.3	176.5	-178.7	0	0	0	0	110.3	D27 K29 V53 E54	D27-V42 HydrophobicContact CB-CB 3.99Å; D27-V42 HydrophobicContact CB-CG2 4.25Å; D27-V42 WeakPolarHBondContact O-CB 3.45Å; D27-V42 WeakPolarHBondContact O-CG2 3.29Å; D27-V42 PolarHBondContact O-N 3.25Å; K29-V42 HydrophobicContact CB-CG2 4.07Å; V42-V53 WeakPolarHBondContact CA-O 3.49Å; V42-E54 HydrophobicContact CG2-CG 4.31Å
43	V	91.7	Very high	91.5	Very high	27 Å²	27	46.7 Å²	46.7	16%	0.164	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	135.1	175.9	179	0	0	0	0	109.8	F45 S52 V53 Q55	V43-F45 HydrophobicContact CB-CE2 4.27Å; V43-F45 HydrophobicContact CB-CZ 4.46Å; V43-F45 HydrophobicContact CG1-CD2 4.47Å; V43-F45 HydrophobicContact CG1-CE1 4.18Å; V43-F45 HydrophobicContact CG1-CE2 3.73Å; V43-F45 HydrophobicContact CG1-CZ 3.56Å; V43-S52 CarbonylContact O-C 3.51Å; V43-S52 WeakPolarHBondContact O-CA 3.06Å; V43-S52 WeakPolarHBondContact O-CB 3.45Å; V43-V53 PolarHBondContact N-O 2.78Å; V43-V53 PolarHBondContact O-N 3.02Å; V43-Q55 VanDerWaalsContact CG2-CD 3.45Å; V43-Q55 HydrophobicContact CG2-CG 4.14Å
44	H	90.7	Very high	91.7	Very high	75 Å²	75	48 Å²	48	35%	0.347	25%	0.246	S	C	.	.			trans	-109.3	126.1	-177.6	-61.1	-68.2	0	0	0	112.5	D27 R46 S52	D27-H44 IonicContact OD2-NE2 3.68Å; H44-R46 HydrophobicContact CB-CG 4.31Å; H44-S52 WeakPolarHBondContact ND1-CB 3.48Å
45	F	87.3	Confident	91.9	Very high	7 Å²	7	45.8 Å²	45.8	3%	0.031	23%	0.23	C	C	.	.			trans	-106.3	41.2	176.8	-62.1	-77.7	0	0	0	112.2	V43 H47 L48 G49 L50 V53 S196 I197	V43-F45 HydrophobicContact CB-CE2 4.27Å; V43-F45 HydrophobicContact CB-CZ 4.46Å; V43-F45 HydrophobicContact CG1-CD2 4.47Å; V43-F45 HydrophobicContact CG1-CE1 4.18Å; V43-F45 HydrophobicContact CG1-CE2 3.73Å; V43-F45 HydrophobicContact CG1-CZ 3.56Å; F45-H47 PolarHBondContact O-N 3.09Å; F45-H47 VanDerWaalsContact O-N 3.16Å; F45-L48 HydrophobicContact CD1-CD1 4.28Å; F45-L48 PolarHBondContact O-N 3.35Å; F45-G49 PolarHBondContact O-N 3.43Å; F45-L50 HydrophobicContact CB-CB 3.79Å; F45-L50 PolarHBondContact O-N 3.3Å; F45-V53 HydrophobicContact CD2-CG2 4.19Å; F45-V53 HydrophobicContact CE2-CB 4.18Å; F45-V53 HydrophobicContact CE2-CG2 3.81Å; F45-S196 VanDerWaalsContact CZ-CB 3.44Å; F45-I197 HydrophobicContact CE1-CG1 4.19Å
46	R	84.4	Confident	92.2	Very high	173 Å²	173	45.3 Å²	45.3	65%	0.653	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-55	-36.7	-176	-64.7	-178.6	-169.3	176.7	5.4	112.4	H44 L48 G49	H44-R46 HydrophobicContact CB-CG 4.31Å; R46-L48 VanDerWaalsContact C-N 3.25Å; R46-L48 PolarHBondContact O-N 2.98Å; R46-G49 PolarHBondContact O-N 3.09Å; R46-G49 VanDerWaalsContact O-N 3.15Å
47	H	83.4	Confident	92.3	Very high	125 Å²	125	45.3 Å²	45.3	58%	0.579	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-67	-20.8	179.6	64.2	-84.2	0	0	0	114.2	F45	F45-H47 PolarHBondContact O-N 3.09Å; F45-H47 VanDerWaalsContact O-N 3.16Å
48	L	85.1	Confident	92.3	Very high	51 Å²	51	41 Å²	41	27%	0.267	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-99.6	-0.9	175.9	-57.3	177.2	0	0	0	112.6	F45 R46 L50 I197 L540	F45-L48 HydrophobicContact CD1-CD1 4.28Å; F45-L48 PolarHBondContact O-N 3.35Å; R46-L48 VanDerWaalsContact C-N 3.25Å; R46-L48 PolarHBondContact O-N 2.98Å; L48-L50 HydrophobicContact CB-CB 4.28Å; L48-L50 HydrophobicContact CB-CD1 3.91Å; L48-L50 HydrophobicContact CB-CG 3.82Å; L48-L50 HydrophobicContact CD1-CD1 3.95Å; L48-L50 PolarHBondContact O-N 2.99Å; L48-I197 HydrophobicContact CD1-CD1 4.23Å; L48-L540 HydrophobicContact CD1-CB 4.43Å; L48-L540 WeakPolarHBondContact CD2-O 3.3Å
49	G	87.4	Confident	92.3	Very high	71 Å²	71	41 Å²	41	73%	0.732	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.7	16.4	-170.9	0	0	0	0	0	113.7	F45 R46	F45-G49 PolarHBondContact O-N 3.43Å; R46-G49 PolarHBondContact O-N 3.09Å; R46-G49 VanDerWaalsContact O-N 3.15Å
50	L	90.5	Very high	92.4	Very high	30 Å²	30	37 Å²	37	16%	0.157	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-90.7	151.3	-179.1	-68.9	179.3	0	0	0	111.3	F45 L48 I197 A200 Y201	F45-L50 HydrophobicContact CB-CB 3.79Å; F45-L50 PolarHBondContact O-N 3.3Å; L48-L50 HydrophobicContact CB-CB 4.28Å; L48-L50 HydrophobicContact CB-CD1 3.91Å; L48-L50 HydrophobicContact CB-CG 3.82Å; L48-L50 HydrophobicContact CD1-CD1 3.95Å; L48-L50 PolarHBondContact O-N 2.99Å; L50-I197 HydrophobicContact CD1-CG2 4.23Å; L50-A200 HydrophobicContact CB-CB 4.1Å; L50-A200 HydrophobicContact CD1-CB 4.35Å; L50-Y201 HydrophobicContact CD2-CD2 4.1Å
51	P	91.8	Very high	92.5	Very high	47 Å²	47	37.1 Å²	37.1	31%	0.305	20%	0.198	S	C	.	.	P	Polyproline II helix	trans	-61.9	156	173.3	27.8	-34.3	0	0	0	111	A200	P51-A200 HydrophobicContact CG-CB 4.01Å; P51-A200 WeakPolarHBondContact CG-O 3.48Å
52	S	93.6	Very high	92.5	Very high	30 Å²	30	34.4 Å²	34.4	21%	0.21	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-66.6	160.5	170.7	53.8	0	0	0	0	111.4	V43 H44 A145	V43-S52 CarbonylContact O-C 3.51Å; V43-S52 WeakPolarHBondContact O-CA 3.06Å; V43-S52 WeakPolarHBondContact O-CB 3.45Å; H44-S52 WeakPolarHBondContact ND1-CB 3.48Å; S52-A145 WeakPolarHBondContact O-CB 3.21Å; S52-A145 PolarHBondContact O-N 3.49Å; S52-A145 VanDerWaalsContact OG-CB 3.23Å; S52-A145 WeakPolarHBondContact OG-CB 3.32Å
53	V	95.1	Very high	92.6	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	129.2	-179.8	177.4	0	0	0	0	108.9	V42 V43 F45 Q55 F142 V143 S196 A200	V42-V53 WeakPolarHBondContact CA-O 3.49Å; V43-V53 PolarHBondContact N-O 2.78Å; V43-V53 PolarHBondContact O-N 3.02Å; F45-V53 HydrophobicContact CD2-CG2 4.19Å; F45-V53 HydrophobicContact CE2-CB 4.18Å; F45-V53 HydrophobicContact CE2-CG2 3.81Å; V53-Q55 HydrophobicContact CG1-CG 4.27Å; V53-F142 HydrophobicContact CG1-CB 4.04Å; V53-V143 CarbonylContact C-O 3.59Å; V53-V143 WeakPolarHBondContact CA-O 3.42Å; V53-S196 WeakPolarHBondContact CG2-O 3.3Å; V53-A200 HydrophobicContact CG2-CB 3.77Å
54	E	95.7	Very high	92.9	Very high	35 Å²	35	35.1 Å²	35.1	16%	0.164	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	121.5	167.5	-46.8	-177.2	170.7	0	0	108.1	K29 V42 Y56 V143	K29-E54 VanDerWaalsContact CE-OE1 3.3Å; K29-E54 WeakPolarHBondContact CE-OE1 3.4Å; K29-E54 HydrophobicContact CG-CG 4.41Å; K29-E54 IonicContact NZ-OE1 3.88Å; K29-E54 PolarHBondContact NZ-OE1 3.21Å; K29-E54 IonicContact NZ-OE2 2.7Å; V42-E54 HydrophobicContact CG2-CG 4.31Å; E54-Y56 HydrophobicContact CB-CE2 3.82Å; E54-Y56 PolarHBondContact OE2-OH 3.29Å; E54-V143 HydrophobicContact CB-CB 4.29Å; E54-V143 PolarHBondContact N-O 3.43Å; E54-V143 PolarHBondContact O-N 2.91Å
55	Q	96.3	Very high	93.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.4	179.1	-64.3	-176.5	-15.9	0	0	110.1	G40 R41 V43 V53 L57 L141 F142 S196 S547	G40-Q55 CarbonylContact C-O 3.56Å; G40-Q55 WeakPolarHBondContact CA-O 3.37Å; R41-Q55 HydrophobicContact CG-CB 3.99Å; R41-Q55 VanDerWaalsContact CZ-OE1 3.27Å; R41-Q55 PolarHBondContact N-O 2.95Å; R41-Q55 PolarHBondContact O-N 3.48Å; V43-Q55 VanDerWaalsContact CG2-CD 3.45Å; V43-Q55 HydrophobicContact CG2-CG 4.14Å; V53-Q55 HydrophobicContact CG1-CG 4.27Å; Q55-L57 HydrophobicContact CB-CD2 4.22Å; Q55-L57 HydrophobicContact CB-CG 4.34Å; Q55-L141 WeakPolarHBondContact CA-O 3.36Å; Q55-F142 HydrophobicContact CG-CD1 3.92Å; Q55-F142 HydrophobicContact CG-CE1 4.28Å; Q55-S196 PolarHBondContact NE2-OG 2.87Å; Q55-S547 PolarHBondContact NE2-OG 3.16Å
56	Y	97	Very high	93.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	97.2	171.8	-56.7	-92.6	0	0	0	107.9	K29 V31 L38 E54 A87 N140 L141 V143 F249	K29-Y56 VanDerWaalsContact CG-OH 3.24Å; K29-Y56 WeakPolarHBondContact CG-OH 3.34Å; V31-Y56 HydrophobicContact CB-CE1 4.16Å; V31-Y56 HydrophobicContact CG1-CD1 4.14Å; V31-Y56 HydrophobicContact CG1-CE1 3.42Å; V31-Y56 VanDerWaalsContact CG1-CE1 3.42Å; L38-Y56 HydrophobicContact CB-CD1 4.1Å; L38-Y56 HydrophobicContact CB-CE1 4.43Å; E54-Y56 HydrophobicContact CB-CE2 3.82Å; E54-Y56 PolarHBondContact OE2-OH 3.29Å; Y56-A87 CarbonylContact C-O 3.56Å; Y56-A87 WeakPolarHBondContact CA-O 3.24Å; Y56-N140 CarbonylContact O-C 3.42Å; Y56-N140 WeakPolarHBondContact O-CA 3.21Å; Y56-L141 PolarHBondContact N-O 3.44Å; Y56-L141 PolarHBondContact O-N 2.75Å; Y56-V143 HydrophobicContact CD2-CG2 4.38Å; Y56-V143 HydrophobicContact CE2-CG2 4.32Å; Y56-F249 HydrophobicContact CD1-CE1 4.08Å; Y56-F249 AromaticContact CD2-CD1 3.9Å; Y56-F249 HydrophobicContact CD2-CD1 3.9Å; Y56-F249 AromaticContact CD2-CE1 3.51Å; Y56-F249 HydrophobicContact CD2-CE1 3.51Å; Y56-F249 HydrophobicContact CE1-CE1 4.17Å; Y56-F249 AromaticContact CE2-CD1 3.71Å; Y56-F249 HydrophobicContact CE2-CD1 3.71Å; Y56-F249 AromaticContact CE2-CE1 3.62Å; Y56-F249 HydrophobicContact CE2-CE1 3.62Å; Y56-F249 AromaticContact CG-CE1 3.76Å; Y56-F249 HydrophobicContact CG-CE1 3.76Å; Y56-F249 AromaticContact CZ-CE1 3.95Å
57	L	96.2	Very high	93.9	Very high	2 Å²	2	28 Å²	28	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	135.2	-172.9	-51.8	-177.4	0	0	0	109.5	Q55 A87 D89 M90 N140 F142	Q55-L57 HydrophobicContact CB-CD2 4.22Å; Q55-L57 HydrophobicContact CB-CG 4.34Å; L57-A87 PolarHBondContact N-O 2.88Å; L57-A87 CarbonylContact O-C 3.29Å; L57-A87 VanDerWaalsContact O-C 3.23Å; L57-A87 WeakPolarHBondContact O-CA 3.15Å; L57-A87 VanDerWaalsContact O-CB 3.24Å; L57-A87 WeakPolarHBondContact O-CB 3.32Å; L57-D89 CarbonylContact C-O 3.47Å; L57-D89 VanDerWaalsContact CB-O 3.22Å; L57-D89 WeakPolarHBondContact CB-O 3.3Å; L57-M90 HydrophobicContact CB-SD 4.19Å; L57-M90 HydrophobicContact CD1-CE 4.39Å; L57-M90 HydrophobicContact CD1-CG 4.28Å; L57-M90 HydrophobicContact CD1-SD 4.04Å; L57-M90 HydrophobicContact CD2-CE 4.28Å; L57-M90 HydrophobicContact CD2-SD 4.1Å; L57-M90 HydrophobicContact CG-SD 4.33Å; L57-N140 WeakPolarHBondContact CA-OD1 3.42Å; L57-N140 HydrophobicContact CD2-CB 3.97Å; L57-F142 HydrophobicContact CD2-CE1 4.23Å; L57-F142 HydrophobicContact CD2-CZ 4.23Å
58	G	96	Very high	94.2	Very high	8 Å²	8	26.4 Å²	26.4	8%	0.082	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	74.4	37.3	176.6	0	0	0	0	0	115.4	P60 Y138 M139 N140	G58-P60 WeakPolarHBondContact O-CD 3.4Å; G58-Y138 VanDerWaalsContact O-CD1 3.26Å; G58-Y138 WeakPolarHBondContact O-CD1 3.22Å; G58-M139 PolarHBondContact N-O 3.1Å; G58-N140 PolarHBondContact N-OD1 3.06Å
59	V	97	Very high	94.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	117.7	173.8	-176.2	0	0	0	0	109.6	L38 W80 A87 Y138 M139 L141 M245	L38-V59 HydrophobicContact CD1-CG1 4.02Å; L38-V59 HydrophobicContact CD1-CG2 4.07Å; L38-V59 HydrophobicContact CD2-CG1 4.43Å; L38-V59 HydrophobicContact CD2-CG2 4.29Å; V59-W80 HydrophobicContact CG1-CH2 4.27Å; V59-W80 HydrophobicContact CG1-CZ2 4.42Å; V59-A87 HydrophobicContact CG2-CB 4.21Å; V59-Y138 CarbonylContact O-C 3.44Å; V59-Y138 WeakPolarHBondContact O-CA 3.37Å; V59-M139 HydrophobicContact CB-CG 4.02Å; V59-M139 PolarHBondContact N-O 3.36Å; V59-M139 PolarHBondContact O-N 3.1Å; V59-L141 HydrophobicContact CB-CD1 4.1Å; V59-L141 HydrophobicContact CG2-CD1 3.74Å; V59-M245 HydrophobicContact CG1-CE 4.14Å; V59-M245 HydrophobicContact CG1-SD 4.3Å
60	P	96.7	Very high	95.1	Very high	14 Å²	14	24.6 Å²	24.6	9%	0.091	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	133.7	-177.8	27.9	-32.8	0	0	0	111	G58 A77 W80 Y138	G58-P60 WeakPolarHBondContact O-CD 3.4Å; P60-A77 HydrophobicContact CB-CB 4.25Å; P60-W80 HydrophobicContact CG-CE3 4.29Å; P60-W80 HydrophobicContact CG-CH2 4.06Å; P60-W80 HydrophobicContact CG-CZ3 3.7Å; P60-Y138 HydrophobicContact CB-CD1 3.92Å; P60-Y138 HydrophobicContact CB-CE1 3.75Å; P60-Y138 HydrophobicContact CG-CE1 4.45Å
61	Y	97.3	Very high	95.3	Very high	1 Å²	1	23.4 Å²	23.4	0%	0.004	15%	0.152	C	C	.	.			trans	-114.2	-27.9	173.6	69.7	-102.9	0	0	0	112.7	A77 L137 Y138 M139 N210 D234 C237 A238	Y61-A77 PolarHBondContact O-N 2.83Å; Y61-L137 WeakPolarHBondContact CD1-O 3.22Å; Y61-L137 HydrophobicContact CD2-CB 4.41Å; Y61-L137 HydrophobicContact CE1-CB 4.18Å; Y61-L137 HydrophobicContact CE2-CB 3.85Å; Y61-L137 HydrophobicContact CE2-CD2 4.37Å; Y61-L137 HydrophobicContact CE2-CG 4.46Å; Y61-L137 PolarHBondContact N-O 3.22Å; Y61-L137 WeakPolarHBondContact OH-CD2 3.29Å; Y61-Y138 VanDerWaalsContact CE1-N 3.32Å; Y61-Y138 WeakPolarHBondContact CE1-O 3.35Å; Y61-M139 VanDerWaalsContact CB-CE 3.47Å; Y61-M139 HydrophobicContact CD1-CB 4.28Å; Y61-M139 HydrophobicContact CD1-CE 3.98Å; Y61-M139 HydrophobicContact CG-CE 3.99Å; Y61-N210 WeakPolarHBondContact CE1-O 3.11Å; Y61-N210 PolarHBondContact OH-O 3.3Å; Y61-D234 HydrophobicContact CE2-CB 4.41Å; Y61-D234 WeakPolarHBondContact CE2-O 3.43Å; Y61-C237 HydrophobicContact CD2-CB 4.39Å; Y61-A238 HydrophobicContact CD1-CB 3.94Å; Y61-A238 HydrophobicContact CD2-CB 3.74Å; Y61-A238 HydrophobicContact CE1-CB 4.06Å; Y61-A238 HydrophobicContact CE2-CB 3.89Å; Y61-A238 HydrophobicContact CG-CB 3.79Å
62	G	96.3	Very high	95.4	Very high	4 Å²	4	25.4 Å²	25.4	4%	0.041	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-118.6	159.8	176.3	0	0	0	0	0	112.5	Q75 L137	G62-Q75 CarbonylContact C-O 3.4Å; G62-Q75 VanDerWaalsContact CA-O 3.23Å; G62-Q75 WeakPolarHBondContact CA-O 3.32Å; G62-L137 PolarHBondContact N-O 2.98Å
63	T	95.9	Very high	95.5	Very high	36 Å²	36	28.3 Å²	28.3	22%	0.221	17%	0.169	C	C	.	.			trans	-76.1	148.2	164.7	69.7	0	0	0	0	110	P65 K69 Q75	T63-P65 WeakPolarHBondContact O-CD 3.24Å; T63-P65 VanDerWaalsContact O-N 3.15Å; T63-K69 PolarHBondContact OG1-NZ 3.2Å; T63-Q75 HydrophobicContact CG2-CB 4.21Å; T63-Q75 PolarHBondContact N-O 3.46Å
64	A	96.7	Very high	95.5	Very high	28 Å²	28	29.4 Å²	29.4	23%	0.231	18%	0.176	C	C	.	.			trans	-45.9	118.5	174.7	0	0	0	0	0	112.3	T66 D135	A64-T66 HydrophobicContact CB-CG2 4.25Å; A64-T66 PolarHBondContact O-N 3Å; A64-D135 HydrophobicContact CB-CB 3.71Å
65	P	96.4	Very high	95.5	Very high	5 Å²	5	32.7 Å²	32.7	3%	0.032	19%	0.192	C	C	.	.			trans	-82	50.1	-178.9	34.3	-37.3	0	0	0	112	T63 R70 E134 L137 R212	T63-P65 WeakPolarHBondContact O-CD 3.24Å; T63-P65 VanDerWaalsContact O-N 3.15Å; P65-R70 WeakPolarHBondContact O-CA 3.34Å; P65-E134 VanDerWaalsContact CD-O 3.22Å; P65-E134 WeakPolarHBondContact CD-O 3.31Å; P65-E134 WeakPolarHBondContact CG-O 3.34Å; P65-L137 HydrophobicContact CG-CD1 4.12Å; P65-L137 HydrophobicContact CG-CG 4.2Å; P65-R212 HydrophobicContact CG-CG 4.2Å
66	T	95.5	Very high	95.5	Very high	63 Å²	63	35.9 Å²	35.9	39%	0.387	21%	0.212	S	C	.	.			trans	-100.9	159.6	-174.8	53.2	0	0	0	0	112.8	A64 S68 K69 E134	A64-T66 HydrophobicContact CB-CG2 4.25Å; A64-T66 PolarHBondContact O-N 3Å; T66-S68 PolarHBondContact O-N 3.44Å; T66-K69 PolarHBondContact O-N 2.89Å; T66-K69 VanDerWaalsContact O-N 3.09Å; T66-E134 HydrophobicContact CG2-CB 3.55Å; T66-E134 HydrophobicContact CG2-CG 4.47Å
67	G	91.1	Very high	95.3	Very high	37 Å²	37	36.5 Å²	36.5	38%	0.381	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	59.3	-127.1	174.1	0	0	0	0	0	111.4	K69 R70	G67-K69 PolarHBondContact O-N 3.42Å; G67-K69 VanDerWaalsContact O-N 3.09Å; G67-R70 WeakPolarHBondContact O-CB 3.31Å; G67-R70 PolarHBondContact O-N 3.45Å
68	S	91.3	Very high	95.1	Very high	92 Å²	92	40.2 Å²	40.2	64%	0.643	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-65.4	-12	178.8	70.2	0	0	0	0	114.4	T66 M72	T66-S68 PolarHBondContact O-N 3.44Å; S68-M72 WeakPolarHBondContact O-CE 3.43Å
69	K	94.3	Very high	94.9	Very high	71 Å²	71	45.8 Å²	45.8	31%	0.309	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-90.2	-5.1	174	-57.4	-171.8	-172.8	-170.9	0	112.9	T63 T66 G67 M72	T63-K69 PolarHBondContact OG1-NZ 3.2Å; T66-K69 PolarHBondContact O-N 2.89Å; T66-K69 VanDerWaalsContact O-N 3.09Å; G67-K69 PolarHBondContact O-N 3.42Å; G67-K69 VanDerWaalsContact O-N 3.09Å; K69-M72 PolarHBondContact O-N 3.08Å
70	R	95.8	Very high	94.7	Very high	14 Å²	14	47.2 Å²	47.2	5%	0.053	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	138.8	175.3	-169.3	-174.5	-71.9	162.6	-4.7	109	P65 G67 M72 E134 F216 Q342 D344	P65-R70 WeakPolarHBondContact O-CA 3.34Å; G67-R70 WeakPolarHBondContact O-CB 3.31Å; G67-R70 PolarHBondContact O-N 3.45Å; R70-M72 VanDerWaalsContact C-N 3.27Å; R70-M72 PolarHBondContact O-N 2.95Å; R70-E134 IonicContact CZ-OE1 3.98Å; R70-E134 IonicContact CZ-OE2 2.88Å; R70-E134 IonicContact NE-OE1 3.49Å; R70-E134 PolarHBondContact NE-OE1 2.53Å; R70-E134 IonicContact NE-OE2 3.39Å; R70-E134 IonicContact NH2-OE1 2.91Å; R70-E134 PolarHBondContact NH2-OE1 3.45Å; R70-E134 IonicContact NH2-OE2 3.68Å; R70-E134 PolarHBondContact NH2-OE2 3.05Å; R70-F216 HydrophobicContact CG-CD1 4.19Å; R70-F216 HydrophobicContact CG-CE1 4.49Å; R70-Q342 PolarHBondContact NH1-O 2.92Å; R70-Q342 PolarHBondContact O-NE2 3.31Å; R70-D344 PolarHBondContact NH1-O 3.31Å
71	F	96	Very high	94.3	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.018	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	39.1	-175.7	-38.2	-60.1	0	0	0	113.3	V215 F216 L219 W230 L338 I341 Q342	F71-V215 HydrophobicContact CE1-CG2 4.3Å; F71-V215 WeakPolarHBondContact CE1-O 3.35Å; F71-F216 HydrophobicContact CE1-CD1 4.2Å; F71-L219 HydrophobicContact CD1-CB 3.95Å; F71-L219 HydrophobicContact CD1-CD2 3.93Å; F71-L219 HydrophobicContact CD2-CD2 4.09Å; F71-L219 HydrophobicContact CE1-CB 4.13Å; F71-L219 HydrophobicContact CE1-CD2 3.82Å; F71-L219 HydrophobicContact CE2-CD2 4Å; F71-L219 HydrophobicContact CG-CD2 4.06Å; F71-L219 HydrophobicContact CZ-CD2 3.85Å; F71-W230 VanDerWaalsContact C-CE2 3.47Å; F71-W230 HydrophobicContact CB-CZ2 4.35Å; F71-W230 VanDerWaalsContact O-CE2 3.31Å; F71-W230 WeakPolarHBondContact O-CH2 3.06Å; F71-W230 WeakPolarHBondContact O-CZ2 3.45Å; F71-L338 HydrophobicContact CB-CD1 4.33Å; F71-L338 HydrophobicContact CD2-CD1 3.85Å; F71-L338 HydrophobicContact CG-CD1 4.41Å; F71-I341 HydrophobicContact CE2-CG2 3.71Å; F71-I341 HydrophobicContact CZ-CG2 3.99Å; F71-Q342 HydrophobicContact CD2-CG 3.61Å; F71-Q342 HydrophobicContact CE2-CG 4.01Å
72	M	94.2	Very high	93.8	Very high	89 Å²	89	58.7 Å²	58.7	44%	0.438	34%	0.339	S	S	.	.	S	Bend	trans	-129.8	166.1	171.6	-61.8	-168.8	177.5	0	0	111.1	S68 K69 R70 R212	S68-M72 WeakPolarHBondContact O-CE 3.43Å; K69-M72 PolarHBondContact O-N 3.08Å; R70-M72 VanDerWaalsContact C-N 3.27Å; R70-M72 PolarHBondContact O-N 2.95Å; M72-R212 VanDerWaalsContact O-CZ 3.28Å; M72-R212 PolarHBondContact O-NH1 2.95Å; M72-R212 PolarHBondContact O-NH2 3.16Å
73	M	94.4	Very high	93.6	Very high	91 Å²	91	63.3 Å²	63.3	45%	0.448	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-58	143.7	170.7	-71.9	-175.8	176.9	0	0	110.9	W230 I372	M73-W230 HydrophobicContact CG-CE3 4.45Å; M73-W230 HydrophobicContact CG-CZ3 4.28Å; M73-I372 HydrophobicContact CE-CG2 4.2Å
74	P	96.3	Very high	93.5	Very high	23 Å²	23	65.3 Å²	65.3	15%	0.149	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-65.1	147.1	178	31.9	-38.1	0	0	0	110.7	L137 S233 D234 C237	P74-L137 HydrophobicContact CB-CD1 4.04Å; P74-S233 VanDerWaalsContact CD-CB 3.48Å; P74-S233 WeakPolarHBondContact CG-O 3.47Å; P74-D234 WeakPolarHBondContact CB-OD1 3.26Å; P74-D234 WeakPolarHBondContact CG-OD1 3.37Å; P74-C237 HydrophobicContact CB-CB 4.19Å; P74-C237 HydrophobicContact CG-CB 3.58Å
75	Q	95.4	Very high	93.4	Very high	105 Å²	105	67.5 Å²	67.5	49%	0.491	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-101.3	139.2	167	-64	178.8	-19.4	0	0	108.6	G62 T63	G62-Q75 CarbonylContact C-O 3.4Å; G62-Q75 VanDerWaalsContact CA-O 3.23Å; G62-Q75 WeakPolarHBondContact CA-O 3.32Å; T63-Q75 HydrophobicContact CG2-CB 4.21Å; T63-Q75 PolarHBondContact N-O 3.46Å
76	T	95.3	Very high	93.3	Very high	67 Å²	67	71.3 Å²	71.3	41%	0.411	40%	0.399	S	S	.	.	B	Isolated β-bridge	trans	-57.9	140.4	177.8	-55.2	0	0	0	0	111.8	F35 V241	F35-T76 HydrophobicContact CE1-CG2 4.08Å; F35-T76 HydrophobicContact CZ-CG2 4.26Å; T76-V241 HydrophobicContact CG2-CG2 3.67Å
77	A	92.5	Very high	93.3	Very high	12 Å²	12	68.3 Å²	68.3	10%	0.099	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-56.5	143.1	176.5	0	0	0	0	0	112.6	P60 Y61 W80	P60-A77 HydrophobicContact CB-CB 4.25Å; Y61-A77 PolarHBondContact O-N 2.83Å; A77-W80 HydrophobicContact CB-CZ3 4.48Å
78	A	92	Very high	93.5	Very high	80 Å²	80	67.8 Å²	67.8	66%	0.661	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-67.7	144.3	174	0	0	0	0	0	110.9	W80	A78-W80 VanDerWaalsContact O-CE3 3.28Å
79	K	93.2	Very high	93.5	Very high	126 Å²	126	69 Å²	69	55%	0.548	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-66.5	134.1	175.4	-62.1	-167.9	176.1	-157.5	0	111.1	S34 F35 T81	S34-K79 PolarHBondContact O-NZ 3.25Å; F35-K79 HydrophobicContact CD1-CG 3.88Å; F35-K79 HydrophobicContact CE1-CG 4.45Å; F35-K79 HydrophobicContact CG-CG 4.44Å; F35-K79 CarbonylContact O-C 3.59Å; F35-K79 WeakPolarHBondContact O-CA 2.99Å; F35-K79 WeakPolarHBondContact O-CB 3.4Å; K79-T81 HydrophobicContact CB-CG2 4.14Å; K79-T81 PolarHBondContact O-N 2.96Å
80	W	91.7	Very high	93.4	Very high	30 Å²	30	68 Å²	68	11%	0.114	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	64.8	176.3	50.5	93.3	0	0	0	111.1	F35 G36 K37 L38 V59 P60 A77 A78 N82 K85	F35-W80 HydrophobicContact CB-CD2 4.22Å; F35-W80 HydrophobicContact CB-CE3 4.22Å; F35-W80 HydrophobicContact CB-CH2 3.55Å; F35-W80 HydrophobicContact CB-CZ2 3.54Å; F35-W80 HydrophobicContact CB-CZ3 3.89Å; F35-W80 HydrophobicContact CD1-CH2 4.29Å; F35-W80 HydrophobicContact CD1-CZ3 4.13Å; F35-W80 HydrophobicContact CG-CH2 4.06Å; F35-W80 HydrophobicContact CG-CZ2 4.48Å; F35-W80 HydrophobicContact CG-CZ3 4.31Å; F35-W80 CarbonylContact O-C 3.32Å; F35-W80 PolarHBondContact O-N 2.88Å; G36-W80 WeakPolarHBondContact CA-O 3.26Å; K37-W80 PolarHBondContact O-NE1 2.83Å; L38-W80 HydrophobicContact CD1-CZ2 4.25Å; L38-W80 HydrophobicContact CD2-CZ2 3.95Å; L38-W80 HydrophobicContact CG-CZ2 4.16Å; V59-W80 HydrophobicContact CG1-CH2 4.27Å; V59-W80 HydrophobicContact CG1-CZ2 4.42Å; P60-W80 HydrophobicContact CG-CE3 4.29Å; P60-W80 HydrophobicContact CG-CH2 4.06Å; P60-W80 HydrophobicContact CG-CZ3 3.7Å; A77-W80 HydrophobicContact CB-CZ3 4.48Å; A78-W80 VanDerWaalsContact O-CE3 3.28Å; W80-N82 VanDerWaalsContact C-N 3.33Å; W80-N82 PolarHBondContact O-N 2.86Å; W80-K85 HydrophobicContact CD2-CB 4.38Å; W80-K85 HydrophobicContact CG-CB 4.05Å
81	T	88.5	Confident	93.3	Very high	100 Å²	100	68 Å²	68	61%	0.613	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72	-24.7	-174.5	57	0	0	0	0	114.3	K79	K79-T81 HydrophobicContact CB-CG2 4.14Å; K79-T81 PolarHBondContact O-N 2.96Å
82	N	87.7	Confident	93.3	Very high	155 Å²	155	68.6 Å²	68.6	83%	0.829	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.8	-5	-169.3	-59.1	-15.1	0	0	0	113.5	W80	W80-N82 VanDerWaalsContact C-N 3.33Å; W80-N82 PolarHBondContact O-N 2.86Å
83	V	91.5	Very high	93.4	Very high	102 Å²	102	64.5 Å²	64.5	62%	0.618	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.6	142.1	-175	-176.1	0	0	0	0	108.7	K85	V83-K85 PolarHBondContact O-N 3.29Å
84	I	92.9	Very high	93.6	Very high	77 Å²	77	60.3 Å²	60.3	40%	0.395	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	114.5	168.2	-57.1	174.2	0	0	0	106.7	I30 K37 R39 D86	I30-I84 HydrophobicContact CD1-CD1 4.38Å; K37-I84 HydrophobicContact CB-CB 4.35Å; K37-I84 HydrophobicContact CB-CG1 3.93Å; K37-I84 HydrophobicContact CB-CG2 4.24Å; K37-I84 HydrophobicContact CD-CG1 4.16Å; R39-I84 HydrophobicContact CB-CG2 3.81Å; I84-D86 PolarHBondContact O-N 3.14Å
85	K	94.6	Very high	93.7	Very high	75 Å²	75	59.9 Å²	59.9	33%	0.326	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	123.4	177.3	178.7	72.3	175.3	-179.6	0	108.5	K37 L38 R39 W80 V83	K37-K85 PolarHBondContact O-N 3.31Å; L38-K85 WeakPolarHBondContact CA-O 3.24Å; L38-K85 HydrophobicContact CD2-CB 3.79Å; L38-K85 HydrophobicContact CD2-CG 3.86Å; R39-K85 PolarHBondContact N-O 3.08Å; W80-K85 HydrophobicContact CD2-CB 4.38Å; W80-K85 HydrophobicContact CG-CB 4.05Å; V83-K85 PolarHBondContact O-N 3.29Å
86	D	95.4	Very high	93.7	Very high	84 Å²	84	55 Å²	55	45%	0.449	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	126.6	175.2	-152.1	-14.8	0	0	0	109.7	I84 T88	I84-D86 PolarHBondContact O-N 3.14Å; D86-T88 WeakPolarHBondContact OD1-CB 3.45Å; D86-T88 VanDerWaalsContact OD1-CG2 3.27Å; D86-T88 WeakPolarHBondContact OD1-CG2 3.38Å; D86-T88 PolarHBondContact OD1-N 3.3Å; D86-T88 PolarHBondContact OD1-OG1 3.41Å
87	A	95.7	Very high	93.7	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.008	29%	0.291	C	S	.	.			trans	-135.2	43.4	-177.1	0	0	0	0	0	109.7	L38 R39 Y56 L57 V59	L38-A87 HydrophobicContact CD2-CB 4.14Å; R39-A87 CarbonylContact O-C 3.5Å; R39-A87 VanDerWaalsContact O-C 3.29Å; R39-A87 VanDerWaalsContact O-CA 3.27Å; R39-A87 WeakPolarHBondContact O-CA 3.16Å; R39-A87 WeakPolarHBondContact O-CB 3.22Å; R39-A87 PolarHBondContact O-N 2.98Å; Y56-A87 CarbonylContact C-O 3.56Å; Y56-A87 WeakPolarHBondContact CA-O 3.24Å; L57-A87 PolarHBondContact N-O 2.88Å; L57-A87 CarbonylContact O-C 3.29Å; L57-A87 VanDerWaalsContact O-C 3.23Å; L57-A87 WeakPolarHBondContact O-CA 3.15Å; L57-A87 VanDerWaalsContact O-CB 3.24Å; L57-A87 WeakPolarHBondContact O-CB 3.32Å; V59-A87 HydrophobicContact CG2-CB 4.21Å
88	T	94.3	Very high	93.6	Very high	25 Å²	25	53.9 Å²	53.9	15%	0.153	29%	0.293	C	S	.	.	S	Bend	trans	-101.2	-18.7	-178.3	48.7	0	0	0	0	113.2	R39 R41 D86	R39-T88 HydrophobicContact CG-CG2 4.25Å; R41-T88 HydrophobicContact CB-CG2 4.34Å; D86-T88 WeakPolarHBondContact OD1-CB 3.45Å; D86-T88 VanDerWaalsContact OD1-CG2 3.27Å; D86-T88 WeakPolarHBondContact OD1-CG2 3.38Å; D86-T88 PolarHBondContact OD1-N 3.3Å; D86-T88 PolarHBondContact OD1-OG1 3.41Å
89	D	92.4	Very high	93.3	Very high	119 Å²	119	51.2 Å²	51.2	64%	0.636	27%	0.27	S	S	*	.	S	Bend	trans	-118.1	155.3	-176.9	-63.3	-49.8	0	0	0	112	L57	L57-D89 CarbonylContact C-O 3.47Å; L57-D89 VanDerWaalsContact CB-O 3.22Å; L57-D89 WeakPolarHBondContact CB-O 3.3Å
90	M	91.9	Very high	92.8	Very high	50 Å²	50	51.1 Å²	51.1	25%	0.246	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-68.2	140.2	179.1	-76.9	-60.6	-159	0	0	112.2	L57 T191 I548	L57-M90 HydrophobicContact CB-SD 4.19Å; L57-M90 HydrophobicContact CD1-CE 4.39Å; L57-M90 HydrophobicContact CD1-CG 4.28Å; L57-M90 HydrophobicContact CD1-SD 4.04Å; L57-M90 HydrophobicContact CD2-CE 4.28Å; L57-M90 HydrophobicContact CD2-SD 4.1Å; L57-M90 HydrophobicContact CG-SD 4.33Å; M90-T191 HydrophobicContact CB-CG2 3.62Å; M90-T191 HydrophobicContact CE-CG2 4.27Å; M90-T191 WeakPolarHBondContact CE-O 3.48Å; M90-T191 HydrophobicContact CG-CG2 3.69Å; M90-T191 HydrophobicContact SD-CG2 3.75Å; M90-I548 HydrophobicContact CE-CB 3.71Å; M90-I548 HydrophobicContact CE-CD1 3.7Å; M90-I548 HydrophobicContact CE-CG1 4.29Å; M90-I548 HydrophobicContact CE-CG2 3.53Å
91	P	94.1	Very high	92.1	Very high	13 Å²	13	51.7 Å²	51.7	8%	0.084	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-73.4	159.6	176	32.2	-34.4	0	0	0	111.2	Y138 N140	P91-Y138 HydrophobicContact CB-CD1 4.22Å; P91-Y138 HydrophobicContact CB-CD2 3.62Å; P91-Y138 HydrophobicContact CB-CE2 4.43Å; P91-Y138 HydrophobicContact CB-CG 3.52Å; P91-Y138 HydrophobicContact CG-CG 4.24Å; P91-N140 WeakPolarHBondContact CD-OD1 3.39Å
92	P	95.6	Very high	91.7	Very high	17 Å²	17	47.1 Å²	47.1	11%	0.11	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-58.6	148.5	169	27.9	-35.7	0	0	0	110.6	R133 D135 Y138 N210	P92-R133 HydrophobicContact CB-CB 4.22Å; P92-R133 HydrophobicContact CB-CG 3.91Å; P92-R133 HydrophobicContact CG-CB 4.37Å; P92-R133 HydrophobicContact CG-CG 4.29Å; P92-D135 WeakPolarHBondContact CG-O 3.34Å; P92-Y138 HydrophobicContact CG-CE2 4.3Å; P92-N210 PolarHBondContact O-ND2 2.79Å
93	A	96.5	Very high	91.2	Very high	3 Å²	3	43.8 Å²	43.8	3%	0.025	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-76.2	157.6	172.5	0	0	0	0	0	110.4	L129 D131 Q132 R133	A93-L129 HydrophobicContact CB-CB 4.4Å; A93-L129 HydrophobicContact CB-CD2 4.05Å; A93-D131 PolarHBondContact N-O 3.3Å; A93-Q132 WeakPolarHBondContact O-CA 3.43Å; A93-R133 PolarHBondContact O-N 2.81Å
94	C	98.1	Very high	90.4	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.02	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-65.3	156.3	167.4	-61.8	0	0	0	0	110.4	Q96 C136 Y211	C94-Q96 WeakPolarHBondContact O-CG 3.35Å; C94-Q96 PolarHBondContact O-N 3.02Å; C94-Q96 PolarHBondContact O-NE2 2.75Å; C94-C136 VanDerWaalsContact CA-CB 3.43Å; C94-C136 WeakPolarHBondContact CA-SG 3.27Å; C94-C136 HydrophobicContact CB-CB 3.78Å; C94-C136 WeakPolarHBondContact CB-SG 3.22Å; C94-C136 WeakPolarHBondContact SG-CB 3.23Å; C94-C136 CovalentContact SG-SG 2.03Å; C94-C136 PolarHBondContact SG-SG 3.08Å; C94-Y211 PolarHBondContact SG-O 3.1Å
95	V	97.8	Very high	89.3	Confident	14 Å²	14	48.8 Å²	48.8	9%	0.085	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-57.2	129.4	175.9	-178.4	0	0	0	0	110.3	E134 F216 V346 T350	V95-E134 HydrophobicContact CG2-CG 4.26Å; V95-F216 HydrophobicContact CB-CD2 4.04Å; V95-F216 HydrophobicContact CB-CE2 3.97Å; V95-F216 HydrophobicContact CG1-CD2 4.15Å; V95-F216 HydrophobicContact CG1-CE2 3.66Å; V95-F216 HydrophobicContact CG1-CZ 4.46Å; V95-V346 HydrophobicContact CB-CG1 4.35Å; V95-V346 HydrophobicContact CG1-CG1 3.9Å; V95-V346 HydrophobicContact CG2-CG1 3.6Å; V95-T350 HydrophobicContact CG1-CG2 4.44Å; V95-T350 VanDerWaalsContact CG1-OG1 3.3Å; V95-T350 WeakPolarHBondContact CG1-OG1 3.25Å
96	Q	96	Very high	88.8	Confident	3 Å²	3	46.9 Å²	46.9	1%	0.014	23%	0.234	C	C	.	.			trans	-106	147	-172.9	-50.1	-77.5	-65.4	0	0	110.7	C94 W98 L129 Q132 W187 N188 L213	C94-Q96 WeakPolarHBondContact O-CG 3.35Å; C94-Q96 PolarHBondContact O-N 3.02Å; C94-Q96 PolarHBondContact O-NE2 2.75Å; Q96-W98 HydrophobicContact CB-CD2 4.34Å; Q96-W98 HydrophobicContact CB-CH2 4.41Å; Q96-W98 HydrophobicContact CB-CZ2 3.75Å; Q96-W98 HydrophobicContact CG-CH2 4.38Å; Q96-W98 HydrophobicContact CG-CZ2 3.8Å; Q96-L129 HydrophobicContact CG-CD1 4.44Å; Q96-Q132 HydrophobicContact CG-CG 4.25Å; Q96-W187 HydrophobicContact CB-CB 4.38Å; Q96-N188 PolarHBondContact NE2-O 3.01Å; Q96-N188 PolarHBondContact OE1-O 3.4Å; Q96-L213 VanDerWaalsContact NE2-CD1 3.25Å
97	L	94.5	Very high	88.2	Confident	15 Å²	15	49.5 Å²	49.5	8%	0.079	24%	0.238	C	C	.	.			trans	-111.8	93.6	173.7	-172.3	69.2	0	0	0	110.9	N186 W187 T350 A353 A354 F365	L97-N186 HydrophobicContact CB-CB 3.96Å; L97-N186 PolarHBondContact N-O 2.97Å; L97-W187 VanDerWaalsContact O-CE3 3.23Å; L97-T350 HydrophobicContact CD1-CG2 4.06Å; L97-T350 WeakPolarHBondContact CD1-O 3.37Å; L97-A353 HydrophobicContact CD1-CB 4.18Å; L97-A353 HydrophobicContact CD2-CB 4.25Å; L97-A354 HydrophobicContact CD1-CB 3.61Å; L97-F365 HydrophobicContact CD2-CD2 4.17Å; L97-F365 HydrophobicContact CD2-CE2 4.25Å
98	W	91.9	Very high	87.6	Confident	39 Å²	39	53.3 Å²	53.3	15%	0.148	27%	0.265	C	S	.	.			trans	-76.7	137.7	-176	-57.7	111.7	0	0	0	113.2	Q96 R100 M103 V122 L125 V126 L129 W187	Q96-W98 HydrophobicContact CB-CD2 4.34Å; Q96-W98 HydrophobicContact CB-CH2 4.41Å; Q96-W98 HydrophobicContact CB-CZ2 3.75Å; Q96-W98 HydrophobicContact CG-CH2 4.38Å; Q96-W98 HydrophobicContact CG-CZ2 3.8Å; W98-R100 PolarHBondContact O-N 3.36Å; W98-M103 HydrophobicContact CB-CG 3.84Å; W98-M103 HydrophobicContact CB-SD 4.34Å; W98-V122 HydrophobicContact CE3-CG1 3.71Å; W98-V122 HydrophobicContact CZ3-CG1 4.04Å; W98-L125 HydrophobicContact CH2-CB 3.8Å; W98-L125 HydrophobicContact CZ3-CB 4.13Å; W98-V126 HydrophobicContact CD2-CG2 3.55Å; W98-V126 HydrophobicContact CE3-CG2 3.9Å; W98-V126 HydrophobicContact CG-CG2 4.01Å; W98-V126 HydrophobicContact CH2-CG2 4.14Å; W98-V126 HydrophobicContact CZ2-CB 4.48Å; W98-V126 HydrophobicContact CZ2-CG2 3.83Å; W98-V126 HydrophobicContact CZ3-CG2 4.17Å; W98-L129 HydrophobicContact CH2-CD1 4.23Å; W98-W187 HydrophobicContact CE3-CB 3.94Å; W98-W187 HydrophobicContact CE3-CG 4.11Å; W98-W187 HydrophobicContact CH2-CB 4.08Å; W98-W187 HydrophobicContact CZ3-CB 3.59Å; W98-W187 AromaticContact CZ3-CG 3.77Å; W98-W187 HydrophobicContact CZ3-CG 3.77Å
99	P	85	Confident	87.1	Confident	25 Å²	25	56.6 Å²	56.6	16%	0.162	28%	0.278	C	S	.	.			trans	-61.4	131.7	177.2	-25.5	35.5	0	0	0	112.9	S101 I102 M103 W187	P99-S101 VanDerWaalsContact C-N 3.29Å; P99-S101 PolarHBondContact O-N 2.75Å; P99-I102 HydrophobicContact CB-CB 4.4Å; P99-I102 HydrophobicContact CB-CD1 3.96Å; P99-I102 HydrophobicContact CB-CG1 4.05Å; P99-I102 HydrophobicContact CG-CD1 3.86Å; P99-I102 HydrophobicContact CG-CG1 4.49Å; P99-I102 PolarHBondContact O-N 3.36Å; P99-I102 VanDerWaalsContact O-N 3.14Å; P99-M103 WeakPolarHBondContact O-CG 3.32Å; P99-M103 PolarHBondContact O-N 2.72Å; P99-W187 VanDerWaalsContact CD-CZ3 3.47Å; P99-W187 HydrophobicContact CG-CE3 3.99Å; P99-W187 HydrophobicContact CG-CH2 3.26Å; P99-W187 HydrophobicContact CG-CZ2 4.04Å; P99-W187 HydrophobicContact CG-CZ3 3.24Å
100	R	83.5	Confident	86.6	Confident	123 Å²	123	51 Å²	51	46%	0.464	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-40.3	175.6	-69.3	178.4	171.3	-149.3	-23.1	113.7	W98 I102 M103 Q104 A354 L355	W98-R100 PolarHBondContact O-N 3.36Å; R100-I102 PolarHBondContact O-N 3.49Å; R100-M103 CarbonylContact O-C 3.6Å; R100-M103 PolarHBondContact O-N 3.47Å; R100-M103 VanDerWaalsContact O-N 3.13Å; R100-Q104 WeakPolarHBondContact O-CG 3Å; R100-Q104 PolarHBondContact O-N 2.95Å; R100-Q104 VanDerWaalsContact O-N 3.15Å; R100-A354 WeakPolarHBondContact CD-O 3.39Å; R100-A354 PolarHBondContact NE-O 2.74Å; R100-A354 PolarHBondContact NH2-O 2.94Å; R100-L355 VanDerWaalsContact CZ-CD2 3.47Å; R100-L355 VanDerWaalsContact NH1-CD2 3.33Å
101	S	76.7	Confident	86.3	Confident	43 Å²	43	49.7 Å²	49.7	30%	0.301	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-35.2	178.4	48.4	0	0	0	0	111.8	P99 Q104 A110	P99-S101 VanDerWaalsContact C-N 3.29Å; P99-S101 PolarHBondContact O-N 2.75Å; S101-Q104 WeakPolarHBondContact O-CG 3.42Å; S101-A110 WeakPolarHBondContact O-CB 3.42Å
102	I	78.6	Confident	85.8	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.021	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-32	179.2	-56.2	175.9	0	0	0	111.7	P99 R100 Q104 V114 I118 V122 K123	P99-I102 HydrophobicContact CB-CB 4.4Å; P99-I102 HydrophobicContact CB-CD1 3.96Å; P99-I102 HydrophobicContact CB-CG1 4.05Å; P99-I102 HydrophobicContact CG-CD1 3.86Å; P99-I102 HydrophobicContact CG-CG1 4.49Å; P99-I102 PolarHBondContact O-N 3.36Å; P99-I102 VanDerWaalsContact O-N 3.14Å; R100-I102 PolarHBondContact O-N 3.49Å; I102-Q104 PolarHBondContact O-N 2.84Å; I102-V114 HydrophobicContact CD1-CG1 4.47Å; I102-V114 HydrophobicContact CG1-CB 4.45Å; I102-V114 HydrophobicContact CG1-CG1 3.86Å; I102-V114 HydrophobicContact CG1-CG2 4.11Å; I102-I118 HydrophobicContact CD1-CG2 3.7Å; I102-V122 HydrophobicContact CB-CG1 4.36Å; I102-V122 HydrophobicContact CD1-CB 4Å; I102-V122 HydrophobicContact CD1-CG1 4.11Å; I102-V122 HydrophobicContact CD1-CG2 3.69Å; I102-V122 HydrophobicContact CG2-CB 3.88Å; I102-V122 HydrophobicContact CG2-CG1 3.67Å; I102-K123 PolarHBondContact O-NZ 3.04Å
103	M	79.1	Confident	85.2	Confident	85 Å²	85	58.4 Å²	58.4	42%	0.419	28%	0.283	S	S	.	.	S	Bend	trans	-82	9.9	178.9	-63.3	-57.2	-75.1	0	0	113.8	W98 P99 R100 V126	W98-M103 HydrophobicContact CB-CG 3.84Å; W98-M103 HydrophobicContact CB-SD 4.34Å; P99-M103 WeakPolarHBondContact O-CG 3.32Å; P99-M103 PolarHBondContact O-N 2.72Å; R100-M103 CarbonylContact O-C 3.6Å; R100-M103 PolarHBondContact O-N 3.47Å; R100-M103 VanDerWaalsContact O-N 3.13Å; M103-V126 HydrophobicContact SD-CG2 4.23Å
104	Q	73.9	Confident	84.8	Confident	66 Å²	66	59.2 Å²	59.2	31%	0.308	29%	0.288	S	S	.	.			trans	-56.9	152.9	172.2	-68.2	-177.5	8.6	0	0	111.8	R100 S101 I102 S106 E109 A110	R100-Q104 WeakPolarHBondContact O-CG 3Å; R100-Q104 PolarHBondContact O-N 2.95Å; R100-Q104 VanDerWaalsContact O-N 3.15Å; S101-Q104 WeakPolarHBondContact O-CG 3.42Å; I102-Q104 PolarHBondContact O-N 2.84Å; Q104-S106 VanDerWaalsContact C-N 3.35Å; Q104-S106 PolarHBondContact O-N 3.46Å; Q104-E109 PolarHBondContact OE1-O 3.11Å; Q104-A110 HydrophobicContact CB-CB 4.47Å; Q104-A110 VanDerWaalsContact OE1-N 3.15Å
105	K	69.8	Low	84.4	Confident	217 Å²	217	59.1 Å²	59.1	94%	0.943	29%	0.287	S	S	*	.	S	Bend	trans	-66.6	-36.4	-173.9	-69.7	-176.3	178.8	179.3	0	112.3
106	S	83.6	Confident	84	Confident	35 Å²	35	61.8 Å²	61.8	25%	0.245	30%	0.299	C	S	.	.			trans	-110.4	139.3	-179.1	79.2	0	0	0	0	111.9	Q104 S108 E109 A110	Q104-S106 VanDerWaalsContact C-N 3.35Å; Q104-S106 PolarHBondContact O-N 3.46Å; S106-S108 PolarHBondContact O-N 3.42Å; S106-S108 PolarHBondContact OG-OG 3.17Å; S106-E109 PolarHBondContact O-N 2.04Å; S106-E109 WeakPolarHBondContact OG-CB 3.05Å; S106-E109 WeakPolarHBondContact OG-CG 3.38Å; S106-E109 PolarHBondContact OG-N 3.06Å; S106-E109 PolarHBondContact OG-OE2 2.86Å; S106-A110 PolarHBondContact O-N 3.31Å
107	R	83.9	Confident	83.6	Confident	139 Å²	139	63.9 Å²	63.9	53%	0.525	31%	0.306	S	S	.	.	H	α-helix	trans	-57.8	-40	172.5	178.7	178.8	174.7	126.7	1.9	111	E109 A110 L111 E116	R107-E109 VanDerWaalsContact C-N 3.31Å; R107-E109 PolarHBondContact O-N 3.17Å; R107-A110 PolarHBondContact O-N 3.24Å; R107-L111 HydrophobicContact CG-CD1 3.76Å; R107-L111 HydrophobicContact CG-CG 4.03Å; R107-L111 VanDerWaalsContact O-CG 3.28Å; R107-L111 WeakPolarHBondContact O-CG 3.42Å; R107-L111 PolarHBondContact O-N 3.39Å; R107-E116 IonicContact CZ-OE1 3.67Å; R107-E116 IonicContact NH2-OE1 2.68Å; R107-E116 PolarHBondContact NH2-OE1 2.84Å
108	S	83.2	Confident	83.3	Confident	81 Å²	81	64.2 Å²	64.2	57%	0.566	31%	0.308	S	S	*	.	H	α-helix	trans	-62.5	-34.1	-178.7	47.6	0	0	0	0	113.7	S106 K112	S106-S108 PolarHBondContact O-N 3.42Å; S106-S108 PolarHBondContact OG-OG 3.17Å; S108-K112 WeakPolarHBondContact O-CG 3.23Å
109	E	83	Confident	83.2	Confident	95 Å²	95	63 Å²	63	44%	0.444	30%	0.304	S	S	.	.	H	α-helix	trans	-77.8	-40.2	176.5	-65.9	163.2	144.8	0	0	110.8	Q104 S106 R107 L111 K112	Q104-E109 PolarHBondContact OE1-O 3.11Å; S106-E109 PolarHBondContact O-N 2.04Å; S106-E109 WeakPolarHBondContact OG-CB 3.05Å; S106-E109 WeakPolarHBondContact OG-CG 3.38Å; S106-E109 PolarHBondContact OG-N 3.06Å; S106-E109 PolarHBondContact OG-OE2 2.86Å; R107-E109 VanDerWaalsContact C-N 3.31Å; R107-E109 PolarHBondContact O-N 3.17Å; E109-L111 VanDerWaalsContact C-N 3.34Å; E109-L111 PolarHBondContact O-N 3.39Å; E109-K112 WeakPolarHBondContact O-CB 3.33Å; E109-K112 PolarHBondContact O-N 3.42Å
110	A	82.8	Confident	83.3	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.6	-45	176.6	0	0	0	0	0	111.5	S101 Q104 S106 R107 K112 V113 V114	S101-A110 WeakPolarHBondContact O-CB 3.42Å; Q104-A110 HydrophobicContact CB-CB 4.47Å; Q104-A110 VanDerWaalsContact OE1-N 3.15Å; S106-A110 PolarHBondContact O-N 3.31Å; R107-A110 PolarHBondContact O-N 3.24Å; A110-K112 PolarHBondContact O-N 3.14Å; A110-K112 VanDerWaalsContact O-N 3.11Å; A110-V113 WeakPolarHBondContact O-CG2 3.35Å; A110-V113 PolarHBondContact O-N 2.81Å; A110-V114 HydrophobicContact CB-CG2 4.33Å; A110-V114 WeakPolarHBondContact O-CG2 3.29Å; A110-V114 PolarHBondContact O-N 2.77Å
111	L	84.9	Confident	83.5	Confident	24 Å²	24	58.4 Å²	58.4	13%	0.126	29%	0.291	C	S	.	.	H	α-helix	trans	-69	-10	-177	-65.6	-176.1	0	0	0	115.2	R107 E109 V113 V114 E116 H119	R107-L111 HydrophobicContact CG-CD1 3.76Å; R107-L111 HydrophobicContact CG-CG 4.03Å; R107-L111 VanDerWaalsContact O-CG 3.28Å; R107-L111 WeakPolarHBondContact O-CG 3.42Å; R107-L111 PolarHBondContact O-N 3.39Å; E109-L111 VanDerWaalsContact C-N 3.34Å; E109-L111 PolarHBondContact O-N 3.39Å; L111-V113 VanDerWaalsContact C-N 3.33Å; L111-V114 CarbonylContact C-O 3.51Å; L111-V114 VanDerWaalsContact CA-O 3.31Å; L111-V114 WeakPolarHBondContact CA-O 3.37Å; L111-E116 HydrophobicContact CD1-CG 3.61Å; L111-E116 WeakPolarHBondContact CD1-OE1 3.46Å; L111-E116 HydrophobicContact CD2-CB 4.21Å; L111-E116 HydrophobicContact CD2-CG 3.51Å; L111-E116 HydrophobicContact CG-CG 4.17Å; L111-H119 HydrophobicContact CD2-CB 3.91Å
112	K	83.5	Confident	84.2	Confident	135 Å²	135	56.4 Å²	56.4	59%	0.587	28%	0.277	S	S	*	.	H	α-helix	trans	-74.4	-27.5	170.2	-68.1	174.1	-177.8	-177.8	0	112.2	S108 E109 A110 S408	S108-K112 WeakPolarHBondContact O-CG 3.23Å; E109-K112 WeakPolarHBondContact O-CB 3.33Å; E109-K112 PolarHBondContact O-N 3.42Å; A110-K112 PolarHBondContact O-N 3.14Å; A110-K112 VanDerWaalsContact O-N 3.11Å; K112-S408 VanDerWaalsContact O-CB 3.28Å; K112-S408 WeakPolarHBondContact O-CB 3.37Å
113	V	83.6	Confident	84.7	Confident	78 Å²	78	60 Å²	60	47%	0.473	29%	0.292	S	S	.	.	H	α-helix	trans	-112.6	-26.2	-174.1	-74.8	0	0	0	0	113.4	A110 L111	A110-V113 WeakPolarHBondContact O-CG2 3.35Å; A110-V113 PolarHBondContact O-N 2.81Å; L111-V113 VanDerWaalsContact C-N 3.33Å
114	V	87	Confident	85.1	Confident	19 Å²	19	59.3 Å²	59.3	12%	0.115	29%	0.285	C	S	.	.	S	Bend	trans	-125.2	154.4	176.2	-63.9	0	0	0	0	110.4	I102 A110 L111 H119	I102-V114 HydrophobicContact CD1-CG1 4.47Å; I102-V114 HydrophobicContact CG1-CB 4.45Å; I102-V114 HydrophobicContact CG1-CG1 3.86Å; I102-V114 HydrophobicContact CG1-CG2 4.11Å; A110-V114 HydrophobicContact CB-CG2 4.33Å; A110-V114 WeakPolarHBondContact O-CG2 3.29Å; A110-V114 PolarHBondContact O-N 2.77Å; L111-V114 CarbonylContact C-O 3.51Å; L111-V114 VanDerWaalsContact CA-O 3.31Å; L111-V114 WeakPolarHBondContact CA-O 3.37Å; V114-H119 HydrophobicContact CG2-CB 3.97Å
115	N	90.1	Very high	86	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.011	27%	0.271	C	S	.	.			trans	-77	162.6	173.2	69.7	68.9	0	0	0	112.4	R117 I118 H119 D405 L407 T409 L412	N115-R117 VanDerWaalsContact C-N 3.29Å; N115-R117 PolarHBondContact O-N 3.17Å; N115-R117 WeakPolarHBondContact OD1-CA 3.11Å; N115-R117 WeakPolarHBondContact OD1-CB 3.32Å; N115-R117 PolarHBondContact OD1-N 2.97Å; N115-I118 PolarHBondContact O-N 3.27Å; N115-I118 PolarHBondContact OD1-N 3.5Å; N115-H119 WeakPolarHBondContact O-CB 2.98Å; N115-H119 PolarHBondContact O-N 2.82Å; N115-D405 VanDerWaalsContact ND2-CA 3.34Å; N115-D405 WeakPolarHBondContact ND2-CA 3.35Å; N115-D405 PolarHBondContact ND2-O 3.41Å; N115-D405 PolarHBondContact ND2-OD1 2.91Å; N115-D405 VanDerWaalsContact ND2-OD1 3.15Å; N115-L407 WeakPolarHBondContact CB-O 3.44Å; N115-T409 VanDerWaalsContact CA-OG1 3.29Å; N115-T409 WeakPolarHBondContact CA-OG1 3.22Å; N115-L412 HydrophobicContact CB-CD1 3.69Å
116	E	88.4	Confident	87	Confident	70 Å²	70	47.9 Å²	47.9	33%	0.327	24%	0.238	S	C	.	.	H	α-helix	trans	-61.5	-32.7	-179.1	-79.8	-169.6	142.9	0	0	114.1	R107 L111 G120 T409 Y521	R107-E116 IonicContact CZ-OE1 3.67Å; R107-E116 IonicContact NH2-OE1 2.68Å; R107-E116 PolarHBondContact NH2-OE1 2.84Å; L111-E116 HydrophobicContact CD1-CG 3.61Å; L111-E116 WeakPolarHBondContact CD1-OE1 3.46Å; L111-E116 HydrophobicContact CD2-CB 4.21Å; L111-E116 HydrophobicContact CD2-CG 3.51Å; L111-E116 HydrophobicContact CG-CG 4.17Å; E116-G120 PolarHBondContact O-N 2.89Å; E116-T409 HydrophobicContact CG-CG2 4.05Å; E116-T409 WeakPolarHBondContact CG-OG1 3.37Å; E116-T409 PolarHBondContact N-OG1 3.08Å; E116-Y521 PolarHBondContact OE2-OH 3.35Å
117	R	87.7	Confident	87.3	Confident	46 Å²	46	48.6 Å²	48.6	17%	0.174	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-54.4	179.3	178.7	-166.5	-178.2	-156.1	7.3	110.3	N115 G120 Q121 D405 H528	N115-R117 VanDerWaalsContact C-N 3.29Å; N115-R117 PolarHBondContact O-N 3.17Å; N115-R117 WeakPolarHBondContact OD1-CA 3.11Å; N115-R117 WeakPolarHBondContact OD1-CB 3.32Å; N115-R117 PolarHBondContact OD1-N 2.97Å; R117-G120 PolarHBondContact O-N 3.32Å; R117-Q121 WeakPolarHBondContact O-CB 3.21Å; R117-Q121 PolarHBondContact O-N 3.5Å; R117-D405 IonicContact CZ-OD2 3.7Å; R117-D405 IonicContact NH1-OD1 2.77Å; R117-D405 IonicContact NH1-OD2 3.31Å; R117-D405 PolarHBondContact NH1-OD2 2.9Å; R117-H528 VanDerWaalsContact CZ-O 3.29Å; R117-H528 PolarHBondContact NH1-O 3.17Å; R117-H528 PolarHBondContact NH2-O 3.27Å
118	I	89	Confident	87.6	Confident	22 Å²	22	44.7 Å²	44.7	11%	0.113	23%	0.234	C	C	.	.	H	α-helix	trans	-62.8	-44.4	178.4	-68.3	-61.1	0	0	0	111.2	I102 N115 G120 Q121 V122 D405	I102-I118 HydrophobicContact CD1-CG2 3.7Å; N115-I118 PolarHBondContact O-N 3.27Å; N115-I118 PolarHBondContact OD1-N 3.5Å; I118-G120 VanDerWaalsContact C-N 3.34Å; I118-G120 PolarHBondContact O-N 2.84Å; I118-Q121 PolarHBondContact O-N 3.42Å; I118-V122 HydrophobicContact CG2-CG2 4.34Å; I118-V122 WeakPolarHBondContact O-CB 3.38Å; I118-V122 WeakPolarHBondContact O-CG2 3.38Å; I118-V122 PolarHBondContact O-N 3.3Å; I118-D405 HydrophobicContact CD1-CB 3.82Å; I118-D405 HydrophobicContact CG1-CB 3.69Å; I118-D405 WeakPolarHBondContact CG1-OD1 3.21Å
119	H	89.4	Confident	88.1	Confident	14 Å²	14	41.1 Å²	41.1	7%	0.065	21%	0.209	C	C	.	.	H	α-helix	trans	-58.5	-46.6	175.8	175.5	-90.6	0	0	0	111.4	L111 V114 N115 K123	L111-H119 HydrophobicContact CD2-CB 3.91Å; V114-H119 HydrophobicContact CG2-CB 3.97Å; N115-H119 WeakPolarHBondContact O-CB 2.98Å; N115-H119 PolarHBondContact O-N 2.82Å; H119-K123 WeakPolarHBondContact NE2-CE 3.2Å; H119-K123 WeakPolarHBondContact O-CB 3.48Å; H119-K123 WeakPolarHBondContact O-CG 3.37Å; H119-K123 PolarHBondContact O-N 3.37Å; H119-K123 VanDerWaalsContact O-N 3.08Å
120	G	87.8	Confident	88.6	Confident	19 Å²	19	46.1 Å²	46.1	20%	0.196	22%	0.223	C	C	.	.	H	α-helix	trans	-62.5	-47.2	176.8	0	0	0	0	0	112.7	E116 R117 I118 K123 R124	E116-G120 PolarHBondContact O-N 2.89Å; R117-G120 PolarHBondContact O-N 3.32Å; I118-G120 VanDerWaalsContact C-N 3.34Å; I118-G120 PolarHBondContact O-N 2.84Å; G120-K123 PolarHBondContact O-N 2.86Å; G120-R124 WeakPolarHBondContact O-CG 3.33Å; G120-R124 PolarHBondContact O-N 3.41Å
121	Q	88.2	Confident	89.1	Confident	33 Å²	33	49.8 Å²	49.8	15%	0.154	24%	0.243	C	C	.	.	H	α-helix	trans	-56.3	-57.6	177	174.7	177.9	-16.6	0	0	111.2	R117 I118 K123 R124 L125 D183	R117-Q121 WeakPolarHBondContact O-CB 3.21Å; R117-Q121 PolarHBondContact O-N 3.5Å; I118-Q121 PolarHBondContact O-N 3.42Å; Q121-K123 VanDerWaalsContact C-N 3.3Å; Q121-K123 PolarHBondContact O-N 3.38Å; Q121-R124 WeakPolarHBondContact O-CB 3.44Å; Q121-R124 PolarHBondContact O-N 2.84Å; Q121-L125 HydrophobicContact CG-CD1 4.01Å; Q121-L125 HydrophobicContact CG-CG 4.31Å; Q121-L125 WeakPolarHBondContact O-CG 3.33Å; Q121-L125 PolarHBondContact O-N 3.03Å; Q121-D183 PolarHBondContact NE2-OD2 3.3Å; Q121-D183 VanDerWaalsContact NE2-OD2 3.13Å
122	V	89.8	Confident	89.6	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	25%	0.25	C	C	.	.	H	α-helix	trans	-62.1	-38	-177.4	170.5	0	0	0	0	111.4	W98 I102 I118 R124 L125 V126	W98-V122 HydrophobicContact CE3-CG1 3.71Å; W98-V122 HydrophobicContact CZ3-CG1 4.04Å; I102-V122 HydrophobicContact CB-CG1 4.36Å; I102-V122 HydrophobicContact CD1-CB 4Å; I102-V122 HydrophobicContact CD1-CG1 4.11Å; I102-V122 HydrophobicContact CD1-CG2 3.69Å; I102-V122 HydrophobicContact CG2-CB 3.88Å; I102-V122 HydrophobicContact CG2-CG1 3.67Å; I118-V122 HydrophobicContact CG2-CG2 4.34Å; I118-V122 WeakPolarHBondContact O-CB 3.38Å; I118-V122 WeakPolarHBondContact O-CG2 3.38Å; I118-V122 PolarHBondContact O-N 3.3Å; V122-R124 PolarHBondContact O-N 3.39Å; V122-L125 PolarHBondContact O-N 2.82Å; V122-V126 HydrophobicContact CG1-CG2 4.22Å; V122-V126 WeakPolarHBondContact O-CB 3.33Å; V122-V126 WeakPolarHBondContact O-CG2 3.19Å; V122-V126 PolarHBondContact O-N 3.23Å
123	K	89.1	Confident	90.3	Very high	79 Å²	79	51.2 Å²	51.2	34%	0.343	25%	0.245	S	C	.	.	H	α-helix	trans	-62.1	-39.8	174	-71.4	-69	-177.7	-169.4	0	112.6	I102 H119 G120 Q121 A127	I102-K123 PolarHBondContact O-NZ 3.04Å; H119-K123 WeakPolarHBondContact NE2-CE 3.2Å; H119-K123 WeakPolarHBondContact O-CB 3.48Å; H119-K123 WeakPolarHBondContact O-CG 3.37Å; H119-K123 PolarHBondContact O-N 3.37Å; H119-K123 VanDerWaalsContact O-N 3.08Å; G120-K123 PolarHBondContact O-N 2.86Å; Q121-K123 VanDerWaalsContact C-N 3.3Å; Q121-K123 PolarHBondContact O-N 3.38Å; K123-A127 PolarHBondContact O-N 3.16Å
124	R	89	Confident	90.9	Very high	71 Å²	71	48.8 Å²	48.8	27%	0.268	23%	0.229	S	C	.	.	H	α-helix	trans	-64.7	-45.9	173.1	-69.9	-170.5	-54.4	-93.5	-5.8	111.1	G120 Q121 V122 V126 A127 M128 D554	G120-R124 WeakPolarHBondContact O-CG 3.33Å; G120-R124 PolarHBondContact O-N 3.41Å; Q121-R124 WeakPolarHBondContact O-CB 3.44Å; Q121-R124 PolarHBondContact O-N 2.84Å; V122-R124 PolarHBondContact O-N 3.39Å; R124-V126 PolarHBondContact O-N 3.24Å; R124-A127 WeakPolarHBondContact O-CB 3.46Å; R124-A127 PolarHBondContact O-N 3.08Å; R124-A127 VanDerWaalsContact O-N 3.08Å; R124-M128 HydrophobicContact CB-CE 4.26Å; R124-M128 WeakPolarHBondContact O-CB 3.25Å; R124-M128 WeakPolarHBondContact O-CG 3.48Å; R124-M128 PolarHBondContact O-N 2.94Å; R124-D554 IonicContact CZ-OD2 3.33Å; R124-D554 IonicContact NE-OD2 3.21Å; R124-D554 VanDerWaalsContact NH1-CB 3.34Å; R124-D554 IonicContact NH1-OD2 2.8Å; R124-D554 PolarHBondContact NH1-OD2 2.78Å
125	L	92.1	Very high	91.4	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-60.9	-43.7	179	-65.6	-177	0	0	0	112.2	W98 Q121 V122 A127 M128 L129 L192	W98-L125 HydrophobicContact CH2-CB 3.8Å; W98-L125 HydrophobicContact CZ3-CB 4.13Å; Q121-L125 HydrophobicContact CG-CD1 4.01Å; Q121-L125 HydrophobicContact CG-CG 4.31Å; Q121-L125 WeakPolarHBondContact O-CG 3.33Å; Q121-L125 PolarHBondContact O-N 3.03Å; V122-L125 PolarHBondContact O-N 2.82Å; L125-A127 PolarHBondContact O-N 3.47Å; L125-M128 PolarHBondContact O-N 2.92Å; L125-M128 VanDerWaalsContact O-N 3.13Å; L125-L129 WeakPolarHBondContact O-CB 3.4Å; L125-L129 WeakPolarHBondContact O-CG 3.33Å; L125-L129 PolarHBondContact O-N 3.19Å; L125-L192 HydrophobicContact CD2-CD1 3.45Å; L125-L192 VanDerWaalsContact CD2-CD1 3.45Å; L125-L192 HydrophobicContact CD2-CD2 4.24Å; L125-L192 HydrophobicContact CD2-CG 4.46Å
126	V	91.4	Very high	91.7	Very high	40 Å²	40	50.3 Å²	50.3	24%	0.242	24%	0.237	C	C	.	.	H	α-helix	trans	-58	-38.8	174.1	169.9	0	0	0	0	111.2	W98 M103 V122 R124	W98-V126 HydrophobicContact CD2-CG2 3.55Å; W98-V126 HydrophobicContact CE3-CG2 3.9Å; W98-V126 HydrophobicContact CG-CG2 4.01Å; W98-V126 HydrophobicContact CH2-CG2 4.14Å; W98-V126 HydrophobicContact CZ2-CB 4.48Å; W98-V126 HydrophobicContact CZ2-CG2 3.83Å; W98-V126 HydrophobicContact CZ3-CG2 4.17Å; M103-V126 HydrophobicContact SD-CG2 4.23Å; V122-V126 HydrophobicContact CG1-CG2 4.22Å; V122-V126 WeakPolarHBondContact O-CB 3.33Å; V122-V126 WeakPolarHBondContact O-CG2 3.19Å; V122-V126 PolarHBondContact O-N 3.23Å; R124-V126 PolarHBondContact O-N 3.24Å
127	A	90	Very high	92.2	Very high	49 Å²	49	47 Å²	47	41%	0.405	22%	0.221	S	C	.	.	H	α-helix	trans	-73.5	-30.6	178.2	0	0	0	0	0	113.2	K123 R124 L125 R130	K123-A127 PolarHBondContact O-N 3.16Å; R124-A127 WeakPolarHBondContact O-CB 3.46Å; R124-A127 PolarHBondContact O-N 3.08Å; R124-A127 VanDerWaalsContact O-N 3.08Å; L125-A127 PolarHBondContact O-N 3.47Å; A127-R130 WeakPolarHBondContact O-CD 3.45Å; A127-R130 WeakPolarHBondContact O-CG 3.22Å; A127-R130 PolarHBondContact O-NE 2.97Å
128	M	90.5	Very high	92.7	Very high	58 Å²	58	46.2 Å²	46.2	29%	0.286	22%	0.218	S	C	.	.	H	α-helix	trans	-83.3	-39.4	-179.5	-74.8	177.4	-169.2	0	0	112.8	R124 L125 R130 L192 L550 N551	R124-M128 HydrophobicContact CB-CE 4.26Å; R124-M128 WeakPolarHBondContact O-CB 3.25Å; R124-M128 WeakPolarHBondContact O-CG 3.48Å; R124-M128 PolarHBondContact O-N 2.94Å; L125-M128 PolarHBondContact O-N 2.92Å; L125-M128 VanDerWaalsContact O-N 3.13Å; M128-R130 PolarHBondContact O-N 2.93Å; M128-L192 HydrophobicContact CB-CD2 4.17Å; M128-L192 HydrophobicContact SD-CD2 4.24Å; M128-L550 HydrophobicContact CB-CD2 3.81Å; M128-L550 HydrophobicContact CG-CD2 3.81Å; M128-N551 VanDerWaalsContact CE-O 3.25Å; M128-N551 WeakPolarHBondContact CE-O 3.21Å
129	L	93.5	Very high	93.1	Very high	6 Å²	6	45.1 Å²	45.1	3%	0.031	21%	0.213	C	C	.	.			trans	-96.9	50.7	-176.9	-57	-173.9	0	0	0	111.5	A93 Q96 W98 L125 Q132 L192	A93-L129 HydrophobicContact CB-CB 4.4Å; A93-L129 HydrophobicContact CB-CD2 4.05Å; Q96-L129 HydrophobicContact CG-CD1 4.44Å; W98-L129 HydrophobicContact CH2-CD1 4.23Å; L125-L129 WeakPolarHBondContact O-CB 3.4Å; L125-L129 WeakPolarHBondContact O-CG 3.33Å; L125-L129 PolarHBondContact O-N 3.19Å; L129-Q132 VanDerWaalsContact O-CG 3.31Å; L129-Q132 WeakPolarHBondContact O-CG 3.2Å; L129-Q132 PolarHBondContact O-NE2 2.88Å; L129-L192 HydrophobicContact CD1-CD1 4.12Å; L129-L192 HydrophobicContact CD2-CD1 4.18Å; L129-L192 HydrophobicContact CD2-CD2 3.78Å; L129-L192 HydrophobicContact CD2-CG 3.98Å; L129-L192 HydrophobicContact CG-CD1 4.38Å; L129-L192 HydrophobicContact CG-CD2 4.37Å
130	R	92.6	Very high	93.5	Very high	199 Å²	199	44.5 Å²	44.5	75%	0.751	21%	0.21	S	C	*	.			trans	-76.2	-37.2	179.2	-67	179.4	-167.1	-163	-1.1	112.8	A127 M128 Q132	A127-R130 WeakPolarHBondContact O-CD 3.45Å; A127-R130 WeakPolarHBondContact O-CG 3.22Å; A127-R130 PolarHBondContact O-NE 2.97Å; M128-R130 PolarHBondContact O-N 2.93Å; R130-Q132 PolarHBondContact O-N 3Å
131	D	94.3	Very high	94	Very high	77 Å²	77	43.6 Å²	43.6	41%	0.412	20%	0.201	S	C	.	.			trans	-82.4	96.2	175.8	-169.3	6.6	0	0	0	109.4	A93 R133	A93-D131 PolarHBondContact N-O 3.3Å; D131-R133 IonicContact OD1-CZ 3.5Å; D131-R133 IonicContact OD1-NE 3.68Å; D131-R133 PolarHBondContact OD1-NE 3.15Å; D131-R133 IonicContact OD1-NH2 2.83Å; D131-R133 PolarHBondContact OD1-NH2 3.26Å; D131-R133 IonicContact OD2-CZ 3.6Å; D131-R133 IonicContact OD2-NE 3.25Å; D131-R133 IonicContact OD2-NH2 3.58Å; D131-R133 PolarHBondContact OD2-NH2 3.03Å
132	Q	95.6	Very high	94.4	Very high	58 Å²	58	42 Å²	42	27%	0.271	19%	0.193	S	C	.	.	B	Isolated β-bridge	trans	-115.7	132.1	178.8	-63.8	178.6	26.3	0	0	109.7	A93 Q96 L129 R130	A93-Q132 WeakPolarHBondContact O-CA 3.43Å; Q96-Q132 HydrophobicContact CG-CG 4.25Å; L129-Q132 VanDerWaalsContact O-CG 3.31Å; L129-Q132 WeakPolarHBondContact O-CG 3.2Å; L129-Q132 PolarHBondContact O-NE2 2.88Å; R130-Q132 PolarHBondContact O-N 3Å
133	R	96.6	Very high	94.7	Very high	131 Å²	131	42.2 Å²	42.2	49%	0.494	19%	0.194	S	C	.	.			trans	-141.5	155.6	178.7	-56.4	-174.2	-160.9	176.1	6.6	110.1	P92 A93 D131 D135 C136	P92-R133 HydrophobicContact CB-CB 4.22Å; P92-R133 HydrophobicContact CB-CG 3.91Å; P92-R133 HydrophobicContact CG-CB 4.37Å; P92-R133 HydrophobicContact CG-CG 4.29Å; A93-R133 PolarHBondContact O-N 2.81Å; D131-R133 IonicContact OD1-CZ 3.5Å; D131-R133 IonicContact OD1-NE 3.68Å; D131-R133 PolarHBondContact OD1-NE 3.15Å; D131-R133 IonicContact OD1-NH2 2.83Å; D131-R133 PolarHBondContact OD1-NH2 3.26Å; D131-R133 IonicContact OD2-CZ 3.6Å; D131-R133 IonicContact OD2-NE 3.25Å; D131-R133 IonicContact OD2-NH2 3.58Å; D131-R133 PolarHBondContact OD2-NH2 3.03Å; R133-D135 VanDerWaalsContact C-N 3.28Å; R133-C136 WeakPolarHBondContact O-CB 3.48Å
134	E	96.9	Very high	95	Very high	27 Å²	27	38.6 Å²	38.6	13%	0.126	18%	0.179	C	C	.	.	S	Bend	trans	-67.2	-34.5	165.5	-75.4	-169.1	98.2	0	0	111.1	P65 T66 R70 V95 C136 F216 V346	P65-E134 VanDerWaalsContact CD-O 3.22Å; P65-E134 WeakPolarHBondContact CD-O 3.31Å; P65-E134 WeakPolarHBondContact CG-O 3.34Å; T66-E134 HydrophobicContact CG2-CB 3.55Å; T66-E134 HydrophobicContact CG2-CG 4.47Å; R70-E134 IonicContact CZ-OE1 3.98Å; R70-E134 IonicContact CZ-OE2 2.88Å; R70-E134 IonicContact NE-OE1 3.49Å; R70-E134 PolarHBondContact NE-OE1 2.53Å; R70-E134 IonicContact NE-OE2 3.39Å; R70-E134 IonicContact NH2-OE1 2.91Å; R70-E134 PolarHBondContact NH2-OE1 3.45Å; R70-E134 IonicContact NH2-OE2 3.68Å; R70-E134 PolarHBondContact NH2-OE2 3.05Å; V95-E134 HydrophobicContact CG2-CG 4.26Å; E134-C136 VanDerWaalsContact C-N 3.29Å; E134-C136 PolarHBondContact O-N 3.23Å; E134-F216 HydrophobicContact CG-CE1 4.38Å; E134-V346 VanDerWaalsContact CD-CG2 3.44Å; E134-V346 HydrophobicContact CG-CG1 4.46Å; E134-V346 HydrophobicContact CG-CG2 3.67Å; E134-V346 WeakPolarHBondContact OE2-CG2 3.4Å
135	D	97.1	Very high	94.9	Very high	52 Å²	52	36.7 Å²	36.7	28%	0.278	18%	0.178	S	C	.	.			trans	-73.1	84.5	168.2	-176.7	24.7	0	0	0	110.2	A64 P92 R133 Y138	A64-D135 HydrophobicContact CB-CB 3.71Å; P92-D135 WeakPolarHBondContact CG-O 3.34Å; R133-D135 VanDerWaalsContact C-N 3.28Å; D135-Y138 WeakPolarHBondContact O-CE2 3.42Å; D135-Y138 PolarHBondContact OD1-OH 2.77Å; D135-Y138 PolarHBondContact OD2-OH 2.88Å
136	C	97.6	Very high	94.1	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.014	20%	0.197	C	C	.	.			trans	-134.4	6.4	-174.7	67.7	0	0	0	0	114.2	C94 R133 E134 Y138 N210	C94-C136 VanDerWaalsContact CA-CB 3.43Å; C94-C136 WeakPolarHBondContact CA-SG 3.27Å; C94-C136 HydrophobicContact CB-CB 3.78Å; C94-C136 WeakPolarHBondContact CB-SG 3.22Å; C94-C136 WeakPolarHBondContact SG-CB 3.23Å; C94-C136 CovalentContact SG-SG 2.03Å; C94-C136 PolarHBondContact SG-SG 3.08Å; R133-C136 WeakPolarHBondContact O-CB 3.48Å; E134-C136 VanDerWaalsContact C-N 3.29Å; E134-C136 PolarHBondContact O-N 3.23Å; C136-Y138 PolarHBondContact O-N 2.83Å; C136-N210 VanDerWaalsContact O-CB 3.26Å; C136-N210 WeakPolarHBondContact O-CB 3.36Å
137	L	98.1	Very high	92.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	23%	0.23	C	C	.	.			trans	-78.2	70	-175.3	-57.9	-172.4	0	0	0	112	Y61 G62 P65 P74 R212 D234	Y61-L137 WeakPolarHBondContact CD1-O 3.22Å; Y61-L137 HydrophobicContact CD2-CB 4.41Å; Y61-L137 HydrophobicContact CE1-CB 4.18Å; Y61-L137 HydrophobicContact CE2-CB 3.85Å; Y61-L137 HydrophobicContact CE2-CD2 4.37Å; Y61-L137 HydrophobicContact CE2-CG 4.46Å; Y61-L137 PolarHBondContact N-O 3.22Å; Y61-L137 WeakPolarHBondContact OH-CD2 3.29Å; G62-L137 PolarHBondContact N-O 2.98Å; P65-L137 HydrophobicContact CG-CD1 4.12Å; P65-L137 HydrophobicContact CG-CG 4.2Å; P74-L137 HydrophobicContact CB-CD1 4.04Å; L137-R212 HydrophobicContact CD2-CG 4.19Å; L137-D234 HydrophobicContact CD2-CB 4.29Å
138	Y	97.8	Very high	90.4	Very high	29 Å²	29	51.6 Å²	51.6	11%	0.114	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	153.7	-176	-61.8	-83.7	0	0	0	112.6	G58 V59 P60 Y61 P91 P92 D135 C136 N210	G58-Y138 VanDerWaalsContact O-CD1 3.26Å; G58-Y138 WeakPolarHBondContact O-CD1 3.22Å; V59-Y138 CarbonylContact O-C 3.44Å; V59-Y138 WeakPolarHBondContact O-CA 3.37Å; P60-Y138 HydrophobicContact CB-CD1 3.92Å; P60-Y138 HydrophobicContact CB-CE1 3.75Å; P60-Y138 HydrophobicContact CG-CE1 4.45Å; Y61-Y138 VanDerWaalsContact CE1-N 3.32Å; Y61-Y138 WeakPolarHBondContact CE1-O 3.35Å; P91-Y138 HydrophobicContact CB-CD1 4.22Å; P91-Y138 HydrophobicContact CB-CD2 3.62Å; P91-Y138 HydrophobicContact CB-CE2 4.43Å; P91-Y138 HydrophobicContact CB-CG 3.52Å; P91-Y138 HydrophobicContact CG-CG 4.24Å; P92-Y138 HydrophobicContact CG-CE2 4.3Å; D135-Y138 WeakPolarHBondContact O-CE2 3.42Å; D135-Y138 PolarHBondContact OD1-OH 2.77Å; D135-Y138 PolarHBondContact OD2-OH 2.88Å; C136-Y138 PolarHBondContact O-N 2.83Å; Y138-N210 PolarHBondContact O-N 3.46Å
139	M	97.7	Very high	88.2	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	155.3	172.1	66.7	173.2	81.4	0	0	111.8	G58 V59 Y61 L141 V207 T208 L209 A238 V241 L242 M245	G58-M139 PolarHBondContact N-O 3.1Å; V59-M139 HydrophobicContact CB-CG 4.02Å; V59-M139 PolarHBondContact N-O 3.36Å; V59-M139 PolarHBondContact O-N 3.1Å; Y61-M139 VanDerWaalsContact CB-CE 3.47Å; Y61-M139 HydrophobicContact CD1-CB 4.28Å; Y61-M139 HydrophobicContact CD1-CE 3.98Å; Y61-M139 HydrophobicContact CG-CE 3.99Å; M139-L141 HydrophobicContact CG-CD1 3.96Å; M139-L141 HydrophobicContact SD-CD1 4.13Å; M139-V207 HydrophobicContact CB-CG1 4.16Å; M139-V207 HydrophobicContact SD-CG1 4.1Å; M139-T208 CarbonylContact C-O 3.54Å; M139-T208 WeakPolarHBondContact CA-O 3.49Å; M139-L209 HydrophobicContact CB-CD2 3.32Å; M139-L209 HydrophobicContact CE-CD2 4.34Å; M139-L209 HydrophobicContact CG-CD2 4.44Å; M139-L209 HydrophobicContact SD-CD2 4.38Å; M139-A238 HydrophobicContact CE-CB 3.99Å; M139-A238 WeakPolarHBondContact CE-O 3.3Å; M139-V241 HydrophobicContact CE-CB 4.41Å; M139-V241 HydrophobicContact CE-CG1 4.29Å; M139-L242 HydrophobicContact CE-CB 4.37Å; M139-L242 HydrophobicContact SD-CB 4.49Å; M139-L242 HydrophobicContact SD-CD1 4.2Å; M139-M245 HydrophobicContact CE-CE 4.02Å; M139-M245 HydrophobicContact CG-CE 4.31Å; M139-M245 HydrophobicContact SD-CE 3.29Å; M139-M245 WeakPolarHBondContact SD-CE 3.47Å
140	N	97.5	Very high	85.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	132.3	177.1	-48.5	-60.1	0	0	0	109.3	Y56 L57 G58 P91 F142 V207 T208	Y56-N140 CarbonylContact O-C 3.42Å; Y56-N140 WeakPolarHBondContact O-CA 3.21Å; L57-N140 WeakPolarHBondContact CA-OD1 3.42Å; L57-N140 HydrophobicContact CD2-CB 3.97Å; G58-N140 PolarHBondContact N-OD1 3.06Å; P91-N140 WeakPolarHBondContact CD-OD1 3.39Å; N140-F142 HydrophobicContact CB-CE2 4.11Å; N140-F142 HydrophobicContact CB-CZ 4.39Å; N140-V207 CarbonylContact O-C 3.23Å; N140-V207 WeakPolarHBondContact O-CA 3.38Å; N140-T208 PolarHBondContact N-O 3.41Å; N140-T208 PolarHBondContact ND2-OG1 3.17Å; N140-T208 PolarHBondContact O-N 2.83Å
141	L	97.9	Very high	83.4	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	131.9	179.7	-63	85.3	0	0	0	110.7	Q55 Y56 V59 M139 V143 V207 L242 M245 F249	Q55-L141 WeakPolarHBondContact CA-O 3.36Å; Y56-L141 PolarHBondContact N-O 3.44Å; Y56-L141 PolarHBondContact O-N 2.75Å; V59-L141 HydrophobicContact CB-CD1 4.1Å; V59-L141 HydrophobicContact CG2-CD1 3.74Å; M139-L141 HydrophobicContact CG-CD1 3.96Å; M139-L141 HydrophobicContact SD-CD1 4.13Å; L141-V143 HydrophobicContact CB-CG2 4.43Å; L141-V207 HydrophobicContact CG-CG2 4.21Å; L141-L242 HydrophobicContact CD2-CD1 4.27Å; L141-M245 HydrophobicContact CD1-CE 4.19Å; L141-M245 HydrophobicContact CD2-CE 4.32Å; L141-F249 HydrophobicContact CD2-CD1 4.29Å; L141-F249 HydrophobicContact CD2-CD2 3.88Å; L141-F249 HydrophobicContact CD2-CE1 4.18Å; L141-F249 HydrophobicContact CD2-CE2 3.8Å; L141-F249 HydrophobicContact CD2-CG 4.12Å; L141-F249 HydrophobicContact CD2-CZ 3.94Å
142	F	97.4	Very high	81	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	105.7	176.2	-55.9	-89.5	0	0	0	108.9	V53 Q55 L57 N140 S196 A199 I205 V206 T208 I548	V53-F142 HydrophobicContact CG1-CB 4.04Å; Q55-F142 HydrophobicContact CG-CD1 3.92Å; Q55-F142 HydrophobicContact CG-CE1 4.28Å; L57-F142 HydrophobicContact CD2-CE1 4.23Å; L57-F142 HydrophobicContact CD2-CZ 4.23Å; N140-F142 HydrophobicContact CB-CE2 4.11Å; N140-F142 HydrophobicContact CB-CZ 4.39Å; F142-S196 WeakPolarHBondContact CD1-OG 3.32Å; F142-A199 HydrophobicContact CB-CB 4.05Å; F142-I205 WeakPolarHBondContact O-CA 3.5Å; F142-V206 HydrophobicContact CB-CB 4.22Å; F142-V206 HydrophobicContact CD2-CB 4.26Å; F142-V206 HydrophobicContact CD2-CG1 4.34Å; F142-V206 WeakPolarHBondContact CD2-O 3.4Å; F142-V206 PolarHBondContact N-O 2.98Å; F142-V206 PolarHBondContact O-N 3.4Å; F142-V206 VanDerWaalsContact O-N 3.1Å; F142-T208 HydrophobicContact CE2-CG2 4.08Å; F142-I548 HydrophobicContact CE1-CG2 4.31Å
143	V	96.9	Very high	78.9	Confident	5 Å²	5	67.2 Å²	67.2	3%	0.03	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	113.5	-170.8	-175.4	0	0	0	0	109.7	V53 E54 Y56 L141 M174 I205 F249	V53-V143 CarbonylContact C-O 3.59Å; V53-V143 WeakPolarHBondContact CA-O 3.42Å; E54-V143 HydrophobicContact CB-CB 4.29Å; E54-V143 PolarHBondContact N-O 3.43Å; E54-V143 PolarHBondContact O-N 2.91Å; Y56-V143 HydrophobicContact CD2-CG2 4.38Å; Y56-V143 HydrophobicContact CE2-CG2 4.32Å; L141-V143 HydrophobicContact CB-CG2 4.43Å; V143-M174 HydrophobicContact CG1-CE 3.97Å; V143-I205 HydrophobicContact CG1-CD1 4.38Å; V143-I205 HydrophobicContact CG1-CG1 4.38Å; V143-I205 HydrophobicContact CG2-CD1 4.36Å; V143-I205 HydrophobicContact CG2-CG1 4.45Å; V143-I205 HydrophobicContact CG2-CG2 4.27Å; V143-F249 HydrophobicContact CG2-CB 4.09Å; V143-F249 HydrophobicContact CG2-CD1 4.02Å; V143-F249 HydrophobicContact CG2-CG 4.4Å
144	P	94.9	Very high	76.9	Confident	4 Å²	4	64.9 Å²	64.9	3%	0.026	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	142.1	-179.7	29.9	-33.6	0	0	0	110.8	R146 M174 A199 L204	P144-R146 PolarHBondContact O-N 2.92Å; P144-M174 HydrophobicContact CG-CE 4.21Å; P144-M174 HydrophobicContact CG-SD 3.77Å; P144-A199 WeakPolarHBondContact CB-O 3.35Å; P144-A199 WeakPolarHBondContact CG-O 3.39Å; P144-L204 VanDerWaalsContact CD-O 3.29Å; P144-L204 WeakPolarHBondContact CD-O 3.3Å
145	A	86.8	Confident	74.7	Confident	30 Å²	30	67.4 Å²	67.4	25%	0.248	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-62.5	127.6	-179.6	0	0	0	0	0	110.8	S52 R147	S52-A145 WeakPolarHBondContact O-CB 3.21Å; S52-A145 PolarHBondContact O-N 3.49Å; S52-A145 VanDerWaalsContact OG-CB 3.23Å; S52-A145 WeakPolarHBondContact OG-CB 3.32Å; A145-R147 PolarHBondContact O-N 2.92Å
146	R	74.6	Confident	72.7	Confident	111 Å²	111	70 Å²	70	42%	0.419	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-73.2	117.1	173	-68.2	173.3	164.8	-162.4	-15.5	108.4	P144 G148 E172 G250	P144-R146 PolarHBondContact O-N 2.92Å; R146-G148 PolarHBondContact O-N 2.78Å; R146-E172 PolarHBondContact NH2-O 3.34Å; R146-G250 VanDerWaalsContact NH2-C 3.32Å; R146-G250 PolarHBondContact NH2-O 2.91Å
147	R	57.3	Low	70.6	Confident	246 Å²	246	78 Å²	78	93%	0.928	37%	0.366	S	S	*	.			trans	-61.9	105	162.5	-97	-175.1	176.5	161.6	1	107	A145 K149	A145-R147 PolarHBondContact O-N 2.92Å; R147-K149 PolarHBondContact O-N 3.2Å; R147-K149 VanDerWaalsContact O-N 3.15Å
148	G	47.2	Very low	68.5	Low	49 Å²	49	85.8 Å²	85.8	51%	0.505	40%	0.4	S	S	.	.			trans	-52.4	122.6	169.8	0	0	0	0	0	108.2	R146 Y150	R146-G148 PolarHBondContact O-N 2.78Å; G148-Y150 PolarHBondContact O-N 3.42Å
149	K	43.5	Very low	66.5	Low	185 Å²	185	86.8 Å²	86.8	80%	0.804	42%	0.415	S	S	*	.	S	Bend	trans	-66.5	4.4	-177	-131.3	174.7	-175.8	175.3	0	113.4	R147	R147-K149 PolarHBondContact O-N 3.2Å; R147-K149 VanDerWaalsContact O-N 3.15Å
150	Y	42.8	Very low	64.5	Low	107 Å²	107	93.1 Å²	93.1	42%	0.42	44%	0.442	S	S	.	.			trans	-144.5	106.7	178.7	-53.8	-79	0	0	0	107.8	G148 P169	G148-Y150 PolarHBondContact O-N 3.42Å; Y150-P169 HydrophobicContact CE2-CG 4.26Å
151	R	43.3	Very low	62	Low	233 Å²	233	98.3 Å²	98.3	88%	0.879	48%	0.476	S	S	*	.			trans	-134.5	-1.7	175.9	-129.8	-178.9	167.7	179.1	-4.6	114.4
152	T	43.2	Very low	59.6	Low	63 Å²	63	107.3 Å²	107.3	39%	0.387	52%	0.515	S	S	.	.			trans	-116	140.2	166.7	65.2	0	0	0	0	110.5	V154 D155 L156	T152-V154 PolarHBondContact O-N 3.42Å; T152-V154 VanDerWaalsContact O-N 3.1Å; T152-D155 PolarHBondContact N-OD2 3.26Å; T152-D155 PolarHBondContact O-N 3.03Å; T152-D155 PolarHBondContact OG1-N 2.83Å; T152-D155 PolarHBondContact OG1-OD1 2.76Å; T152-D155 PolarHBondContact OG1-OD2 3.47Å; T152-L156 PolarHBondContact O-N 2.9Å
153	I	51.3	Low	57.2	Low	137 Å²	137	114.2 Å²	114.2	70%	0.703	55%	0.551	S	S	*	*	H	α-helix	trans	-51.8	-27.9	164.9	-79.2	170.4	0	0	0	110.1	L156 F157	I153-L156 PolarHBondContact O-N 2.83Å; I153-F157 WeakPolarHBondContact O-CB 3.37Å; I153-F157 PolarHBondContact O-N 2.76Å
154	V	54.8	Low	54.5	Low	83 Å²	83	121 Å²	121	50%	0.503	59%	0.587	S	S	.	*	H	α-helix	trans	-63.4	-44.1	175.7	-166.7	0	0	0	0	111.8	T152 L156 F157 F158	T152-V154 PolarHBondContact O-N 3.42Å; T152-V154 VanDerWaalsContact O-N 3.1Å; V154-L156 VanDerWaalsContact C-N 3.32Å; V154-L156 PolarHBondContact O-N 3.04Å; V154-F157 PolarHBondContact O-N 2.94Å; V154-F157 VanDerWaalsContact O-N 3.17Å; V154-F158 HydrophobicContact CG1-CD2 3.68Å; V154-F158 HydrophobicContact CG1-CE2 3.62Å; V154-F158 VanDerWaalsContact O-CD2 3.29Å; V154-F158 WeakPolarHBondContact O-CD2 3.03Å; V154-F158 PolarHBondContact O-N 3.19Å
155	D	52.1	Low	51.9	Low	79 Å²	79	130.3 Å²	130.3	42%	0.422	63%	0.628	S	S	.	*	H	α-helix	trans	-65.2	-34.7	176	-62.2	-42.8	0	0	0	112.3	T152 A159	T152-D155 PolarHBondContact N-OD2 3.26Å; T152-D155 PolarHBondContact O-N 3.03Å; T152-D155 PolarHBondContact OG1-N 2.83Å; T152-D155 PolarHBondContact OG1-OD1 2.76Å; T152-D155 PolarHBondContact OG1-OD2 3.47Å; D155-A159 WeakPolarHBondContact O-CB 3.24Å; D155-A159 PolarHBondContact O-N 2.7Å
156	L	53.1	Low	49.8	Very low	107 Å²	107	136.6 Å²	136.6	56%	0.56	66%	0.657	S	S	*	*	H	α-helix	trans	-71.2	-31.3	174.3	-87.8	150.9	0	0	0	112.6	T152 I153 V154	T152-L156 PolarHBondContact O-N 2.9Å; I153-L156 PolarHBondContact O-N 2.83Å; V154-L156 VanDerWaalsContact C-N 3.32Å; V154-L156 PolarHBondContact O-N 3.04Å
157	F	53.8	Low	48.1	Very low	169 Å²	169	141.1 Å²	141.1	74%	0.741	68%	0.679	S	S	*	*	H	α-helix	trans	-80.8	-31.3	-177.8	-144	-95.6	0	0	0	112.9	I153 V154	I153-F157 WeakPolarHBondContact O-CB 3.37Å; I153-F157 PolarHBondContact O-N 2.76Å; V154-F157 PolarHBondContact O-N 2.94Å; V154-F157 VanDerWaalsContact O-N 3.17Å
158	F	55.5	Low	47.4	Very low	164 Å²	164	138.8 Å²	138.8	72%	0.719	68%	0.676	S	S	*	*	H	α-helix	trans	-91.5	-20.1	178.1	-75.7	-71.4	0	0	0	114.5	V154	V154-F158 HydrophobicContact CG1-CD2 3.68Å; V154-F158 HydrophobicContact CG1-CE2 3.62Å; V154-F158 VanDerWaalsContact O-CD2 3.29Å; V154-F158 WeakPolarHBondContact O-CD2 3.03Å; V154-F158 PolarHBondContact O-N 3.19Å
159	A	56	Low	47	Very low	50 Å²	50	140.2 Å²	140.2	41%	0.413	68%	0.676	S	S	.	*	S	Bend	trans	-78.5	-13.4	-178.5	0	0	0	0	0	114.7	D155	D155-A159 WeakPolarHBondContact O-CB 3.24Å; D155-A159 PolarHBondContact O-N 2.7Å
160	F	54.6	Low	47.2	Very low	133 Å²	133	140.7 Å²	140.7	58%	0.583	68%	0.681	S	S	*	*			trans	-150.5	78	-173	-62.6	-78.7	0	0	0	116.5	K162	F160-K162 PolarHBondContact O-N 3.22Å
161	P	45.9	Very low	48	Very low	109 Å²	109	139.7 Å²	139.7	71%	0.708	69%	0.686	S	S	*	*	S	Bend	trans	-93	88.6	154.9	32.8	-22.1	0	0	0	108.4
162	K	47.2	Very low	49.5	Very low	190 Å²	190	137.1 Å²	137.1	83%	0.826	69%	0.685	S	S	*	*	S	Bend	trans	91.8	139.3	174.1	-50.4	169	-179.6	178.8	0	116.2	F160	F160-K162 PolarHBondContact O-N 3.22Å
163	L	46.7	Very low	51.8	Low	144 Å²	144	137.2 Å²	137.2	75%	0.754	68%	0.682	S	S	*	*			trans	88.6	122.4	163.3	-97.7	70.4	0	0	0	120.4
164	N	39.3	Very low	53.9	Low	147 Å²	147	131.8 Å²	131.8	79%	0.786	65%	0.654	S	S	*	*			trans	75.1	91.2	156.3	-63.6	-7.4	0	0	0	120.1
165	F	40.3	Very low	55.8	Low	201 Å²	201	128.3 Å²	128.3	88%	0.882	63%	0.634	S	S	*	*			trans	-46.4	139	155	-93.1	-103.3	0	0	0	113.7
166	L	42.5	Very low	58	Low	162 Å²	162	124.6 Å²	124.6	85%	0.848	61%	0.613	S	S	*	*			trans	81.6	63.8	157.9	-54.2	167.7	0	0	0	119.7
167	K	40.1	Very low	60.2	Low	206 Å²	206	119.5 Å²	119.5	90%	0.896	59%	0.587	S	S	*	*			trans	-133.2	113.8	142	-100	-177.1	178.6	179.9	0	108.9
168	K	41.5	Very low	62.3	Low	196 Å²	196	111.4 Å²	111.4	85%	0.852	55%	0.551	S	S	*	*			trans	-53.7	133.9	165.2	-94.5	-177.5	176	178.5	0	107	Q170	K168-Q170 PolarHBondContact O-N 3.02Å
169	P	40.1	Very low	64.4	Low	80 Å²	80	103.7 Å²	103.7	52%	0.519	52%	0.518	S	S	.	.			trans	-55.9	114	170.2	23	-30.7	0	0	0	107.1	Y150 T171	Y150-P169 HydrophobicContact CE2-CG 4.26Å; P169-T171 PolarHBondContact O-N 3.2Å
170	Q	47.8	Very low	66.4	Low	194 Å²	194	101.3 Å²	101.3	91%	0.907	50%	0.498	S	S	*	.			trans	-61.1	104.7	170	-87.9	-178.4	-25.5	0	0	106	K168 E172	K168-Q170 PolarHBondContact O-N 3.02Å; Q170-E172 PolarHBondContact O-N 3.21Å; Q170-E172 VanDerWaalsContact O-N 3.17Å
171	T	59.4	Low	68.5	Low	86 Å²	86	95 Å²	95	53%	0.528	47%	0.47	S	S	.	.			trans	-67.1	112.4	171.9	50.1	0	0	0	0	106.9	P169 L173	P169-T171 PolarHBondContact O-N 3.2Å; T171-L173 PolarHBondContact O-N 3.43Å
172	E	75.3	Confident	70.8	Confident	180 Å²	180	89.9 Å²	89.9	84%	0.841	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-51.5	126	175.1	-166.3	174.9	179.9	0	0	109.4	R146 Q170	R146-E172 PolarHBondContact NH2-O 3.34Å; Q170-E172 PolarHBondContact O-N 3.21Å; Q170-E172 VanDerWaalsContact O-N 3.17Å
173	L	90.6	Very high	72.9	Confident	65 Å²	65	82.2 Å²	82.2	34%	0.34	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-74	142.4	178.4	-63.9	177.1	0	0	0	109.2	T171 G250 D252	T171-L173 PolarHBondContact O-N 3.43Å; L173-G250 WeakPolarHBondContact CA-O 3.47Å; L173-D252 HydrophobicContact CB-CB 3.64Å; L173-D252 HydrophobicContact CD1-CB 4.27Å
174	M	94.5	Very high	75.2	Confident	23 Å²	23	76 Å²	76	11%	0.113	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	143.8	-177.2	-65	-178.7	-62.9	0	0	110.8	V143 P144 I205 G250 G251 D252	V143-M174 HydrophobicContact CG1-CE 3.97Å; P144-M174 HydrophobicContact CG-CE 4.21Å; P144-M174 HydrophobicContact CG-SD 3.77Å; M174-I205 HydrophobicContact CB-CG1 4.37Å; M174-I205 HydrophobicContact CE-CD1 4.17Å; M174-I205 HydrophobicContact CE-CG1 3.9Å; M174-G250 PolarHBondContact N-O 3.5Å; M174-G251 CarbonylContact O-C 3.44Å; M174-G251 WeakPolarHBondContact O-CA 3.35Å; M174-D252 PolarHBondContact O-N 2.94Å
175	P	96.7	Very high	77.9	Confident	10 Å²	10	69.1 Å²	69.1	7%	0.065	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	159.2	173.3	33.1	-37.4	0	0	0	110.7	L204 I205 M255 V576 K577	P175-L204 HydrophobicContact CG-CB 3.87Å; P175-I205 PolarHBondContact O-N 2.92Å; P175-M255 HydrophobicContact CB-CB 4.08Å; P175-V576 HydrophobicContact CB-CG1 3.87Å; P175-V576 HydrophobicContact CG-CG1 4.16Å; P175-K577 HydrophobicContact CG-CG 3.7Å
176	V	98.3	Very high	80.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	124.5	-171.4	-173.6	0	0	0	0	109.2	V178 I205 V207 L242 V246 M255 V256 T257	V176-V178 HydrophobicContact CG1-CG2 4.21Å; V176-I205 CarbonylContact C-O 3.53Å; V176-I205 WeakPolarHBondContact CA-O 3.37Å; V176-I205 HydrophobicContact CG1-CB 4.48Å; V176-I205 HydrophobicContact CG1-CG2 4.48Å; V176-I205 HydrophobicContact CG2-CB 4.41Å; V176-V207 HydrophobicContact CG1-CG2 4.03Å; V176-L242 HydrophobicContact CG1-CD2 4.09Å; V176-V246 HydrophobicContact CG1-CG2 4.24Å; V176-V246 HydrophobicContact CG2-CG2 3.56Å; V176-M255 PolarHBondContact N-O 2.83Å; V176-V256 HydrophobicContact CB-CG2 4.22Å; V176-V256 CarbonylContact O-C 3.14Å; V176-V256 WeakPolarHBondContact O-CA 3.31Å; V176-T257 PolarHBondContact O-N 2.03Å
177	L	98.5	Very high	83.1	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	118.9	172.9	177.6	62.6	0	0	0	109	I179 L198 L204 I205 V206 V207 T257 L259 I289 I572 V576	L177-I179 HydrophobicContact CG-CG1 4.33Å; L177-L198 HydrophobicContact CD2-CD2 3.58Å; L177-L204 HydrophobicContact CB-CD1 3.79Å; L177-L204 HydrophobicContact CD2-CD1 4.4Å; L177-I205 PolarHBondContact N-O 3.11Å; L177-V206 CarbonylContact O-C 3.41Å; L177-V206 WeakPolarHBondContact O-CA 3.47Å; L177-V207 PolarHBondContact O-N 3.47Å; L177-T257 WeakPolarHBondContact CA-O 3.26Å; L177-T257 HydrophobicContact CD1-CG2 4.03Å; L177-L259 HydrophobicContact CD1-CB 3.73Å; L177-L259 HydrophobicContact CD1-CD1 4.49Å; L177-I289 HydrophobicContact CD1-CD1 4.38Å; L177-I572 HydrophobicContact CD2-CG2 4.33Å; L177-V576 HydrophobicContact CB-CG1 4.34Å; L177-V576 HydrophobicContact CB-CG2 4.35Å; L177-V576 HydrophobicContact CD1-CG2 3.89Å; L177-V576 HydrophobicContact CD2-CG2 4.48Å; L177-V576 HydrophobicContact CG-CG2 4.48Å
178	V	98.7	Very high	85.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.6	176.3	-175	0	0	0	0	108.9	V176 I180 V207 L209 L239 L242 V256 T257 L258 L259	V176-V178 HydrophobicContact CG1-CG2 4.21Å; V178-I180 HydrophobicContact CG1-CD1 4.12Å; V178-V207 CarbonylContact C-O 3.59Å; V178-V207 WeakPolarHBondContact CA-O 3.34Å; V178-V207 HydrophobicContact CG1-CB 4.49Å; V178-V207 HydrophobicContact CG2-CB 4.24Å; V178-L209 HydrophobicContact CG1-CD1 3.63Å; V178-L209 HydrophobicContact CG1-CD2 4.4Å; V178-L209 HydrophobicContact CG1-CG 3.84Å; V178-L239 HydrophobicContact CB-CD2 4.48Å; V178-L239 HydrophobicContact CG1-CD2 4.26Å; V178-L239 HydrophobicContact CG2-CD2 4.11Å; V178-L242 HydrophobicContact CG2-CD2 3.45Å; V178-L242 VanDerWaalsContact CG2-CD2 3.45Å; V178-V256 HydrophobicContact CG2-CG1 3.88Å; V178-T257 PolarHBondContact N-O 2.55Å; V178-L258 HydrophobicContact CB-CD2 3.78Å; V178-L258 HydrophobicContact CG1-CD2 4.28Å; V178-L258 HydrophobicContact CG2-CD2 4.29Å; V178-L258 CarbonylContact O-C 3.58Å; V178-L258 WeakPolarHBondContact O-CA 2.99Å; V178-L259 PolarHBondContact O-N 3.03Å
179	I	98.4	Very high	88.3	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	121.2	-176.4	-61.8	179.7	0	0	0	109.6	L177 V206 V207 T208 L209 L259 W261 L536	L177-I179 HydrophobicContact CG-CG1 4.33Å; I179-V206 HydrophobicContact CD1-CG1 3.6Å; I179-V206 HydrophobicContact CG1-CG1 4.21Å; I179-V207 PolarHBondContact N-O 3.16Å; I179-T208 HydrophobicContact CB-CG2 4.19Å; I179-T208 HydrophobicContact CD1-CG2 4.28Å; I179-L209 PolarHBondContact O-N 3.24Å; I179-L259 CarbonylContact C-O 3.53Å; I179-L259 WeakPolarHBondContact CA-O 3.3Å; I179-L259 HydrophobicContact CG2-CD2 4.44Å; I179-W261 HydrophobicContact CG2-CE3 4.47Å; I179-W261 HydrophobicContact CG2-CH2 4.06Å; I179-W261 HydrophobicContact CG2-CZ3 3.47Å; I179-W261 VanDerWaalsContact CG2-CZ3 3.47Å; I179-L536 HydrophobicContact CD1-CD2 3.82Å
180	I	98.4	Very high	91	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	108.5	174.1	-48.3	-55.3	0	0	0	107.8	V178 L209 Y211 I235 L259 G260 L267 V268	V178-I180 HydrophobicContact CG1-CD1 4.12Å; I180-L209 HydrophobicContact CD1-CD1 3.64Å; I180-L209 HydrophobicContact CD1-CG 4.34Å; I180-Y211 HydrophobicContact CG2-CD1 4.44Å; I180-Y211 HydrophobicContact CG2-CE1 3.79Å; I180-I235 HydrophobicContact CD1-CD1 4.36Å; I180-I235 HydrophobicContact CD1-CG1 4.3Å; I180-I235 HydrophobicContact CD1-CG2 3.83Å; I180-I235 HydrophobicContact CG2-CD1 3.78Å; I180-L259 PolarHBondContact N-O 3.05Å; I180-G260 WeakPolarHBondContact O-CA 3.4Å; I180-L267 HydrophobicContact CG2-CD1 4.18Å; I180-V268 HydrophobicContact CB-CG2 4.15Å; I180-V268 HydrophobicContact CG1-CG2 3.8Å
181	H	97.7	Very high	93.1	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	11%	0.112	C	C	.	.			trans	-67.6	150	-178.8	68.2	81.1	0	0	0	112	G190 Y193 L209 Y211 W261	H181-G190 PolarHBondContact CD2-N 3.43Å; H181-Y193 HydrophobicContact CB-CD2 4.48Å; H181-Y193 HydrophobicContact CB-CE2 3.89Å; H181-L209 PolarHBondContact CD2-O 2.89Å; H181-Y211 AromaticContact CD2-CE1 3.64Å; H181-Y211 AromaticContact CE1-CE1 3.59Å; H181-Y211 AromaticContact CE1-CZ 3.62Å; H181-Y211 AromaticContact NE2-CD1 3.78Å; H181-Y211 AromaticContact NE2-CE1 3.36Å; H181-Y211 WeakPolarHBondContact NE2-CE1 3.45Å; H181-Y211 AromaticContact NE2-CZ 3.87Å; H181-Y211 PolarHBondContact O-OH 2.88Å; H181-W261 VanDerWaalsContact CA-CH2 3.47Å; H181-W261 VanDerWaalsContact CA-CZ2 3.42Å; H181-W261 HydrophobicContact CB-CH2 3.61Å; H181-W261 HydrophobicContact CB-CZ2 3.49Å; H181-W261 VanDerWaalsContact CB-CZ2 3.49Å
182	G	95.1	Very high	94.7	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.087	C	C	.	.			trans	-119.2	-131.2	174.3	0	0	0	0	0	112.6	S184 N188 W261 T263	G182-S184 PolarHBondContact O-N 2.99Å; G182-N188 WeakPolarHBondContact O-CB 3.41Å; G182-N188 PolarHBondContact O-ND2 3.29Å; G182-W261 VanDerWaalsContact CA-O 3.31Å; G182-W261 WeakPolarHBondContact CA-O 3.33Å; G182-T263 VanDerWaalsContact CA-OG1 3.23Å; G182-T263 WeakPolarHBondContact CA-OG1 3.2Å
183	D	92	Very high	95.5	Very high	30 Å²	30	9.3 Å²	9.3	16%	0.16	5%	0.048	C	C	.	.	S	Bend	trans	78.5	-46.3	-170.9	-163.8	41.7	0	0	0	113	Q121 W187 N188 D262 T263	Q121-D183 PolarHBondContact NE2-OD2 3.3Å; Q121-D183 VanDerWaalsContact NE2-OD2 3.13Å; D183-W187 PolarHBondContact OD2-NE1 3.05Å; D183-N188 WeakPolarHBondContact CB-ND2 3.14Å; D183-D262 VanDerWaalsContact CA-OD2 3.25Å; D183-D262 WeakPolarHBondContact CA-OD2 3.44Å; D183-D262 PolarHBondContact N-OD2 2.81Å; D183-T263 PolarHBondContact N-OG1 2.83Å
184	S	93.6	Very high	95.6	Very high	14 Å²	14	6.5 Å²	6.5	10%	0.098	3%	0.034	C	C	.	.			trans	-163.4	153.1	172.7	-170.5	0	0	0	0	110.7	G182 N186 W187 T263	G182-S184 PolarHBondContact O-N 2.99Å; S184-N186 PolarHBondContact O-N 3.15Å; S184-N186 PolarHBondContact OG-N 2.93Å; S184-N186 VanDerWaalsContact OG-N 3.1Å; S184-W187 VanDerWaalsContact CB-CZ2 3.48Å; S184-W187 VanDerWaalsContact O-O 3.05Å; S184-W187 WeakPolarHBondContact OG-CZ3 3.29Å; S184-T263 PolarHBondContact N-OG1 2.92Å
185	Y	97.4	Very high	95.6	Very high	1 Å²	1	5.4 Å²	5.4	0%	0.004	3%	0.029	C	C	.	.	S	Bend	trans	-67.6	-15.2	164.2	-66.1	-48.2	0	0	0	112.9	L213 G214 F218 T263 A266 L267 A300 T363 F365 P367	Y185-L213 CarbonylContact O-C 3.53Å; Y185-L213 WeakPolarHBondContact O-CA 3.3Å; Y185-L213 WeakPolarHBondContact O-CB 3.42Å; Y185-L213 VanDerWaalsContact O-CD2 3.26Å; Y185-L213 WeakPolarHBondContact O-CD2 3.48Å; Y185-G214 PolarHBondContact O-N 3.28Å; Y185-F218 HydrophobicContact CD1-CE1 4.36Å; Y185-F218 AromaticContact CD1-CE2 3.75Å; Y185-F218 HydrophobicContact CD1-CE2 3.75Å; Y185-F218 AromaticContact CD1-CZ 3.51Å; Y185-F218 HydrophobicContact CD1-CZ 3.51Å; Y185-F218 HydrophobicContact CE1-CZ 4.11Å; Y185-F218 AromaticContact CG-CE2 3.92Å; Y185-F218 HydrophobicContact CG-CE2 3.92Å; Y185-F218 HydrophobicContact CG-CZ 4.04Å; Y185-T263 HydrophobicContact CD1-CG2 4.26Å; Y185-T263 HydrophobicContact CD2-CG2 4Å; Y185-T263 HydrophobicContact CE1-CG2 4.08Å; Y185-T263 HydrophobicContact CE2-CG2 3.83Å; Y185-T263 HydrophobicContact CG-CG2 4.21Å; Y185-T263 PolarHBondContact OH-O 3.15Å; Y185-A266 WeakPolarHBondContact OH-CB 3.14Å; Y185-L267 HydrophobicContact CE1-CD1 4.13Å; Y185-L267 HydrophobicContact CE1-CD2 3.7Å; Y185-L267 HydrophobicContact CE1-CG 3.82Å; Y185-A300 PolarHBondContact OH-O 2.67Å; Y185-T363 HydrophobicContact CD2-CG2 4.27Å; Y185-T363 HydrophobicContact CE2-CG2 4.33Å; Y185-F365 WeakPolarHBondContact CB-O 3.45Å; Y185-P367 HydrophobicContact CE1-CG 4.3Å; Y185-P367 VanDerWaalsContact CE2-CD 3.43Å; Y185-P367 HydrophobicContact CE2-CG 4.39Å; Y185-P367 VanDerWaalsContact CZ-CD 3.4Å
186	N	95.9	Very high	95.5	Very high	7 Å²	7	5 Å²	5	4%	0.037	3%	0.026	C	C	.	.	S	Bend	trans	-94.9	-20.6	-173.6	-78.1	-37.7	0	0	0	114.1	L97 S184 G214 N364	L97-N186 HydrophobicContact CB-CB 3.96Å; L97-N186 PolarHBondContact N-O 2.97Å; S184-N186 PolarHBondContact O-N 3.15Å; S184-N186 PolarHBondContact OG-N 2.93Å; S184-N186 VanDerWaalsContact OG-N 3.1Å; N186-G214 WeakPolarHBondContact OD1-CA 3.47Å; N186-N364 PolarHBondContact ND2-OD1 3.21Å
187	W	95.2	Very high	95.4	Very high	27 Å²	27	5.2 Å²	5.2	10%	0.102	3%	0.027	C	C	.	.	S	Bend	trans	-150.5	-172.7	-178.2	61.4	81	0	0	0	112.3	Q96 L97 W98 P99 D183 S184	Q96-W187 HydrophobicContact CB-CB 4.38Å; L97-W187 VanDerWaalsContact O-CE3 3.23Å; W98-W187 HydrophobicContact CE3-CB 3.94Å; W98-W187 HydrophobicContact CE3-CG 4.11Å; W98-W187 HydrophobicContact CH2-CB 4.08Å; W98-W187 HydrophobicContact CZ3-CB 3.59Å; W98-W187 AromaticContact CZ3-CG 3.77Å; W98-W187 HydrophobicContact CZ3-CG 3.77Å; P99-W187 VanDerWaalsContact CD-CZ3 3.47Å; P99-W187 HydrophobicContact CG-CE3 3.99Å; P99-W187 HydrophobicContact CG-CH2 3.26Å; P99-W187 HydrophobicContact CG-CZ2 4.04Å; P99-W187 HydrophobicContact CG-CZ3 3.24Å; D183-W187 PolarHBondContact OD2-NE1 3.05Å; S184-W187 VanDerWaalsContact CB-CZ2 3.48Å; S184-W187 VanDerWaalsContact O-O 3.05Å; S184-W187 WeakPolarHBondContact OG-CZ3 3.29Å
188	N	95.2	Very high	95.3	Very high	1 Å²	1	5.2 Å²	5.2	1%	0.005	3%	0.027	C	C	.	.			trans	86.6	171.9	-173.5	-151.3	-16.2	0	0	0	113.3	Q96 G182 D183 L192 Y193 L213	Q96-N188 PolarHBondContact NE2-O 3.01Å; Q96-N188 PolarHBondContact OE1-O 3.4Å; G182-N188 WeakPolarHBondContact O-CB 3.41Å; G182-N188 PolarHBondContact O-ND2 3.29Å; D183-N188 WeakPolarHBondContact CB-ND2 3.14Å; N188-L192 WeakPolarHBondContact OD1-CD1 3.47Å; N188-Y193 VanDerWaalsContact CG-OH 3.27Å; N188-Y193 PolarHBondContact ND2-OH 2.91Å; N188-Y193 WeakPolarHBondContact OD1-CE2 3.46Å; N188-Y193 PolarHBondContact OD1-OH 2.92Å; N188-L213 WeakPolarHBondContact O-CD1 3.38Å
189	S	96.6	Very high	95.2	Very high	1 Å²	1	5.2 Å²	5.2	1%	0.007	3%	0.027	C	C	.	.			trans	-162.7	142.4	-177.5	171.5	0	0	0	0	111.5	T191 L192 Y193 N210	S189-T191 PolarHBondContact O-N 3.21Å; S189-T191 VanDerWaalsContact OG-CB 3.23Å; S189-T191 WeakPolarHBondContact OG-CB 3.42Å; S189-T191 PolarHBondContact OG-N 2.99Å; S189-T191 VanDerWaalsContact OG-N 3.16Å; S189-T191 PolarHBondContact OG-OG1 3.01Å; S189-L192 PolarHBondContact O-N 2.68Å; S189-Y193 WeakPolarHBondContact O-CD2 3.35Å; S189-Y193 WeakPolarHBondContact O-CE2 3.33Å; S189-N210 PolarHBondContact OG-OD1 3.33Å
190	G	94.9	Very high	95.1	Very high	1 Å²	1	5.2 Å²	5.2	1%	0.01	3%	0.027	C	C	.	.	G	3₁₀ helix	trans	-62.7	-18.7	172.7	0	0	0	0	0	113.8	H181 L192 Y193 T208 L209 N210	H181-G190 PolarHBondContact CD2-N 3.43Å; G190-L192 PolarHBondContact O-N 2.91Å; G190-Y193 PolarHBondContact O-N 3.03Å; G190-T208 VanDerWaalsContact O-CB 3.28Å; G190-T208 WeakPolarHBondContact O-CB 3.35Å; G190-T208 PolarHBondContact O-OG1 2.8Å; G190-L209 WeakPolarHBondContact CA-O 3.36Å; G190-L209 PolarHBondContact N-O 3.11Å; G190-N210 PolarHBondContact N-OD1 3.25Å
191	T	92.7	Very high	94.9	Very high	4 Å²	4	8.4 Å²	8.4	3%	0.025	4%	0.04	C	C	.	.	G	3₁₀ helix	trans	-62.5	-19.9	175.1	-62.6	0	0	0	0	113.2	M90 S189 N210 L550	M90-T191 HydrophobicContact CB-CG2 3.62Å; M90-T191 HydrophobicContact CE-CG2 4.27Å; M90-T191 WeakPolarHBondContact CE-O 3.48Å; M90-T191 HydrophobicContact CG-CG2 3.69Å; M90-T191 HydrophobicContact SD-CG2 3.75Å; S189-T191 PolarHBondContact O-N 3.21Å; S189-T191 VanDerWaalsContact OG-CB 3.23Å; S189-T191 WeakPolarHBondContact OG-CB 3.42Å; S189-T191 PolarHBondContact OG-N 2.99Å; S189-T191 VanDerWaalsContact OG-N 3.16Å; S189-T191 PolarHBondContact OG-OG1 3.01Å; T191-N210 PolarHBondContact OG1-ND2 2.95Å; T191-L550 HydrophobicContact CG2-CD1 3.76Å
192	L	92.5	Very high	94.6	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.04	C	C	.	.	G	3₁₀ helix	trans	-86.9	-8.4	-174.8	-62.9	165.6	0	0	0	114.7	L125 M128 L129 N188 S189 G190 L550 A552	L125-L192 HydrophobicContact CD2-CD1 3.45Å; L125-L192 VanDerWaalsContact CD2-CD1 3.45Å; L125-L192 HydrophobicContact CD2-CD2 4.24Å; L125-L192 HydrophobicContact CD2-CG 4.46Å; M128-L192 HydrophobicContact CB-CD2 4.17Å; M128-L192 HydrophobicContact SD-CD2 4.24Å; L129-L192 HydrophobicContact CD1-CD1 4.12Å; L129-L192 HydrophobicContact CD2-CD1 4.18Å; L129-L192 HydrophobicContact CD2-CD2 3.78Å; L129-L192 HydrophobicContact CD2-CG 3.98Å; L129-L192 HydrophobicContact CG-CD1 4.38Å; L129-L192 HydrophobicContact CG-CD2 4.37Å; N188-L192 WeakPolarHBondContact OD1-CD1 3.47Å; S189-L192 PolarHBondContact O-N 2.68Å; G190-L192 PolarHBondContact O-N 2.91Å; L192-L550 HydrophobicContact CD2-CB 4.09Å; L192-L550 HydrophobicContact CD2-CD1 4.46Å; L192-A552 HydrophobicContact CB-CB 4.21Å
193	Y	93.1	Very high	94.6	Very high	8 Å²	8	15 Å²	15	3%	0.031	7%	0.069	C	C	.	.			trans	-114.8	112.4	-169.2	-56	-80	0	0	0	110.9	H181 N188 S189 G190 G195 W261 L536 A552 F553	H181-Y193 HydrophobicContact CB-CD2 4.48Å; H181-Y193 HydrophobicContact CB-CE2 3.89Å; N188-Y193 VanDerWaalsContact CG-OH 3.27Å; N188-Y193 PolarHBondContact ND2-OH 2.91Å; N188-Y193 WeakPolarHBondContact OD1-CE2 3.46Å; N188-Y193 PolarHBondContact OD1-OH 2.92Å; S189-Y193 WeakPolarHBondContact O-CD2 3.35Å; S189-Y193 WeakPolarHBondContact O-CE2 3.33Å; G190-Y193 PolarHBondContact O-N 3.03Å; Y193-G195 PolarHBondContact O-N 2.8Å; Y193-W261 AromaticContact CD1-CH2 3.93Å; Y193-W261 HydrophobicContact CD1-CH2 3.93Å; Y193-W261 HydrophobicContact CD1-CZ2 4.45Å; Y193-W261 AromaticContact CD2-CH2 3.79Å; Y193-W261 HydrophobicContact CD2-CH2 3.79Å; Y193-W261 HydrophobicContact CD2-CZ2 4.35Å; Y193-W261 AromaticContact CE1-CH2 3.66Å; Y193-W261 HydrophobicContact CE1-CH2 3.66Å; Y193-W261 AromaticContact CE1-CZ2 3.72Å; Y193-W261 HydrophobicContact CE1-CZ2 3.72Å; Y193-W261 AromaticContact CE2-CH2 3.52Å; Y193-W261 HydrophobicContact CE2-CH2 3.52Å; Y193-W261 AromaticContact CE2-CZ2 3.61Å; Y193-W261 HydrophobicContact CE2-CZ2 3.61Å; Y193-W261 HydrophobicContact CG-CH2 4.01Å; Y193-W261 AromaticContact CZ-CH2 3.48Å; Y193-W261 VanDerWaalsContact CZ-CH2 3.48Å; Y193-W261 AromaticContact CZ-CZ2 3.27Å; Y193-W261 WeakPolarHBondContact OH-CZ2 3.4Å; Y193-L536 HydrophobicContact CD1-CD1 3.86Å; Y193-L536 HydrophobicContact CG-CD1 4.45Å; Y193-A552 HydrophobicContact CE1-CB 3.97Å; Y193-F553 HydrophobicContact CD1-CE2 4.26Å; Y193-F553 HydrophobicContact CD1-CZ 4.22Å; Y193-F553 HydrophobicContact CE1-CE2 4.44Å; Y193-F553 HydrophobicContact CE1-CZ 4.05Å
194	D	92.7	Very high	94.8	Very high	6 Å²	6	13.6 Å²	13.6	3%	0.032	6%	0.061	C	C	.	.			trans	-77.9	110.5	176	-163.4	-15.6	0	0	0	111.2	S196 P546 S547 I548	D194-S196 VanDerWaalsContact C-N 3.29Å; D194-S196 WeakPolarHBondContact OD1-CB 3.19Å; D194-S196 PolarHBondContact OD1-N 2.91Å; D194-S196 PolarHBondContact OD1-OG 3.48Å; D194-P546 HydrophobicContact CB-CB 4.21Å; D194-S547 VanDerWaalsContact CG-OG 3.28Å; D194-S547 PolarHBondContact OD1-OG 3.17Å; D194-S547 WeakPolarHBondContact OD2-CB 3.35Å; D194-S547 PolarHBondContact OD2-N 2.97Å; D194-S547 PolarHBondContact OD2-OG 3.02Å; D194-I548 HydrophobicContact CB-CD1 3.72Å; D194-I548 HydrophobicContact CB-CG1 3.8Å
195	G	94.6	Very high	95	Very high	1 Å²	1	13 Å²	13	1%	0.01	6%	0.057	C	C	.	.			trans	-81.6	-2.8	175.9	0	0	0	0	0	114.4	Y193 L198 A199	Y193-G195 PolarHBondContact O-N 2.8Å; G195-L198 PolarHBondContact O-N 2.84Å; G195-A199 VanDerWaalsContact O-CB 3.23Å; G195-A199 WeakPolarHBondContact O-CB 3.49Å; G195-A199 PolarHBondContact O-N 3.44Å
196	S	95	Very high	95	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-67.4	-43.9	-165.1	-55.9	0	0	0	0	114.1	F45 V53 Q55 F142 D194 A199 A200 S547	F45-S196 VanDerWaalsContact CZ-CB 3.44Å; V53-S196 WeakPolarHBondContact CG2-O 3.3Å; Q55-S196 PolarHBondContact NE2-OG 2.87Å; F142-S196 WeakPolarHBondContact CD1-OG 3.32Å; D194-S196 VanDerWaalsContact C-N 3.29Å; D194-S196 WeakPolarHBondContact OD1-CB 3.19Å; D194-S196 PolarHBondContact OD1-N 2.91Å; D194-S196 PolarHBondContact OD1-OG 3.48Å; S196-A199 PolarHBondContact O-N 3.06Å; S196-A200 VanDerWaalsContact O-CB 3.3Å; S196-A200 WeakPolarHBondContact O-CB 3.27Å; S196-A200 PolarHBondContact O-N 2.9Å; S196-S547 PolarHBondContact OG-OG 2.99Å
197	I	95.1	Very high	95.2	Very high	5 Å²	5	12.6 Å²	12.6	3%	0.026	6%	0.055	C	C	.	.	H	α-helix	trans	-65.8	-47.3	-179.8	-66.3	-173.3	0	0	0	110	F45 L48 L50 A199 A200 Y201 G537 L540 L541 M569	F45-I197 HydrophobicContact CE1-CG1 4.19Å; L48-I197 HydrophobicContact CD1-CD1 4.23Å; L50-I197 HydrophobicContact CD1-CG2 4.23Å; I197-A199 VanDerWaalsContact C-N 3.32Å; I197-A199 PolarHBondContact O-N 3.4Å; I197-A200 PolarHBondContact O-N 3.21Å; I197-Y201 WeakPolarHBondContact O-CB 3.4Å; I197-Y201 PolarHBondContact O-N 2.99Å; I197-G537 WeakPolarHBondContact CD1-O 3.31Å; I197-L540 HydrophobicContact CG2-CD2 4.21Å; I197-L541 HydrophobicContact CD1-CD1 4.28Å; I197-L541 HydrophobicContact CD1-CD2 3.54Å; I197-L541 HydrophobicContact CD1-CG 3.53Å; I197-M569 HydrophobicContact CG2-CE 4.38Å; I197-M569 HydrophobicContact CG2-SD 3.99Å
198	L	96.3	Very high	95.3	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-61.3	-40.5	176.7	180	58.7	0	0	0	111.8	L177 G195 G202 V206 I535 L536 M569	L177-L198 HydrophobicContact CD2-CD2 3.58Å; G195-L198 PolarHBondContact O-N 2.84Å; L198-G202 VanDerWaalsContact O-CA 3.27Å; L198-G202 WeakPolarHBondContact O-CA 3.45Å; L198-G202 PolarHBondContact O-N 3.46Å; L198-V206 HydrophobicContact CB-CG2 4.31Å; L198-V206 HydrophobicContact CD2-CG2 4.25Å; L198-V206 HydrophobicContact CG-CG2 4.15Å; L198-I535 HydrophobicContact CD2-CG2 4.36Å; L198-L536 HydrophobicContact CD2-CD2 4.45Å; L198-M569 HydrophobicContact CD1-CB 4.17Å; L198-M569 HydrophobicContact CD1-CG 4.05Å; L198-M569 HydrophobicContact CD1-SD 4.44Å
199	A	97	Very high	95.3	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-61.2	-47.5	175.1	0	0	0	0	0	111.7	F142 P144 G195 S196 I197 K203 L204 V206	F142-A199 HydrophobicContact CB-CB 4.05Å; P144-A199 WeakPolarHBondContact CB-O 3.35Å; P144-A199 WeakPolarHBondContact CG-O 3.39Å; G195-A199 VanDerWaalsContact O-CB 3.23Å; G195-A199 WeakPolarHBondContact O-CB 3.49Å; G195-A199 PolarHBondContact O-N 3.44Å; S196-A199 PolarHBondContact O-N 3.06Å; I197-A199 VanDerWaalsContact C-N 3.32Å; I197-A199 PolarHBondContact O-N 3.4Å; A199-K203 VanDerWaalsContact O-CA 3.3Å; A199-K203 WeakPolarHBondContact O-CA 3.23Å; A199-K203 PolarHBondContact O-N 3.26Å; A199-L204 VanDerWaalsContact CA-O 3.29Å; A199-L204 WeakPolarHBondContact CA-O 3.5Å; A199-L204 WeakPolarHBondContact CB-O 3.46Å; A199-L204 PolarHBondContact O-N 3.47Å; A199-V206 HydrophobicContact CB-CB 4.42Å; A199-V206 HydrophobicContact CB-CG2 3.92Å
200	A	95.4	Very high	95.4	Very high	2 Å²	2	11.4 Å²	11.4	2%	0.017	5%	0.05	C	C	.	.	H	α-helix	trans	-68.1	-47	-178.8	0	0	0	0	0	112.8	L50 P51 V53 S196 I197	L50-A200 HydrophobicContact CB-CB 4.1Å; L50-A200 HydrophobicContact CD1-CB 4.35Å; P51-A200 HydrophobicContact CG-CB 4.01Å; P51-A200 WeakPolarHBondContact CG-O 3.48Å; V53-A200 HydrophobicContact CG2-CB 3.77Å; S196-A200 VanDerWaalsContact O-CB 3.3Å; S196-A200 WeakPolarHBondContact O-CB 3.27Å; S196-A200 PolarHBondContact O-N 2.9Å; I197-A200 PolarHBondContact O-N 3.21Å
201	Y	94.2	Very high	95.5	Very high	67 Å²	67	11.3 Å²	11.3	26%	0.263	5%	0.05	S	C	.	.	H	α-helix	trans	-68.6	-49.1	179.3	-172.1	-83.9	0	0	0	110.9	L50 I197 K203 L540 E566 M569 R570	L50-Y201 HydrophobicContact CD2-CD2 4.1Å; I197-Y201 WeakPolarHBondContact O-CB 3.4Å; I197-Y201 PolarHBondContact O-N 2.99Å; Y201-K203 VanDerWaalsContact C-N 3.35Å; Y201-K203 PolarHBondContact O-N 3.13Å; Y201-L540 HydrophobicContact CD2-CD2 4.41Å; Y201-E566 HydrophobicContact CE2-CB 4.47Å; Y201-E566 HydrophobicContact CE2-CG 4.08Å; Y201-E566 PolarHBondContact OH-O 2.97Å; Y201-M569 HydrophobicContact CD1-CB 3.89Å; Y201-M569 HydrophobicContact CD1-CE 4.29Å; Y201-M569 HydrophobicContact CD1-SD 4.47Å; Y201-M569 HydrophobicContact CD2-CE 4.06Å; Y201-M569 HydrophobicContact CE1-CB 4.06Å; Y201-M569 HydrophobicContact CE2-CE 4.36Å; Y201-M569 HydrophobicContact CG-CE 4.04Å; Y201-M569 HydrophobicContact CG-SD 4.33Å; Y201-R570 HydrophobicContact CE1-CB 4.26Å
202	G	93	Very high	95.8	Very high	1 Å²	1	11.5 Å²	11.5	1%	0.01	5%	0.05	C	C	.	.	H	α-helix	trans	-75.2	-17.3	-177.6	0	0	0	0	0	114.2	L198 L204 K577	L198-G202 VanDerWaalsContact O-CA 3.27Å; L198-G202 WeakPolarHBondContact O-CA 3.45Å; L198-G202 PolarHBondContact O-N 3.46Å; G202-L204 VanDerWaalsContact C-N 3.3Å; G202-L204 PolarHBondContact O-N 3.24Å; G202-K577 WeakPolarHBondContact O-CE 3.3Å; G202-K577 PolarHBondContact O-NZ 3.25Å
203	K	93.9	Very high	96.1	Very high	140 Å²	140	11.6 Å²	11.6	61%	0.609	5%	0.05	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	50.3	-171.6	-58	179.6	-177.2	173.1	0	111.8	A199 Y201	A199-K203 VanDerWaalsContact O-CA 3.3Å; A199-K203 WeakPolarHBondContact O-CA 3.23Å; A199-K203 PolarHBondContact O-N 3.26Å; Y201-K203 VanDerWaalsContact C-N 3.35Å; Y201-K203 PolarHBondContact O-N 3.13Å
204	L	96.3	Very high	96.3	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	5%	0.05	C	C	.	.	S	Bend	trans	-138.6	156.7	-179.2	61.7	88.5	0	0	0	108.9	P144 P175 L177 A199 G202 V206 A573 V576	P144-L204 VanDerWaalsContact CD-O 3.29Å; P144-L204 WeakPolarHBondContact CD-O 3.3Å; P175-L204 HydrophobicContact CG-CB 3.87Å; L177-L204 HydrophobicContact CB-CD1 3.79Å; L177-L204 HydrophobicContact CD2-CD1 4.4Å; A199-L204 VanDerWaalsContact CA-O 3.29Å; A199-L204 WeakPolarHBondContact CA-O 3.5Å; A199-L204 WeakPolarHBondContact CB-O 3.46Å; A199-L204 PolarHBondContact O-N 3.47Å; G202-L204 VanDerWaalsContact C-N 3.3Å; G202-L204 PolarHBondContact O-N 3.24Å; L204-V206 HydrophobicContact CD1-CG2 3.39Å; L204-A573 HydrophobicContact CD2-CB 3.84Å; L204-V576 HydrophobicContact CD2-CB 4.24Å; L204-V576 HydrophobicContact CD2-CG1 4.05Å
205	I	97.8	Very high	96.5	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	126.6	173.1	-60.7	-176.4	0	0	0	107.9	F142 V143 M174 P175 V176 L177 V207 V246 F249	F142-I205 WeakPolarHBondContact O-CA 3.5Å; V143-I205 HydrophobicContact CG1-CD1 4.38Å; V143-I205 HydrophobicContact CG1-CG1 4.38Å; V143-I205 HydrophobicContact CG2-CD1 4.36Å; V143-I205 HydrophobicContact CG2-CG1 4.45Å; V143-I205 HydrophobicContact CG2-CG2 4.27Å; M174-I205 HydrophobicContact CB-CG1 4.37Å; M174-I205 HydrophobicContact CE-CD1 4.17Å; M174-I205 HydrophobicContact CE-CG1 3.9Å; P175-I205 PolarHBondContact O-N 2.92Å; V176-I205 CarbonylContact C-O 3.53Å; V176-I205 WeakPolarHBondContact CA-O 3.37Å; V176-I205 HydrophobicContact CG1-CB 4.48Å; V176-I205 HydrophobicContact CG1-CG2 4.48Å; V176-I205 HydrophobicContact CG2-CB 4.41Å; L177-I205 PolarHBondContact N-O 3.11Å; I205-V207 HydrophobicContact CG2-CG2 4.07Å; I205-V246 HydrophobicContact CD1-CG2 4.23Å; I205-F249 HydrophobicContact CD1-CB 4.06Å
206	V	98.4	Very high	96.6	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	136.1	170.3	-177.8	0	0	0	0	108.6	F142 L177 I179 L198 A199 L204	F142-V206 HydrophobicContact CB-CB 4.22Å; F142-V206 HydrophobicContact CD2-CB 4.26Å; F142-V206 HydrophobicContact CD2-CG1 4.34Å; F142-V206 WeakPolarHBondContact CD2-O 3.4Å; F142-V206 PolarHBondContact N-O 2.98Å; F142-V206 PolarHBondContact O-N 3.4Å; F142-V206 VanDerWaalsContact O-N 3.1Å; L177-V206 CarbonylContact O-C 3.41Å; L177-V206 WeakPolarHBondContact O-CA 3.47Å; I179-V206 HydrophobicContact CD1-CG1 3.6Å; I179-V206 HydrophobicContact CG1-CG1 4.21Å; L198-V206 HydrophobicContact CB-CG2 4.31Å; L198-V206 HydrophobicContact CD2-CG2 4.25Å; L198-V206 HydrophobicContact CG-CG2 4.15Å; A199-V206 HydrophobicContact CB-CB 4.42Å; A199-V206 HydrophobicContact CB-CG2 3.92Å; L204-V206 HydrophobicContact CD1-CG2 3.39Å
207	V	98.6	Very high	96.8	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	130.1	175.6	-175.7	0	0	0	0	108.8	M139 N140 L141 V176 L177 V178 I179 I205 L209 L242	M139-V207 HydrophobicContact CB-CG1 4.16Å; M139-V207 HydrophobicContact SD-CG1 4.1Å; N140-V207 CarbonylContact O-C 3.23Å; N140-V207 WeakPolarHBondContact O-CA 3.38Å; L141-V207 HydrophobicContact CG-CG2 4.21Å; V176-V207 HydrophobicContact CG1-CG2 4.03Å; L177-V207 PolarHBondContact O-N 3.47Å; V178-V207 CarbonylContact C-O 3.59Å; V178-V207 WeakPolarHBondContact CA-O 3.34Å; V178-V207 HydrophobicContact CG1-CB 4.49Å; V178-V207 HydrophobicContact CG2-CB 4.24Å; I179-V207 PolarHBondContact N-O 3.16Å; I205-V207 HydrophobicContact CG2-CG2 4.07Å; V207-L209 HydrophobicContact CG1-CD2 3.8Å; V207-L242 HydrophobicContact CG2-CD1 4.03Å; V207-L242 HydrophobicContact CG2-CD2 4.15Å
208	T	98.1	Very high	96.9	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.006	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	142.5	169.1	67.2	0	0	0	0	109.9	M139 N140 F142 I179 G190	M139-T208 CarbonylContact C-O 3.54Å; M139-T208 WeakPolarHBondContact CA-O 3.49Å; N140-T208 PolarHBondContact N-O 3.41Å; N140-T208 PolarHBondContact ND2-OG1 3.17Å; N140-T208 PolarHBondContact O-N 2.83Å; F142-T208 HydrophobicContact CE2-CG2 4.08Å; I179-T208 HydrophobicContact CB-CG2 4.19Å; I179-T208 HydrophobicContact CD1-CG2 4.28Å; G190-T208 VanDerWaalsContact O-CB 3.28Å; G190-T208 WeakPolarHBondContact O-CB 3.35Å; G190-T208 PolarHBondContact O-OG1 2.8Å
209	L	95.3	Very high	97	Very high	2 Å²	2	11.8 Å²	11.8	1%	0.01	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	143.8	-175.4	-56.3	-174.8	0	0	0	111.5	M139 V178 I179 I180 H181 G190 V207 A238	M139-L209 HydrophobicContact CB-CD2 3.32Å; M139-L209 HydrophobicContact CE-CD2 4.34Å; M139-L209 HydrophobicContact CG-CD2 4.44Å; M139-L209 HydrophobicContact SD-CD2 4.38Å; V178-L209 HydrophobicContact CG1-CD1 3.63Å; V178-L209 HydrophobicContact CG1-CD2 4.4Å; V178-L209 HydrophobicContact CG1-CG 3.84Å; I179-L209 PolarHBondContact O-N 3.24Å; I180-L209 HydrophobicContact CD1-CD1 3.64Å; I180-L209 HydrophobicContact CD1-CG 4.34Å; H181-L209 PolarHBondContact CD2-O 2.89Å; G190-L209 WeakPolarHBondContact CA-O 3.36Å; G190-L209 PolarHBondContact N-O 3.11Å; V207-L209 HydrophobicContact CG1-CD2 3.8Å; L209-A238 HydrophobicContact CD1-CB 3.76Å; L209-A238 HydrophobicContact CD2-CB 4.04Å
210	N	97.8	Very high	97	Very high	1 Å²	1	12 Å²	12	1%	0.005	5%	0.053	C	C	.	.			trans	-97.6	140.1	155.9	-72.8	-22.4	0	0	0	108.7	Y61 P92 C136 Y138 S189 G190 T191	Y61-N210 WeakPolarHBondContact CE1-O 3.11Å; Y61-N210 PolarHBondContact OH-O 3.3Å; P92-N210 PolarHBondContact O-ND2 2.79Å; C136-N210 VanDerWaalsContact O-CB 3.26Å; C136-N210 WeakPolarHBondContact O-CB 3.36Å; Y138-N210 PolarHBondContact O-N 3.46Å; S189-N210 PolarHBondContact OG-OD1 3.33Å; G190-N210 PolarHBondContact N-OD1 3.25Å; T191-N210 PolarHBondContact OG1-ND2 2.95Å
211	Y	98.4	Very high	97	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.055	C	C	.	.			trans	-138.1	158.4	173.5	58.3	-92.9	0	0	0	108.7	C94 I180 H181 L213 A231 I235 L267	C94-Y211 PolarHBondContact SG-O 3.1Å; I180-Y211 HydrophobicContact CG2-CD1 4.44Å; I180-Y211 HydrophobicContact CG2-CE1 3.79Å; H181-Y211 AromaticContact CD2-CE1 3.64Å; H181-Y211 AromaticContact CE1-CE1 3.59Å; H181-Y211 AromaticContact CE1-CZ 3.62Å; H181-Y211 AromaticContact NE2-CD1 3.78Å; H181-Y211 AromaticContact NE2-CE1 3.36Å; H181-Y211 WeakPolarHBondContact NE2-CE1 3.45Å; H181-Y211 AromaticContact NE2-CZ 3.87Å; H181-Y211 PolarHBondContact O-OH 2.88Å; Y211-L213 HydrophobicContact CD2-CD2 4.07Å; Y211-L213 HydrophobicContact CE2-CD2 3.45Å; Y211-L213 VanDerWaalsContact CE2-CD2 3.45Å; Y211-L213 HydrophobicContact CE2-CG 4.43Å; Y211-A231 HydrophobicContact CD2-CB 3.8Å; Y211-A231 HydrophobicContact CE2-CB 4.36Å; Y211-I235 HydrophobicContact CD1-CD1 4.32Å; Y211-I235 HydrophobicContact CD1-CG1 4.29Å; Y211-I235 HydrophobicContact CG-CD1 4.42Å; Y211-I235 HydrophobicContact CG-CG1 4.3Å; Y211-L267 HydrophobicContact CE1-CD1 4.44Å; Y211-L267 HydrophobicContact CE2-CD1 3.82Å
212	R	98.5	Very high	96.8	Very high	8 Å²	8	11.9 Å²	11.9	3%	0.03	7%	0.071	C	C	.	.			trans	-61.3	141.3	-177.9	-74.9	172.8	-77.2	178.3	-4.2	111.8	P65 M72 L137 G217 W230 A231 D234	P65-R212 HydrophobicContact CG-CG 4.2Å; M72-R212 VanDerWaalsContact O-CZ 3.28Å; M72-R212 PolarHBondContact O-NH1 2.95Å; M72-R212 PolarHBondContact O-NH2 3.16Å; L137-R212 HydrophobicContact CD2-CG 4.19Å; R212-G217 WeakPolarHBondContact O-CA 3.17Å; R212-W230 PolarHBondContact NH2-O 3.34Å; R212-A231 VanDerWaalsContact O-CB 3.29Å; R212-A231 WeakPolarHBondContact O-CB 3.5Å; R212-D234 WeakPolarHBondContact CB-OD2 3.29Å; R212-D234 WeakPolarHBondContact CG-OD2 3.42Å; R212-D234 IonicContact CZ-OD1 3.61Å; R212-D234 IonicContact CZ-OD2 2.75Å; R212-D234 PolarHBondContact N-OD2 2.58Å; R212-D234 IonicContact NE-OD1 2.75Å; R212-D234 PolarHBondContact NE-OD1 3.16Å; R212-D234 IonicContact NE-OD2 3.44Å; R212-D234 PolarHBondContact NE-OD2 3.05Å; R212-D234 IonicContact NH2-OD1 3.89Å; R212-D234 PolarHBondContact NH2-OD1 3.27Å; R212-D234 IonicContact NH2-OD2 3.19Å
213	L	98.2	Very high	96.7	Very high	2 Å²	2	14.8 Å²	14.8	1%	0.01	9%	0.087	C	C	.	.			trans	-120.3	164.5	-176.1	-66.8	164.6	0	0	0	111.9	Q96 Y185 N188 Y211 F216 G217	Q96-L213 VanDerWaalsContact NE2-CD1 3.25Å; Y185-L213 CarbonylContact O-C 3.53Å; Y185-L213 WeakPolarHBondContact O-CA 3.3Å; Y185-L213 WeakPolarHBondContact O-CB 3.42Å; Y185-L213 VanDerWaalsContact O-CD2 3.26Å; Y185-L213 WeakPolarHBondContact O-CD2 3.48Å; N188-L213 WeakPolarHBondContact O-CD1 3.38Å; Y211-L213 HydrophobicContact CD2-CD2 4.07Å; Y211-L213 HydrophobicContact CE2-CD2 3.45Å; Y211-L213 VanDerWaalsContact CE2-CD2 3.45Å; Y211-L213 HydrophobicContact CE2-CG 4.43Å; L213-F216 PolarHBondContact O-N 2.86Å; L213-F216 VanDerWaalsContact O-N 3.12Å; L213-G217 PolarHBondContact O-N 2.78Å
214	G	96.9	Very high	96.5	Very high	2 Å²	2	12.6 Å²	12.6	2%	0.021	9%	0.086	C	C	.	.	H	α-helix	trans	50.3	-134.6	178.8	0	0	0	0	0	112.5	Y185 N186 F216 G217 F218	Y185-G214 PolarHBondContact O-N 3.28Å; N186-G214 WeakPolarHBondContact OD1-CA 3.47Å; G214-F216 PolarHBondContact O-N 3.4Å; G214-G217 PolarHBondContact O-N 2.92Å; G214-G217 VanDerWaalsContact O-N 3.11Å; G214-F218 PolarHBondContact O-N 3.12Å
215	V	97.4	Very high	96.3	Very high	3 Å²	3	15.2 Å²	15.2	2%	0.018	10%	0.102	C	C	.	.	H	α-helix	trans	-54.9	-37.9	177.3	64	0	0	0	0	112.7	F71 G217 L219 L312 I349 A353 F365	F71-V215 HydrophobicContact CE1-CG2 4.3Å; F71-V215 WeakPolarHBondContact CE1-O 3.35Å; V215-G217 VanDerWaalsContact C-N 3.34Å; V215-G217 PolarHBondContact O-N 3.4Å; V215-L219 HydrophobicContact CG2-CB 4.08Å; V215-L219 HydrophobicContact CG2-CD1 4.22Å; V215-L219 HydrophobicContact CG2-CD2 4.35Å; V215-L219 HydrophobicContact CG2-CG 4.46Å; V215-L219 WeakPolarHBondContact O-CB 3.36Å; V215-L219 PolarHBondContact O-N 3.17Å; V215-L312 HydrophobicContact CG2-CD2 3.43Å; V215-L312 VanDerWaalsContact CG2-CD2 3.43Å; V215-I349 HydrophobicContact CG1-CG2 3.67Å; V215-I349 HydrophobicContact CG2-CG2 4.13Å; V215-A353 HydrophobicContact CB-CB 3.99Å; V215-A353 HydrophobicContact CG1-CB 3.93Å; V215-A353 HydrophobicContact CG2-CB 4.5Å; V215-F365 HydrophobicContact CB-CD1 4.37Å; V215-F365 HydrophobicContact CB-CE1 4.08Å; V215-F365 HydrophobicContact CB-CE2 4.4Å; V215-F365 HydrophobicContact CB-CZ 4.08Å; V215-F365 HydrophobicContact CG2-CE1 4.08Å; V215-F365 HydrophobicContact CG2-CZ 4.25Å
216	F	98	Very high	96.1	Very high	13 Å²	13	15.2 Å²	15.2	6%	0.057	10%	0.102	C	C	.	.	H	α-helix	trans	-70.9	-29.6	-179.5	-60.9	-83.7	0	0	0	113.1	R70 F71 V95 E134 L213 G214 V346 I349	R70-F216 HydrophobicContact CG-CD1 4.19Å; R70-F216 HydrophobicContact CG-CE1 4.49Å; F71-F216 HydrophobicContact CE1-CD1 4.2Å; V95-F216 HydrophobicContact CB-CD2 4.04Å; V95-F216 HydrophobicContact CB-CE2 3.97Å; V95-F216 HydrophobicContact CG1-CD2 4.15Å; V95-F216 HydrophobicContact CG1-CE2 3.66Å; V95-F216 HydrophobicContact CG1-CZ 4.46Å; E134-F216 HydrophobicContact CG-CE1 4.38Å; L213-F216 PolarHBondContact O-N 2.86Å; L213-F216 VanDerWaalsContact O-N 3.12Å; G214-F216 PolarHBondContact O-N 3.4Å; F216-V346 HydrophobicContact CE2-CG1 4.34Å; F216-V346 HydrophobicContact CZ-CB 4.4Å; F216-V346 HydrophobicContact CZ-CG1 3.81Å; F216-I349 HydrophobicContact CE1-CD1 4.42Å; F216-I349 HydrophobicContact CE1-CG2 4.21Å; F216-I349 HydrophobicContact CE2-CG2 4.24Å; F216-I349 HydrophobicContact CZ-CB 4.09Å; F216-I349 HydrophobicContact CZ-CG2 3.73Å
217	G	97.9	Very high	95.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-88.1	-26.6	179.1	0	0	0	0	0	114.5	R212 L213 G214 V215 W230 A231	R212-G217 WeakPolarHBondContact O-CA 3.17Å; L213-G217 PolarHBondContact O-N 2.78Å; G214-G217 PolarHBondContact O-N 2.92Å; G214-G217 VanDerWaalsContact O-N 3.11Å; V215-G217 VanDerWaalsContact C-N 3.34Å; V215-G217 PolarHBondContact O-N 3.4Å; G217-W230 WeakPolarHBondContact O-CA 3.41Å; G217-W230 VanDerWaalsContact O-CB 3.31Å; G217-W230 WeakPolarHBondContact O-CB 3.18Å; G217-W230 PolarHBondContact O-N 3.08Å; G217-A231 PolarHBondContact O-N 2.91Å
218	F	97.9	Very high	95.7	Very high	4 Å²	4	18.6 Å²	18.6	2%	0.018	12%	0.118	C	C	.	.	H	α-helix	trans	-139.7	2.9	-162.4	-60.6	-76.2	0	0	0	116	Y185 G214 S220 A231 L267 F365 G366 P367	Y185-F218 HydrophobicContact CD1-CE1 4.36Å; Y185-F218 AromaticContact CD1-CE2 3.75Å; Y185-F218 HydrophobicContact CD1-CE2 3.75Å; Y185-F218 AromaticContact CD1-CZ 3.51Å; Y185-F218 HydrophobicContact CD1-CZ 3.51Å; Y185-F218 HydrophobicContact CE1-CZ 4.11Å; Y185-F218 AromaticContact CG-CE2 3.92Å; Y185-F218 HydrophobicContact CG-CE2 3.92Å; Y185-F218 HydrophobicContact CG-CZ 4.04Å; G214-F218 PolarHBondContact O-N 3.12Å; F218-S220 PolarHBondContact O-N 2.88Å; F218-S220 VanDerWaalsContact O-N 3.13Å; F218-A231 HydrophobicContact CD1-CB 4.3Å; F218-A231 HydrophobicContact CD2-CB 4.49Å; F218-A231 HydrophobicContact CE1-CB 3.59Å; F218-A231 HydrophobicContact CE2-CB 3.79Å; F218-A231 HydrophobicContact CZ-CB 3.3Å; F218-L267 HydrophobicContact CE1-CD2 4.32Å; F218-L267 HydrophobicContact CZ-CD2 4.32Å; F218-F365 HydrophobicContact CB-CB 4.2Å; F218-G366 WeakPolarHBondContact CD1-O 3.43Å; F218-P367 HydrophobicContact CE1-CG 4Å
219	L	97.5	Very high	95.6	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.005	12%	0.117	C	C	.	.			trans	-54.6	123.9	175.6	-177.9	66.3	0	0	0	110.6	F71 V215 C226 G228 W230 F309 L312 I341 F365	F71-L219 HydrophobicContact CD1-CB 3.95Å; F71-L219 HydrophobicContact CD1-CD2 3.93Å; F71-L219 HydrophobicContact CD2-CD2 4.09Å; F71-L219 HydrophobicContact CE1-CB 4.13Å; F71-L219 HydrophobicContact CE1-CD2 3.82Å; F71-L219 HydrophobicContact CE2-CD2 4Å; F71-L219 HydrophobicContact CG-CD2 4.06Å; F71-L219 HydrophobicContact CZ-CD2 3.85Å; V215-L219 HydrophobicContact CG2-CB 4.08Å; V215-L219 HydrophobicContact CG2-CD1 4.22Å; V215-L219 HydrophobicContact CG2-CD2 4.35Å; V215-L219 HydrophobicContact CG2-CG 4.46Å; V215-L219 WeakPolarHBondContact O-CB 3.36Å; V215-L219 PolarHBondContact O-N 3.17Å; L219-C226 PolarHBondContact O-SG 3Å; L219-G228 VanDerWaalsContact O-CA 3.32Å; L219-G228 WeakPolarHBondContact O-CA 3.38Å; L219-W230 PolarHBondContact O-NE1 3.21Å; L219-F309 HydrophobicContact CD1-CB 4.27Å; L219-F309 HydrophobicContact CD1-CD2 3.77Å; L219-F309 HydrophobicContact CD1-CG 4.47Å; L219-F309 HydrophobicContact CD2-CD2 4.23Å; L219-F309 HydrophobicContact CD2-CE2 4.37Å; L219-F309 HydrophobicContact CG-CD2 3.95Å; L219-L312 HydrophobicContact CD1-CD2 3.76Å; L219-L312 HydrophobicContact CD2-CD2 4.1Å; L219-I341 HydrophobicContact CD2-CD1 4.44Å; L219-I341 HydrophobicContact CD2-CG2 4.22Å; L219-F365 HydrophobicContact CD1-CE1 4.32Å
220	S	96.9	Very high	95.7	Very high	5 Å²	5	19.3 Å²	19.3	4%	0.035	12%	0.12	C	C	.	.			trans	-140.1	136.2	178.4	179	0	0	0	0	109.5	F218 G222 C226 K227 P305 F309	F218-S220 PolarHBondContact O-N 2.88Å; F218-S220 VanDerWaalsContact O-N 3.13Å; S220-G222 PolarHBondContact OG-N 3.09Å; S220-G222 VanDerWaalsContact OG-N 3.15Å; S220-C226 CarbonylContact C-O 3.6Å; S220-C226 WeakPolarHBondContact CA-O 3.09Å; S220-C226 PolarHBondContact OG-O 2.72Å; S220-K227 WeakPolarHBondContact CB-O 3.17Å; S220-K227 PolarHBondContact OG-O 3.32Å; S220-P305 CarbonylContact O-C 3.5Å; S220-P305 VanDerWaalsContact O-C 3.32Å; S220-P305 VanDerWaalsContact O-O 3.04Å; S220-F309 WeakPolarHBondContact O-CB 3.5Å
221	S	95.4	Very high	95.7	Very high	7 Å²	7	19.2 Å²	19.2	5%	0.049	12%	0.12	C	C	.	.			trans	-87.9	-10.6	172.1	62.9	0	0	0	0	112.6	D223 C226 S306 V334	S221-D223 PolarHBondContact O-N 3.24Å; S221-D223 WeakPolarHBondContact OG-CB 3.26Å; S221-D223 PolarHBondContact OG-N 3.06Å; S221-D223 VanDerWaalsContact OG-N 3.09Å; S221-C226 PolarHBondContact N-O 2.89Å; S221-C226 WeakPolarHBondContact OG-CB 3.28Å; S221-C226 PolarHBondContact OG-O 3.13Å; S221-C226 VanDerWaalsContact OG-O 3.12Å; S221-S306 VanDerWaalsContact O-CB 3.24Å; S221-S306 WeakPolarHBondContact O-CB 3.35Å; S221-V334 WeakPolarHBondContact OG-CG1 3.2Å
222	G	91	Very high	95.7	Very high	59 Å²	59	19.2 Å²	19.2	61%	0.608	12%	0.12	S	C	*	.	S	Bend	trans	76.9	-8.4	-165.2	0	0	0	0	0	114.5	S220	S220-G222 PolarHBondContact OG-N 3.09Å; S220-G222 VanDerWaalsContact OG-N 3.15Å
223	D	90	Very high	95.6	Very high	63 Å²	63	19.2 Å²	19.2	34%	0.337	12%	0.121	S	C	.	.	S	Bend	trans	-94	153.5	177.4	-176.9	-86.7	0	0	0	111.8	S221 T225 C226 V334	S221-D223 PolarHBondContact O-N 3.24Å; S221-D223 WeakPolarHBondContact OG-CB 3.26Å; S221-D223 PolarHBondContact OG-N 3.06Å; S221-D223 VanDerWaalsContact OG-N 3.09Å; D223-T225 PolarHBondContact O-N 2.83Å; D223-T225 WeakPolarHBondContact OD1-CB 3.38Å; D223-T225 PolarHBondContact OD1-N 2.63Å; D223-T225 PolarHBondContact OD1-OG1 2.9Å; D223-C226 CarbonylContact O-C 3.5Å; D223-C226 PolarHBondContact O-N 2.83Å; D223-V334 HydrophobicContact CB-CB 4.49Å; D223-V334 HydrophobicContact CB-CG1 4.4Å; D223-V334 HydrophobicContact CB-CG2 3.98Å
224	P	90	Very high	95.6	Very high	93 Å²	93	19.1 Å²	19.1	60%	0.604	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-22.1	176.1	-29.8	37.9	0	0	0	116.5	K227	P224-K227 WeakPolarHBondContact O-CE 3.21Å; P224-K227 VanDerWaalsContact O-CG 3.29Å; P224-K227 WeakPolarHBondContact O-CG 3.35Å
225	T	91.8	Very high	95.6	Very high	55 Å²	55	19.1 Å²	19.1	34%	0.337	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-38.3	180	-71	0	0	0	0	113.1	D223 V334 E335 L338	D223-T225 PolarHBondContact O-N 2.83Å; D223-T225 WeakPolarHBondContact OD1-CB 3.38Å; D223-T225 PolarHBondContact OD1-N 2.63Å; D223-T225 PolarHBondContact OD1-OG1 2.9Å; T225-V334 HydrophobicContact CG2-CG1 4.27Å; T225-E335 WeakPolarHBondContact CB-OE1 3.23Å; T225-E335 HydrophobicContact CG2-CB 4.32Å; T225-E335 HydrophobicContact CG2-CG 3.61Å; T225-E335 WeakPolarHBondContact CG2-OE1 3.19Å; T225-E335 PolarHBondContact OG1-OE1 3.38Å; T225-L338 HydrophobicContact CG2-CD2 4.3Å
226	C	94.1	Very high	95.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	12%	0.121	C	C	.	.	S	Bend	trans	-128	79	174.6	-173.2	0	0	0	0	109.5	L219 S220 S221 D223 F309 V334 L338	L219-C226 PolarHBondContact O-SG 3Å; S220-C226 CarbonylContact C-O 3.6Å; S220-C226 WeakPolarHBondContact CA-O 3.09Å; S220-C226 PolarHBondContact OG-O 2.72Å; S221-C226 PolarHBondContact N-O 2.89Å; S221-C226 WeakPolarHBondContact OG-CB 3.28Å; S221-C226 PolarHBondContact OG-O 3.13Å; S221-C226 VanDerWaalsContact OG-O 3.12Å; D223-C226 CarbonylContact O-C 3.5Å; D223-C226 PolarHBondContact O-N 2.83Å; C226-F309 HydrophobicContact CB-CE2 4.44Å; C226-V334 HydrophobicContact CB-CG1 4.37Å; C226-L338 HydrophobicContact CB-CD1 4.33Å; C226-L338 HydrophobicContact CB-CD2 4.08Å
227	K	93.4	Very high	95.5	Very high	69 Å²	69	19.2 Å²	19.2	30%	0.3	12%	0.122	S	C	.	.			trans	-70.3	-34.4	-173.3	-64.5	-173.4	-179.8	-173.2	0	114.1	S220 P224 V368 D370 I372	S220-K227 WeakPolarHBondContact CB-O 3.17Å; S220-K227 PolarHBondContact OG-O 3.32Å; P224-K227 WeakPolarHBondContact O-CE 3.21Å; P224-K227 VanDerWaalsContact O-CG 3.29Å; P224-K227 WeakPolarHBondContact O-CG 3.35Å; K227-V368 WeakPolarHBondContact O-CG2 3.15Å; K227-D370 HydrophobicContact CB-CB 4.1Å; K227-I372 HydrophobicContact CD-CD1 3.84Å
228	G	94.7	Very high	95.5	Very high	2 Å²	2	19.2 Å²	19.2	2%	0.021	12%	0.122	C	C	.	.			trans	93.5	-159.7	-173	0	0	0	0	0	113.3	L219 W230	L219-G228 VanDerWaalsContact O-CA 3.32Å; L219-G228 WeakPolarHBondContact O-CA 3.38Å; G228-W230 VanDerWaalsContact C-N 3.26Å; G228-W230 PolarHBondContact O-N 3.32Å
229	N	96.8	Very high	95.4	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	12%	0.122	C	C	.	.			trans	57.6	30.8	179.1	-61.1	-25.8	0	0	0	115.4	A231 L232 S233 P367 V368 D370 V373	N229-A231 VanDerWaalsContact C-N 3.3Å; N229-A231 PolarHBondContact O-N 2.86Å; N229-L232 HydrophobicContact CB-CB 4.46Å; N229-L232 HydrophobicContact CB-CD1 3.86Å; N229-L232 PolarHBondContact O-N 3.33Å; N229-S233 PolarHBondContact O-N 3.36Å; N229-S233 VanDerWaalsContact O-N 3.16Å; N229-S233 PolarHBondContact O-OG 3.25Å; N229-S233 VanDerWaalsContact O-OG 3.14Å; N229-P367 VanDerWaalsContact OD1-CA 3.25Å; N229-P367 WeakPolarHBondContact OD1-CA 3.41Å; N229-V368 PolarHBondContact ND2-O 2.94Å; N229-V368 PolarHBondContact OD1-N 3.24Å; N229-D370 PolarHBondContact ND2-OD2 3.23Å; N229-V373 HydrophobicContact CB-CB 4.42Å
230	W	96.9	Very high	95.3	Very high	18 Å²	18	22.6 Å²	22.6	7%	0.068	14%	0.14	C	C	.	.	H	α-helix	trans	-62.9	-38.7	179.4	-43.1	120.7	0	0	0	111.8	F71 M73 R212 G217 L219 G228 S233 D234	F71-W230 VanDerWaalsContact C-CE2 3.47Å; F71-W230 HydrophobicContact CB-CZ2 4.35Å; F71-W230 VanDerWaalsContact O-CE2 3.31Å; F71-W230 WeakPolarHBondContact O-CH2 3.06Å; F71-W230 WeakPolarHBondContact O-CZ2 3.45Å; M73-W230 HydrophobicContact CG-CE3 4.45Å; M73-W230 HydrophobicContact CG-CZ3 4.28Å; R212-W230 PolarHBondContact NH2-O 3.34Å; G217-W230 WeakPolarHBondContact O-CA 3.41Å; G217-W230 VanDerWaalsContact O-CB 3.31Å; G217-W230 WeakPolarHBondContact O-CB 3.18Å; G217-W230 PolarHBondContact O-N 3.08Å; L219-W230 PolarHBondContact O-NE1 3.21Å; G228-W230 VanDerWaalsContact C-N 3.26Å; G228-W230 PolarHBondContact O-N 3.32Å; W230-S233 WeakPolarHBondContact O-CB 3.46Å; W230-S233 PolarHBondContact O-N 2.93Å; W230-D234 PolarHBondContact O-N 3.13Å
231	A	97.9	Very high	95.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.9	-43.2	174.6	0	0	0	0	0	113.8	Y211 R212 G217 F218 N229 S233 D234 I235	Y211-A231 HydrophobicContact CD2-CB 3.8Å; Y211-A231 HydrophobicContact CE2-CB 4.36Å; R212-A231 VanDerWaalsContact O-CB 3.29Å; R212-A231 WeakPolarHBondContact O-CB 3.5Å; G217-A231 PolarHBondContact O-N 2.91Å; F218-A231 HydrophobicContact CD1-CB 4.3Å; F218-A231 HydrophobicContact CD2-CB 4.49Å; F218-A231 HydrophobicContact CE1-CB 3.59Å; F218-A231 HydrophobicContact CE2-CB 3.79Å; F218-A231 HydrophobicContact CZ-CB 3.3Å; N229-A231 VanDerWaalsContact C-N 3.3Å; N229-A231 PolarHBondContact O-N 2.86Å; A231-S233 VanDerWaalsContact C-N 3.29Å; A231-S233 PolarHBondContact O-N 2.86Å; A231-D234 WeakPolarHBondContact O-CB 3.21Å; A231-D234 PolarHBondContact O-N 3.3Å; A231-I235 WeakPolarHBondContact O-CG1 3.36Å; A231-I235 PolarHBondContact O-N 2.89Å; A231-I235 VanDerWaalsContact O-N 3.13Å
232	L	97.8	Very high	95.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.6	-39.6	175.9	-76.5	145.9	0	0	0	110.6	N229 D234 I235 V236 L267 L270 L271 P367 V373 V374	N229-L232 HydrophobicContact CB-CB 4.46Å; N229-L232 HydrophobicContact CB-CD1 3.86Å; N229-L232 PolarHBondContact O-N 3.33Å; L232-D234 VanDerWaalsContact C-N 3.31Å; L232-D234 PolarHBondContact O-N 2.79Å; L232-I235 PolarHBondContact O-N 2.77Å; L232-V236 WeakPolarHBondContact O-CG2 3.4Å; L232-V236 PolarHBondContact O-N 3.36Å; L232-L267 HydrophobicContact CD1-CD2 4.35Å; L232-L267 HydrophobicContact CD2-CB 4.31Å; L232-L267 HydrophobicContact CD2-CD2 3.89Å; L232-L267 HydrophobicContact CG-CD2 3.89Å; L232-L270 HydrophobicContact CD1-CD1 4.4Å; L232-L270 HydrophobicContact CD2-CB 4.21Å; L232-L271 HydrophobicContact CD2-CD1 4.5Å; L232-L271 HydrophobicContact CD2-CD2 3.93Å; L232-L271 HydrophobicContact CD2-CG 3.87Å; L232-P367 HydrophobicContact CD1-CB 4.2Å; L232-P367 HydrophobicContact CD1-CG 4.26Å; L232-V373 HydrophobicContact CB-CG1 3.62Å; L232-V373 HydrophobicContact CD1-CG1 4.05Å; L232-V373 HydrophobicContact CD2-CG1 4.37Å; L232-V373 HydrophobicContact CG-CG1 4.22Å; L232-V374 HydrophobicContact CD1-CG2 4.1Å
233	S	96.5	Very high	95.4	Very high	8 Å²	8	23.1 Å²	23.1	6%	0.056	12%	0.123	C	C	.	.	H	α-helix	trans	-64.9	-35.1	175.8	-54.4	0	0	0	0	111.9	P74 N229 W230 A231 V236 C237	P74-S233 VanDerWaalsContact CD-CB 3.48Å; P74-S233 WeakPolarHBondContact CG-O 3.47Å; N229-S233 PolarHBondContact O-N 3.36Å; N229-S233 VanDerWaalsContact O-N 3.16Å; N229-S233 PolarHBondContact O-OG 3.25Å; N229-S233 VanDerWaalsContact O-OG 3.14Å; W230-S233 WeakPolarHBondContact O-CB 3.46Å; W230-S233 PolarHBondContact O-N 2.93Å; A231-S233 VanDerWaalsContact C-N 3.29Å; A231-S233 PolarHBondContact O-N 2.86Å; S233-V236 PolarHBondContact O-N 2.78Å; S233-C237 WeakPolarHBondContact O-CB 3.43Å; S233-C237 PolarHBondContact O-N 2.56Å
234	D	98.3	Very high	95.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.1	-45.8	172.3	-64.6	-19.8	0	0	0	111.7	Y61 P74 L137 R212 W230 A231 L232 C237 A238	Y61-D234 HydrophobicContact CE2-CB 4.41Å; Y61-D234 WeakPolarHBondContact CE2-O 3.43Å; P74-D234 WeakPolarHBondContact CB-OD1 3.26Å; P74-D234 WeakPolarHBondContact CG-OD1 3.37Å; L137-D234 HydrophobicContact CD2-CB 4.29Å; R212-D234 WeakPolarHBondContact CB-OD2 3.29Å; R212-D234 WeakPolarHBondContact CG-OD2 3.42Å; R212-D234 IonicContact CZ-OD1 3.61Å; R212-D234 IonicContact CZ-OD2 2.75Å; R212-D234 PolarHBondContact N-OD2 2.58Å; R212-D234 IonicContact NE-OD1 2.75Å; R212-D234 PolarHBondContact NE-OD1 3.16Å; R212-D234 IonicContact NE-OD2 3.44Å; R212-D234 PolarHBondContact NE-OD2 3.05Å; R212-D234 IonicContact NH2-OD1 3.89Å; R212-D234 PolarHBondContact NH2-OD1 3.27Å; R212-D234 IonicContact NH2-OD2 3.19Å; W230-D234 PolarHBondContact O-N 3.13Å; A231-D234 WeakPolarHBondContact O-CB 3.21Å; A231-D234 PolarHBondContact O-N 3.3Å; L232-D234 VanDerWaalsContact C-N 3.31Å; L232-D234 PolarHBondContact O-N 2.79Å; D234-C237 WeakPolarHBondContact O-CB 3.39Å; D234-C237 PolarHBondContact O-N 2.92Å; D234-A238 WeakPolarHBondContact O-CB 3.4Å; D234-A238 PolarHBondContact O-N 3.04Å
235	I	97.9	Very high	95.7	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-62.8	-45	177.9	-63.1	166.4	0	0	0	110.4	I180 Y211 A231 L232 C237 A238 L239 L267 L271	I180-I235 HydrophobicContact CD1-CD1 4.36Å; I180-I235 HydrophobicContact CD1-CG1 4.3Å; I180-I235 HydrophobicContact CD1-CG2 3.83Å; I180-I235 HydrophobicContact CG2-CD1 3.78Å; Y211-I235 HydrophobicContact CD1-CD1 4.32Å; Y211-I235 HydrophobicContact CD1-CG1 4.29Å; Y211-I235 HydrophobicContact CG-CD1 4.42Å; Y211-I235 HydrophobicContact CG-CG1 4.3Å; A231-I235 WeakPolarHBondContact O-CG1 3.36Å; A231-I235 PolarHBondContact O-N 2.89Å; A231-I235 VanDerWaalsContact O-N 3.13Å; L232-I235 PolarHBondContact O-N 2.77Å; I235-C237 VanDerWaalsContact C-N 3.35Å; I235-C237 PolarHBondContact O-N 3.26Å; I235-A238 WeakPolarHBondContact O-CB 3.29Å; I235-A238 PolarHBondContact O-N 2.67Å; I235-L239 HydrophobicContact CG2-CD1 4.2Å; I235-L239 HydrophobicContact CG2-CG 4.45Å; I235-L239 VanDerWaalsContact O-CG 3.3Å; I235-L239 WeakPolarHBondContact O-CG 3.43Å; I235-L239 PolarHBondContact O-N 2.86Å; I235-L267 HydrophobicContact CD1-CB 4.25Å; I235-L267 HydrophobicContact CD1-CD1 3.84Å; I235-L271 HydrophobicContact CB-CD1 4.15Å; I235-L271 HydrophobicContact CG2-CD1 3.53Å
236	V	96.4	Very high	95.8	Very high	8 Å²	8	14.6 Å²	14.6	5%	0.048	7%	0.074	C	C	.	.	H	α-helix	trans	-60	-45.7	176.6	174.8	0	0	0	0	110.9	L232 S233 A238 L239 D240 L271 I276 L284	L232-V236 WeakPolarHBondContact O-CG2 3.4Å; L232-V236 PolarHBondContact O-N 3.36Å; S233-V236 PolarHBondContact O-N 2.78Å; V236-A238 VanDerWaalsContact C-N 3.33Å; V236-A238 PolarHBondContact O-N 3.16Å; V236-L239 PolarHBondContact O-N 3.36Å; V236-L239 VanDerWaalsContact O-N 3.16Å; V236-D240 PolarHBondContact O-N 3.41Å; V236-L271 HydrophobicContact CG2-CD2 3.64Å; V236-I276 HydrophobicContact CG1-CD1 4.32Å; V236-I276 HydrophobicContact CG1-CG1 4.19Å; V236-I276 HydrophobicContact CG1-CG2 4.37Å; V236-I276 HydrophobicContact CG2-CG2 3.73Å; V236-L284 HydrophobicContact CG1-CD1 4.05Å
237	C	96.4	Very high	95.8	Very high	10 Å²	10	17.3 Å²	17.3	7%	0.068	9%	0.093	C	C	.	.	H	α-helix	trans	-59.8	-42.7	176.4	-171.7	0	0	0	0	112.1	Y61 P74 S233 D234 I235 D240 V241	Y61-C237 HydrophobicContact CD2-CB 4.39Å; P74-C237 HydrophobicContact CB-CB 4.19Å; P74-C237 HydrophobicContact CG-CB 3.58Å; S233-C237 WeakPolarHBondContact O-CB 3.43Å; S233-C237 PolarHBondContact O-N 2.56Å; D234-C237 WeakPolarHBondContact O-CB 3.39Å; D234-C237 PolarHBondContact O-N 2.92Å; I235-C237 VanDerWaalsContact C-N 3.35Å; I235-C237 PolarHBondContact O-N 3.26Å; C237-D240 PolarHBondContact O-N 2.78Å; C237-V241 WeakPolarHBondContact O-CG2 3.48Å; C237-V241 PolarHBondContact O-N 3.24Å
238	A	97.8	Very high	95.8	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.008	10%	0.097	C	C	.	.	H	α-helix	trans	-61.9	-42.6	175.5	0	0	0	0	0	111.7	Y61 M139 L209 D234 I235 V236 V241 L242	Y61-A238 HydrophobicContact CD1-CB 3.94Å; Y61-A238 HydrophobicContact CD2-CB 3.74Å; Y61-A238 HydrophobicContact CE1-CB 4.06Å; Y61-A238 HydrophobicContact CE2-CB 3.89Å; Y61-A238 HydrophobicContact CG-CB 3.79Å; M139-A238 HydrophobicContact CE-CB 3.99Å; M139-A238 WeakPolarHBondContact CE-O 3.3Å; L209-A238 HydrophobicContact CD1-CB 3.76Å; L209-A238 HydrophobicContact CD2-CB 4.04Å; D234-A238 WeakPolarHBondContact O-CB 3.4Å; D234-A238 PolarHBondContact O-N 3.04Å; I235-A238 WeakPolarHBondContact O-CB 3.29Å; I235-A238 PolarHBondContact O-N 2.67Å; V236-A238 VanDerWaalsContact C-N 3.33Å; V236-A238 PolarHBondContact O-N 3.16Å; A238-V241 PolarHBondContact O-N 3.18Å; A238-L242 VanDerWaalsContact O-CB 3.23Å; A238-L242 WeakPolarHBondContact O-CB 3.43Å; A238-L242 PolarHBondContact O-N 2.85Å
239	L	97.2	Very high	95.7	Very high	4 Å²	4	17.9 Å²	17.9	2%	0.021	10%	0.098	C	C	.	.	H	α-helix	trans	-65.1	-39.3	177.5	-66.8	174.7	0	0	0	112.4	V178 I235 V236 L242 R243 V256 L258 L284 F285	V178-L239 HydrophobicContact CB-CD2 4.48Å; V178-L239 HydrophobicContact CG1-CD2 4.26Å; V178-L239 HydrophobicContact CG2-CD2 4.11Å; I235-L239 HydrophobicContact CG2-CD1 4.2Å; I235-L239 HydrophobicContact CG2-CG 4.45Å; I235-L239 VanDerWaalsContact O-CG 3.3Å; I235-L239 WeakPolarHBondContact O-CG 3.43Å; I235-L239 PolarHBondContact O-N 2.86Å; V236-L239 PolarHBondContact O-N 3.36Å; V236-L239 VanDerWaalsContact O-N 3.16Å; L239-L242 PolarHBondContact O-N 2.87Å; L239-R243 VanDerWaalsContact O-CB 3.3Å; L239-R243 WeakPolarHBondContact O-CB 3.29Å; L239-R243 PolarHBondContact O-N 3.25Å; L239-V256 HydrophobicContact CD2-CG1 4.39Å; L239-L258 HydrophobicContact CD1-CD1 4.19Å; L239-L258 HydrophobicContact CD1-CD2 4.14Å; L239-L258 HydrophobicContact CD2-CD2 3.66Å; L239-L284 HydrophobicContact CB-CB 4.24Å; L239-L284 HydrophobicContact CB-CD1 4.01Å; L239-L284 HydrophobicContact CD1-CB 4.36Å; L239-F285 HydrophobicContact CD1-CD1 4.17Å
240	D	94.4	Very high	95.5	Very high	71 Å²	71	18 Å²	18	38%	0.38	10%	0.1	S	C	.	.	H	α-helix	trans	-62.8	-44.4	174.7	-81.9	-30.2	0	0	0	112.4	V236 C237 A244 L284	V236-D240 PolarHBondContact O-N 3.41Å; C237-D240 PolarHBondContact O-N 2.78Å; D240-A244 PolarHBondContact O-N 3.22Å; D240-L284 WeakPolarHBondContact OD1-CD2 3.46Å
241	V	95.6	Very high	95.5	Very high	2 Å²	2	17.1 Å²	17.1	1%	0.012	10%	0.097	C	C	.	.	H	α-helix	trans	-64.8	-46.4	176	171.4	0	0	0	0	110.6	F35 T76 M139 C237 A238 R243 A244 M245	F35-V241 HydrophobicContact CE2-CG1 3.95Å; F35-V241 HydrophobicContact CZ-CB 4.45Å; F35-V241 HydrophobicContact CZ-CG1 3.95Å; F35-V241 HydrophobicContact CZ-CG2 4.13Å; T76-V241 HydrophobicContact CG2-CG2 3.67Å; M139-V241 HydrophobicContact CE-CB 4.41Å; M139-V241 HydrophobicContact CE-CG1 4.29Å; C237-V241 WeakPolarHBondContact O-CG2 3.48Å; C237-V241 PolarHBondContact O-N 3.24Å; A238-V241 PolarHBondContact O-N 3.18Å; V241-R243 PolarHBondContact O-N 3.49Å; V241-A244 PolarHBondContact O-N 3.42Å; V241-A244 VanDerWaalsContact O-N 3.08Å; V241-M245 HydrophobicContact CG1-CE 4.23Å; V241-M245 HydrophobicContact CG1-SD 4.2Å; V241-M245 WeakPolarHBondContact O-CG 3.43Å; V241-M245 PolarHBondContact O-N 3.33Å
242	L	96	Very high	95.3	Very high	3 Å²	3	18.5 Å²	18.5	2%	0.016	10%	0.104	C	C	.	.	H	α-helix	trans	-58.5	-48.9	178.8	-177.6	64.3	0	0	0	110.7	M139 L141 V176 V178 V207 A238 L239 A244 M245 V246	M139-L242 HydrophobicContact CE-CB 4.37Å; M139-L242 HydrophobicContact SD-CB 4.49Å; M139-L242 HydrophobicContact SD-CD1 4.2Å; L141-L242 HydrophobicContact CD2-CD1 4.27Å; V176-L242 HydrophobicContact CG1-CD2 4.09Å; V178-L242 HydrophobicContact CG2-CD2 3.45Å; V178-L242 VanDerWaalsContact CG2-CD2 3.45Å; V207-L242 HydrophobicContact CG2-CD1 4.03Å; V207-L242 HydrophobicContact CG2-CD2 4.15Å; A238-L242 VanDerWaalsContact O-CB 3.23Å; A238-L242 WeakPolarHBondContact O-CB 3.43Å; A238-L242 PolarHBondContact O-N 2.85Å; L239-L242 PolarHBondContact O-N 2.87Å; L242-A244 PolarHBondContact O-N 3.16Å; L242-A244 VanDerWaalsContact O-N 3.16Å; L242-M245 HydrophobicContact CD1-CE 4.15Å; L242-M245 PolarHBondContact O-N 2.96Å; L242-V246 HydrophobicContact CD1-CB 3.92Å; L242-V246 HydrophobicContact CD1-CG2 3.96Å; L242-V246 HydrophobicContact CG-CB 4.2Å; L242-V246 HydrophobicContact CG-CG2 4.44Å; L242-V246 WeakPolarHBondContact O-CB 3.42Å; L242-V246 WeakPolarHBondContact O-CG1 3.23Å; L242-V246 PolarHBondContact O-N 3.06Å
243	R	93	Very high	95.1	Very high	78 Å²	78	20 Å²	20	29%	0.294	11%	0.113	S	C	.	.	H	α-helix	trans	-53.7	-36.7	175.8	179.7	-179.5	172.1	164.1	2.2	112.4	L239 V241 P253 S282	L239-R243 VanDerWaalsContact O-CB 3.3Å; L239-R243 WeakPolarHBondContact O-CB 3.29Å; L239-R243 PolarHBondContact O-N 3.25Å; V241-R243 PolarHBondContact O-N 3.49Å; R243-P253 HydrophobicContact CG-CB 4.05Å; R243-S282 PolarHBondContact NH1-O 2.86Å; R243-S282 PolarHBondContact NH1-OG 3.35Å; R243-S282 PolarHBondContact NH2-OG 3.4Å
244	A	92.1	Very high	95	Very high	32 Å²	32	24.2 Å²	24.2	26%	0.264	14%	0.139	S	C	.	.	H	α-helix	trans	-79.4	-13.7	-179.2	0	0	0	0	0	114.9	S34 F35 D240 V241 L242	S34-A244 WeakPolarHBondContact CB-O 3.29Å; S34-A244 PolarHBondContact OG-O 3.36Å; F35-A244 HydrophobicContact CE2-CB 4.2Å; D240-A244 PolarHBondContact O-N 3.22Å; V241-A244 PolarHBondContact O-N 3.42Å; V241-A244 VanDerWaalsContact O-N 3.08Å; L242-A244 PolarHBondContact O-N 3.16Å; L242-A244 VanDerWaalsContact O-N 3.16Å
245	M	93.9	Very high	94.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-126.1	-18.3	-176.8	72.1	177.3	179.8	0	0	114.8	F35 V59 M139 L141 V241 L242 S247 D248 F249	F35-M245 HydrophobicContact CD2-CB 4.42Å; V59-M245 HydrophobicContact CG1-CE 4.14Å; V59-M245 HydrophobicContact CG1-SD 4.3Å; M139-M245 HydrophobicContact CE-CE 4.02Å; M139-M245 HydrophobicContact CG-CE 4.31Å; M139-M245 HydrophobicContact SD-CE 3.29Å; M139-M245 WeakPolarHBondContact SD-CE 3.47Å; L141-M245 HydrophobicContact CD1-CE 4.19Å; L141-M245 HydrophobicContact CD2-CE 4.32Å; V241-M245 HydrophobicContact CG1-CE 4.23Å; V241-M245 HydrophobicContact CG1-SD 4.2Å; V241-M245 WeakPolarHBondContact O-CG 3.43Å; V241-M245 PolarHBondContact O-N 3.33Å; L242-M245 HydrophobicContact CD1-CE 4.15Å; L242-M245 PolarHBondContact O-N 2.96Å; M245-S247 PolarHBondContact O-N 2.72Å; M245-S247 VanDerWaalsContact O-N 3.17Å; M245-D248 WeakPolarHBondContact O-CB 3.44Å; M245-D248 PolarHBondContact O-N 3.12Å; M245-F249 HydrophobicContact CB-CE2 4.43Å; M245-F249 HydrophobicContact CG-CE2 4.11Å; M245-F249 WeakPolarHBondContact O-CD2 3.35Å; M245-F249 HydrophobicContact SD-CE2 4.17Å
246	V	95	Very high	94.7	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-64.4	-28	-169.1	73	0	0	0	0	113.2	V176 I205 L242 D248 F249 G250 G251 P253	V176-V246 HydrophobicContact CG1-CG2 4.24Å; V176-V246 HydrophobicContact CG2-CG2 3.56Å; I205-V246 HydrophobicContact CD1-CG2 4.23Å; L242-V246 HydrophobicContact CD1-CB 3.92Å; L242-V246 HydrophobicContact CD1-CG2 3.96Å; L242-V246 HydrophobicContact CG-CB 4.2Å; L242-V246 HydrophobicContact CG-CG2 4.44Å; L242-V246 WeakPolarHBondContact O-CB 3.42Å; L242-V246 WeakPolarHBondContact O-CG1 3.23Å; L242-V246 PolarHBondContact O-N 3.06Å; V246-D248 PolarHBondContact O-N 3.35Å; V246-F249 PolarHBondContact O-N 3.46Å; V246-F249 VanDerWaalsContact O-N 3.14Å; V246-G250 PolarHBondContact O-N 2.77Å; V246-G251 PolarHBondContact O-N 3.4Å; V246-P253 HydrophobicContact CG1-CB 3.85Å
247	S	93.8	Very high	94.8	Very high	56 Å²	56	26.3 Å²	26.3	39%	0.392	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-63.3	-28.4	172.6	-59.9	0	0	0	0	113.3	M245 F249 G250 G251 P253	M245-S247 PolarHBondContact O-N 2.72Å; M245-S247 VanDerWaalsContact O-N 3.17Å; S247-F249 PolarHBondContact O-N 2.77Å; S247-G250 WeakPolarHBondContact O-CA 3.11Å; S247-G250 PolarHBondContact O-N 3.1Å; S247-G251 WeakPolarHBondContact CA-O 3.43Å; S247-P253 WeakPolarHBondContact OG-CD 3.46Å
248	D	93.2	Very high	94.9	Very high	71 Å²	71	25.9 Å²	25.9	38%	0.38	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-68.9	-27	176.6	-57.5	-38.6	0	0	0	111.5	T33 S34 M245 V246 G250	T33-D248 WeakPolarHBondContact CA-OD2 3.33Å; T33-D248 HydrophobicContact CG2-CB 4.3Å; S34-D248 PolarHBondContact N-OD2 2.92Å; M245-D248 WeakPolarHBondContact O-CB 3.44Å; M245-D248 PolarHBondContact O-N 3.12Å; V246-D248 PolarHBondContact O-N 3.35Å; D248-G250 VanDerWaalsContact C-N 3.3Å
249	F	93.6	Very high	95	Very high	12 Å²	12	26 Å²	26	5%	0.053	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-87.9	-1.1	171.1	-59.3	-90.2	0	0	0	112.7	V31 T33 L38 Y56 L141 V143 I205 M245 V246 S247	V31-F249 HydrophobicContact CG1-CD1 4.2Å; V31-F249 HydrophobicContact CG1-CE1 3.56Å; V31-F249 HydrophobicContact CG1-CZ 3.98Å; V31-F249 HydrophobicContact CG2-CD1 4.47Å; T33-F249 HydrophobicContact CG2-CE2 3.77Å; T33-F249 HydrophobicContact CG2-CZ 3.78Å; L38-F249 HydrophobicContact CD1-CZ 3.79Å; Y56-F249 HydrophobicContact CD1-CE1 4.08Å; Y56-F249 AromaticContact CD2-CD1 3.9Å; Y56-F249 HydrophobicContact CD2-CD1 3.9Å; Y56-F249 AromaticContact CD2-CE1 3.51Å; Y56-F249 HydrophobicContact CD2-CE1 3.51Å; Y56-F249 HydrophobicContact CE1-CE1 4.17Å; Y56-F249 AromaticContact CE2-CD1 3.71Å; Y56-F249 HydrophobicContact CE2-CD1 3.71Å; Y56-F249 AromaticContact CE2-CE1 3.62Å; Y56-F249 HydrophobicContact CE2-CE1 3.62Å; Y56-F249 AromaticContact CG-CE1 3.76Å; Y56-F249 HydrophobicContact CG-CE1 3.76Å; Y56-F249 AromaticContact CZ-CE1 3.95Å; L141-F249 HydrophobicContact CD2-CD1 4.29Å; L141-F249 HydrophobicContact CD2-CD2 3.88Å; L141-F249 HydrophobicContact CD2-CE1 4.18Å; L141-F249 HydrophobicContact CD2-CE2 3.8Å; L141-F249 HydrophobicContact CD2-CG 4.12Å; L141-F249 HydrophobicContact CD2-CZ 3.94Å; V143-F249 HydrophobicContact CG2-CB 4.09Å; V143-F249 HydrophobicContact CG2-CD1 4.02Å; V143-F249 HydrophobicContact CG2-CG 4.4Å; I205-F249 HydrophobicContact CD1-CB 4.06Å; M245-F249 HydrophobicContact CB-CE2 4.43Å; M245-F249 HydrophobicContact CG-CE2 4.11Å; M245-F249 WeakPolarHBondContact O-CD2 3.35Å; M245-F249 HydrophobicContact SD-CE2 4.17Å; V246-F249 PolarHBondContact O-N 3.46Å; V246-F249 VanDerWaalsContact O-N 3.14Å; S247-F249 PolarHBondContact O-N 2.77Å
250	G	92.7	Very high	95	Very high	3 Å²	3	25.8 Å²	25.8	3%	0.031	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	82	19.7	-178.5	0	0	0	0	0	115.3	R146 L173 M174 V246 S247 D248	R146-G250 VanDerWaalsContact NH2-C 3.32Å; R146-G250 PolarHBondContact NH2-O 2.91Å; L173-G250 WeakPolarHBondContact CA-O 3.47Å; M174-G250 PolarHBondContact N-O 3.5Å; V246-G250 PolarHBondContact O-N 2.77Å; S247-G250 WeakPolarHBondContact O-CA 3.11Å; S247-G250 PolarHBondContact O-N 3.1Å; D248-G250 VanDerWaalsContact C-N 3.3Å
251	G	95.3	Very high	95.2	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	159	170.8	0	0	0	0	0	113.1	M174 V246 S247 P253	M174-G251 CarbonylContact O-C 3.44Å; M174-G251 WeakPolarHBondContact O-CA 3.35Å; V246-G251 PolarHBondContact O-N 3.4Å; S247-G251 WeakPolarHBondContact CA-O 3.43Å; G251-P253 WeakPolarHBondContact O-CD 3.24Å
252	D	94.7	Very high	95.2	Very high	28 Å²	28	23.2 Å²	23.2	15%	0.15	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	112.8	176.8	-165.1	-31.5	0	0	0	110.1	L173 M174 T254 M255	L173-D252 HydrophobicContact CB-CB 3.64Å; L173-D252 HydrophobicContact CD1-CB 4.27Å; M174-D252 PolarHBondContact O-N 2.94Å; D252-T254 VanDerWaalsContact CG-OG1 3.26Å; D252-T254 PolarHBondContact O-N 2.97Å; D252-T254 VanDerWaalsContact O-N 3.15Å; D252-T254 WeakPolarHBondContact OD1-CA 3.45Å; D252-T254 WeakPolarHBondContact OD1-CB 3.24Å; D252-T254 PolarHBondContact OD1-N 2.92Å; D252-T254 PolarHBondContact OD1-OG1 2.81Å; D252-T254 PolarHBondContact OD2-OG1 2.94Å; D252-M255 HydrophobicContact CB-CB 4.1Å; D252-M255 HydrophobicContact CB-CE 3.58Å; D252-M255 HydrophobicContact CB-CG 4.23Å; D252-M255 PolarHBondContact O-N 2.82Å; D252-M255 VanDerWaalsContact O-N 3.11Å; D252-M255 VanDerWaalsContact OD2-CE 3.24Å; D252-M255 WeakPolarHBondContact OD2-CE 3.16Å
253	P	94.1	Very high	95.3	Very high	31 Å²	31	23.6 Å²	23.6	20%	0.201	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	-13.2	178.3	27.6	-34.2	0	0	0	113.2	R243 V246 S247 G251	R243-P253 HydrophobicContact CG-CB 4.05Å; V246-P253 HydrophobicContact CG1-CB 3.85Å; S247-P253 WeakPolarHBondContact OG-CD 3.46Å; G251-P253 WeakPolarHBondContact O-CD 3.24Å
254	T	92.7	Very high	95.6	Very high	97 Å²	97	19.9 Å²	19.9	60%	0.595	12%	0.119	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	-14.2	176.4	73.2	0	0	0	0	113	D252	D252-T254 VanDerWaalsContact CG-OG1 3.26Å; D252-T254 PolarHBondContact O-N 2.97Å; D252-T254 VanDerWaalsContact O-N 3.15Å; D252-T254 WeakPolarHBondContact OD1-CA 3.45Å; D252-T254 WeakPolarHBondContact OD1-CB 3.24Å; D252-T254 PolarHBondContact OD1-N 2.92Å; D252-T254 PolarHBondContact OD1-OG1 2.81Å; D252-T254 PolarHBondContact OD2-OG1 2.94Å
255	M	94.2	Very high	95.9	Very high	50 Å²	50	18.3 Å²	18.3	25%	0.246	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	52.2	179.4	-61.3	-165.9	-82.4	0	0	111.7	P175 V176 D252	P175-M255 HydrophobicContact CB-CB 4.08Å; V176-M255 PolarHBondContact N-O 2.83Å; D252-M255 HydrophobicContact CB-CB 4.1Å; D252-M255 HydrophobicContact CB-CE 3.58Å; D252-M255 HydrophobicContact CB-CG 4.23Å; D252-M255 PolarHBondContact O-N 2.82Å; D252-M255 VanDerWaalsContact O-N 3.11Å; D252-M255 VanDerWaalsContact OD2-CE 3.24Å; D252-M255 WeakPolarHBondContact OD2-CE 3.16Å
256	V	97.3	Very high	96.1	Very high	4 Å²	4	18.3 Å²	18.3	2%	0.024	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	128.6	174.2	-179.5	0	0	0	0	109.8	V176 V178 L239 L258 F285 R286 R287	V176-V256 HydrophobicContact CB-CG2 4.22Å; V176-V256 CarbonylContact O-C 3.14Å; V176-V256 WeakPolarHBondContact O-CA 3.31Å; V178-V256 HydrophobicContact CG2-CG1 3.88Å; L239-V256 HydrophobicContact CD2-CG1 4.39Å; V256-L258 HydrophobicContact CG1-CD2 4.32Å; V256-F285 HydrophobicContact CB-CB 4.12Å; V256-F285 HydrophobicContact CG1-CB 3.92Å; V256-F285 WeakPolarHBondContact O-CA 3.34Å; V256-F285 WeakPolarHBondContact O-CB 3.21Å; V256-R286 PolarHBondContact O-N 3.06Å; V256-R287 PolarHBondContact O-N 3.35Å
257	T	98.4	Very high	96.2	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.6	174.1	-57.1	0	0	0	0	109.2	V176 L177 V178 R287 I289 F575 V576	V176-T257 PolarHBondContact O-N 2.03Å; L177-T257 WeakPolarHBondContact CA-O 3.26Å; L177-T257 HydrophobicContact CD1-CG2 4.03Å; V178-T257 PolarHBondContact N-O 2.55Å; T257-R287 WeakPolarHBondContact CA-O 3.41Å; T257-R287 HydrophobicContact CG2-CB 3.79Å; T257-I289 HydrophobicContact CG2-CD1 4.04Å; T257-I289 HydrophobicContact CG2-CG1 4.02Å; T257-F575 HydrophobicContact CG2-CD1 4.48Å; T257-F575 HydrophobicContact CG2-CE1 4.27Å; T257-V576 HydrophobicContact CG2-CG2 3.94Å
258	L	98.6	Very high	96.4	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	136.6	170.8	-54.3	-170.5	0	0	0	110	V178 L239 V256 V268 L271 F285 R287 A288 I289	V178-L258 HydrophobicContact CB-CD2 3.78Å; V178-L258 HydrophobicContact CG1-CD2 4.28Å; V178-L258 HydrophobicContact CG2-CD2 4.29Å; V178-L258 CarbonylContact O-C 3.58Å; V178-L258 WeakPolarHBondContact O-CA 2.99Å; L239-L258 HydrophobicContact CD1-CD1 4.19Å; L239-L258 HydrophobicContact CD1-CD2 4.14Å; L239-L258 HydrophobicContact CD2-CD2 3.66Å; V256-L258 HydrophobicContact CG1-CD2 4.32Å; L258-V268 HydrophobicContact CB-CG1 3.76Å; L258-V268 HydrophobicContact CB-CG2 3.95Å; L258-V268 HydrophobicContact CD1-CG1 4.27Å; L258-V268 HydrophobicContact CD1-CG2 4.41Å; L258-L271 HydrophobicContact CD1-CD1 4.39Å; L258-F285 HydrophobicContact CD1-CD1 3.59Å; L258-F285 HydrophobicContact CD1-CD2 3.91Å; L258-F285 HydrophobicContact CD1-CE1 3.54Å; L258-F285 HydrophobicContact CD1-CE2 3.84Å; L258-F285 HydrophobicContact CD1-CG 3.77Å; L258-F285 HydrophobicContact CD1-CZ 3.67Å; L258-F285 HydrophobicContact CD2-CB 4.24Å; L258-F285 HydrophobicContact CD2-CG 4.32Å; L258-F285 HydrophobicContact CG-CB 4Å; L258-F285 HydrophobicContact CG-CD1 3.99Å; L258-F285 HydrophobicContact CG-CD2 3.77Å; L258-F285 HydrophobicContact CG-CE1 4.37Å; L258-F285 HydrophobicContact CG-CE2 4.15Å; L258-F285 HydrophobicContact CG-CG 3.66Å; L258-F285 HydrophobicContact CG-CZ 4.45Å; L258-R287 PolarHBondContact N-O 3.33Å; L258-A288 CarbonylContact O-C 3.44Å; L258-A288 VanDerWaalsContact O-CA 3.32Å; L258-A288 WeakPolarHBondContact O-CA 3.41Å; L258-I289 PolarHBondContact O-N 3.41Å
259	L	98.4	Very high	96.6	Very high	4 Å²	4	12.3 Å²	12.3	2%	0.021	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	126.5	168.2	179.2	159.6	0	0	0	108.5	L177 V178 I179 I180 W261 I289 L291 I535	L177-L259 HydrophobicContact CD1-CB 3.73Å; L177-L259 HydrophobicContact CD1-CD1 4.49Å; V178-L259 PolarHBondContact O-N 3.03Å; I179-L259 CarbonylContact C-O 3.53Å; I179-L259 WeakPolarHBondContact CA-O 3.3Å; I179-L259 HydrophobicContact CG2-CD2 4.44Å; I180-L259 PolarHBondContact N-O 3.05Å; L259-W261 HydrophobicContact CD2-CE3 4.09Å; L259-W261 HydrophobicContact CD2-CZ3 4.44Å; L259-I289 WeakPolarHBondContact CA-O 3.38Å; L259-I289 HydrophobicContact CB-CB 3.98Å; L259-I289 HydrophobicContact CB-CD1 4.34Å; L259-I289 HydrophobicContact CD1-CB 4.24Å; L259-I289 HydrophobicContact CD1-CD1 3.98Å; L259-I289 HydrophobicContact CD1-CG2 4.05Å; L259-I289 HydrophobicContact CG-CB 3.95Å; L259-I289 HydrophobicContact CG-CD1 4.49Å; L259-I289 HydrophobicContact CG-CG2 4.02Å; L259-L291 HydrophobicContact CD1-CD1 4.38Å; L259-L291 HydrophobicContact CD2-CD1 4.08Å; L259-L291 HydrophobicContact CG-CD1 4.3Å; L259-I535 HydrophobicContact CD1-CG2 4.19Å
260	G	98.4	Very high	96.8	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	153.5	170.2	0	0	0	0	0	110.8	I180 A265 I289 L291	I180-G260 WeakPolarHBondContact O-CA 3.4Å; G260-A265 WeakPolarHBondContact O-CB 3.33Å; G260-I289 PolarHBondContact N-O 3.23Å; G260-L291 PolarHBondContact O-N 3.3Å
261	W	97.5	Very high	97	Very high	10 Å²	10	11.8 Å²	11.8	4%	0.038	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	151.3	168	65.4	90	0	0	0	110.9	I179 H181 G182 Y193 L259 T263 G264 A265 L291 L532	I179-W261 HydrophobicContact CG2-CE3 4.47Å; I179-W261 HydrophobicContact CG2-CH2 4.06Å; I179-W261 HydrophobicContact CG2-CZ3 3.47Å; I179-W261 VanDerWaalsContact CG2-CZ3 3.47Å; H181-W261 VanDerWaalsContact CA-CH2 3.47Å; H181-W261 VanDerWaalsContact CA-CZ2 3.42Å; H181-W261 HydrophobicContact CB-CH2 3.61Å; H181-W261 HydrophobicContact CB-CZ2 3.49Å; H181-W261 VanDerWaalsContact CB-CZ2 3.49Å; G182-W261 VanDerWaalsContact CA-O 3.31Å; G182-W261 WeakPolarHBondContact CA-O 3.33Å; Y193-W261 AromaticContact CD1-CH2 3.93Å; Y193-W261 HydrophobicContact CD1-CH2 3.93Å; Y193-W261 HydrophobicContact CD1-CZ2 4.45Å; Y193-W261 AromaticContact CD2-CH2 3.79Å; Y193-W261 HydrophobicContact CD2-CH2 3.79Å; Y193-W261 HydrophobicContact CD2-CZ2 4.35Å; Y193-W261 AromaticContact CE1-CH2 3.66Å; Y193-W261 HydrophobicContact CE1-CH2 3.66Å; Y193-W261 AromaticContact CE1-CZ2 3.72Å; Y193-W261 HydrophobicContact CE1-CZ2 3.72Å; Y193-W261 AromaticContact CE2-CH2 3.52Å; Y193-W261 HydrophobicContact CE2-CH2 3.52Å; Y193-W261 AromaticContact CE2-CZ2 3.61Å; Y193-W261 HydrophobicContact CE2-CZ2 3.61Å; Y193-W261 HydrophobicContact CG-CH2 4.01Å; Y193-W261 AromaticContact CZ-CH2 3.48Å; Y193-W261 VanDerWaalsContact CZ-CH2 3.48Å; Y193-W261 AromaticContact CZ-CZ2 3.27Å; Y193-W261 WeakPolarHBondContact OH-CZ2 3.4Å; L259-W261 HydrophobicContact CD2-CE3 4.09Å; L259-W261 HydrophobicContact CD2-CZ3 4.44Å; W261-T263 PolarHBondContact O-N 3.11Å; W261-G264 VanDerWaalsContact O-CA 3.28Å; W261-G264 WeakPolarHBondContact O-CA 3.4Å; W261-G264 PolarHBondContact O-N 2.74Å; W261-A265 PolarHBondContact O-N 2.78Å; W261-A265 VanDerWaalsContact O-N 3.11Å; W261-L291 CarbonylContact C-O 3.33Å; W261-L291 WeakPolarHBondContact CA-O 3.24Å; W261-L291 HydrophobicContact CB-CB 3.84Å; W261-L532 HydrophobicContact CB-CD1 4.21Å; W261-L532 HydrophobicContact CB-CD2 3.99Å; W261-L532 HydrophobicContact CD2-CD1 3.54Å; W261-L532 HydrophobicContact CD2-CD2 4.05Å; W261-L532 HydrophobicContact CD2-CG 4.47Å; W261-L532 HydrophobicContact CE3-CD1 4.02Å; W261-L532 HydrophobicContact CE3-CD2 3.86Å; W261-L532 HydrophobicContact CG-CD1 3.6Å; W261-L532 HydrophobicContact CG-CD2 4.12Å; W261-L532 HydrophobicContact CG-CG 4.45Å; W261-L532 HydrophobicContact CZ2-CD1 4.42Å
262	D	96.8	Very high	97	Very high	9 Å²	9	11.8 Å²	11.8	5%	0.048	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	-123.5	175.4	-176.5	44.5	0	0	0	111.8	D183 G264 A265 A266 L291 G292 H528	D183-D262 VanDerWaalsContact CA-OD2 3.25Å; D183-D262 WeakPolarHBondContact CA-OD2 3.44Å; D183-D262 PolarHBondContact N-OD2 2.81Å; D262-G264 PolarHBondContact O-N 2.89Å; D262-A265 WeakPolarHBondContact O-CA 3.47Å; D262-A265 VanDerWaalsContact O-CB 3.32Å; D262-A265 WeakPolarHBondContact O-CB 3.32Å; D262-A265 PolarHBondContact O-N 3.14Å; D262-A266 PolarHBondContact O-N 3.28Å; D262-L291 PolarHBondContact N-O 3.13Å; D262-G292 WeakPolarHBondContact CA-O 3.16Å; D262-H528 IonicContact OD1-CE1 3.69Å; D262-H528 IonicContact OD1-NE2 4Å
263	T	97.8	Very high	96.8	Very high	10 Å²	10	11 Å²	11	6%	0.061	6%	0.063	C	C	.	.	H	α-helix	trans	-54.9	-34.6	173.7	45.5	0	0	0	0	113.8	G182 D183 S184 Y185 W261 A266 L267 W299	G182-T263 VanDerWaalsContact CA-OG1 3.23Å; G182-T263 WeakPolarHBondContact CA-OG1 3.2Å; D183-T263 PolarHBondContact N-OG1 2.83Å; S184-T263 PolarHBondContact N-OG1 2.92Å; Y185-T263 HydrophobicContact CD1-CG2 4.26Å; Y185-T263 HydrophobicContact CD2-CG2 4Å; Y185-T263 HydrophobicContact CE1-CG2 4.08Å; Y185-T263 HydrophobicContact CE2-CG2 3.83Å; Y185-T263 HydrophobicContact CG-CG2 4.21Å; Y185-T263 PolarHBondContact OH-O 3.15Å; W261-T263 PolarHBondContact O-N 3.11Å; T263-A266 WeakPolarHBondContact O-CB 3.44Å; T263-A266 PolarHBondContact O-N 3.39Å; T263-L267 WeakPolarHBondContact O-CG 3.25Å; T263-L267 PolarHBondContact O-N 3.15Å; T263-L267 VanDerWaalsContact O-N 3.11Å; T263-W299 HydrophobicContact CG2-CE3 4.07Å; T263-W299 HydrophobicContact CG2-CZ3 4.1Å
264	G	98.4	Very high	96.7	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-68.6	-34.6	173.2	0	0	0	0	0	113.1	W261 D262 L267 V268	W261-G264 VanDerWaalsContact O-CA 3.28Å; W261-G264 WeakPolarHBondContact O-CA 3.4Å; W261-G264 PolarHBondContact O-N 2.74Å; D262-G264 PolarHBondContact O-N 2.89Å; G264-L267 PolarHBondContact O-N 3.41Å; G264-V268 WeakPolarHBondContact O-CG2 3.21Å; G264-V268 PolarHBondContact O-N 2.93Å
265	A	98.5	Very high	96.5	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-65.9	-40.1	172.4	0	0	0	0	0	110.9	G260 W261 D262 L267 V268 N269 L290 G293	G260-A265 WeakPolarHBondContact O-CB 3.33Å; W261-A265 PolarHBondContact O-N 2.78Å; W261-A265 VanDerWaalsContact O-N 3.11Å; D262-A265 WeakPolarHBondContact O-CA 3.47Å; D262-A265 VanDerWaalsContact O-CB 3.32Å; D262-A265 WeakPolarHBondContact O-CB 3.32Å; D262-A265 PolarHBondContact O-N 3.14Å; A265-L267 VanDerWaalsContact C-N 3.34Å; A265-L267 PolarHBondContact O-N 3.3Å; A265-V268 PolarHBondContact O-N 2.91Å; A265-N269 WeakPolarHBondContact O-CB 3.29Å; A265-N269 PolarHBondContact O-N 3.12Å; A265-L290 HydrophobicContact CB-CB 4.16Å; A265-L290 HydrophobicContact CB-CD2 4.29Å; A265-L290 WeakPolarHBondContact O-CD2 3.46Å; A265-G293 WeakPolarHBondContact CB-O 3.49Å
266	A	98.2	Very high	96.3	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-59.8	-42.4	173.2	0	0	0	0	0	112.1	Y185 D262 T263 N269 L270 S294 W299 A300	Y185-A266 WeakPolarHBondContact OH-CB 3.14Å; D262-A266 PolarHBondContact O-N 3.28Å; T263-A266 WeakPolarHBondContact O-CB 3.44Å; T263-A266 PolarHBondContact O-N 3.39Å; A266-N269 PolarHBondContact O-N 2.9Å; A266-L270 VanDerWaalsContact O-CG 3.31Å; A266-L270 WeakPolarHBondContact O-CG 3.38Å; A266-L270 PolarHBondContact O-N 3.42Å; A266-S294 WeakPolarHBondContact CB-O 3.45Å; A266-W299 HydrophobicContact CB-CZ3 3.93Å; A266-A300 HydrophobicContact CB-CB 3.95Å
267	L	98.4	Very high	96	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-61.1	-46.4	174.2	-61.7	177.1	0	0	0	112.2	I180 Y185 Y211 F218 L232 I235 T263 G264 A265 N269 L270 L271 P367	I180-L267 HydrophobicContact CG2-CD1 4.18Å; Y185-L267 HydrophobicContact CE1-CD1 4.13Å; Y185-L267 HydrophobicContact CE1-CD2 3.7Å; Y185-L267 HydrophobicContact CE1-CG 3.82Å; Y211-L267 HydrophobicContact CE1-CD1 4.44Å; Y211-L267 HydrophobicContact CE2-CD1 3.82Å; F218-L267 HydrophobicContact CE1-CD2 4.32Å; F218-L267 HydrophobicContact CZ-CD2 4.32Å; L232-L267 HydrophobicContact CD1-CD2 4.35Å; L232-L267 HydrophobicContact CD2-CB 4.31Å; L232-L267 HydrophobicContact CD2-CD2 3.89Å; L232-L267 HydrophobicContact CG-CD2 3.89Å; I235-L267 HydrophobicContact CD1-CB 4.25Å; I235-L267 HydrophobicContact CD1-CD1 3.84Å; T263-L267 WeakPolarHBondContact O-CG 3.25Å; T263-L267 PolarHBondContact O-N 3.15Å; T263-L267 VanDerWaalsContact O-N 3.11Å; G264-L267 PolarHBondContact O-N 3.41Å; A265-L267 VanDerWaalsContact C-N 3.34Å; A265-L267 PolarHBondContact O-N 3.3Å; L267-N269 VanDerWaalsContact C-N 3.31Å; L267-N269 PolarHBondContact O-N 3.13Å; L267-L270 PolarHBondContact O-N 2.85Å; L267-L271 WeakPolarHBondContact O-CG 3.42Å; L267-L271 PolarHBondContact O-N 2.84Å; L267-P367 HydrophobicContact CD2-CG 3.73Å
268	V	98.2	Very high	95.5	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-59.6	-45	176.8	172.8	0	0	0	0	110.4	I180 L258 G264 A265 L270 L271 M272 A288 L290	I180-V268 HydrophobicContact CB-CG2 4.15Å; I180-V268 HydrophobicContact CG1-CG2 3.8Å; L258-V268 HydrophobicContact CB-CG1 3.76Å; L258-V268 HydrophobicContact CB-CG2 3.95Å; L258-V268 HydrophobicContact CD1-CG1 4.27Å; L258-V268 HydrophobicContact CD1-CG2 4.41Å; G264-V268 WeakPolarHBondContact O-CG2 3.21Å; G264-V268 PolarHBondContact O-N 2.93Å; A265-V268 PolarHBondContact O-N 2.91Å; V268-L270 PolarHBondContact O-N 3Å; V268-L271 PolarHBondContact O-N 3.23Å; V268-L271 VanDerWaalsContact O-N 3.16Å; V268-M272 WeakPolarHBondContact O-CG 3.42Å; V268-M272 PolarHBondContact O-N 3.02Å; V268-A288 HydrophobicContact CG1-CB 3.81Å; V268-L290 HydrophobicContact CB-CD2 3.8Å; V268-L290 HydrophobicContact CG1-CD2 3.63Å
269	N	97.3	Very high	94.7	Very high	0 Å²	0	11 Å²	11	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-64	-39	179.9	-171.3	-168	0	0	0	112.4	A265 A266 L267 M272 L290 A295	A265-N269 WeakPolarHBondContact O-CB 3.29Å; A265-N269 PolarHBondContact O-N 3.12Å; A266-N269 PolarHBondContact O-N 2.9Å; L267-N269 VanDerWaalsContact C-N 3.31Å; L267-N269 PolarHBondContact O-N 3.13Å; N269-M272 WeakPolarHBondContact O-CB 3.38Å; N269-M272 PolarHBondContact O-N 3.05Å; N269-L290 HydrophobicContact CB-CD1 3.88Å; N269-L290 HydrophobicContact CB-CD2 4.16Å; N269-A295 HydrophobicContact CB-CB 4.01Å; N269-A295 WeakPolarHBondContact OD1-CB 3.29Å; N269-A295 PolarHBondContact OD1-N 2.89Å
270	L	97.1	Very high	93.6	Very high	4 Å²	4	17.9 Å²	17.9	2%	0.021	11%	0.111	C	C	.	.	H	α-helix	trans	-62.8	-41.2	172.3	-70.7	169.3	0	0	0	111.7	L232 A266 L267 V268 M272 S273 S274 A295 L301 P367 V374 P378	L232-L270 HydrophobicContact CD1-CD1 4.4Å; L232-L270 HydrophobicContact CD2-CB 4.21Å; A266-L270 VanDerWaalsContact O-CG 3.31Å; A266-L270 WeakPolarHBondContact O-CG 3.38Å; A266-L270 PolarHBondContact O-N 3.42Å; L267-L270 PolarHBondContact O-N 2.85Å; V268-L270 PolarHBondContact O-N 3Å; L270-M272 VanDerWaalsContact C-N 3.29Å; L270-M272 PolarHBondContact O-N 2.66Å; L270-S273 PolarHBondContact O-N 2.98Å; L270-S273 PolarHBondContact O-OG 2.96Å; L270-S274 WeakPolarHBondContact O-CB 3.38Å; L270-S274 PolarHBondContact O-N 3.2Å; L270-S274 VanDerWaalsContact O-N 3.1Å; L270-A295 HydrophobicContact CD2-CB 3.68Å; L270-A295 HydrophobicContact CG-CB 3.84Å; L270-L301 HydrophobicContact CD1-CD1 4.47Å; L270-L301 HydrophobicContact CD2-CD1 4.25Å; L270-P367 HydrophobicContact CD1-CB 3.61Å; L270-P367 HydrophobicContact CD1-CG 3.7Å; L270-V374 HydrophobicContact CD1-CG2 4.23Å; L270-V374 HydrophobicContact CD2-CG1 4.12Å; L270-V374 HydrophobicContact CD2-CG2 4.08Å; L270-P378 HydrophobicContact CD2-CB 4.4Å; L270-P378 HydrophobicContact CD2-CG 3.72Å
271	L	96.1	Very high	92.4	Very high	1 Å²	1	25 Å²	25	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-66.9	-28.8	177.4	-69.6	172.8	0	0	0	112.8	L232 I235 V236 L258 L267 V268 S273 S274 S277 F285	L232-L271 HydrophobicContact CD2-CD1 4.5Å; L232-L271 HydrophobicContact CD2-CD2 3.93Å; L232-L271 HydrophobicContact CD2-CG 3.87Å; I235-L271 HydrophobicContact CB-CD1 4.15Å; I235-L271 HydrophobicContact CG2-CD1 3.53Å; V236-L271 HydrophobicContact CG2-CD2 3.64Å; L258-L271 HydrophobicContact CD1-CD1 4.39Å; L267-L271 WeakPolarHBondContact O-CG 3.42Å; L267-L271 PolarHBondContact O-N 2.84Å; V268-L271 PolarHBondContact O-N 3.23Å; V268-L271 VanDerWaalsContact O-N 3.16Å; L271-S273 VanDerWaalsContact C-N 3.29Å; L271-S273 PolarHBondContact O-N 3.23Å; L271-S274 PolarHBondContact O-N 3.5Å; L271-S277 WeakPolarHBondContact O-CB 3.3Å; L271-S277 PolarHBondContact O-OG 3.46Å; L271-F285 HydrophobicContact CB-CE1 4.17Å; L271-F285 HydrophobicContact CB-CZ 4.1Å
272	M	94.9	Very high	91.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.8	-38.5	176.3	-67.5	171.3	73	0	0	112.3	V268 N269 L270 R283 F285 A288 L388 F389 I392 L394	V268-M272 WeakPolarHBondContact O-CG 3.42Å; V268-M272 PolarHBondContact O-N 3.02Å; N269-M272 WeakPolarHBondContact O-CB 3.38Å; N269-M272 PolarHBondContact O-N 3.05Å; L270-M272 VanDerWaalsContact C-N 3.29Å; L270-M272 PolarHBondContact O-N 2.66Å; M272-R283 PolarHBondContact O-NH1 3.44Å; M272-F285 HydrophobicContact CG-CE2 3.99Å; M272-F285 HydrophobicContact CG-CZ 4.2Å; M272-A288 HydrophobicContact CE-CB 4.02Å; M272-A288 HydrophobicContact CG-CB 4Å; M272-A288 HydrophobicContact SD-CB 3.55Å; M272-A288 VanDerWaalsContact SD-CB 3.55Å; M272-L388 CarbonylContact O-C 3.34Å; M272-F389 HydrophobicContact CB-CD2 4.04Å; M272-F389 HydrophobicContact CE-CD2 3.46Å; M272-F389 VanDerWaalsContact CE-CD2 3.46Å; M272-F389 HydrophobicContact CE-CE2 3.56Å; M272-F389 HydrophobicContact SD-CD2 4.1Å; M272-F389 HydrophobicContact SD-CE2 4.15Å; M272-I392 HydrophobicContact CB-CD1 3.73Å; M272-I392 HydrophobicContact CE-CB 3.96Å; M272-I392 HydrophobicContact CE-CD1 4.47Å; M272-I392 HydrophobicContact CE-CG2 3.81Å; M272-I392 HydrophobicContact CG-CD1 3.81Å; M272-I392 HydrophobicContact CG-CG2 4.49Å; M272-L394 HydrophobicContact CE-CB 4.39Å; M272-L394 HydrophobicContact CE-CD1 3.97Å; M272-L394 HydrophobicContact CE-CD2 4.46Å; M272-L394 HydrophobicContact CE-CG 4.49Å; M272-L394 HydrophobicContact SD-CD1 4.19Å
273	S	90.9	Very high	91.3	Very high	10 Å²	10	28.1 Å²	28.1	7%	0.07	17%	0.166	C	C	.	.	H	α-helix	trans	-95.3	-6.1	-179.4	57.6	0	0	0	0	113.8	L270 L271	L270-S273 PolarHBondContact O-N 2.98Å; L270-S273 PolarHBondContact O-OG 2.96Å; L271-S273 VanDerWaalsContact C-N 3.29Å; L271-S273 PolarHBondContact O-N 3.23Å
274	S	92.3	Very high	91.1	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.014	17%	0.165	C	C	.	.			trans	-80.2	127.8	-179.4	-171	0	0	0	0	112	L270 L271 I276 S277 V373	L270-S274 WeakPolarHBondContact O-CB 3.38Å; L270-S274 PolarHBondContact O-N 3.2Å; L270-S274 VanDerWaalsContact O-N 3.1Å; L271-S274 PolarHBondContact O-N 3.5Å; S274-I276 PolarHBondContact O-N 3.35Å; S274-I276 VanDerWaalsContact OG-CG2 3.31Å; S274-I276 WeakPolarHBondContact OG-CG2 3.19Å; S274-S277 PolarHBondContact O-N 2.98Å; S274-S277 PolarHBondContact O-OG 3.16Å; S274-V373 WeakPolarHBondContact CB-O 3.4Å; S274-V373 PolarHBondContact OG-O 3.27Å
275	P	89.3	Confident	91	Very high	55 Å²	55	28.1 Å²	28.1	36%	0.357	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-62.2	-26.3	176.2	-24.6	35.5	0	0	0	113.9	S277 A278 N375 L388	P275-S277 PolarHBondContact O-N 3.32Å; P275-A278 CarbonylContact O-C 3.54Å; P275-A278 PolarHBondContact O-N 3.15Å; P275-N375 WeakPolarHBondContact CD-ND2 3.23Å; P275-N375 VanDerWaalsContact CG-ND2 3.3Å; P275-N375 WeakPolarHBondContact CG-ND2 3.31Å; P275-L388 HydrophobicContact CB-CD1 4.43Å; P275-L388 HydrophobicContact CG-CD1 4.09Å
276	I	90.1	Very high	90.8	Very high	48 Å²	48	33.1 Å²	33.1	25%	0.246	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-64.5	-23	-179.6	-154.2	176.5	0	0	0	112.3	V236 S274 A278	V236-I276 HydrophobicContact CG1-CD1 4.32Å; V236-I276 HydrophobicContact CG1-CG1 4.19Å; V236-I276 HydrophobicContact CG1-CG2 4.37Å; V236-I276 HydrophobicContact CG2-CG2 3.73Å; S274-I276 PolarHBondContact O-N 3.35Å; S274-I276 VanDerWaalsContact OG-CG2 3.31Å; S274-I276 WeakPolarHBondContact OG-CG2 3.19Å; I276-A278 VanDerWaalsContact C-N 3.32Å
277	S	90.9	Very high	90.7	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.007	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-85.2	-7.9	176	79.4	0	0	0	0	113.4	L271 S274 P275 P279 R283 L284	L271-S277 WeakPolarHBondContact O-CB 3.3Å; L271-S277 PolarHBondContact O-OG 3.46Å; S274-S277 PolarHBondContact O-N 2.98Å; S274-S277 PolarHBondContact O-OG 3.16Å; P275-S277 PolarHBondContact O-N 3.32Å; S277-P279 WeakPolarHBondContact O-CD 3.27Å; S277-R283 WeakPolarHBondContact O-CG 3.28Å; S277-L284 WeakPolarHBondContact O-CG 3.43Å; S277-L284 PolarHBondContact O-N 2.98Å
278	A	87.4	Confident	90.6	Very high	28 Å²	28	34.2 Å²	34.2	23%	0.231	19%	0.189	C	C	.	.	S	Bend	trans	-122.5	59.7	-179	0	0	0	0	0	111.6	P275 I276 R283 L388	P275-A278 CarbonylContact O-C 3.54Å; P275-A278 PolarHBondContact O-N 3.15Å; I276-A278 VanDerWaalsContact C-N 3.32Å; A278-R283 HydrophobicContact CB-CG 4.3Å; A278-L388 HydrophobicContact CB-CD2 4.1Å
279	P	81.5	Confident	90.6	Very high	50 Å²	50	34.2 Å²	34.2	33%	0.325	19%	0.189	S	C	.	.			trans	-62.4	156.1	176.5	28.7	-33.8	0	0	0	110.8	S277 D281 S282 L284	S277-P279 WeakPolarHBondContact O-CD 3.27Å; P279-D281 PolarHBondContact O-N 2.84Å; P279-S282 WeakPolarHBondContact CD-O 2.89Å; P279-S282 VanDerWaalsContact CG-O 3.3Å; P279-S282 WeakPolarHBondContact CG-O 3.3Å; P279-S282 CarbonylContact O-C 3.44Å; P279-S282 PolarHBondContact O-N 3.26Å; P279-S282 VanDerWaalsContact O-N 3.13Å; P279-L284 HydrophobicContact CG-CD2 4.21Å; P279-L284 HydrophobicContact CG-CG 4.49Å
280	V	75.3	Confident	90.7	Very high	148 Å²	148	34.2 Å²	34.2	90%	0.897	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.2	-36.7	-171.2	-177.7	0	0	0	0	113.4
281	D	72.5	Confident	90.7	Very high	148 Å²	148	34.2 Å²	34.2	79%	0.791	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-43	-175.4	-63.5	-32.1	0	0	0	113.3	P279	P279-D281 PolarHBondContact O-N 2.84Å
282	S	81.8	Confident	90.8	Very high	45 Å²	45	34.3 Å²	34.3	32%	0.315	19%	0.19	S	C	.	.			trans	-175.7	152.7	167.4	80.8	0	0	0	0	110.5	R243 P279	R243-S282 PolarHBondContact NH1-O 2.86Å; R243-S282 PolarHBondContact NH1-OG 3.35Å; R243-S282 PolarHBondContact NH2-OG 3.4Å; P279-S282 WeakPolarHBondContact CD-O 2.89Å; P279-S282 VanDerWaalsContact CG-O 3.3Å; P279-S282 WeakPolarHBondContact CG-O 3.3Å; P279-S282 CarbonylContact O-C 3.44Å; P279-S282 PolarHBondContact O-N 3.26Å; P279-S282 VanDerWaalsContact O-N 3.13Å
283	R	90.1	Very high	90.9	Very high	40 Å²	40	34.3 Å²	34.3	15%	0.151	19%	0.19	C	C	.	.			trans	-53.8	146.5	168.1	-163.1	178.1	-76.4	-95.9	10.1	112.8	M272 S277 A278 F285 L388 E391	M272-R283 PolarHBondContact O-NH1 3.44Å; S277-R283 WeakPolarHBondContact O-CG 3.28Å; A278-R283 HydrophobicContact CB-CG 4.3Å; R283-F285 WeakPolarHBondContact CD-O 3.47Å; R283-F285 WeakPolarHBondContact CG-O 3.33Å; R283-L388 VanDerWaalsContact CZ-O 3.25Å; R283-L388 PolarHBondContact NH1-O 2.83Å; R283-L388 VanDerWaalsContact NH2-CA 3.33Å; R283-L388 PolarHBondContact NH2-O 3.43Å; R283-E391 IonicContact CZ-OE2 3.36Å; R283-E391 IonicContact NE-OE2 3.65Å; R283-E391 IonicContact NH2-OE2 2.72Å; R283-E391 PolarHBondContact NH2-OE2 3.22Å
284	L	94.3	Very high	91.2	Very high	5 Å²	5	33.8 Å²	33.8	3%	0.026	19%	0.187	C	C	.	.	S	Bend	trans	-76.2	-23.2	-179.5	-61.5	-176.8	0	0	0	113.6	V236 L239 D240 S277 P279	V236-L284 HydrophobicContact CG1-CD1 4.05Å; L239-L284 HydrophobicContact CB-CB 4.24Å; L239-L284 HydrophobicContact CB-CD1 4.01Å; L239-L284 HydrophobicContact CD1-CB 4.36Å; D240-L284 WeakPolarHBondContact OD1-CD2 3.46Å; S277-L284 WeakPolarHBondContact O-CG 3.43Å; S277-L284 PolarHBondContact O-N 2.98Å; P279-L284 HydrophobicContact CG-CD2 4.21Å; P279-L284 HydrophobicContact CG-CG 4.49Å
285	F	95.9	Very high	91.4	Very high	5 Å²	5	34 Å²	34	2%	0.022	19%	0.188	C	C	.	.			trans	-150.3	152.5	177	63	-84.9	0	0	0	111.2	L239 V256 L258 L271 M272 R283 R287 I392	L239-F285 HydrophobicContact CD1-CD1 4.17Å; V256-F285 HydrophobicContact CB-CB 4.12Å; V256-F285 HydrophobicContact CG1-CB 3.92Å; V256-F285 WeakPolarHBondContact O-CA 3.34Å; V256-F285 WeakPolarHBondContact O-CB 3.21Å; L258-F285 HydrophobicContact CD1-CD1 3.59Å; L258-F285 HydrophobicContact CD1-CD2 3.91Å; L258-F285 HydrophobicContact CD1-CE1 3.54Å; L258-F285 HydrophobicContact CD1-CE2 3.84Å; L258-F285 HydrophobicContact CD1-CG 3.77Å; L258-F285 HydrophobicContact CD1-CZ 3.67Å; L258-F285 HydrophobicContact CD2-CB 4.24Å; L258-F285 HydrophobicContact CD2-CG 4.32Å; L258-F285 HydrophobicContact CG-CB 4Å; L258-F285 HydrophobicContact CG-CD1 3.99Å; L258-F285 HydrophobicContact CG-CD2 3.77Å; L258-F285 HydrophobicContact CG-CE1 4.37Å; L258-F285 HydrophobicContact CG-CE2 4.15Å; L258-F285 HydrophobicContact CG-CG 3.66Å; L258-F285 HydrophobicContact CG-CZ 4.45Å; L271-F285 HydrophobicContact CB-CE1 4.17Å; L271-F285 HydrophobicContact CB-CZ 4.1Å; M272-F285 HydrophobicContact CG-CE2 3.99Å; M272-F285 HydrophobicContact CG-CZ 4.2Å; R283-F285 WeakPolarHBondContact CD-O 3.47Å; R283-F285 WeakPolarHBondContact CG-O 3.33Å; F285-R287 WeakPolarHBondContact CD2-O 3.34Å; F285-I392 HydrophobicContact CD2-CD1 4.3Å; F285-I392 HydrophobicContact CE2-CD1 3.6Å; F285-I392 HydrophobicContact CE2-CG1 4.47Å; F285-I392 HydrophobicContact CE2-CG2 4.33Å; F285-I392 HydrophobicContact CZ-CD1 4.03Å
286	R	93.2	Very high	91.8	Very high	106 Å²	106	33.1 Å²	33.1	40%	0.4	18%	0.18	S	C	.	.	S	Bend	trans	-108	-19.9	-175.3	-176	59.8	-170.6	-142.3	11	113.4	V256 I392 D393	V256-R286 PolarHBondContact O-N 3.06Å; R286-I392 WeakPolarHBondContact O-CA 3.18Å; R286-D393 PolarHBondContact O-N 3.29Å; R286-D393 VanDerWaalsContact O-N 3.09Å
287	R	96.1	Very high	92.1	Very high	22 Å²	22	31 Å²	31	8%	0.083	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	154.4	-177	-45.9	-164.9	177.3	95	-1.1	112	V256 T257 L258 F285 D393 F575 V576 K577 S578	V256-R287 PolarHBondContact O-N 3.35Å; T257-R287 WeakPolarHBondContact CA-O 3.41Å; T257-R287 HydrophobicContact CG2-CB 3.79Å; L258-R287 PolarHBondContact N-O 3.33Å; F285-R287 WeakPolarHBondContact CD2-O 3.34Å; R287-D393 CarbonylContact C-O 3.54Å; R287-D393 VanDerWaalsContact CA-O 3.22Å; R287-D393 WeakPolarHBondContact CA-O 3.28Å; R287-D393 HydrophobicContact CB-CB 4.19Å; R287-D393 HydrophobicContact CG-CB 3.81Å; R287-D393 IonicContact CZ-OD2 3.65Å; R287-D393 IonicContact NE-OD2 2.89Å; R287-D393 PolarHBondContact NE-OD2 3.25Å; R287-F575 HydrophobicContact CB-CE1 3.85Å; R287-F575 HydrophobicContact CB-CZ 4.1Å; R287-F575 WeakPolarHBondContact CD-O 3.47Å; R287-F575 PolarHBondContact NE-O 3.25Å; R287-V576 PolarHBondContact NH1-O 3.41Å; R287-K577 PolarHBondContact NH1-O 3.44Å; R287-K577 PolarHBondContact NH2-O 3.49Å; R287-S578 PolarHBondContact NH2-O 2.63Å
288	A	98	Very high	92.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	141.9	177.6	0	0	0	0	0	111.3	L258 V268 M272 I392 D393 L394 L395	L258-A288 CarbonylContact O-C 3.44Å; L258-A288 VanDerWaalsContact O-CA 3.32Å; L258-A288 WeakPolarHBondContact O-CA 3.41Å; V268-A288 HydrophobicContact CG1-CB 3.81Å; M272-A288 HydrophobicContact CE-CB 4.02Å; M272-A288 HydrophobicContact CG-CB 4Å; M272-A288 HydrophobicContact SD-CB 3.55Å; M272-A288 VanDerWaalsContact SD-CB 3.55Å; A288-I392 HydrophobicContact CB-CG2 3.92Å; A288-D393 PolarHBondContact N-O 3.41Å; A288-L394 HydrophobicContact CB-CD1 4.22Å; A288-L394 WeakPolarHBondContact O-CA 3.39Å; A288-L395 PolarHBondContact O-N 2.8Å
289	I	98.3	Very high	92.6	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	117.8	172.8	-53	175.1	0	0	0	107.4	L177 T257 L258 L259 G260 L291 L395 I572 F575 V576	L177-I289 HydrophobicContact CD1-CD1 4.38Å; T257-I289 HydrophobicContact CG2-CD1 4.04Å; T257-I289 HydrophobicContact CG2-CG1 4.02Å; L258-I289 PolarHBondContact O-N 3.41Å; L259-I289 WeakPolarHBondContact CA-O 3.38Å; L259-I289 HydrophobicContact CB-CB 3.98Å; L259-I289 HydrophobicContact CB-CD1 4.34Å; L259-I289 HydrophobicContact CD1-CB 4.24Å; L259-I289 HydrophobicContact CD1-CD1 3.98Å; L259-I289 HydrophobicContact CD1-CG2 4.05Å; L259-I289 HydrophobicContact CG-CB 3.95Å; L259-I289 HydrophobicContact CG-CD1 4.49Å; L259-I289 HydrophobicContact CG-CG2 4.02Å; G260-I289 PolarHBondContact N-O 3.23Å; I289-L291 HydrophobicContact CG2-CD2 3.85Å; I289-L291 HydrophobicContact CG2-CG 4.15Å; I289-L395 CarbonylContact C-O 3.51Å; I289-L395 VanDerWaalsContact CA-O 3.24Å; I289-L395 WeakPolarHBondContact CA-O 3.42Å; I289-L395 HydrophobicContact CD1-CD2 4.37Å; I289-L395 HydrophobicContact CG1-CB 4.21Å; I289-L395 HydrophobicContact CG1-CD2 4.27Å; I289-L395 HydrophobicContact CG2-CB 4.42Å; I289-L395 HydrophobicContact CG2-CD2 4.1Å; I289-L395 HydrophobicContact CG2-CG 4.25Å; I289-I572 HydrophobicContact CD1-CD1 4.1Å; I289-I572 HydrophobicContact CD1-CG2 4.08Å; I289-I572 HydrophobicContact CG2-CD1 4.41Å; I289-F575 HydrophobicContact CD1-CD1 3.84Å; I289-F575 HydrophobicContact CD1-CE1 4.2Å; I289-F575 HydrophobicContact CG1-CD1 3.74Å; I289-F575 HydrophobicContact CG1-CE1 3.58Å; I289-V576 HydrophobicContact CD1-CG2 4.31Å
290	L	98.4	Very high	93.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	117.7	-179.6	-52.1	-176.5	0	0	0	109.3	A265 V268 N269 L394 L395 V396 G397 V481	A265-L290 HydrophobicContact CB-CB 4.16Å; A265-L290 HydrophobicContact CB-CD2 4.29Å; A265-L290 WeakPolarHBondContact O-CD2 3.46Å; V268-L290 HydrophobicContact CB-CD2 3.8Å; V268-L290 HydrophobicContact CG1-CD2 3.63Å; N269-L290 HydrophobicContact CB-CD1 3.88Å; N269-L290 HydrophobicContact CB-CD2 4.16Å; L290-L394 HydrophobicContact CD1-CD1 3.8Å; L290-L394 HydrophobicContact CG-CD1 3.78Å; L290-L395 PolarHBondContact N-O 2.83Å; L290-V396 HydrophobicContact CB-CG2 4.35Å; L290-V396 CarbonylContact O-C 3.48Å; L290-V396 VanDerWaalsContact O-CA 3.31Å; L290-V396 WeakPolarHBondContact O-CA 3.43Å; L290-G397 PolarHBondContact O-N 3.2Å; L290-V481 HydrophobicContact CD1-CG1 4.41Å
291	L	98.1	Very high	94.4	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.021	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	116.2	-178.8	-54.4	179	0	0	0	110	L259 G260 W261 D262 I289 G293 G397 Y509 L532 I535	L259-L291 HydrophobicContact CD1-CD1 4.38Å; L259-L291 HydrophobicContact CD2-CD1 4.08Å; L259-L291 HydrophobicContact CG-CD1 4.3Å; G260-L291 PolarHBondContact O-N 3.3Å; W261-L291 CarbonylContact C-O 3.33Å; W261-L291 WeakPolarHBondContact CA-O 3.24Å; W261-L291 HydrophobicContact CB-CB 3.84Å; D262-L291 PolarHBondContact N-O 3.13Å; I289-L291 HydrophobicContact CG2-CD2 3.85Å; I289-L291 HydrophobicContact CG2-CG 4.15Å; L291-G293 VanDerWaalsContact C-N 3.28Å; L291-G293 PolarHBondContact O-N 2.86Å; L291-G397 WeakPolarHBondContact CA-O 3.22Å; L291-Y509 HydrophobicContact CD2-CE1 3.9Å; L291-Y509 WeakPolarHBondContact CD2-OH 3.36Å; L291-L532 HydrophobicContact CD1-CD2 3.48Å; L291-L532 VanDerWaalsContact CD1-CD2 3.48Å; L291-I535 HydrophobicContact CD1-CD1 3.44Å; L291-I535 VanDerWaalsContact CD1-CD1 3.44Å; L291-I535 HydrophobicContact CD2-CD1 4.37Å
292	G	97.1	Very high	95.5	Very high	3 Å²	3	17.8 Å²	17.8	3%	0.031	9%	0.089	C	C	.	.	S	Bend	trans	56.7	36.1	174.1	0	0	0	0	0	114.3	D262 G397 E402 Y474	D262-G292 WeakPolarHBondContact CA-O 3.16Å; G292-G397 PolarHBondContact N-O 2.92Å; G292-E402 VanDerWaalsContact CA-OE1 3.23Å; G292-E402 WeakPolarHBondContact CA-OE1 3.46Å; G292-Y474 WeakPolarHBondContact O-CD1 3.35Å; G292-Y474 WeakPolarHBondContact O-CE1 3.41Å
293	G	97.1	Very high	95.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.098	C	C	.	.			trans	-178.2	151.4	-178.3	0	0	0	0	0	115.1	A265 L291 L478	A265-G293 WeakPolarHBondContact CB-O 3.49Å; L291-G293 VanDerWaalsContact C-N 3.28Å; L291-G293 PolarHBondContact O-N 2.86Å; G293-L478 WeakPolarHBondContact O-CD2 3.44Å
294	S	97.5	Very high	95.7	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.106	C	C	.	.			trans	-151.9	169.5	176.7	69.6	0	0	0	0	112.7	A266 L296 S297 A300 P477	A266-S294 WeakPolarHBondContact CB-O 3.45Å; S294-L296 PolarHBondContact O-N 3.5Å; S294-L296 PolarHBondContact OG-N 3.25Å; S294-S297 PolarHBondContact N-OG 3.37Å; S294-S297 WeakPolarHBondContact O-CB 3.3Å; S294-S297 PolarHBondContact O-N 3.42Å; S294-S297 PolarHBondContact OG-N 2.8Å; S294-S297 PolarHBondContact OG-OG 3.18Å; S294-A300 WeakPolarHBondContact O-CB 3.25Å; S294-P477 WeakPolarHBondContact OG-CB 3.21Å
295	A	97	Very high	95.7	Very high	5 Å²	5	20.8 Å²	20.8	4%	0.041	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-11.2	172.1	0	0	0	0	0	113.7	N269 L270 P378	N269-A295 HydrophobicContact CB-CB 4.01Å; N269-A295 WeakPolarHBondContact OD1-CB 3.29Å; N269-A295 PolarHBondContact OD1-N 2.89Å; L270-A295 HydrophobicContact CD2-CB 3.68Å; L270-A295 HydrophobicContact CG-CB 3.84Å; A295-P378 HydrophobicContact CB-CB 3.97Å; A295-P378 HydrophobicContact CB-CG 4.37Å
296	L	96.5	Very high	95.6	Very high	37 Å²	37	23 Å²	23	19%	0.194	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-4.3	178.7	-58.5	-171.4	0	0	0	113.2	S294 P378 A379 L382 P477 K480 V481	S294-L296 PolarHBondContact O-N 3.5Å; S294-L296 PolarHBondContact OG-N 3.25Å; L296-P378 HydrophobicContact CD2-CB 4.02Å; L296-A379 HydrophobicContact CD2-CB 3.9Å; L296-L382 HydrophobicContact CD1-CD1 4.22Å; L296-L382 HydrophobicContact CD2-CD1 4.09Å; L296-L382 HydrophobicContact CG-CD1 4.11Å; L296-P477 HydrophobicContact CB-CB 4.03Å; L296-K480 HydrophobicContact CD1-CB 4.15Å; L296-K480 HydrophobicContact CD1-CD 3.93Å; L296-K480 HydrophobicContact CD1-CG 3.86Å; L296-V481 HydrophobicContact CB-CG2 4.43Å; L296-V481 HydrophobicContact CD1-CG2 3.66Å; L296-V481 HydrophobicContact CG-CG2 3.83Å
297	S	96.9	Very high	95.5	Very high	5 Å²	5	20.9 Å²	20.9	4%	0.035	12%	0.123	C	C	.	.	S	Bend	trans	-68.8	144.1	175.2	-66	0	0	0	0	110	S294 W299 A300 L473	S294-S297 PolarHBondContact N-OG 3.37Å; S294-S297 WeakPolarHBondContact O-CB 3.3Å; S294-S297 PolarHBondContact O-N 3.42Å; S294-S297 PolarHBondContact OG-N 2.8Å; S294-S297 PolarHBondContact OG-OG 3.18Å; S297-W299 VanDerWaalsContact CB-CZ2 3.43Å; S297-W299 PolarHBondContact O-N 3.3Å; S297-W299 VanDerWaalsContact O-N 3.12Å; S297-W299 WeakPolarHBondContact OG-CZ2 3.41Å; S297-A300 WeakPolarHBondContact O-CB 3.35Å; S297-A300 PolarHBondContact O-N 3.22Å; S297-L473 PolarHBondContact OG-O 3.44Å; S297-L473 VanDerWaalsContact OG-O 3.12Å
298	S	94.5	Very high	95.4	Very high	32 Å²	32	20.5 Å²	20.5	22%	0.224	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-29.4	-175.1	57.9	0	0	0	0	114.6	A300 F361 L362 M432 L473	S298-A300 VanDerWaalsContact C-N 3.34Å; S298-F361 PolarHBondContact OG-O 3.46Å; S298-L362 VanDerWaalsContact O-CD2 3.31Å; S298-L362 WeakPolarHBondContact O-CD2 3.45Å; S298-M432 WeakPolarHBondContact CB-SD 3.26Å; S298-L473 VanDerWaalsContact OG-CD2 3.27Å; S298-L473 WeakPolarHBondContact OG-CD2 3.47Å
299	W	95.4	Very high	95.4	Very high	18 Å²	18	20.5 Å²	20.5	7%	0.068	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	1	179.7	44.6	-103	0	0	0	113.1	T263 A266 S297 T363 L473 Y474	T263-W299 HydrophobicContact CG2-CE3 4.07Å; T263-W299 HydrophobicContact CG2-CZ3 4.1Å; A266-W299 HydrophobicContact CB-CZ3 3.93Å; S297-W299 VanDerWaalsContact CB-CZ2 3.43Å; S297-W299 PolarHBondContact O-N 3.3Å; S297-W299 VanDerWaalsContact O-N 3.12Å; S297-W299 WeakPolarHBondContact OG-CZ2 3.41Å; W299-T363 VanDerWaalsContact O-CG2 3.22Å; W299-T363 WeakPolarHBondContact O-CG2 3.41Å; W299-L473 PolarHBondContact NE1-O 3.1Å; W299-Y474 AromaticContact CZ2-CD1 3.85Å; W299-Y474 HydrophobicContact CZ2-CD1 3.85Å; W299-Y474 AromaticContact CZ2-CE1 3.6Å; W299-Y474 HydrophobicContact CZ2-CE1 3.6Å
300	A	97.6	Very high	95.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	-75.6	-33.3	-177.6	0	0	0	0	0	113.3	Y185 A266 S294 S297 S298 P367	Y185-A300 PolarHBondContact OH-O 2.67Å; A266-A300 HydrophobicContact CB-CB 3.95Å; S294-A300 WeakPolarHBondContact O-CB 3.25Å; S297-A300 WeakPolarHBondContact O-CB 3.35Å; S297-A300 PolarHBondContact O-N 3.22Å; S298-A300 VanDerWaalsContact C-N 3.34Å; A300-P367 VanDerWaalsContact O-CD 3.26Å; A300-P367 WeakPolarHBondContact O-CD 3.45Å; A300-P367 WeakPolarHBondContact O-CG 3.15Å
301	L	95.9	Very high	95.1	Very high	33 Å²	33	26.6 Å²	26.6	17%	0.173	15%	0.148	C	C	.	.	S	Bend	trans	-122.4	147.1	-178.7	-88.7	70.3	0	0	0	111.6	L270 P367 I369 P378	L270-L301 HydrophobicContact CD1-CD1 4.47Å; L270-L301 HydrophobicContact CD2-CD1 4.25Å; L301-P367 CarbonylContact C-O 3.56Å; L301-P367 VanDerWaalsContact CA-O 3.3Å; L301-P367 WeakPolarHBondContact CA-O 3.33Å; L301-P367 HydrophobicContact CD1-CB 4.49Å; L301-I369 HydrophobicContact CD2-CD1 4.29Å; L301-I369 HydrophobicContact CD2-CG1 3.85Å; L301-P378 HydrophobicContact CD1-CG 3.91Å; L301-P378 HydrophobicContact CD2-CG 4Å
302	V	94.8	Very high	95.1	Very high	13 Å²	13	26.4 Å²	26.4	8%	0.079	15%	0.147	C	C	.	.			trans	-81.9	131.7	170.4	-178.5	0	0	0	0	109.6	P305 Y308 T363 N364 G366 P367 V368	V302-P305 HydrophobicContact CG1-CB 4.23Å; V302-Y308 HydrophobicContact CG1-CD2 4.02Å; V302-Y308 HydrophobicContact CG1-CE2 3.92Å; V302-T363 HydrophobicContact CG2-CG2 3.78Å; V302-N364 WeakPolarHBondContact CG2-O 3.32Å; V302-G366 VanDerWaalsContact CG2-N 3.25Å; V302-P367 PolarHBondContact N-O 3.23Å; V302-V368 HydrophobicContact CB-CG1 3.98Å; V302-V368 HydrophobicContact CG2-CG1 4.48Å
303	T	87.2	Confident	95.1	Very high	82 Å²	82	26.2 Å²	26.2	50%	0.503	15%	0.146	S	C	.	.	S	Bend	trans	-85.6	-27.7	-179.5	49.1	0	0	0	0	114
304	S	89.4	Confident	95.1	Very high	47 Å²	47	31.8 Å²	31.8	33%	0.329	18%	0.176	S	C	.	.			trans	-139.5	65.3	-175.1	-55.6	0	0	0	0	112.1	S306 E307 Y308	S304-S306 VanDerWaalsContact C-N 3.33Å; S304-S306 PolarHBondContact O-N 3.34Å; S304-E307 PolarHBondContact O-N 3.47Å; S304-Y308 VanDerWaalsContact O-CD2 3.29Å; S304-Y308 WeakPolarHBondContact O-CD2 3.32Å
305	P	93.8	Very high	95	Very high	25 Å²	25	34.1 Å²	34.1	16%	0.162	20%	0.199	C	C	.	.	H	α-helix	trans	-61.7	-37.9	-174.4	23.5	-33.3	0	0	0	113.7	S220 V302 E307 Y308 F309 V368	S220-P305 CarbonylContact O-C 3.5Å; S220-P305 VanDerWaalsContact O-C 3.32Å; S220-P305 VanDerWaalsContact O-O 3.04Å; V302-P305 HydrophobicContact CG1-CB 4.23Å; P305-E307 VanDerWaalsContact C-N 3.27Å; P305-E307 PolarHBondContact O-N 2.79Å; P305-Y308 PolarHBondContact O-N 3.48Å; P305-F309 PolarHBondContact O-N 2.9Å; P305-V368 HydrophobicContact CB-CG1 3.75Å; P305-V368 HydrophobicContact CG-CG1 3.9Å
306	S	93.8	Very high	95	Very high	52 Å²	52	35.2 Å²	35.2	36%	0.364	20%	0.204	S	C	.	.	H	α-helix	trans	-59.1	-36.7	179.4	56.9	0	0	0	0	112.9	S221 S304 F309 Y310	S221-S306 VanDerWaalsContact O-CB 3.24Å; S221-S306 WeakPolarHBondContact O-CB 3.35Å; S304-S306 VanDerWaalsContact C-N 3.33Å; S304-S306 PolarHBondContact O-N 3.34Å; S306-F309 WeakPolarHBondContact O-CB 3.49Å; S306-F309 PolarHBondContact O-N 2.69Å; S306-Y310 WeakPolarHBondContact O-CD2 3.46Å; S306-Y310 PolarHBondContact O-N 3.02Å
307	E	92.2	Very high	95	Very high	60 Å²	60	36.7 Å²	36.7	28%	0.28	23%	0.228	S	C	.	.	H	α-helix	trans	-62.5	-48.8	178.1	-179.2	172.8	-173.8	0	0	110.9	S304 P305 F309 Y310 Q311 P645	S304-E307 PolarHBondContact O-N 3.47Å; P305-E307 VanDerWaalsContact C-N 3.27Å; P305-E307 PolarHBondContact O-N 2.79Å; E307-F309 VanDerWaalsContact C-N 3.3Å; E307-F309 PolarHBondContact O-N 3.02Å; E307-Y310 PolarHBondContact O-N 3.02Å; E307-Q311 HydrophobicContact CG-CG 4.41Å; E307-Q311 VanDerWaalsContact CG-NE2 3.33Å; E307-Q311 WeakPolarHBondContact O-CB 3.36Å; E307-Q311 VanDerWaalsContact O-CG 3.28Å; E307-Q311 WeakPolarHBondContact O-CG 3.43Å; E307-Q311 PolarHBondContact O-N 2.81Å; E307-Q311 PolarHBondContact OE1-NE2 2.83Å; E307-P645 VanDerWaalsContact OE1-CG 3.32Å; E307-P645 WeakPolarHBondContact OE1-CG 3.2Å
308	Y	94.8	Very high	95	Very high	14 Å²	14	36.8 Å²	36.8	6%	0.055	23%	0.229	C	C	.	.	H	α-helix	trans	-66.1	-33.1	177.8	-60	-66.7	0	0	0	112.4	V302 S304 P305 L312 L356 P359 N364	V302-Y308 HydrophobicContact CG1-CD2 4.02Å; V302-Y308 HydrophobicContact CG1-CE2 3.92Å; S304-Y308 VanDerWaalsContact O-CD2 3.29Å; S304-Y308 WeakPolarHBondContact O-CD2 3.32Å; P305-Y308 PolarHBondContact O-N 3.48Å; Y308-L312 VanDerWaalsContact O-CB 3.23Å; Y308-L312 WeakPolarHBondContact O-CB 3.44Å; Y308-L312 PolarHBondContact O-N 3.29Å; Y308-L356 HydrophobicContact CD1-CD1 4.27Å; Y308-P359 VanDerWaalsContact OH-CD 3.24Å; Y308-P359 WeakPolarHBondContact OH-CD 3.22Å; Y308-P359 WeakPolarHBondContact OH-CG 3.33Å; Y308-N364 HydrophobicContact CD1-CB 3.99Å; Y308-N364 HydrophobicContact CD2-CB 4.42Å; Y308-N364 WeakPolarHBondContact CD2-O 3.47Å; Y308-N364 HydrophobicContact CE1-CB 3.6Å; Y308-N364 HydrophobicContact CE2-CB 4.08Å; Y308-N364 HydrophobicContact CG-CB 4.37Å
309	F	96.7	Very high	95	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.6	-50.5	173.7	177.7	-89.6	0	0	0	112	L219 S220 C226 P305 S306 E307 L312 A313 V334 V337 L338 I341	L219-F309 HydrophobicContact CD1-CB 4.27Å; L219-F309 HydrophobicContact CD1-CD2 3.77Å; L219-F309 HydrophobicContact CD1-CG 4.47Å; L219-F309 HydrophobicContact CD2-CD2 4.23Å; L219-F309 HydrophobicContact CD2-CE2 4.37Å; L219-F309 HydrophobicContact CG-CD2 3.95Å; S220-F309 WeakPolarHBondContact O-CB 3.5Å; C226-F309 HydrophobicContact CB-CE2 4.44Å; P305-F309 PolarHBondContact O-N 2.9Å; S306-F309 WeakPolarHBondContact O-CB 3.49Å; S306-F309 PolarHBondContact O-N 2.69Å; E307-F309 VanDerWaalsContact C-N 3.3Å; E307-F309 PolarHBondContact O-N 3.02Å; F309-L312 PolarHBondContact O-N 3.35Å; F309-A313 PolarHBondContact O-N 3.43Å; F309-V334 HydrophobicContact CE1-CG1 4.45Å; F309-V334 HydrophobicContact CZ-CG1 4.1Å; F309-V337 HydrophobicContact CE1-CB 4.1Å; F309-V337 HydrophobicContact CE1-CG1 3.68Å; F309-V337 HydrophobicContact CZ-CB 4.2Å; F309-V337 HydrophobicContact CZ-CG1 3.94Å; F309-L338 HydrophobicContact CE2-CD1 4.28Å; F309-L338 HydrophobicContact CZ-CB 4.4Å; F309-I341 HydrophobicContact CD2-CD1 4.34Å; F309-I341 HydrophobicContact CE2-CD1 3.86Å; F309-I341 HydrophobicContact CZ-CD1 4.01Å
310	Y	95.8	Very high	95	Very high	58 Å²	58	41.4 Å²	41.4	23%	0.227	25%	0.248	C	C	.	.	H	α-helix	trans	-73.7	-34	-179.3	-70	-64.8	0	0	0	112.9	S306 E307 L312 A313 D314 I320	S306-Y310 WeakPolarHBondContact O-CD2 3.46Å; S306-Y310 PolarHBondContact O-N 3.02Å; E307-Y310 PolarHBondContact O-N 3.02Å; Y310-L312 VanDerWaalsContact C-N 3.32Å; Y310-L312 PolarHBondContact O-N 3.32Å; Y310-A313 PolarHBondContact O-N 2.97Å; Y310-D314 WeakPolarHBondContact O-CB 3.36Å; Y310-D314 PolarHBondContact O-N 3.45Å; Y310-I320 HydrophobicContact CD1-CD1 4.44Å; Y310-I320 HydrophobicContact CD1-CG1 4.37Å; Y310-I320 HydrophobicContact CD1-CG2 3.7Å; Y310-I320 HydrophobicContact CE1-CG2 4.03Å; Y310-I320 WeakPolarHBondContact O-CD1 3.16Å
311	Q	95.5	Very high	94.8	Very high	70 Å²	70	47 Å²	47	33%	0.327	27%	0.27	S	S	.	.	H	α-helix	trans	-64.5	-37.4	172	-71.2	179	9.2	0	0	111.9	E307 G315 L356	E307-Q311 HydrophobicContact CG-CG 4.41Å; E307-Q311 VanDerWaalsContact CG-NE2 3.33Å; E307-Q311 WeakPolarHBondContact O-CB 3.36Å; E307-Q311 VanDerWaalsContact O-CG 3.28Å; E307-Q311 WeakPolarHBondContact O-CG 3.43Å; E307-Q311 PolarHBondContact O-N 2.81Å; E307-Q311 PolarHBondContact OE1-NE2 2.83Å; Q311-G315 PolarHBondContact O-N 3.28Å; Q311-L356 HydrophobicContact CB-CD1 4.38Å; Q311-L356 HydrophobicContact CB-CD2 3.62Å
312	L	97.2	Very high	94.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-47.5	172.9	178.6	68.5	0	0	0	111.1	V215 L219 Y308 F309 Y310 D314 G315 L316 I341 A352 A353 L356	V215-L312 HydrophobicContact CG2-CD2 3.43Å; V215-L312 VanDerWaalsContact CG2-CD2 3.43Å; L219-L312 HydrophobicContact CD1-CD2 3.76Å; L219-L312 HydrophobicContact CD2-CD2 4.1Å; Y308-L312 VanDerWaalsContact O-CB 3.23Å; Y308-L312 WeakPolarHBondContact O-CB 3.44Å; Y308-L312 PolarHBondContact O-N 3.29Å; F309-L312 PolarHBondContact O-N 3.35Å; Y310-L312 VanDerWaalsContact C-N 3.32Å; Y310-L312 PolarHBondContact O-N 3.32Å; L312-D314 VanDerWaalsContact C-N 3.32Å; L312-D314 PolarHBondContact O-N 2.91Å; L312-G315 PolarHBondContact O-N 3.3Å; L312-L316 HydrophobicContact CD1-CD1 4.2Å; L312-L316 HydrophobicContact CD1-CG 4.47Å; L312-L316 HydrophobicContact CG-CD1 4.07Å; L312-L316 WeakPolarHBondContact O-CG 3.22Å; L312-L316 PolarHBondContact O-N 2.75Å; L312-I341 HydrophobicContact CD2-CD1 4.5Å; L312-I341 HydrophobicContact CD2-CG2 4.12Å; L312-A352 HydrophobicContact CD1-CB 3.78Å; L312-A353 HydrophobicContact CD1-CB 4.08Å; L312-L356 HydrophobicContact CB-CD1 4.27Å
313	A	97.6	Very high	94	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-57.2	-46.1	178	0	0	0	0	0	111.6	F309 Y310 L316 G317 C318 I320 V337 I341	F309-A313 PolarHBondContact O-N 3.43Å; Y310-A313 PolarHBondContact O-N 2.97Å; A313-L316 PolarHBondContact O-N 2.95Å; A313-G317 PolarHBondContact O-N 2.86Å; A313-C318 HydrophobicContact CB-CB 4.1Å; A313-C318 WeakPolarHBondContact O-CB 3.41Å; A313-C318 PolarHBondContact O-N 3.16Å; A313-I320 HydrophobicContact CB-CD1 4.05Å; A313-I320 HydrophobicContact CB-CG1 4.03Å; A313-V337 HydrophobicContact CB-CG1 3.55Å; A313-I341 HydrophobicContact CB-CD1 4.14Å; A313-I341 HydrophobicContact CB-CG1 4.46Å
314	D	96.3	Very high	93.9	Very high	117 Å²	117	54.9 Å²	54.9	63%	0.626	30%	0.3	S	S	*	.	H	α-helix	trans	-62.5	-43.8	176.9	-171.4	57.1	0	0	0	111.2	Y310 L312 L316 G317 I320	Y310-D314 WeakPolarHBondContact O-CB 3.36Å; Y310-D314 PolarHBondContact O-N 3.45Å; L312-D314 VanDerWaalsContact C-N 3.32Å; L312-D314 PolarHBondContact O-N 2.91Å; D314-L316 PolarHBondContact O-N 3.48Å; D314-G317 PolarHBondContact O-N 3.34Å; D314-I320 HydrophobicContact CB-CD1 3.83Å
315	G	96.1	Very high	93.6	Very high	48 Å²	48	62.2 Å²	62.2	50%	0.495	33%	0.328	S	S	.	.	H	α-helix	trans	-63.5	-22.1	176.4	0	0	0	0	0	114.8	Q311 L312	Q311-G315 PolarHBondContact O-N 3.28Å; L312-G315 PolarHBondContact O-N 3.3Å
316	L	97.5	Very high	93.3	Very high	28 Å²	28	69.5 Å²	69.5	15%	0.147	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-4.5	173.3	-65.3	171.7	0	0	0	112.8	L312 A313 D314 C318 I341 N348 I349 A352	L312-L316 HydrophobicContact CD1-CD1 4.2Å; L312-L316 HydrophobicContact CD1-CG 4.47Å; L312-L316 HydrophobicContact CG-CD1 4.07Å; L312-L316 WeakPolarHBondContact O-CG 3.22Å; L312-L316 PolarHBondContact O-N 2.75Å; A313-L316 PolarHBondContact O-N 2.95Å; D314-L316 PolarHBondContact O-N 3.48Å; L316-C318 VanDerWaalsContact C-N 3.28Å; L316-I341 HydrophobicContact CD1-CB 4.38Å; L316-I341 HydrophobicContact CD1-CG1 4.2Å; L316-I341 HydrophobicContact CD1-CG2 3.92Å; L316-N348 HydrophobicContact CD2-CB 4.1Å; L316-I349 HydrophobicContact CD1-CG1 4.03Å; L316-I349 HydrophobicContact CD2-CG1 4.37Å; L316-A352 HydrophobicContact CD2-CB 3.58Å; L316-A352 HydrophobicContact CG-CB 3.89Å
317	G	96.5	Very high	92.8	Very high	68 Å²	68	69.3 Å²	69.3	70%	0.701	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	20.5	-175.5	0	0	0	0	0	113.6	A313 D314	A313-G317 PolarHBondContact O-N 2.86Å; D314-G317 PolarHBondContact O-N 3.34Å
318	C	96.8	Very high	92.4	Very high	8 Å²	8	72.5 Å²	72.5	5%	0.054	38%	0.379	C	S	.	.			trans	-68.7	140.6	172.9	-69.8	0	0	0	0	110.5	A313 L316 I320 C340	A313-C318 HydrophobicContact CB-CB 4.1Å; A313-C318 WeakPolarHBondContact O-CB 3.41Å; A313-C318 PolarHBondContact O-N 3.16Å; L316-C318 VanDerWaalsContact C-N 3.28Å; C318-I320 PolarHBondContact O-N 2.77Å; C318-C340 WeakPolarHBondContact CA-SG 3.44Å; C318-C340 HydrophobicContact CB-CB 3.81Å; C318-C340 WeakPolarHBondContact CB-SG 3.46Å; C318-C340 WeakPolarHBondContact SG-CB 2.94Å; C318-C340 CovalentContact SG-SG 2.04Å; C318-C340 PolarHBondContact SG-SG 3.15Å
319	Q	94.7	Very high	91.9	Very high	130 Å²	130	77.9 Å²	77.9	61%	0.607	40%	0.404	S	S	*	.			trans	-70.1	122.4	174.7	-165.2	-179.9	-7	0	0	109.3	Y321 L332	Q319-Y321 WeakPolarHBondContact CG-O 3.48Å; Q319-Y321 PolarHBondContact NE2-O 3.42Å; Q319-L332 HydrophobicContact CB-CD1 3.82Å; Q319-L332 HydrophobicContact CG-CD1 3.56Å; Q319-L332 WeakPolarHBondContact O-CD1 3.42Å
320	I	94.7	Very high	91.5	Very high	16 Å²	16	80.7 Å²	80.7	8%	0.082	42%	0.421	C	S	.	.			trans	-101.6	-27.3	178.1	-62.2	168.1	0	0	0	111.4	Y310 A313 D314 C318 L331 L332	Y310-I320 HydrophobicContact CD1-CD1 4.44Å; Y310-I320 HydrophobicContact CD1-CG1 4.37Å; Y310-I320 HydrophobicContact CD1-CG2 3.7Å; Y310-I320 HydrophobicContact CE1-CG2 4.03Å; Y310-I320 WeakPolarHBondContact O-CD1 3.16Å; A313-I320 HydrophobicContact CB-CD1 4.05Å; A313-I320 HydrophobicContact CB-CG1 4.03Å; D314-I320 HydrophobicContact CB-CD1 3.83Å; C318-I320 PolarHBondContact O-N 2.77Å; I320-L331 HydrophobicContact CG2-CD2 3.62Å; I320-L332 PolarHBondContact O-N 3.38Å
321	Y	93	Very high	91.2	Very high	118 Å²	118	82.1 Å²	82.1	46%	0.463	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	134.5	-177.8	-58.2	-81.2	0	0	0	111.8	Q319 Q329 T330 L331	Q319-Y321 WeakPolarHBondContact CG-O 3.48Å; Q319-Y321 PolarHBondContact NE2-O 3.42Å; Y321-Q329 HydrophobicContact CD1-CB 4.22Å; Y321-Q329 HydrophobicContact CG-CB 4.34Å; Y321-T330 CarbonylContact C-O 3.58Å; Y321-T330 VanDerWaalsContact CA-O 3.27Å; Y321-T330 WeakPolarHBondContact CA-O 3.46Å; Y321-L331 HydrophobicContact CD1-CD2 3.81Å; Y321-L331 HydrophobicContact CD1-CG 4.39Å; Y321-L331 HydrophobicContact CE1-CD2 3.37Å; Y321-L331 HydrophobicContact CE1-CG 4.09Å
322	K	89.8	Confident	91	Very high	103 Å²	103	80.2 Å²	80.2	45%	0.448	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	138.1	163.9	66.7	-172.3	177.1	-172.1	0	109.8	T330 L332	K322-T330 WeakPolarHBondContact CE-OG1 3.36Å; K322-T330 WeakPolarHBondContact CG-OG1 3.14Å; K322-T330 PolarHBondContact N-O 3.25Å; K322-T330 PolarHBondContact O-N 3.19Å; K322-T330 PolarHBondContact O-OG1 3.16Å; K322-L332 HydrophobicContact CB-CD2 4.17Å; K322-L332 HydrophobicContact CB-CG 4.08Å; K322-L332 HydrophobicContact CD-CD2 4.41Å
323	Q	85.7	Confident	90.8	Very high	137 Å²	137	82.1 Å²	82.1	64%	0.64	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	131.5	170.8	-71.7	-178.4	-18.8	0	0	109.3	Q328 Q329	Q323-Q328 WeakPolarHBondContact CA-O 3.42Å; Q323-Q329 HydrophobicContact CG-CG 4.02Å
324	N	83.4	Confident	90.7	Very high	54 Å²	54	82.8 Å²	82.8	29%	0.289	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-78.7	173.9	167.8	69.8	11.8	0	0	0	110.7	F326 G327 Q328	N324-F326 PolarHBondContact O-N 3.34Å; N324-F326 WeakPolarHBondContact OD1-CA 3.48Å; N324-F326 WeakPolarHBondContact OD1-CB 3.4Å; N324-F326 PolarHBondContact OD1-N 3.45Å; N324-G327 PolarHBondContact O-N 3.32Å; N324-G327 PolarHBondContact OD1-N 3.38Å; N324-Q328 PolarHBondContact N-O 3.1Å; N324-Q328 PolarHBondContact ND2-OE1 3.4Å; N324-Q328 PolarHBondContact OD1-N 3.41Å; N324-Q328 PolarHBondContact OD1-O 2.65Å
325	H	84.5	Confident	90.7	Very high	200 Å²	200	81.5 Å²	81.5	93%	0.926	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-15.7	178.3	-68.3	-62.6	0	0	0	114.5
326	F	86.8	Confident	90.6	Very high	179 Å²	179	83 Å²	83	79%	0.785	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	3.4	177.5	-58	-74.6	0	0	0	113.5	N324 Q328	N324-F326 PolarHBondContact O-N 3.34Å; N324-F326 WeakPolarHBondContact OD1-CA 3.48Å; N324-F326 WeakPolarHBondContact OD1-CB 3.4Å; N324-F326 PolarHBondContact OD1-N 3.45Å; F326-Q328 VanDerWaalsContact C-N 3.26Å; F326-Q328 PolarHBondContact O-N 3.01Å
327	G	83.4	Confident	90.6	Very high	47 Å²	47	81.7 Å²	81.7	49%	0.485	42%	0.424	S	S	.	.	S	Bend	trans	77.1	4.8	-177.7	0	0	0	0	0	114.7	N324	N324-G327 PolarHBondContact O-N 3.32Å; N324-G327 PolarHBondContact OD1-N 3.38Å
328	Q	84.1	Confident	90.6	Very high	128 Å²	128	79 Å²	79	60%	0.598	39%	0.394	S	S	*	.			trans	-76.1	132.3	173.4	-62.2	175	-41.8	0	0	109.7	Q323 N324 F326	Q323-Q328 WeakPolarHBondContact CA-O 3.42Å; N324-Q328 PolarHBondContact N-O 3.1Å; N324-Q328 PolarHBondContact ND2-OE1 3.4Å; N324-Q328 PolarHBondContact OD1-N 3.41Å; N324-Q328 PolarHBondContact OD1-O 2.65Å; F326-Q328 VanDerWaalsContact C-N 3.26Å; F326-Q328 PolarHBondContact O-N 3.01Å
329	Q	84.5	Confident	90.5	Very high	127 Å²	127	84.4 Å²	84.4	59%	0.593	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	129.1	175	-73.8	178.7	-21.8	0	0	110.1	Y321 Q323	Y321-Q329 HydrophobicContact CD1-CB 4.22Å; Y321-Q329 HydrophobicContact CG-CB 4.34Å; Q323-Q329 HydrophobicContact CG-CG 4.02Å
330	T	87.9	Confident	90.6	Very high	58 Å²	58	80.3 Å²	80.3	36%	0.356	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	148.5	171.4	53.6	0	0	0	0	108.1	Y321 K322	Y321-T330 CarbonylContact C-O 3.58Å; Y321-T330 VanDerWaalsContact CA-O 3.27Å; Y321-T330 WeakPolarHBondContact CA-O 3.46Å; K322-T330 WeakPolarHBondContact CE-OG1 3.36Å; K322-T330 WeakPolarHBondContact CG-OG1 3.14Å; K322-T330 PolarHBondContact N-O 3.25Å; K322-T330 PolarHBondContact O-N 3.19Å; K322-T330 PolarHBondContact O-OG1 3.16Å
331	L	89	Confident	90.7	Very high	88 Å²	88	79.6 Å²	79.6	46%	0.461	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	140.7	176	-70.4	170	0	0	0	110.2	I320 Y321	I320-L331 HydrophobicContact CG2-CD2 3.62Å; Y321-L331 HydrophobicContact CD1-CD2 3.81Å; Y321-L331 HydrophobicContact CD1-CG 4.39Å; Y321-L331 HydrophobicContact CE1-CD2 3.37Å; Y321-L331 HydrophobicContact CE1-CG 4.09Å
332	L	92.2	Very high	90.9	Very high	30 Å²	30	75.2 Å²	75.2	16%	0.157	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-66.8	162.6	166.4	-84.8	148	0	0	0	110.3	Q319 I320 K322 D336 V337	Q319-L332 HydrophobicContact CB-CD1 3.82Å; Q319-L332 HydrophobicContact CG-CD1 3.56Å; Q319-L332 WeakPolarHBondContact O-CD1 3.42Å; I320-L332 PolarHBondContact O-N 3.38Å; K322-L332 HydrophobicContact CB-CD2 4.17Å; K322-L332 HydrophobicContact CB-CG 4.08Å; K322-L332 HydrophobicContact CD-CD2 4.41Å; L332-D336 HydrophobicContact CD2-CB 4.26Å; L332-V337 HydrophobicContact CB-CG2 3.96Å
333	A	93.3	Very high	91.1	Very high	40 Å²	40	75.5 Å²	75.5	33%	0.331	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-67.6	148	173.9	0	0	0	0	0	109.1	E335 D336 V337	A333-E335 VanDerWaalsContact CB-OE2 3.25Å; A333-E335 WeakPolarHBondContact CB-OE2 3.4Å; A333-E335 PolarHBondContact O-N 3.09Å; A333-D336 WeakPolarHBondContact CB-OD2 3.42Å; A333-D336 PolarHBondContact O-N 3.39Å; A333-D336 VanDerWaalsContact O-N 3.15Å; A333-V337 PolarHBondContact O-N 3.3Å
334	V	94.9	Very high	91.6	Very high	14 Å²	14	70.9 Å²	70.9	9%	0.085	37%	0.374	C	S	.	.	H	α-helix	trans	-61.8	-33.3	-177.3	171.8	0	0	0	0	110.6	S221 D223 T225 C226 F309 V337 L338	S221-V334 WeakPolarHBondContact OG-CG1 3.2Å; D223-V334 HydrophobicContact CB-CB 4.49Å; D223-V334 HydrophobicContact CB-CG1 4.4Å; D223-V334 HydrophobicContact CB-CG2 3.98Å; T225-V334 HydrophobicContact CG2-CG1 4.27Å; C226-V334 HydrophobicContact CB-CG1 4.37Å; F309-V334 HydrophobicContact CE1-CG1 4.45Å; F309-V334 HydrophobicContact CZ-CG1 4.1Å; V334-V337 PolarHBondContact O-N 2.79Å; V334-L338 WeakPolarHBondContact O-CB 3.42Å; V334-L338 PolarHBondContact O-N 2.79Å
335	E	95.1	Very high	92.2	Very high	90 Å²	90	70.5 Å²	70.5	42%	0.421	38%	0.376	S	S	.	.	H	α-helix	trans	-56.4	-48.8	175.2	-61.1	68.6	-158.1	0	0	111.5	T225 A333 V337 L338 E339	T225-E335 WeakPolarHBondContact CB-OE1 3.23Å; T225-E335 HydrophobicContact CG2-CB 4.32Å; T225-E335 HydrophobicContact CG2-CG 3.61Å; T225-E335 WeakPolarHBondContact CG2-OE1 3.19Å; T225-E335 PolarHBondContact OG1-OE1 3.38Å; A333-E335 VanDerWaalsContact CB-OE2 3.25Å; A333-E335 WeakPolarHBondContact CB-OE2 3.4Å; A333-E335 PolarHBondContact O-N 3.09Å; E335-V337 PolarHBondContact O-N 3.19Å; E335-L338 PolarHBondContact O-N 3.48Å; E335-E339 WeakPolarHBondContact O-CB 3.41Å; E335-E339 PolarHBondContact O-N 2.91Å
336	D	95.5	Very high	92.8	Very high	81 Å²	81	62.3 Å²	62.3	43%	0.433	34%	0.339	S	S	.	.	H	α-helix	trans	-65.4	-42	-177.4	-59.4	-39.4	0	0	0	110.9	L332 A333 C340	L332-D336 HydrophobicContact CD2-CB 4.26Å; A333-D336 WeakPolarHBondContact CB-OD2 3.42Å; A333-D336 PolarHBondContact O-N 3.39Å; A333-D336 VanDerWaalsContact O-N 3.15Å; D336-C340 PolarHBondContact O-N 2.46Å
337	V	96.6	Very high	93.2	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-68.2	-42	177.8	-176.9	0	0	0	0	110.4	F309 A313 L332 A333 V334 E335 C340 I341	F309-V337 HydrophobicContact CE1-CB 4.1Å; F309-V337 HydrophobicContact CE1-CG1 3.68Å; F309-V337 HydrophobicContact CZ-CB 4.2Å; F309-V337 HydrophobicContact CZ-CG1 3.94Å; A313-V337 HydrophobicContact CB-CG1 3.55Å; L332-V337 HydrophobicContact CB-CG2 3.96Å; A333-V337 PolarHBondContact O-N 3.3Å; V334-V337 PolarHBondContact O-N 2.79Å; E335-V337 PolarHBondContact O-N 3.19Å; V337-C340 WeakPolarHBondContact O-CB 3.33Å; V337-C340 PolarHBondContact O-N 3.45Å; V337-I341 HydrophobicContact CG1-CD1 4.31Å; V337-I341 WeakPolarHBondContact O-CG1 3.47Å; V337-I341 PolarHBondContact O-N 3.3Å; V337-I341 VanDerWaalsContact O-N 3.11Å
338	L	96.3	Very high	93.9	Very high	12 Å²	12	60.3 Å²	60.3	6%	0.063	32%	0.322	C	S	.	.	H	α-helix	trans	-63.5	-42.7	177.9	179.3	66.3	0	0	0	111.7	F71 T225 C226 F309 V334 E335 C340 I341 Q342	F71-L338 HydrophobicContact CB-CD1 4.33Å; F71-L338 HydrophobicContact CD2-CD1 3.85Å; F71-L338 HydrophobicContact CG-CD1 4.41Å; T225-L338 HydrophobicContact CG2-CD2 4.3Å; C226-L338 HydrophobicContact CB-CD1 4.33Å; C226-L338 HydrophobicContact CB-CD2 4.08Å; F309-L338 HydrophobicContact CE2-CD1 4.28Å; F309-L338 HydrophobicContact CZ-CB 4.4Å; V334-L338 WeakPolarHBondContact O-CB 3.42Å; V334-L338 PolarHBondContact O-N 2.79Å; E335-L338 PolarHBondContact O-N 3.48Å; L338-C340 VanDerWaalsContact C-N 3.29Å; L338-C340 PolarHBondContact O-N 2.93Å; L338-I341 PolarHBondContact O-N 3.31Å; L338-I341 VanDerWaalsContact O-N 3.17Å; L338-Q342 HydrophobicContact CD1-CG 4.27Å; L338-Q342 HydrophobicContact CG-CG 4.24Å; L338-Q342 WeakPolarHBondContact O-CB 3.32Å; L338-Q342 WeakPolarHBondContact O-CG 3.47Å; L338-Q342 PolarHBondContact O-N 3.08Å
339	E	95.8	Very high	94.5	Very high	121 Å²	121	54.2 Å²	54.2	57%	0.565	29%	0.293	S	S	*	.	H	α-helix	trans	-59.3	-42.5	176.8	-175.5	174.5	-173.4	0	0	110.8	E335 I341 Q342 T343	E335-E339 WeakPolarHBondContact O-CB 3.41Å; E335-E339 PolarHBondContact O-N 2.91Å; E339-I341 PolarHBondContact O-N 2.79Å; E339-Q342 PolarHBondContact O-N 3.21Å; E339-T343 WeakPolarHBondContact O-CG2 3.13Å; E339-T343 PolarHBondContact O-N 3.35Å; E339-T343 PolarHBondContact O-OG1 2.81Å
340	C	96.4	Very high	95	Very high	44 Å²	44	49.5 Å²	49.5	30%	0.297	27%	0.273	S	S	.	.	H	α-helix	trans	-57.4	-49.8	173	179.1	0	0	0	0	111.9	C318 D336 V337 L338 Q342 T343 D344	C318-C340 WeakPolarHBondContact CA-SG 3.44Å; C318-C340 HydrophobicContact CB-CB 3.81Å; C318-C340 WeakPolarHBondContact CB-SG 3.46Å; C318-C340 WeakPolarHBondContact SG-CB 2.94Å; C318-C340 CovalentContact SG-SG 2.04Å; C318-C340 PolarHBondContact SG-SG 3.15Å; D336-C340 PolarHBondContact O-N 2.46Å; V337-C340 WeakPolarHBondContact O-CB 3.33Å; V337-C340 PolarHBondContact O-N 3.45Å; L338-C340 VanDerWaalsContact C-N 3.29Å; L338-C340 PolarHBondContact O-N 2.93Å; C340-Q342 VanDerWaalsContact C-N 3.32Å; C340-Q342 PolarHBondContact O-N 3.13Å; C340-T343 PolarHBondContact O-N 3.4Å; C340-T343 PolarHBondContact O-OG1 3.35Å; C340-D344 PolarHBondContact O-N 3.41Å
341	I	97	Very high	95.4	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.6	-39.5	177.8	-58.2	168.1	0	0	0	111.1	F71 L219 F309 L312 A313 L316 V337 L338 E339 T343 D344 I349	F71-I341 HydrophobicContact CE2-CG2 3.71Å; F71-I341 HydrophobicContact CZ-CG2 3.99Å; L219-I341 HydrophobicContact CD2-CD1 4.44Å; L219-I341 HydrophobicContact CD2-CG2 4.22Å; F309-I341 HydrophobicContact CD2-CD1 4.34Å; F309-I341 HydrophobicContact CE2-CD1 3.86Å; F309-I341 HydrophobicContact CZ-CD1 4.01Å; L312-I341 HydrophobicContact CD2-CD1 4.5Å; L312-I341 HydrophobicContact CD2-CG2 4.12Å; A313-I341 HydrophobicContact CB-CD1 4.14Å; A313-I341 HydrophobicContact CB-CG1 4.46Å; L316-I341 HydrophobicContact CD1-CB 4.38Å; L316-I341 HydrophobicContact CD1-CG1 4.2Å; L316-I341 HydrophobicContact CD1-CG2 3.92Å; V337-I341 HydrophobicContact CG1-CD1 4.31Å; V337-I341 WeakPolarHBondContact O-CG1 3.47Å; V337-I341 PolarHBondContact O-N 3.3Å; V337-I341 VanDerWaalsContact O-N 3.11Å; L338-I341 PolarHBondContact O-N 3.31Å; L338-I341 VanDerWaalsContact O-N 3.17Å; E339-I341 PolarHBondContact O-N 2.79Å; I341-T343 VanDerWaalsContact C-N 3.32Å; I341-T343 PolarHBondContact O-N 2.73Å; I341-D344 PolarHBondContact O-N 2.98Å; I341-I349 VanDerWaalsContact O-CD1 3.27Å; I341-I349 WeakPolarHBondContact O-CD1 3.31Å
342	Q	96.1	Very high	95.7	Very high	27 Å²	27	50 Å²	50	13%	0.126	26%	0.264	C	S	.	.	H	α-helix	trans	-66	-32	-179.6	-78.5	176.7	-23.7	0	0	113.2	R70 F71 L338 E339 C340	R70-Q342 PolarHBondContact NH1-O 2.92Å; R70-Q342 PolarHBondContact O-NE2 3.31Å; F71-Q342 HydrophobicContact CD2-CG 3.61Å; F71-Q342 HydrophobicContact CE2-CG 4.01Å; L338-Q342 HydrophobicContact CD1-CG 4.27Å; L338-Q342 HydrophobicContact CG-CG 4.24Å; L338-Q342 WeakPolarHBondContact O-CB 3.32Å; L338-Q342 WeakPolarHBondContact O-CG 3.47Å; L338-Q342 PolarHBondContact O-N 3.08Å; E339-Q342 PolarHBondContact O-N 3.21Å; C340-Q342 VanDerWaalsContact C-N 3.32Å; C340-Q342 PolarHBondContact O-N 3.13Å
343	T	94.9	Very high	95.9	Very high	109 Å²	109	48.6 Å²	48.6	67%	0.669	26%	0.256	S	S	*	.	H	α-helix	trans	-81.1	-16.7	-178.4	56.5	0	0	0	0	114.1	E339 C340 I341	E339-T343 WeakPolarHBondContact O-CG2 3.13Å; E339-T343 PolarHBondContact O-N 3.35Å; E339-T343 PolarHBondContact O-OG1 2.81Å; C340-T343 PolarHBondContact O-N 3.4Å; C340-T343 PolarHBondContact O-OG1 3.35Å; I341-T343 VanDerWaalsContact C-N 3.32Å; I341-T343 PolarHBondContact O-N 2.73Å
344	D	96	Very high	95.9	Very high	40 Å²	40	48 Å²	48	21%	0.214	25%	0.251	C	S	.	.	S	Bend	trans	-72.4	161.4	178.3	-150.1	-33.1	0	0	0	112.2	R70 C340 I341 N348 I349	R70-D344 PolarHBondContact NH1-O 3.31Å; C340-D344 PolarHBondContact O-N 3.41Å; I341-D344 PolarHBondContact O-N 2.98Å; D344-N348 VanDerWaalsContact OD1-CB 3.24Å; D344-N348 WeakPolarHBondContact OD1-CB 3.45Å; D344-N348 PolarHBondContact OD1-ND2 2.89Å; D344-I349 HydrophobicContact CB-CD1 4.34Å; D344-I349 HydrophobicContact CB-CG1 4.15Å
345	S	96.6	Very high	95.8	Very high	46 Å²	46	51.8 Å²	51.8	32%	0.322	27%	0.27	S	S	.	.			trans	-67.1	150.9	175.2	65.2	0	0	0	0	112.4	E347 N348 I349	S345-E347 PolarHBondContact O-N 3.13Å; S345-N348 PolarHBondContact O-N 3.13Å; S345-N348 VanDerWaalsContact OG-CB 3.31Å; S345-N348 WeakPolarHBondContact OG-CB 3.45Å; S345-N348 PolarHBondContact OG-N 3.05Å; S345-N348 PolarHBondContact OG-ND2 2.92Å; S345-N348 VanDerWaalsContact OG-ND2 3.14Å; S345-I349 WeakPolarHBondContact O-CG1 3.39Å; S345-I349 PolarHBondContact O-N 3.47Å; S345-I349 VanDerWaalsContact O-N 3.08Å
346	V	96.2	Very high	95.7	Very high	27 Å²	27	48.7 Å²	48.7	16%	0.164	26%	0.256	C	S	.	.	H	α-helix	trans	-57.6	-40.3	176.2	177.3	0	0	0	0	110.8	V95 E134 F216 I349 T350	V95-V346 HydrophobicContact CB-CG1 4.35Å; V95-V346 HydrophobicContact CG1-CG1 3.9Å; V95-V346 HydrophobicContact CG2-CG1 3.6Å; E134-V346 VanDerWaalsContact CD-CG2 3.44Å; E134-V346 HydrophobicContact CG-CG1 4.46Å; E134-V346 HydrophobicContact CG-CG2 3.67Å; E134-V346 WeakPolarHBondContact OE2-CG2 3.4Å; F216-V346 HydrophobicContact CE2-CG1 4.34Å; F216-V346 HydrophobicContact CZ-CB 4.4Å; F216-V346 HydrophobicContact CZ-CG1 3.81Å; V346-I349 PolarHBondContact O-N 3.09Å; V346-T350 WeakPolarHBondContact O-CB 3.49Å; V346-T350 PolarHBondContact O-N 3.07Å; V346-T350 PolarHBondContact O-OG1 3.34Å
347	E	95.5	Very high	95.5	Very high	124 Å²	124	50 Å²	50	58%	0.579	26%	0.264	S	S	*	.	H	α-helix	trans	-66.1	-41.3	-177.6	-64.5	71.4	-157.1	0	0	112	S345 R351	S345-E347 PolarHBondContact O-N 3.13Å; E347-R351 VanDerWaalsContact O-CB 3.29Å; E347-R351 WeakPolarHBondContact O-CB 3.23Å; E347-R351 PolarHBondContact O-N 3.36Å
348	N	97	Very high	95.2	Very high	60 Å²	60	53.5 Å²	53.5	32%	0.321	28%	0.282	S	S	.	.	H	α-helix	trans	-69.8	-44.8	177.6	-73.1	-15.8	0	0	0	111.3	L316 D344 S345 T350 R351 A352	L316-N348 HydrophobicContact CD2-CB 4.1Å; D344-N348 VanDerWaalsContact OD1-CB 3.24Å; D344-N348 WeakPolarHBondContact OD1-CB 3.45Å; D344-N348 PolarHBondContact OD1-ND2 2.89Å; S345-N348 PolarHBondContact O-N 3.13Å; S345-N348 VanDerWaalsContact OG-CB 3.31Å; S345-N348 WeakPolarHBondContact OG-CB 3.45Å; S345-N348 PolarHBondContact OG-N 3.05Å; S345-N348 PolarHBondContact OG-ND2 2.92Å; S345-N348 VanDerWaalsContact OG-ND2 3.14Å; N348-T350 VanDerWaalsContact C-N 3.34Å; N348-T350 PolarHBondContact O-N 3.23Å; N348-R351 PolarHBondContact O-N 3.03Å; N348-R351 VanDerWaalsContact O-N 3.17Å; N348-R351 PolarHBondContact OD1-NH1 3.44Å; N348-R351 VanDerWaalsContact OD1-NH1 3.08Å; N348-A352 WeakPolarHBondContact O-CB 3.3Å; N348-A352 PolarHBondContact O-N 3.14Å
349	I	97.5	Very high	95	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-57.6	-48.6	176	-66.9	167.9	0	0	0	110.5	V215 F216 L316 I341 D344 S345 V346 R351 A352 A353	V215-I349 HydrophobicContact CG1-CG2 3.67Å; V215-I349 HydrophobicContact CG2-CG2 4.13Å; F216-I349 HydrophobicContact CE1-CD1 4.42Å; F216-I349 HydrophobicContact CE1-CG2 4.21Å; F216-I349 HydrophobicContact CE2-CG2 4.24Å; F216-I349 HydrophobicContact CZ-CB 4.09Å; F216-I349 HydrophobicContact CZ-CG2 3.73Å; L316-I349 HydrophobicContact CD1-CG1 4.03Å; L316-I349 HydrophobicContact CD2-CG1 4.37Å; I341-I349 VanDerWaalsContact O-CD1 3.27Å; I341-I349 WeakPolarHBondContact O-CD1 3.31Å; D344-I349 HydrophobicContact CB-CD1 4.34Å; D344-I349 HydrophobicContact CB-CG1 4.15Å; S345-I349 WeakPolarHBondContact O-CG1 3.39Å; S345-I349 PolarHBondContact O-N 3.47Å; S345-I349 VanDerWaalsContact O-N 3.08Å; V346-I349 PolarHBondContact O-N 3.09Å; I349-R351 VanDerWaalsContact C-N 3.34Å; I349-R351 PolarHBondContact O-N 3.43Å; I349-A352 PolarHBondContact O-N 2.93Å; I349-A353 VanDerWaalsContact O-CB 3.24Å; I349-A353 WeakPolarHBondContact O-CB 3.47Å; I349-A353 PolarHBondContact O-N 2.95Å
350	T	96	Very high	94.9	Very high	28 Å²	28	48.3 Å²	48.3	17%	0.172	26%	0.259	C	S	.	.	H	α-helix	trans	-62.1	-41.1	177.6	-60.5	0	0	0	0	111.6	V95 L97 V346 N348 A354	V95-T350 HydrophobicContact CG1-CG2 4.44Å; V95-T350 VanDerWaalsContact CG1-OG1 3.3Å; V95-T350 WeakPolarHBondContact CG1-OG1 3.25Å; L97-T350 HydrophobicContact CD1-CG2 4.06Å; L97-T350 WeakPolarHBondContact CD1-O 3.37Å; V346-T350 WeakPolarHBondContact O-CB 3.49Å; V346-T350 PolarHBondContact O-N 3.07Å; V346-T350 PolarHBondContact O-OG1 3.34Å; N348-T350 VanDerWaalsContact C-N 3.34Å; N348-T350 PolarHBondContact O-N 3.23Å; T350-A354 VanDerWaalsContact O-CB 3.26Å; T350-A354 WeakPolarHBondContact O-CB 3.31Å; T350-A354 PolarHBondContact O-N 2.97Å
351	R	95	Very high	94.8	Very high	153 Å²	153	46.7 Å²	46.7	58%	0.577	25%	0.247	S	C	*	.	H	α-helix	trans	-66.1	-42.5	178.3	-171.8	-174.7	-61.8	125.3	3.7	112.2	E347 N348 I349 A354 L355	E347-R351 VanDerWaalsContact O-CB 3.29Å; E347-R351 WeakPolarHBondContact O-CB 3.23Å; E347-R351 PolarHBondContact O-N 3.36Å; N348-R351 PolarHBondContact O-N 3.03Å; N348-R351 VanDerWaalsContact O-N 3.17Å; N348-R351 PolarHBondContact OD1-NH1 3.44Å; N348-R351 VanDerWaalsContact OD1-NH1 3.08Å; I349-R351 VanDerWaalsContact C-N 3.34Å; I349-R351 PolarHBondContact O-N 3.43Å; R351-A354 PolarHBondContact O-N 3.41Å; R351-L355 PolarHBondContact O-N 3.17Å
352	A	96.3	Very high	94.7	Very high	5 Å²	5	47.6 Å²	47.6	4%	0.041	25%	0.251	C	S	.	.	H	α-helix	trans	-67	-47.6	177.2	0	0	0	0	0	111.1	L312 L316 N348 I349 A354 L355	L312-A352 HydrophobicContact CD1-CB 3.78Å; L316-A352 HydrophobicContact CD2-CB 3.58Å; L316-A352 HydrophobicContact CG-CB 3.89Å; N348-A352 WeakPolarHBondContact O-CB 3.3Å; N348-A352 PolarHBondContact O-N 3.14Å; I349-A352 PolarHBondContact O-N 2.93Å; A352-A354 PolarHBondContact O-N 3.4Å; A352-L355 VanDerWaalsContact O-CB 3.29Å; A352-L355 WeakPolarHBondContact O-CB 3.19Å; A352-L355 PolarHBondContact O-N 3.22Å
353	A	96.4	Very high	94.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.2	-35.5	174.4	0	0	0	0	0	112	L97 V215 L312 I349 L355 L356 F365	L97-A353 HydrophobicContact CD1-CB 4.18Å; L97-A353 HydrophobicContact CD2-CB 4.25Å; V215-A353 HydrophobicContact CB-CB 3.99Å; V215-A353 HydrophobicContact CG1-CB 3.93Å; V215-A353 HydrophobicContact CG2-CB 4.5Å; L312-A353 HydrophobicContact CD1-CB 4.08Å; I349-A353 VanDerWaalsContact O-CB 3.24Å; I349-A353 WeakPolarHBondContact O-CB 3.47Å; I349-A353 PolarHBondContact O-N 2.95Å; A353-L355 PolarHBondContact O-N 2.85Å; A353-L356 PolarHBondContact O-N 3.13Å; A353-F365 HydrophobicContact CB-CE2 3.94Å; A353-F365 HydrophobicContact CB-CZ 4.13Å
354	A	93.6	Very high	94.5	Very high	26 Å²	26	42 Å²	42	22%	0.215	22%	0.219	C	C	.	.	H	α-helix	trans	-67.5	-22.8	178	0	0	0	0	0	112.2	L97 R100 T350 R351 A352 L356	L97-A354 HydrophobicContact CD1-CB 3.61Å; R100-A354 WeakPolarHBondContact CD-O 3.39Å; R100-A354 PolarHBondContact NE-O 2.74Å; R100-A354 PolarHBondContact NH2-O 2.94Å; T350-A354 VanDerWaalsContact O-CB 3.26Å; T350-A354 WeakPolarHBondContact O-CB 3.31Å; T350-A354 PolarHBondContact O-N 2.97Å; R351-A354 PolarHBondContact O-N 3.41Å; A352-A354 PolarHBondContact O-N 3.4Å; A354-L356 VanDerWaalsContact C-N 3.3Å
355	L	92.8	Very high	94.5	Very high	95 Å²	95	40.2 Å²	40.2	50%	0.497	21%	0.209	S	C	.	.	H	α-helix	trans	-72.2	-20.9	175.6	-73.3	158.1	0	0	0	113.5	R100 R351 A352 A353	R100-L355 VanDerWaalsContact CZ-CD2 3.47Å; R100-L355 VanDerWaalsContact NH1-CD2 3.33Å; R351-L355 PolarHBondContact O-N 3.17Å; A352-L355 VanDerWaalsContact O-CB 3.29Å; A352-L355 WeakPolarHBondContact O-CB 3.19Å; A352-L355 PolarHBondContact O-N 3.22Å; A353-L355 PolarHBondContact O-N 2.85Å
356	L	93.1	Very high	94.5	Very high	24 Å²	24	38 Å²	38	13%	0.126	19%	0.194	C	C	.	.	S	Bend	trans	-76.4	132.5	-176.2	-53.2	-170.8	0	0	0	110.9	Y308 Q311 L312 A353 A354 F365	Y308-L356 HydrophobicContact CD1-CD1 4.27Å; Q311-L356 HydrophobicContact CB-CD1 4.38Å; Q311-L356 HydrophobicContact CB-CD2 3.62Å; L312-L356 HydrophobicContact CB-CD1 4.27Å; A353-L356 PolarHBondContact O-N 3.13Å; A354-L356 VanDerWaalsContact C-N 3.3Å; L356-F365 HydrophobicContact CD1-CE2 4.24Å; L356-F365 HydrophobicContact CD1-CZ 3.73Å
357	D	89.6	Confident	94.6	Very high	110 Å²	110	36.8 Å²	36.8	59%	0.588	19%	0.186	S	C	*	.			trans	-67.9	137.7	179.1	-81	-28.6	0	0	0	110.8	P359 V642	D357-P359 WeakPolarHBondContact O-CD 3.32Å; D357-V642 HydrophobicContact CB-CG1 3.99Å
358	L	90.8	Very high	94.6	Very high	72 Å²	72	31.1 Å²	31.1	38%	0.377	16%	0.16	S	C	.	.			trans	-100.8	109.1	172.8	174.7	66.6	0	0	0	108	T360 L362 N364	L358-T360 PolarHBondContact O-N 3.12Å; L358-L362 WeakPolarHBondContact CD1-O 3.24Å; L358-N364 HydrophobicContact CD1-CB 4.03Å; L358-N364 VanDerWaalsContact CD1-N 3.34Å
359	P	92.2	Very high	94.5	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.019	17%	0.167	C	C	.	.			trans	-60.7	135.6	177.4	-21.6	32.7	0	0	0	111	Y308 D357 F361 L362 R644	Y308-P359 VanDerWaalsContact OH-CD 3.24Å; Y308-P359 WeakPolarHBondContact OH-CD 3.22Å; Y308-P359 WeakPolarHBondContact OH-CG 3.33Å; D357-P359 WeakPolarHBondContact O-CD 3.32Å; P359-F361 PolarHBondContact O-N 3.25Å; P359-L362 HydrophobicContact CB-CB 4.21Å; P359-L362 HydrophobicContact CB-CD1 4.07Å; P359-L362 PolarHBondContact O-N 2.98Å; P359-L362 VanDerWaalsContact O-N 3.11Å; P359-R644 HydrophobicContact CB-CB 4.3Å; P359-R644 HydrophobicContact CG-CB 4.4Å
360	T	93.7	Very high	94.3	Very high	21 Å²	21	33.7 Å²	33.7	13%	0.129	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	134.7	-178	-47	0	0	0	0	110.5	L358 L362 T427 N431 F640 V642	L358-T360 PolarHBondContact O-N 3.12Å; T360-L362 PolarHBondContact O-N 3.07Å; T360-T427 HydrophobicContact CG2-CG2 4.44Å; T360-N431 PolarHBondContact O-ND2 3.44Å; T360-F640 HydrophobicContact CG2-CD1 4.02Å; T360-F640 HydrophobicContact CG2-CE1 3.99Å; T360-F640 PolarHBondContact OG1-O 3.32Å; T360-V642 PolarHBondContact N-O 3.1Å; T360-V642 PolarHBondContact OG1-N 3.38Å; T360-V642 PolarHBondContact OG1-O 3.25Å
361	F	94.8	Very high	94	Very high	11 Å²	11	34.6 Å²	34.6	5%	0.048	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	8.4	-178.6	-44.1	-57.5	0	0	0	116.5	S298 P359 Q406 I424 T427 F428 M432 L473 F640	S298-F361 PolarHBondContact OG-O 3.46Å; P359-F361 PolarHBondContact O-N 3.25Å; F361-Q406 HydrophobicContact CE1-CB 4.22Å; F361-Q406 HydrophobicContact CE1-CG 4.28Å; F361-I424 HydrophobicContact CZ-CG2 4.24Å; F361-T427 HydrophobicContact CE2-CG2 4.48Å; F361-F428 HydrophobicContact CD2-CB 4.08Å; F361-F428 HydrophobicContact CD2-CD2 4.02Å; F361-F428 HydrophobicContact CE2-CB 3.92Å; F361-F428 HydrophobicContact CE2-CD2 4.42Å; F361-F428 HydrophobicContact CG-CD2 4.4Å; F361-M432 HydrophobicContact CB-CE 3.76Å; F361-L473 HydrophobicContact CB-CD2 3.93Å; F361-L473 HydrophobicContact CD1-CD1 3.63Å; F361-L473 HydrophobicContact CD1-CD2 4.43Å; F361-L473 HydrophobicContact CE1-CD1 4.16Å; F361-L473 HydrophobicContact CG-CD1 4.35Å; F361-L473 HydrophobicContact CG-CD2 4.36Å; F361-F640 HydrophobicContact CZ-CD1 4.46Å
362	L	94.7	Very high	93.8	Very high	18 Å²	18	30.2 Å²	30.2	9%	0.094	18%	0.175	C	C	.	.	S	Bend	trans	-124	-179.7	176.9	-64	177.7	0	0	0	110.4	S298 L358 P359 T360 N431 M432	S298-L362 VanDerWaalsContact O-CD2 3.31Å; S298-L362 WeakPolarHBondContact O-CD2 3.45Å; L358-L362 WeakPolarHBondContact CD1-O 3.24Å; P359-L362 HydrophobicContact CB-CB 4.21Å; P359-L362 HydrophobicContact CB-CD1 4.07Å; P359-L362 PolarHBondContact O-N 2.98Å; P359-L362 VanDerWaalsContact O-N 3.11Å; T360-L362 PolarHBondContact O-N 3.07Å; L362-N431 HydrophobicContact CD1-CB 3.96Å; L362-N431 HydrophobicContact CG-CB 4.39Å; L362-M432 HydrophobicContact CD1-CE 4.33Å; L362-M432 HydrophobicContact CD2-CE 3.3Å; L362-M432 HydrophobicContact CD2-SD 4.06Å; L362-M432 HydrophobicContact CG-CE 3.6Å
363	T	94.1	Very high	93.5	Very high	11 Å²	11	30 Å²	30	7%	0.067	17%	0.174	C	C	.	.			trans	-120	147.6	171.3	-170.9	0	0	0	0	111.7	Y185 W299 V302 F365	Y185-T363 HydrophobicContact CD2-CG2 4.27Å; Y185-T363 HydrophobicContact CE2-CG2 4.33Å; W299-T363 VanDerWaalsContact O-CG2 3.22Å; W299-T363 WeakPolarHBondContact O-CG2 3.41Å; V302-T363 HydrophobicContact CG2-CG2 3.78Å; T363-F365 PolarHBondContact OG1-O 3.22Å
364	N	92.5	Very high	93.4	Very high	7 Å²	7	30.4 Å²	30.4	4%	0.037	18%	0.176	C	C	.	.	S	Bend	trans	-96.2	-40.2	174.1	61	-12.1	0	0	0	112	N186 V302 Y308 L358	N186-N364 PolarHBondContact ND2-OD1 3.21Å; V302-N364 WeakPolarHBondContact CG2-O 3.32Å; Y308-N364 HydrophobicContact CD1-CB 3.99Å; Y308-N364 HydrophobicContact CD2-CB 4.42Å; Y308-N364 WeakPolarHBondContact CD2-O 3.47Å; Y308-N364 HydrophobicContact CE1-CB 3.6Å; Y308-N364 HydrophobicContact CE2-CB 4.08Å; Y308-N364 HydrophobicContact CG-CB 4.37Å; L358-N364 HydrophobicContact CD1-CB 4.03Å; L358-N364 VanDerWaalsContact CD1-N 3.34Å
365	F	96	Very high	93.1	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.018	18%	0.182	C	C	.	.	S	Bend	trans	-119.6	111.5	173.1	-63.3	-67.2	0	0	0	108.6	L97 Y185 V215 F218 L219 A353 L356 T363	L97-F365 HydrophobicContact CD2-CD2 4.17Å; L97-F365 HydrophobicContact CD2-CE2 4.25Å; Y185-F365 WeakPolarHBondContact CB-O 3.45Å; V215-F365 HydrophobicContact CB-CD1 4.37Å; V215-F365 HydrophobicContact CB-CE1 4.08Å; V215-F365 HydrophobicContact CB-CE2 4.4Å; V215-F365 HydrophobicContact CB-CZ 4.08Å; V215-F365 HydrophobicContact CG2-CE1 4.08Å; V215-F365 HydrophobicContact CG2-CZ 4.25Å; F218-F365 HydrophobicContact CB-CB 4.2Å; L219-F365 HydrophobicContact CD1-CE1 4.32Å; A353-F365 HydrophobicContact CB-CE2 3.94Å; A353-F365 HydrophobicContact CB-CZ 4.13Å; L356-F365 HydrophobicContact CD1-CE2 4.24Å; L356-F365 HydrophobicContact CD1-CZ 3.73Å; T363-F365 PolarHBondContact OG1-O 3.22Å
366	G	97.1	Very high	93.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-171.5	-175.1	-177.8	0	0	0	0	0	110.9	F218 V302	F218-G366 WeakPolarHBondContact CD1-O 3.43Å; V302-G366 VanDerWaalsContact CG2-N 3.25Å
367	P	97.9	Very high	93	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.188	C	C	.	.			trans	-51.7	143.8	177.6	-28.3	34.3	0	0	0	113.9	Y185 F218 N229 L232 L267 L270 A300 L301 V302	Y185-P367 HydrophobicContact CE1-CG 4.3Å; Y185-P367 VanDerWaalsContact CE2-CD 3.43Å; Y185-P367 HydrophobicContact CE2-CG 4.39Å; Y185-P367 VanDerWaalsContact CZ-CD 3.4Å; F218-P367 HydrophobicContact CE1-CG 4Å; N229-P367 VanDerWaalsContact OD1-CA 3.25Å; N229-P367 WeakPolarHBondContact OD1-CA 3.41Å; L232-P367 HydrophobicContact CD1-CB 4.2Å; L232-P367 HydrophobicContact CD1-CG 4.26Å; L267-P367 HydrophobicContact CD2-CG 3.73Å; L270-P367 HydrophobicContact CD1-CB 3.61Å; L270-P367 HydrophobicContact CD1-CG 3.7Å; A300-P367 VanDerWaalsContact O-CD 3.26Å; A300-P367 WeakPolarHBondContact O-CD 3.45Å; A300-P367 WeakPolarHBondContact O-CG 3.15Å; L301-P367 CarbonylContact C-O 3.56Å; L301-P367 VanDerWaalsContact CA-O 3.3Å; L301-P367 WeakPolarHBondContact CA-O 3.33Å; L301-P367 HydrophobicContact CD1-CB 4.49Å; V302-P367 PolarHBondContact N-O 3.23Å
368	V	96.5	Very high	93.2	Very high	6 Å²	6	27.9 Å²	27.9	4%	0.036	16%	0.161	C	C	.	.			trans	-130.3	160.1	175.3	-66.9	0	0	0	0	110	K227 N229 V302 P305 D370 V374	K227-V368 WeakPolarHBondContact O-CG2 3.15Å; N229-V368 PolarHBondContact ND2-O 2.94Å; N229-V368 PolarHBondContact OD1-N 3.24Å; V302-V368 HydrophobicContact CB-CG1 3.98Å; V302-V368 HydrophobicContact CG2-CG1 4.48Å; P305-V368 HydrophobicContact CB-CG1 3.75Å; P305-V368 HydrophobicContact CG-CG1 3.9Å; V368-D370 PolarHBondContact O-N 3.32Å; V368-V374 WeakPolarHBondContact O-CB 3.39Å
369	I	94.9	Very high	93.2	Very high	90 Å²	90	25.6 Å²	25.6	46%	0.462	15%	0.153	S	C	.	.			trans	-78.7	105.3	172.6	-57.9	170.2	0	0	0	107.9	L301 V374 D377	L301-I369 HydrophobicContact CD2-CD1 4.29Å; L301-I369 HydrophobicContact CD2-CG1 3.85Å; I369-V374 HydrophobicContact CG1-CG1 4.25Å; I369-D377 HydrophobicContact CD1-CB 4.29Å
370	D	92.2	Very high	93.1	Very high	23 Å²	23	31.1 Å²	31.1	12%	0.123	17%	0.174	C	C	.	.			trans	-107.4	-6.4	-176	65.3	-3.5	0	0	0	113.9	K227 N229 V368 I372 V373 V374	K227-D370 HydrophobicContact CB-CB 4.1Å; N229-D370 PolarHBondContact ND2-OD2 3.23Å; V368-D370 PolarHBondContact O-N 3.32Å; D370-I372 PolarHBondContact O-N 2.84Å; D370-I372 PolarHBondContact OD1-N 3.11Å; D370-V373 PolarHBondContact OD1-N 3.32Å; D370-V373 PolarHBondContact OD2-N 2.81Å; D370-V374 PolarHBondContact N-O 3.48Å; D370-V374 VanDerWaalsContact N-O 3.13Å; D370-V374 PolarHBondContact OD1-N 3.06Å
371	G	90.9	Very high	92.9	Very high	47 Å²	47	30.9 Å²	30.9	49%	0.485	17%	0.173	S	C	.	.	S	Bend	trans	75.2	1	-176.9	0	0	0	0	0	114.8	V374	G371-V374 PolarHBondContact N-O 3.35Å; G371-V374 VanDerWaalsContact N-O 3.12Å
372	I	89.2	Confident	92.6	Very high	61 Å²	61	30.5 Å²	30.5	31%	0.313	17%	0.171	S	C	.	.	S	Bend	trans	-121.1	-60.7	-176.7	-62	-179.3	0	0	0	111.4	M73 K227 D370 N375	M73-I372 HydrophobicContact CE-CG2 4.2Å; K227-I372 HydrophobicContact CD-CD1 3.84Å; D370-I372 PolarHBondContact O-N 2.84Å; D370-I372 PolarHBondContact OD1-N 3.11Å; I372-N375 PolarHBondContact O-OD1 2.97Å
373	V	91.1	Very high	92.2	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.012	18%	0.184	C	C	.	.	S	Bend	trans	-91.5	-45.6	-179.5	-176.7	0	0	0	0	108.6	N229 L232 S274 D370	N229-V373 HydrophobicContact CB-CB 4.42Å; L232-V373 HydrophobicContact CB-CG1 3.62Å; L232-V373 HydrophobicContact CD1-CG1 4.05Å; L232-V373 HydrophobicContact CD2-CG1 4.37Å; L232-V373 HydrophobicContact CG-CG1 4.22Å; S274-V373 WeakPolarHBondContact CB-O 3.4Å; S274-V373 PolarHBondContact OG-O 3.27Å; D370-V373 PolarHBondContact OD1-N 3.32Å; D370-V373 PolarHBondContact OD2-N 2.81Å
374	V	92.9	Very high	91.7	Very high	8 Å²	8	35.8 Å²	35.8	5%	0.048	20%	0.197	C	C	.	.	S	Bend	trans	-113.2	91.7	172.4	-176.1	0	0	0	0	107	L232 L270 V368 I369 D370 G371 T376	L232-V374 HydrophobicContact CD1-CG2 4.1Å; L270-V374 HydrophobicContact CD1-CG2 4.23Å; L270-V374 HydrophobicContact CD2-CG1 4.12Å; L270-V374 HydrophobicContact CD2-CG2 4.08Å; V368-V374 WeakPolarHBondContact O-CB 3.39Å; I369-V374 HydrophobicContact CG1-CG1 4.25Å; D370-V374 PolarHBondContact N-O 3.48Å; D370-V374 VanDerWaalsContact N-O 3.13Å; D370-V374 PolarHBondContact OD1-N 3.06Å; G371-V374 PolarHBondContact N-O 3.35Å; G371-V374 VanDerWaalsContact N-O 3.12Å; V374-T376 PolarHBondContact O-N 3.11Å
375	N	88.7	Confident	90.9	Very high	65 Å²	65	40.6 Å²	40.6	35%	0.348	22%	0.219	S	C	.	.			trans	-64	-38	-169.1	-69.7	8.4	0	0	0	114.1	P275 I372	P275-N375 WeakPolarHBondContact CD-ND2 3.23Å; P275-N375 VanDerWaalsContact CG-ND2 3.3Å; P275-N375 WeakPolarHBondContact CG-ND2 3.31Å; I372-N375 PolarHBondContact O-OD1 2.97Å
376	T	91.3	Very high	89.9	Confident	52 Å²	52	40.7 Å²	40.7	32%	0.319	22%	0.221	S	C	.	.	S	Bend	trans	-157	179.6	-175.4	-170.5	0	0	0	0	109	V374 P378 Y380 N381	V374-T376 PolarHBondContact O-N 3.11Å; T376-P378 WeakPolarHBondContact O-CD 3.36Å; T376-Y380 HydrophobicContact CG2-CD1 4.06Å; T376-N381 HydrophobicContact CG2-CB 3.81Å
377	D	92.5	Very high	89	Confident	79 Å²	79	43 Å²	43	42%	0.422	24%	0.237	S	C	.	.			trans	-50.4	122.3	174.1	-173	-48.4	0	0	0	110.4	I369 A379 Y380 N381	I369-D377 HydrophobicContact CD1-CB 4.29Å; D377-A379 PolarHBondContact O-N 2.78Å; D377-A379 WeakPolarHBondContact OD1-CA 3.24Å; D377-A379 VanDerWaalsContact OD1-CB 3.27Å; D377-A379 WeakPolarHBondContact OD1-CB 3.47Å; D377-A379 PolarHBondContact OD1-N 3.38Å; D377-Y380 PolarHBondContact O-N 2.96Å; D377-Y380 VanDerWaalsContact O-N 3.14Å; D377-N381 WeakPolarHBondContact O-CB 3.38Å; D377-N381 PolarHBondContact O-N 2.99Å
378	P	93.2	Very high	88.4	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.032	25%	0.249	C	C	.	.	H	α-helix	trans	-56.4	-35	-179.9	-27.1	35.3	0	0	0	113.9	L270 A295 L296 L301 T376 N381 L382	L270-P378 HydrophobicContact CD2-CB 4.4Å; L270-P378 HydrophobicContact CD2-CG 3.72Å; A295-P378 HydrophobicContact CB-CB 3.97Å; A295-P378 HydrophobicContact CB-CG 4.37Å; L296-P378 HydrophobicContact CD2-CB 4.02Å; L301-P378 HydrophobicContact CD1-CG 3.91Å; L301-P378 HydrophobicContact CD2-CG 4Å; T376-P378 WeakPolarHBondContact O-CD 3.36Å; P378-N381 PolarHBondContact O-N 3.39Å; P378-L382 WeakPolarHBondContact O-CB 3.4Å; P378-L382 WeakPolarHBondContact O-CG 3.48Å; P378-L382 PolarHBondContact O-N 3.5Å
379	A	90.8	Very high	88	Confident	25 Å²	25	45.1 Å²	45.1	21%	0.207	25%	0.247	C	C	.	.	H	α-helix	trans	-63.8	-47.9	177	0	0	0	0	0	110.6	L296 D377 N381 E383	L296-A379 HydrophobicContact CD2-CB 3.9Å; D377-A379 PolarHBondContact O-N 2.78Å; D377-A379 WeakPolarHBondContact OD1-CA 3.24Å; D377-A379 VanDerWaalsContact OD1-CB 3.27Å; D377-A379 WeakPolarHBondContact OD1-CB 3.47Å; D377-A379 PolarHBondContact OD1-N 3.38Å; A379-N381 PolarHBondContact O-N 2.86Å; A379-E383 WeakPolarHBondContact O-CB 3.46Å; A379-E383 VanDerWaalsContact O-CG 3.23Å; A379-E383 WeakPolarHBondContact O-CG 3.38Å; A379-E383 PolarHBondContact O-N 3.03Å; A379-E383 VanDerWaalsContact O-N 3.08Å
380	Y	90.7	Very high	87.8	Confident	118 Å²	118	42 Å²	42	46%	0.463	23%	0.231	S	C	.	.	H	α-helix	trans	-62.3	-44	176.4	-179.5	-91.2	0	0	0	111.7	T376 D377 N384 H385	T376-Y380 HydrophobicContact CG2-CD1 4.06Å; D377-Y380 PolarHBondContact O-N 2.96Å; D377-Y380 VanDerWaalsContact O-N 3.14Å; Y380-N384 WeakPolarHBondContact CD2-ND2 3.4Å; Y380-N384 HydrophobicContact CE1-CB 4.24Å; Y380-N384 HydrophobicContact CE2-CB 4.39Å; Y380-N384 WeakPolarHBondContact CE2-ND2 3.49Å; Y380-N384 VanDerWaalsContact O-CB 3.27Å; Y380-N384 WeakPolarHBondContact O-CB 3.2Å; Y380-N384 PolarHBondContact O-N 2.93Å; Y380-N384 PolarHBondContact O-ND2 3.31Å; Y380-N384 VanDerWaalsContact O-ND2 3.11Å; Y380-H385 AromaticContact CE1-CD2 3.64Å; Y380-H385 AromaticContact CE1-NE2 3.62Å
381	N	88.2	Confident	87.6	Confident	17 Å²	17	42.7 Å²	42.7	9%	0.091	23%	0.233	C	C	.	.	H	α-helix	trans	-63	-49.8	-179.5	-168.8	-28.7	0	0	0	111.4	T376 D377 P378 A379 E383 N384 H385 G386	T376-N381 HydrophobicContact CG2-CB 3.81Å; D377-N381 WeakPolarHBondContact O-CB 3.38Å; D377-N381 PolarHBondContact O-N 2.99Å; P378-N381 PolarHBondContact O-N 3.39Å; A379-N381 PolarHBondContact O-N 2.86Å; N381-E383 VanDerWaalsContact C-N 3.33Å; N381-E383 PolarHBondContact O-N 3.43Å; N381-N384 PolarHBondContact O-N 2.92Å; N381-H385 CarbonylContact O-C 3.43Å; N381-H385 VanDerWaalsContact O-CA 3.29Å; N381-H385 WeakPolarHBondContact O-CA 3.18Å; N381-H385 PolarHBondContact O-N 2.87Å; N381-H385 PolarHBondContact OD1-O 3.5Å; N381-G386 PolarHBondContact O-N 3.29Å
382	L	89.3	Confident	87.6	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-66.6	-33.3	-178.8	-64.6	177.3	0	0	0	112.7	L296 P378 F389 V481 L484	L296-L382 HydrophobicContact CD1-CD1 4.22Å; L296-L382 HydrophobicContact CD2-CD1 4.09Å; L296-L382 HydrophobicContact CG-CD1 4.11Å; P378-L382 WeakPolarHBondContact O-CB 3.4Å; P378-L382 WeakPolarHBondContact O-CG 3.48Å; P378-L382 PolarHBondContact O-N 3.5Å; L382-F389 HydrophobicContact CD2-CB 3.82Å; L382-F389 HydrophobicContact CD2-CD1 3.57Å; L382-F389 HydrophobicContact CD2-CD2 3.71Å; L382-F389 HydrophobicContact CD2-CE1 3.91Å; L382-F389 HydrophobicContact CD2-CE2 4.07Å; L382-F389 HydrophobicContact CD2-CG 3.43Å; L382-F389 VanDerWaalsContact CD2-CG 3.43Å; L382-F389 HydrophobicContact CD2-CZ 4.14Å; L382-V481 HydrophobicContact CD1-CG2 4.17Å; L382-L484 HydrophobicContact CB-CD1 3.84Å
383	E	86.3	Confident	87.9	Confident	78 Å²	78	38.1 Å²	38.1	36%	0.364	20%	0.199	S	C	.	.	H	α-helix	trans	-76.1	-40.3	177.2	-72.5	173.7	-171.1	0	0	112.8	A379 N381 K480 L484 K489	A379-E383 WeakPolarHBondContact O-CB 3.46Å; A379-E383 VanDerWaalsContact O-CG 3.23Å; A379-E383 WeakPolarHBondContact O-CG 3.38Å; A379-E383 PolarHBondContact O-N 3.03Å; A379-E383 VanDerWaalsContact O-N 3.08Å; N381-E383 VanDerWaalsContact C-N 3.33Å; N381-E383 PolarHBondContact O-N 3.43Å; E383-K480 WeakPolarHBondContact OE1-CE 3.05Å; E383-K480 IonicContact OE1-NZ 3.99Å; E383-K480 PolarHBondContact OE1-NZ 3.13Å; E383-L484 HydrophobicContact CG-CD1 3.83Å; E383-L484 HydrophobicContact CG-CD2 3.81Å; E383-L484 HydrophobicContact CG-CG 4.5Å; E383-K489 WeakPolarHBondContact O-CE 3.45Å; E383-K489 PolarHBondContact O-NZ 2.95Å
384	N	83.2	Confident	88.1	Confident	62 Å²	62	38 Å²	38	33%	0.332	20%	0.198	S	C	.	.	H	α-helix	trans	-104.5	-34.9	-169.2	-63.6	-61.9	0	0	0	114.6	Y380 N381 K489	Y380-N384 WeakPolarHBondContact CD2-ND2 3.4Å; Y380-N384 HydrophobicContact CE1-CB 4.24Å; Y380-N384 HydrophobicContact CE2-CB 4.39Å; Y380-N384 WeakPolarHBondContact CE2-ND2 3.49Å; Y380-N384 VanDerWaalsContact O-CB 3.27Å; Y380-N384 WeakPolarHBondContact O-CB 3.2Å; Y380-N384 PolarHBondContact O-N 2.93Å; Y380-N384 PolarHBondContact O-ND2 3.31Å; Y380-N384 VanDerWaalsContact O-ND2 3.11Å; N381-N384 PolarHBondContact O-N 2.92Å; N384-K489 PolarHBondContact O-NZ 2.95Å
385	H	76.3	Confident	88.3	Confident	108 Å²	108	37.8 Å²	37.8	50%	0.5	20%	0.196	S	C	.	.	S	Bend	trans	-128.5	36.9	-171.4	-58.8	-66.1	0	0	0	112.3	Y380 N381 S387	Y380-H385 AromaticContact CE1-CD2 3.64Å; Y380-H385 AromaticContact CE1-NE2 3.62Å; N381-H385 CarbonylContact O-C 3.43Å; N381-H385 VanDerWaalsContact O-CA 3.29Å; N381-H385 WeakPolarHBondContact O-CA 3.18Å; N381-H385 PolarHBondContact O-N 2.87Å; N381-H385 PolarHBondContact OD1-O 3.5Å; H385-S387 PolarHBondContact O-N 2.88Å; H385-S387 VanDerWaalsContact O-N 3.08Å
386	G	74	Confident	88.7	Confident	6 Å²	6	34.7 Å²	34.7	6%	0.062	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	7.3	-172.1	0	0	0	0	0	116.8	N381 L388 F389 Q390	N381-G386 PolarHBondContact O-N 3.29Å; G386-L388 PolarHBondContact O-N 2.93Å; G386-F389 WeakPolarHBondContact O-CB 3.29Å; G386-F389 PolarHBondContact O-N 2.92Å; G386-Q390 VanDerWaalsContact O-CB 3.28Å; G386-Q390 WeakPolarHBondContact O-CB 3.36Å; G386-Q390 WeakPolarHBondContact O-CG 3.5Å; G386-Q390 PolarHBondContact O-N 3.44Å
387	S	80	Confident	88.9	Confident	49 Å²	49	32.2 Å²	32.2	34%	0.343	17%	0.165	S	C	.	.	H	α-helix	trans	-60.1	-49.3	-174.7	57.6	0	0	0	0	112.1	H385 F389 Q390 E391	H385-S387 PolarHBondContact O-N 2.88Å; H385-S387 VanDerWaalsContact O-N 3.08Å; S387-F389 PolarHBondContact O-N 3.48Å; S387-Q390 PolarHBondContact O-N 3.13Å; S387-Q390 VanDerWaalsContact O-N 3.13Å; S387-E391 WeakPolarHBondContact O-CG 3.19Å; S387-E391 PolarHBondContact O-N 2.78Å
388	L	84.7	Confident	89.2	Confident	49 Å²	49	28.4 Å²	28.4	26%	0.257	15%	0.145	S	C	.	.	H	α-helix	trans	-58.6	-37	178.3	-70.4	178.1	0	0	0	112.3	M272 P275 A278 R283 G386	M272-L388 CarbonylContact O-C 3.34Å; P275-L388 HydrophobicContact CB-CD1 4.43Å; P275-L388 HydrophobicContact CG-CD1 4.09Å; A278-L388 HydrophobicContact CB-CD2 4.1Å; R283-L388 VanDerWaalsContact CZ-O 3.25Å; R283-L388 PolarHBondContact NH1-O 2.83Å; R283-L388 VanDerWaalsContact NH2-CA 3.33Å; R283-L388 PolarHBondContact NH2-O 3.43Å; G386-L388 PolarHBondContact O-N 2.93Å
389	F	88.7	Confident	89.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-73.5	-40	178.5	158.5	-108.7	0	0	0	112	M272 L382 G386 S387 E391 I392 L394 V481 L484 H485	M272-F389 HydrophobicContact CB-CD2 4.04Å; M272-F389 HydrophobicContact CE-CD2 3.46Å; M272-F389 VanDerWaalsContact CE-CD2 3.46Å; M272-F389 HydrophobicContact CE-CE2 3.56Å; M272-F389 HydrophobicContact SD-CD2 4.1Å; M272-F389 HydrophobicContact SD-CE2 4.15Å; L382-F389 HydrophobicContact CD2-CB 3.82Å; L382-F389 HydrophobicContact CD2-CD1 3.57Å; L382-F389 HydrophobicContact CD2-CD2 3.71Å; L382-F389 HydrophobicContact CD2-CE1 3.91Å; L382-F389 HydrophobicContact CD2-CE2 4.07Å; L382-F389 HydrophobicContact CD2-CG 3.43Å; L382-F389 VanDerWaalsContact CD2-CG 3.43Å; L382-F389 HydrophobicContact CD2-CZ 4.14Å; G386-F389 WeakPolarHBondContact O-CB 3.29Å; G386-F389 PolarHBondContact O-N 2.92Å; S387-F389 PolarHBondContact O-N 3.48Å; F389-E391 VanDerWaalsContact C-N 3.31Å; F389-E391 PolarHBondContact O-N 3.39Å; F389-I392 PolarHBondContact O-N 3.08Å; F389-L394 HydrophobicContact CE2-CD2 4.27Å; F389-L394 HydrophobicContact CZ-CD2 4.31Å; F389-V481 HydrophobicContact CE2-CG1 3.91Å; F389-V481 HydrophobicContact CZ-CG1 3.65Å; F389-L484 HydrophobicContact CE1-CB 4.48Å; F389-H485 AromaticContact CD1-CD2 3.94Å; F389-H485 VanDerWaalsContact CE1-CA 3.47Å; F389-H485 HydrophobicContact CE1-CB 3.57Å; F389-H485 AromaticContact CE1-CD2 3.59Å; F389-H485 AromaticContact CE1-CG 3.97Å; F389-H485 HydrophobicContact CE2-CB 4.45Å; F389-H485 AromaticContact CE2-CD2 3.76Å; F389-H485 HydrophobicContact CZ-CB 3.47Å; F389-H485 VanDerWaalsContact CZ-CB 3.47Å; F389-H485 AromaticContact CZ-CD2 3.5Å; F389-H485 AromaticContact CZ-CG 3.83Å; F389-H485 PolarHBondContact O-CD2 2.92Å; F389-H485 PolarHBondContact O-NE2 3.12Å
390	Q	88.9	Confident	89.5	Confident	24 Å²	24	30.5 Å²	30.5	11%	0.112	15%	0.149	C	C	.	.	H	α-helix	trans	-76.4	-11.2	-175.9	-75.1	170.9	0.3	0	0	114.2	G386 S387 I392 L484 G504	G386-Q390 VanDerWaalsContact O-CB 3.28Å; G386-Q390 WeakPolarHBondContact O-CB 3.36Å; G386-Q390 WeakPolarHBondContact O-CG 3.5Å; G386-Q390 PolarHBondContact O-N 3.44Å; S387-Q390 PolarHBondContact O-N 3.13Å; S387-Q390 VanDerWaalsContact O-N 3.13Å; Q390-I392 VanDerWaalsContact C-N 3.33Å; Q390-L484 PolarHBondContact NE2-O 3.16Å; Q390-G504 PolarHBondContact O-N 2.88Å
391	E	88	Confident	89.7	Confident	38 Å²	38	25.1 Å²	25.1	18%	0.178	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-15.8	175.2	-75.7	178	168.2	0	0	114.1	R283 S387 F389 T501	R283-E391 IonicContact CZ-OE2 3.36Å; R283-E391 IonicContact NE-OE2 3.65Å; R283-E391 IonicContact NH2-OE2 2.72Å; R283-E391 PolarHBondContact NH2-OE2 3.22Å; S387-E391 WeakPolarHBondContact O-CG 3.19Å; S387-E391 PolarHBondContact O-N 2.78Å; F389-E391 VanDerWaalsContact C-N 3.31Å; F389-E391 PolarHBondContact O-N 3.39Å; E391-T501 WeakPolarHBondContact CG-OG1 3.28Å; E391-T501 WeakPolarHBondContact OE1-CG2 3.35Å; E391-T501 PolarHBondContact OE1-OG1 3Å
392	I	92.7	Very high	90	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.125	C	C	.	.	S	Bend	trans	-94.2	132.7	-172.8	-67.5	167.4	0	0	0	109	M272 F285 R286 A288 F389 Q390 L394 H485	M272-I392 HydrophobicContact CB-CD1 3.73Å; M272-I392 HydrophobicContact CE-CB 3.96Å; M272-I392 HydrophobicContact CE-CD1 4.47Å; M272-I392 HydrophobicContact CE-CG2 3.81Å; M272-I392 HydrophobicContact CG-CD1 3.81Å; M272-I392 HydrophobicContact CG-CG2 4.49Å; F285-I392 HydrophobicContact CD2-CD1 4.3Å; F285-I392 HydrophobicContact CE2-CD1 3.6Å; F285-I392 HydrophobicContact CE2-CG1 4.47Å; F285-I392 HydrophobicContact CE2-CG2 4.33Å; F285-I392 HydrophobicContact CZ-CD1 4.03Å; R286-I392 WeakPolarHBondContact O-CA 3.18Å; A288-I392 HydrophobicContact CB-CG2 3.92Å; F389-I392 PolarHBondContact O-N 3.08Å; Q390-I392 VanDerWaalsContact C-N 3.33Å; I392-L394 PolarHBondContact O-N 2.89Å; I392-H485 PolarHBondContact O-CE1 2.87Å; I392-H485 PolarHBondContact O-NE2 3.23Å
393	D	94.5	Very high	90.3	Very high	13 Å²	13	24.5 Å²	24.5	7%	0.07	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	132.6	170.6	-61.6	-42.1	0	0	0	109.3	R286 R287 A288 G504 K505 F575	R286-D393 PolarHBondContact O-N 3.29Å; R286-D393 VanDerWaalsContact O-N 3.09Å; R287-D393 CarbonylContact C-O 3.54Å; R287-D393 VanDerWaalsContact CA-O 3.22Å; R287-D393 WeakPolarHBondContact CA-O 3.28Å; R287-D393 HydrophobicContact CB-CB 4.19Å; R287-D393 HydrophobicContact CG-CB 3.81Å; R287-D393 IonicContact CZ-OD2 3.65Å; R287-D393 IonicContact NE-OD2 2.89Å; R287-D393 PolarHBondContact NE-OD2 3.25Å; A288-D393 PolarHBondContact N-O 3.41Å; D393-G504 WeakPolarHBondContact OD1-CA 3.35Å; D393-K505 CarbonylContact C-O 3.46Å; D393-K505 PolarHBondContact OD1-N 3.14Å; D393-F575 HydrophobicContact CB-CE2 4.05Å; D393-F575 HydrophobicContact CB-CZ 3.97Å; D393-F575 WeakPolarHBondContact O-CZ 3.39Å
394	L	96.1	Very high	90.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125.9	-172.7	179.5	61.4	0	0	0	111.4	M272 A288 L290 F389 I392 V396 V481 H485 K505 T506 F507	M272-L394 HydrophobicContact CE-CB 4.39Å; M272-L394 HydrophobicContact CE-CD1 3.97Å; M272-L394 HydrophobicContact CE-CD2 4.46Å; M272-L394 HydrophobicContact CE-CG 4.49Å; M272-L394 HydrophobicContact SD-CD1 4.19Å; A288-L394 HydrophobicContact CB-CD1 4.22Å; A288-L394 WeakPolarHBondContact O-CA 3.39Å; L290-L394 HydrophobicContact CD1-CD1 3.8Å; L290-L394 HydrophobicContact CG-CD1 3.78Å; F389-L394 HydrophobicContact CE2-CD2 4.27Å; F389-L394 HydrophobicContact CZ-CD2 4.31Å; I392-L394 PolarHBondContact O-N 2.89Å; L394-V396 HydrophobicContact CD1-CG2 3.96Å; L394-V396 HydrophobicContact CD2-CG2 4.02Å; L394-V396 HydrophobicContact CG-CG2 3.83Å; L394-V481 HydrophobicContact CD2-CG1 4.22Å; L394-H485 HydrophobicContact CD2-CB 3.86Å; L394-K505 PolarHBondContact N-O 2.91Å; L394-T506 HydrophobicContact CD2-CG2 4.41Å; L394-T506 CarbonylContact O-C 3.55Å; L394-T506 WeakPolarHBondContact O-CA 3.41Å; L394-F507 PolarHBondContact O-N 2.84Å
395	L	96.4	Very high	91.2	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.01	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	129.7	165.7	173.6	65.2	0	0	0	108.7	A288 I289 L290 F507 Y509 I572 F575 L582	A288-L395 PolarHBondContact O-N 2.8Å; I289-L395 CarbonylContact C-O 3.51Å; I289-L395 VanDerWaalsContact CA-O 3.24Å; I289-L395 WeakPolarHBondContact CA-O 3.42Å; I289-L395 HydrophobicContact CD1-CD2 4.37Å; I289-L395 HydrophobicContact CG1-CB 4.21Å; I289-L395 HydrophobicContact CG1-CD2 4.27Å; I289-L395 HydrophobicContact CG2-CB 4.42Å; I289-L395 HydrophobicContact CG2-CD2 4.1Å; I289-L395 HydrophobicContact CG2-CG 4.25Å; L290-L395 PolarHBondContact N-O 2.83Å; L395-F507 CarbonylContact C-O 3.57Å; L395-F507 WeakPolarHBondContact CA-O 3.07Å; L395-F507 HydrophobicContact CD1-CB 3.52Å; L395-Y509 HydrophobicContact CD1-CD1 4Å; L395-Y509 HydrophobicContact CG-CD1 4.47Å; L395-I572 HydrophobicContact CD2-CD1 3.74Å; L395-F575 HydrophobicContact CB-CD1 4.09Å; L395-F575 HydrophobicContact CB-CD2 4.11Å; L395-F575 HydrophobicContact CB-CE1 3.8Å; L395-F575 HydrophobicContact CB-CE2 3.84Å; L395-F575 HydrophobicContact CB-CG 4.22Å; L395-F575 HydrophobicContact CB-CZ 3.66Å; L395-F575 HydrophobicContact CD2-CB 4.44Å; L395-F575 HydrophobicContact CD2-CD1 4.29Å; L395-F575 HydrophobicContact CD2-CG 4.21Å; L395-L582 HydrophobicContact CD1-CD1 4.24Å
396	V	97.2	Very high	92	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133	177.6	178	0	0	0	0	109.7	L290 L394 L478 V482 F507 F508 Y509	L290-V396 HydrophobicContact CB-CG2 4.35Å; L290-V396 CarbonylContact O-C 3.48Å; L290-V396 VanDerWaalsContact O-CA 3.31Å; L290-V396 WeakPolarHBondContact O-CA 3.43Å; L394-V396 HydrophobicContact CD1-CG2 3.96Å; L394-V396 HydrophobicContact CD2-CG2 4.02Å; L394-V396 HydrophobicContact CG-CG2 3.83Å; V396-L478 HydrophobicContact CG1-CB 4.23Å; V396-L478 HydrophobicContact CG1-CD1 4.25Å; V396-L478 HydrophobicContact CG1-CD2 3.58Å; V396-L478 HydrophobicContact CG1-CG 4.25Å; V396-V482 HydrophobicContact CB-CG2 3.89Å; V396-V482 HydrophobicContact CG1-CG2 4.17Å; V396-V482 HydrophobicContact CG2-CG2 3.62Å; V396-F507 PolarHBondContact N-O 3.42Å; V396-F508 HydrophobicContact CB-CD2 3.8Å; V396-F508 HydrophobicContact CB-CE2 4.38Å; V396-F508 HydrophobicContact CG1-CD2 3.63Å; V396-F508 HydrophobicContact CG1-CE2 3.7Å; V396-F508 CarbonylContact O-C 3.51Å; V396-F508 VanDerWaalsContact O-CA 3.29Å; V396-F508 WeakPolarHBondContact O-CA 3.28Å; V396-Y509 VanDerWaalsContact O-CD1 3.28Å; V396-Y509 WeakPolarHBondContact O-CD1 3.22Å; V396-Y509 PolarHBondContact O-N 2.93Å
397	G	96.3	Very high	92.9	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	143.9	173.4	0	0	0	0	0	111.3	L290 L291 G292 Y509	L290-G397 PolarHBondContact O-N 3.2Å; L291-G397 WeakPolarHBondContact CA-O 3.22Å; G292-G397 PolarHBondContact N-O 2.92Å; G397-Y509 WeakPolarHBondContact CA-O 2.85Å
398	A	97	Very high	93.4	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	153.2	168.9	0	0	0	0	0	110.7	E402 L475 L478 F508 Y509 L510 F511	A398-E402 VanDerWaalsContact CA-OE1 3.24Å; A398-E402 WeakPolarHBondContact CA-OE1 3.28Å; A398-L475 HydrophobicContact CB-CD1 4.32Å; A398-L478 HydrophobicContact CB-CD1 4.1Å; A398-F508 HydrophobicContact CB-CZ 4.09Å; A398-Y509 PolarHBondContact N-O 2.94Å; A398-L510 HydrophobicContact CB-CD1 4.34Å; A398-L510 CarbonylContact O-C 3.56Å; A398-L510 WeakPolarHBondContact O-CA 3.45Å; A398-F511 PolarHBondContact O-N 2.83Å
399	T	95.8	Very high	93.7	Very high	5 Å²	5	13 Å²	13	3%	0.031	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	168.2	167.5	71.9	0	0	0	0	110.4	E402 S526 I527 H528	T399-E402 PolarHBondContact N-OE1 3.22Å; T399-E402 PolarHBondContact OG1-OE1 3.41Å; T399-E402 PolarHBondContact OG1-OE2 3.13Å; T399-S526 WeakPolarHBondContact CB-OG 3.5Å; T399-I527 WeakPolarHBondContact CG2-O 3.28Å; T399-I527 PolarHBondContact OG1-O 3.02Å; T399-H528 PolarHBondContact OG1-N 3.29Å
400	K	94.4	Very high	93.8	Very high	69 Å²	69	18.2 Å²	18.2	30%	0.3	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-43.6	-175.2	-170.7	-178.6	176.8	-170.2	0	112.1	K524 S526	K400-K524 WeakPolarHBondContact CD-O 3.26Å; K400-K524 PolarHBondContact NZ-O 2.7Å; K400-K524 VanDerWaalsContact NZ-O 3.11Å; K400-S526 PolarHBondContact N-OG 2.91Å
401	H	95.3	Very high	94.1	Very high	4 Å²	4	18.2 Å²	18.2	2%	0.019	9%	0.087	C	C	.	.	B	Isolated β-bridge	trans	-119.1	66.3	-177.7	-58.8	-68.8	0	0	0	110.3	A403 Y404 L523 K524 S526 I527 H528	H401-A403 PolarHBondContact O-N 2.82Å; H401-Y404 WeakPolarHBondContact O-CB 3.41Å; H401-Y404 PolarHBondContact O-N 3.45Å; H401-Y404 VanDerWaalsContact O-N 3.12Å; H401-L523 HydrophobicContact CB-CD2 4.13Å; H401-K524 PolarHBondContact NE2-O 2.9Å; H401-S526 PolarHBondContact N-O 3.17Å; H401-I527 HydrophobicContact CB-CG2 4.3Å; H401-H528 PolarHBondContact O-N 3.2Å
402	E	95.8	Very high	94.3	Very high	7 Å²	7	16.5 Å²	16.5	3%	0.033	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-31	-177.9	-68.1	-75.6	-161.3	0	0	113.1	G292 A398 T399 Y404 S470 Y474 H528	G292-E402 VanDerWaalsContact CA-OE1 3.23Å; G292-E402 WeakPolarHBondContact CA-OE1 3.46Å; A398-E402 VanDerWaalsContact CA-OE1 3.24Å; A398-E402 WeakPolarHBondContact CA-OE1 3.28Å; T399-E402 PolarHBondContact N-OE1 3.22Å; T399-E402 PolarHBondContact OG1-OE1 3.41Å; T399-E402 PolarHBondContact OG1-OE2 3.13Å; E402-Y404 VanDerWaalsContact C-N 3.33Å; E402-Y404 PolarHBondContact O-N 3.5Å; E402-S470 PolarHBondContact N-OG 3.2Å; E402-Y474 HydrophobicContact CB-CD1 3.96Å; E402-Y474 HydrophobicContact CB-CD2 3.37Å; E402-Y474 HydrophobicContact CB-CE1 4.44Å; E402-Y474 HydrophobicContact CB-CE2 3.93Å; E402-Y474 HydrophobicContact CB-CG 3.4Å; E402-Y474 HydrophobicContact CG-CD1 4.42Å; E402-Y474 HydrophobicContact CG-CD2 4.41Å; E402-Y474 HydrophobicContact CG-CG 3.98Å; E402-H528 WeakPolarHBondContact O-CB 3.2Å; E402-H528 IonicContact OE2-CE1 2.79Å; E402-H528 IonicContact OE2-CG 3.5Å; E402-H528 IonicContact OE2-ND1 3.73Å; E402-H528 PolarHBondContact OE2-ND1 2.83Å
403	A	95.9	Very high	94.3	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	14.3	-179.2	0	0	0	0	0	113.8	H401 D405 Q406 I469 S470 Y474	H401-A403 PolarHBondContact O-N 2.82Å; A403-D405 PolarHBondContact O-N 2.73Å; A403-D405 VanDerWaalsContact O-N 3.13Å; A403-Q406 HydrophobicContact CB-CG 4.05Å; A403-Q406 WeakPolarHBondContact O-CB 3.35Å; A403-Q406 PolarHBondContact O-N 3.15Å; A403-I469 HydrophobicContact CB-CB 4.19Å; A403-I469 HydrophobicContact CB-CD1 3.66Å; A403-I469 HydrophobicContact CB-CG1 3.54Å; A403-S470 WeakPolarHBondContact CB-OG 3.39Å; A403-S470 PolarHBondContact N-OG 3.28Å; A403-Y474 HydrophobicContact CB-CD2 4.36Å; A403-Y474 HydrophobicContact CB-CE2 3.97Å
404	Y	94.8	Very high	94.3	Very high	8 Å²	8	27 Å²	27	3%	0.031	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-49.6	-40.7	176.8	-178.3	-93.3	0	0	0	112.1	H401 E402 Q406 L407 L412 P519 L523 I527	H401-Y404 WeakPolarHBondContact O-CB 3.41Å; H401-Y404 PolarHBondContact O-N 3.45Å; H401-Y404 VanDerWaalsContact O-N 3.12Å; E402-Y404 VanDerWaalsContact C-N 3.33Å; E402-Y404 PolarHBondContact O-N 3.5Å; Y404-Q406 PolarHBondContact O-N 2.78Å; Y404-L407 PolarHBondContact O-N 3.39Å; Y404-L412 HydrophobicContact CD1-CD1 4.41Å; Y404-L412 HydrophobicContact CD2-CD2 3.82Å; Y404-L412 HydrophobicContact CE1-CD1 3.83Å; Y404-L412 HydrophobicContact CE2-CD1 3.97Å; Y404-L412 HydrophobicContact CE2-CD2 3.58Å; Y404-L412 HydrophobicContact CE2-CG 4.33Å; Y404-P519 PolarHBondContact OH-O 3.02Å; Y404-L523 HydrophobicContact CD2-CD2 3.72Å; Y404-L523 HydrophobicContact CE2-CD2 4.01Å; Y404-I527 HydrophobicContact CD1-CB 4.23Å; Y404-I527 HydrophobicContact CD1-CD1 3.78Å; Y404-I527 HydrophobicContact CD1-CG2 4.17Å; Y404-I527 HydrophobicContact CD2-CB 4.36Å; Y404-I527 HydrophobicContact CD2-CG2 3.51Å; Y404-I527 HydrophobicContact CE1-CD1 3.85Å; Y404-I527 HydrophobicContact CE2-CG2 4.07Å; Y404-I527 HydrophobicContact CG-CB 3.88Å; Y404-I527 HydrophobicContact CG-CD1 4.26Å; Y404-I527 HydrophobicContact CG-CG2 3.55Å
405	D	92.2	Very high	94.2	Very high	27 Å²	27	27.4 Å²	27.4	14%	0.144	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-75.3	-5	-174.6	-71.3	-40.1	0	0	0	114.7	N115 R117 I118 A403	N115-D405 VanDerWaalsContact ND2-CA 3.34Å; N115-D405 WeakPolarHBondContact ND2-CA 3.35Å; N115-D405 PolarHBondContact ND2-O 3.41Å; N115-D405 PolarHBondContact ND2-OD1 2.91Å; N115-D405 VanDerWaalsContact ND2-OD1 3.15Å; R117-D405 IonicContact CZ-OD2 3.7Å; R117-D405 IonicContact NH1-OD1 2.77Å; R117-D405 IonicContact NH1-OD2 3.31Å; R117-D405 PolarHBondContact NH1-OD2 2.9Å; I118-D405 HydrophobicContact CD1-CB 3.82Å; I118-D405 HydrophobicContact CG1-CB 3.69Å; I118-D405 WeakPolarHBondContact CG1-OD1 3.21Å; A403-D405 PolarHBondContact O-N 2.73Å; A403-D405 VanDerWaalsContact O-N 3.13Å
406	Q	92.5	Very high	94.1	Very high	60 Å²	60	27.3 Å²	27.3	28%	0.28	13%	0.125	S	C	.	.	G	3₁₀ helix	trans	-82.7	-16	176.1	-57.7	-61.4	-38.3	0	0	113.5	F361 A403 Y404 I469 L473	F361-Q406 HydrophobicContact CE1-CB 4.22Å; F361-Q406 HydrophobicContact CE1-CG 4.28Å; A403-Q406 HydrophobicContact CB-CG 4.05Å; A403-Q406 WeakPolarHBondContact O-CB 3.35Å; A403-Q406 PolarHBondContact O-N 3.15Å; Y404-Q406 PolarHBondContact O-N 2.78Å; Q406-I469 HydrophobicContact CB-CD1 3.93Å; Q406-I469 HydrophobicContact CG-CD1 4.44Å; Q406-L473 HydrophobicContact CG-CD1 4.4Å
407	L	93.1	Very high	94	Very high	2 Å²	2	31 Å²	31	1%	0.01	15%	0.146	C	C	.	.	S	Bend	trans	-99.2	151.7	179.7	-60.6	-170.1	0	0	0	111.7	N115 Y404 H411 L412 L416 I424 R462 L466 I469	N115-L407 WeakPolarHBondContact CB-O 3.44Å; Y404-L407 PolarHBondContact O-N 3.39Å; L407-H411 HydrophobicContact CB-CB 4.27Å; L407-L412 HydrophobicContact CB-CD1 4.48Å; L407-L412 HydrophobicContact CB-CD2 3.99Å; L407-L412 HydrophobicContact CB-CG 3.92Å; L407-L412 HydrophobicContact CD1-CD2 4.18Å; L407-L416 HydrophobicContact CD1-CD1 4.29Å; L407-I424 HydrophobicContact CD2-CD1 3.84Å; L407-R462 HydrophobicContact CD1-CG 4.3Å; L407-L466 HydrophobicContact CD1-CD1 4.26Å; L407-L466 HydrophobicContact CD1-CD2 3.47Å; L407-L466 VanDerWaalsContact CD1-CD2 3.47Å; L407-L466 HydrophobicContact CD1-CG 3.62Å; L407-L466 HydrophobicContact CG-CD2 3.86Å; L407-I469 HydrophobicContact CD2-CD1 4.44Å
408	S	91.5	Very high	93.9	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.021	16%	0.158	C	C	.	.			trans	-76.6	163.8	173.7	69	0	0	0	0	111.5	K112 E410 H411 L412	K112-S408 VanDerWaalsContact O-CB 3.28Å; K112-S408 WeakPolarHBondContact O-CB 3.37Å; S408-E410 PolarHBondContact O-N 3.38Å; S408-H411 PolarHBondContact O-N 3.34Å; S408-H411 PolarHBondContact OG-N 3.1Å; S408-H411 PolarHBondContact OG-ND1 3.44Å; S408-L412 VanDerWaalsContact O-CG 3.31Å; S408-L412 WeakPolarHBondContact O-CG 3.14Å; S408-L412 PolarHBondContact O-N 2.94Å
409	T	91.2	Very high	93.7	Very high	11 Å²	11	40 Å²	40	7%	0.067	19%	0.188	C	C	.	.	H	α-helix	trans	-57.9	-39.4	176.3	-60.8	0	0	0	0	112.2	N115 E116 L412 Q413	N115-T409 VanDerWaalsContact CA-OG1 3.29Å; N115-T409 WeakPolarHBondContact CA-OG1 3.22Å; E116-T409 HydrophobicContact CG-CG2 4.05Å; E116-T409 WeakPolarHBondContact CG-OG1 3.37Å; E116-T409 PolarHBondContact N-OG1 3.08Å; T409-L412 PolarHBondContact O-N 3.4Å; T409-Q413 VanDerWaalsContact O-CB 3.26Å; T409-Q413 WeakPolarHBondContact O-CB 3.15Å; T409-Q413 PolarHBondContact O-N 3.23Å
410	E	90.5	Very high	93.7	Very high	110 Å²	110	42.4 Å²	42.4	51%	0.514	20%	0.201	S	C	.	.	H	α-helix	trans	-61.5	-47.7	179.9	-172.7	177.7	174.1	0	0	111.4	S408 L412 Q413 Y414	S408-E410 PolarHBondContact O-N 3.38Å; E410-L412 VanDerWaalsContact C-N 3.31Å; E410-L412 PolarHBondContact O-N 3.08Å; E410-Q413 PolarHBondContact O-N 3.14Å; E410-Y414 HydrophobicContact CG-CD2 3.95Å; E410-Y414 PolarHBondContact O-N 2.99Å
411	H	94.2	Very high	93.7	Very high	24 Å²	24	40.1 Å²	40.1	11%	0.111	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-37.6	176.7	-66	167.5	0	0	0	112.3	L407 S408 G415 L416 R462	L407-H411 HydrophobicContact CB-CB 4.27Å; S408-H411 PolarHBondContact O-N 3.34Å; S408-H411 PolarHBondContact OG-N 3.1Å; S408-H411 PolarHBondContact OG-ND1 3.44Å; H411-G415 CarbonylContact O-C 3.54Å; H411-G415 WeakPolarHBondContact O-CA 3.43Å; H411-G415 PolarHBondContact O-N 2.89Å; H411-L416 HydrophobicContact CB-CD2 3.64Å; H411-L416 HydrophobicContact CB-CG 4.28Å; H411-L416 VanDerWaalsContact CD2-CD2 3.48Å; H411-L416 WeakPolarHBondContact CD2-CD2 3.31Å; H411-R462 WeakPolarHBondContact O-CD 2.95Å
412	L	93.9	Very high	93.8	Very high	1 Å²	1	42 Å²	42	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-70.7	-42.3	178.7	-70.3	169.2	0	0	0	112	N115 Y404 L407 S408 T409 E410 R462 L466 Y521	N115-L412 HydrophobicContact CB-CD1 3.69Å; Y404-L412 HydrophobicContact CD1-CD1 4.41Å; Y404-L412 HydrophobicContact CD2-CD2 3.82Å; Y404-L412 HydrophobicContact CE1-CD1 3.83Å; Y404-L412 HydrophobicContact CE2-CD1 3.97Å; Y404-L412 HydrophobicContact CE2-CD2 3.58Å; Y404-L412 HydrophobicContact CE2-CG 4.33Å; L407-L412 HydrophobicContact CB-CD1 4.48Å; L407-L412 HydrophobicContact CB-CD2 3.99Å; L407-L412 HydrophobicContact CB-CG 3.92Å; L407-L412 HydrophobicContact CD1-CD2 4.18Å; S408-L412 VanDerWaalsContact O-CG 3.31Å; S408-L412 WeakPolarHBondContact O-CG 3.14Å; S408-L412 PolarHBondContact O-N 2.94Å; T409-L412 PolarHBondContact O-N 3.4Å; E410-L412 VanDerWaalsContact C-N 3.31Å; E410-L412 PolarHBondContact O-N 3.08Å; L412-R462 WeakPolarHBondContact O-CD 3.44Å; L412-R462 PolarHBondContact O-NH1 2.86Å; L412-L466 HydrophobicContact CD2-CD1 4.11Å; L412-Y521 HydrophobicContact CB-CD2 3.69Å; L412-Y521 HydrophobicContact CB-CE2 3.96Å; L412-Y521 WeakPolarHBondContact O-CB 3.33Å
413	Q	92.6	Very high	93.8	Very high	81 Å²	81	42.2 Å²	42.2	38%	0.379	20%	0.204	S	C	.	.	H	α-helix	trans	-78.2	-45.6	-175.2	-176.6	174.2	3.9	0	0	113	T409 E410 Y521	T409-Q413 VanDerWaalsContact O-CB 3.26Å; T409-Q413 WeakPolarHBondContact O-CB 3.15Å; T409-Q413 PolarHBondContact O-N 3.23Å; E410-Q413 PolarHBondContact O-N 3.14Å; Q413-Y521 HydrophobicContact CB-CD1 3.75Å; Q413-Y521 HydrophobicContact CB-CE1 3.84Å; Q413-Y521 HydrophobicContact CB-CG 4.13Å; Q413-Y521 HydrophobicContact CG-CD1 3.76Å; Q413-Y521 HydrophobicContact CG-CE1 3.88Å
414	Y	93.6	Very high	93.8	Very high	152 Å²	152	42.3 Å²	42.3	60%	0.596	20%	0.204	S	C	*	.	H	α-helix	trans	-103.8	-10	-172.2	-56.6	-65.2	0	0	0	113.4	E410 P458	E410-Y414 HydrophobicContact CG-CD2 3.95Å; E410-Y414 PolarHBondContact O-N 2.99Å; Y414-P458 WeakPolarHBondContact O-CB 3.32Å
415	G	94.3	Very high	94	Very high	9 Å²	9	42 Å²	42	9%	0.093	20%	0.203	C	C	.	.			trans	91.3	-172.7	-177.8	0	0	0	0	0	113.4	H411 P458	H411-G415 CarbonylContact O-C 3.54Å; H411-G415 WeakPolarHBondContact O-CA 3.43Å; H411-G415 PolarHBondContact O-N 2.89Å; G415-P458 CarbonylContact C-O 3.22Å; G415-P458 VanDerWaalsContact CA-O 3.25Å; G415-P458 WeakPolarHBondContact CA-O 3.45Å
416	L	94.9	Very high	94.2	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.2	C	C	.	.			trans	-117.8	132.8	-179.7	-71.6	174.5	0	0	0	110.1	L407 H411 N420 I424 P458 V461 R462 V465	L407-L416 HydrophobicContact CD1-CD1 4.29Å; H411-L416 HydrophobicContact CB-CD2 3.64Å; H411-L416 HydrophobicContact CB-CG 4.28Å; H411-L416 VanDerWaalsContact CD2-CD2 3.48Å; H411-L416 WeakPolarHBondContact CD2-CD2 3.31Å; L416-N420 HydrophobicContact CD2-CB 3.74Å; L416-I424 HydrophobicContact CD1-CD1 3.87Å; L416-I424 HydrophobicContact CD2-CD1 4.15Å; L416-P458 PolarHBondContact N-O 3.15Å; L416-P458 VanDerWaalsContact O-CA 3.28Å; L416-P458 WeakPolarHBondContact O-CA 3.23Å; L416-V461 HydrophobicContact CB-CB 4.42Å; L416-V461 HydrophobicContact CB-CG1 3.9Å; L416-V461 VanDerWaalsContact O-CB 3.28Å; L416-V461 WeakPolarHBondContact O-CB 3.36Å; L416-V461 WeakPolarHBondContact O-CG1 3.18Å; L416-R462 HydrophobicContact CB-CB 4.5Å; L416-R462 HydrophobicContact CG-CB 4.29Å; L416-V465 HydrophobicContact CD1-CB 3.73Å; L416-V465 HydrophobicContact CD1-CG1 3.79Å; L416-V465 HydrophobicContact CD1-CG2 3.78Å
417	D	93.8	Very high	94.4	Very high	79 Å²	79	39.1 Å²	39.1	42%	0.422	19%	0.187	S	C	.	.			trans	-76.7	169.3	162.9	71.3	6.8	0	0	0	110.6	K419 N420 R421	D417-K419 PolarHBondContact O-N 2.69Å; D417-K419 PolarHBondContact OD1-N 3.19Å; D417-N420 PolarHBondContact O-N 3.24Å; D417-N420 VanDerWaalsContact OD1-CB 3.24Å; D417-N420 WeakPolarHBondContact OD1-CB 3.41Å; D417-N420 PolarHBondContact OD1-N 3.29Å; D417-N420 PolarHBondContact OD1-ND2 3.33Å; D417-R421 PolarHBondContact O-N 3.37Å
418	V	93.7	Very high	94.5	Very high	44 Å²	44	39.5 Å²	39.5	27%	0.267	19%	0.189	S	C	.	.	H	α-helix	trans	-58.5	-36.3	179.3	-175.3	0	0	0	0	111.4	R421 D422 Q456	V418-R421 WeakPolarHBondContact O-CB 3.49Å; V418-R421 PolarHBondContact O-N 3.25Å; V418-D422 WeakPolarHBondContact O-CB 3.39Å; V418-D422 PolarHBondContact O-N 3.32Å; V418-Q456 HydrophobicContact CG2-CB 4.26Å; V418-Q456 HydrophobicContact CG2-CG 4.47Å
419	K	94.5	Very high	94.7	Very high	145 Å²	145	39.3 Å²	39.3	63%	0.63	19%	0.188	S	C	*	.	H	α-helix	trans	-66.2	-44.5	-178.7	-177.1	-174.5	174.7	-171.5	0	111.2	D417 D422 A423	D417-K419 PolarHBondContact O-N 2.69Å; D417-K419 PolarHBondContact OD1-N 3.19Å; K419-D422 PolarHBondContact O-N 2.94Å; K419-A423 WeakPolarHBondContact O-CB 3.39Å; K419-A423 PolarHBondContact O-N 2.62Å
420	N	94.6	Very high	94.8	Very high	55 Å²	55	39.1 Å²	39.1	29%	0.294	19%	0.186	S	C	.	.	H	α-helix	trans	-69.1	-40.5	178	-69.3	-26.3	0	0	0	110.9	L416 D417 D422 A423 I424	L416-N420 HydrophobicContact CD2-CB 3.74Å; D417-N420 PolarHBondContact O-N 3.24Å; D417-N420 VanDerWaalsContact OD1-CB 3.24Å; D417-N420 WeakPolarHBondContact OD1-CB 3.41Å; D417-N420 PolarHBondContact OD1-N 3.29Å; D417-N420 PolarHBondContact OD1-ND2 3.33Å; N420-D422 VanDerWaalsContact C-N 3.34Å; N420-D422 PolarHBondContact O-N 3.37Å; N420-A423 PolarHBondContact O-N 2.95Å; N420-I424 VanDerWaalsContact O-CG1 3.3Å; N420-I424 WeakPolarHBondContact O-CG1 3.37Å; N420-I424 PolarHBondContact O-N 3.26Å
421	R	95.6	Very high	95	Very high	21 Å²	21	34 Å²	34	8%	0.079	16%	0.162	C	C	.	.	H	α-helix	trans	-53	-53	169.4	175.9	-161.2	74.6	-177.9	4.1	110.9	D417 V418 A423 I424 Y425 V461 V465	D417-R421 PolarHBondContact O-N 3.37Å; V418-R421 WeakPolarHBondContact O-CB 3.49Å; V418-R421 PolarHBondContact O-N 3.25Å; R421-A423 VanDerWaalsContact C-N 3.33Å; R421-A423 PolarHBondContact O-N 2.88Å; R421-I424 PolarHBondContact O-N 3.15Å; R421-Y425 HydrophobicContact CG-CD2 4.02Å; R421-Y425 HydrophobicContact CG-CE2 3.72Å; R421-Y425 PolarHBondContact O-N 3.41Å; R421-V461 HydrophobicContact CB-CG1 3.75Å; R421-V461 HydrophobicContact CG-CG1 4.17Å; R421-V465 HydrophobicContact CB-CG2 3.95Å; R421-V465 HydrophobicContact CG-CG2 3.54Å
422	D	96.1	Very high	94.8	Very high	43 Å²	43	34.7 Å²	34.7	23%	0.23	17%	0.165	C	C	.	.	H	α-helix	trans	-64.2	-39.3	-176.9	-70.2	-2.8	0	0	0	111.2	V418 K419 N420 I424 Y425 R426 F441	V418-D422 WeakPolarHBondContact O-CB 3.39Å; V418-D422 PolarHBondContact O-N 3.32Å; K419-D422 PolarHBondContact O-N 2.94Å; N420-D422 VanDerWaalsContact C-N 3.34Å; N420-D422 PolarHBondContact O-N 3.37Å; D422-I424 PolarHBondContact O-N 2.9Å; D422-Y425 PolarHBondContact O-N 2.99Å; D422-R426 WeakPolarHBondContact O-CB 3.32Å; D422-R426 WeakPolarHBondContact O-CD 3.47Å; D422-R426 WeakPolarHBondContact O-CG 3.34Å; D422-R426 PolarHBondContact O-N 3.47Å; D422-F441 HydrophobicContact CB-CE2 4.25Å; D422-F441 HydrophobicContact CB-CZ 3.98Å
423	A	96.5	Very high	94.7	Very high	12 Å²	12	35.8 Å²	35.8	10%	0.099	17%	0.17	C	C	.	.	H	α-helix	trans	-62	-40.5	175.3	0	0	0	0	0	112.6	K419 N420 R421 T427 F640	K419-A423 WeakPolarHBondContact O-CB 3.39Å; K419-A423 PolarHBondContact O-N 2.62Å; N420-A423 PolarHBondContact O-N 2.95Å; R421-A423 VanDerWaalsContact C-N 3.33Å; R421-A423 PolarHBondContact O-N 2.88Å; A423-T427 WeakPolarHBondContact O-CB 3.43Å; A423-T427 PolarHBondContact O-N 3.42Å; A423-T427 VanDerWaalsContact O-N 3.07Å; A423-T427 PolarHBondContact O-OG1 3.24Å; A423-F640 HydrophobicContact CB-CB 4.26Å; A423-F640 PolarHBondContact O-N 3.05Å
424	I	96.7	Very high	94.5	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-63	-53.1	175.7	-69.9	164.4	0	0	0	110.1	F361 L407 L416 N420 R421 D422 R426 T427 F428 V465 I469 F640	F361-I424 HydrophobicContact CZ-CG2 4.24Å; L407-I424 HydrophobicContact CD2-CD1 3.84Å; L416-I424 HydrophobicContact CD1-CD1 3.87Å; L416-I424 HydrophobicContact CD2-CD1 4.15Å; N420-I424 VanDerWaalsContact O-CG1 3.3Å; N420-I424 WeakPolarHBondContact O-CG1 3.37Å; N420-I424 PolarHBondContact O-N 3.26Å; R421-I424 PolarHBondContact O-N 3.15Å; D422-I424 PolarHBondContact O-N 2.9Å; I424-R426 PolarHBondContact O-N 2.89Å; I424-T427 PolarHBondContact O-N 3.45Å; I424-F428 PolarHBondContact O-N 3.45Å; I424-V465 HydrophobicContact CD1-CG1 4.07Å; I424-V465 HydrophobicContact CG2-CG1 4.09Å; I424-I469 HydrophobicContact CG2-CG2 4.22Å; I424-F640 HydrophobicContact CG1-CB 3.96Å; I424-F640 HydrophobicContact CG1-CD1 4.03Å; I424-F640 HydrophobicContact CG1-CD2 3.99Å; I424-F640 HydrophobicContact CG1-CG 3.71Å
425	Y	97.3	Very high	94.4	Very high	3 Å²	3	29.5 Å²	29.5	1%	0.012	15%	0.151	C	C	.	.	H	α-helix	trans	-63.1	-40.5	179.5	-70	-12.6	0	0	0	112.6	R421 D422 T427 F428 V429 I444 V445 V465 A468	R421-Y425 HydrophobicContact CG-CD2 4.02Å; R421-Y425 HydrophobicContact CG-CE2 3.72Å; R421-Y425 PolarHBondContact O-N 3.41Å; D422-Y425 PolarHBondContact O-N 2.99Å; Y425-T427 VanDerWaalsContact C-N 3.28Å; Y425-T427 PolarHBondContact O-N 2.91Å; Y425-F428 PolarHBondContact O-N 3.42Å; Y425-V429 WeakPolarHBondContact O-CB 3.49Å; Y425-V429 VanDerWaalsContact O-CG2 3.27Å; Y425-V429 WeakPolarHBondContact O-CG2 3.16Å; Y425-V429 PolarHBondContact O-N 3Å; Y425-I444 HydrophobicContact CD1-CG2 4.09Å; Y425-I444 HydrophobicContact CD2-CG2 3.88Å; Y425-I444 HydrophobicContact CE1-CG2 4.03Å; Y425-I444 HydrophobicContact CE2-CG2 3.79Å; Y425-I444 HydrophobicContact CG-CG2 4.03Å; Y425-V445 HydrophobicContact CD2-CG2 3.77Å; Y425-V445 HydrophobicContact CE2-CG2 4.2Å; Y425-V465 HydrophobicContact CE1-CG1 4.46Å; Y425-V465 HydrophobicContact CE1-CG2 4.2Å; Y425-A468 HydrophobicContact CE1-CB 3.89Å; Y425-A468 WeakPolarHBondContact OH-CB 3.05Å
426	R	97	Very high	94.3	Very high	25 Å²	25	29.7 Å²	29.7	9%	0.094	15%	0.149	C	C	.	.	H	α-helix	trans	-59.6	-40.5	175.2	-75.6	171.4	64.9	80.8	1.9	111.9	D422 I424 R430 F441 L630 P631 S638 Y639	D422-R426 WeakPolarHBondContact O-CB 3.32Å; D422-R426 WeakPolarHBondContact O-CD 3.47Å; D422-R426 WeakPolarHBondContact O-CG 3.34Å; D422-R426 PolarHBondContact O-N 3.47Å; I424-R426 PolarHBondContact O-N 2.89Å; R426-R430 WeakPolarHBondContact O-CB 3.45Å; R426-R430 PolarHBondContact O-N 3.34Å; R426-F441 HydrophobicContact CG-CD2 3.86Å; R426-F441 HydrophobicContact CG-CE2 3.65Å; R426-F441 HydrophobicContact CG-CZ 4.32Å; R426-L630 HydrophobicContact CB-CD1 4.02Å; R426-L630 HydrophobicContact CG-CD1 4.15Å; R426-P631 VanDerWaalsContact CZ-O 3.28Å; R426-P631 PolarHBondContact NH1-O 3.07Å; R426-P631 PolarHBondContact NH2-O 2.93Å; R426-S638 WeakPolarHBondContact CD-O 3.28Å; R426-S638 PolarHBondContact NE-O 3.05Å; R426-S638 VanDerWaalsContact NE-O 3.12Å; R426-S638 PolarHBondContact NE-OG 3.12Å; R426-S638 PolarHBondContact NH2-OG 3.2Å; R426-Y639 HydrophobicContact CB-CD1 3.89Å; R426-Y639 HydrophobicContact CB-CE1 3.87Å
427	T	96.4	Very high	94.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-68.4	-48.1	178.3	-52.9	0	0	0	0	110.9	T360 F361 A423 I424 Y425 V429 R430 N431 F640 V643	T360-T427 HydrophobicContact CG2-CG2 4.44Å; F361-T427 HydrophobicContact CE2-CG2 4.48Å; A423-T427 WeakPolarHBondContact O-CB 3.43Å; A423-T427 PolarHBondContact O-N 3.42Å; A423-T427 VanDerWaalsContact O-N 3.07Å; A423-T427 PolarHBondContact O-OG1 3.24Å; I424-T427 PolarHBondContact O-N 3.45Å; Y425-T427 VanDerWaalsContact C-N 3.28Å; Y425-T427 PolarHBondContact O-N 2.91Å; T427-V429 VanDerWaalsContact C-N 3.33Å; T427-V429 PolarHBondContact O-N 3.19Å; T427-R430 PolarHBondContact O-N 2.81Å; T427-N431 WeakPolarHBondContact O-CB 3.3Å; T427-N431 PolarHBondContact O-N 3.15Å; T427-F640 WeakPolarHBondContact CG2-O 3.48Å; T427-F640 PolarHBondContact OG1-N 3.23Å; T427-F640 PolarHBondContact OG1-O 3.49Å; T427-V643 HydrophobicContact CG2-CG2 4.38Å
428	F	96	Very high	94.2	Very high	10 Å²	10	28.1 Å²	28.1	4%	0.044	14%	0.141	C	C	.	.	H	α-helix	trans	-53.2	-53.4	175.1	178.1	-95	0	0	0	110.3	F361 I424 Y425 R430 N431 M432 Y433 I444 A472 L473 W608	F361-F428 HydrophobicContact CD2-CB 4.08Å; F361-F428 HydrophobicContact CD2-CD2 4.02Å; F361-F428 HydrophobicContact CE2-CB 3.92Å; F361-F428 HydrophobicContact CE2-CD2 4.42Å; F361-F428 HydrophobicContact CG-CD2 4.4Å; I424-F428 PolarHBondContact O-N 3.45Å; Y425-F428 PolarHBondContact O-N 3.42Å; F428-R430 VanDerWaalsContact C-N 3.34Å; F428-R430 PolarHBondContact O-N 2.72Å; F428-N431 PolarHBondContact O-N 3.02Å; F428-M432 HydrophobicContact CD1-CG 4.41Å; F428-M432 HydrophobicContact CD2-CG 3.96Å; F428-M432 HydrophobicContact CE1-CG 4.13Å; F428-M432 HydrophobicContact CE2-CG 3.65Å; F428-M432 HydrophobicContact CG-CG 4.32Å; F428-M432 HydrophobicContact CZ-CG 3.72Å; F428-M432 WeakPolarHBondContact O-CB 3.39Å; F428-M432 VanDerWaalsContact O-CG 3.22Å; F428-M432 WeakPolarHBondContact O-CG 3.46Å; F428-M432 PolarHBondContact O-N 3.45Å; F428-Y433 AromaticContact CE1-CE2 3.88Å; F428-Y433 HydrophobicContact CE1-CE2 3.88Å; F428-I444 HydrophobicContact CD1-CD1 4.25Å; F428-I444 HydrophobicContact CE1-CD1 4.36Å; F428-A472 HydrophobicContact CE1-CB 4.35Å; F428-A472 HydrophobicContact CE2-CB 3.89Å; F428-A472 HydrophobicContact CZ-CB 3.55Å; F428-L473 HydrophobicContact CD2-CD2 4.32Å; F428-L473 HydrophobicContact CE2-CD2 3.79Å; F428-L473 HydrophobicContact CE2-CG 4.39Å; F428-W608 AromaticContact CE1-CH2 3.88Å; F428-W608 HydrophobicContact CE1-CH2 3.88Å; F428-W608 AromaticContact CE1-CZ3 3.63Å; F428-W608 HydrophobicContact CE1-CZ3 3.63Å; F428-W608 HydrophobicContact CZ-CH2 4.35Å; F428-W608 HydrophobicContact CZ-CZ3 4Å
429	V	95.6	Very high	94.3	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.3	-41.3	-178.9	172.6	0	0	0	0	112.4	Y425 T427 Y433 R437 I440 F441 I444	Y425-V429 WeakPolarHBondContact O-CB 3.49Å; Y425-V429 VanDerWaalsContact O-CG2 3.27Å; Y425-V429 WeakPolarHBondContact O-CG2 3.16Å; Y425-V429 PolarHBondContact O-N 3Å; T427-V429 VanDerWaalsContact C-N 3.33Å; T427-V429 PolarHBondContact O-N 3.19Å; V429-Y433 HydrophobicContact CB-CD2 4.46Å; V429-Y433 HydrophobicContact CG1-CD2 4.25Å; V429-Y433 HydrophobicContact CG2-CD2 4.49Å; V429-Y433 PolarHBondContact O-N 2.93Å; V429-R437 HydrophobicContact CG1-CB 3.6Å; V429-R437 HydrophobicContact CG1-CG 3.82Å; V429-R437 WeakPolarHBondContact CG1-O 3.43Å; V429-I440 HydrophobicContact CG1-CB 4.41Å; V429-I440 HydrophobicContact CG1-CG2 4.2Å; V429-I440 HydrophobicContact CG2-CG2 3.86Å; V429-F441 HydrophobicContact CG2-CB 4.29Å; V429-I444 HydrophobicContact CG2-CD1 3.64Å
430	R	93.4	Very high	94.3	Very high	6 Å²	6	23 Å²	23	2%	0.023	12%	0.116	C	C	.	.	H	α-helix	trans	-65.2	-39.1	179.8	173.3	60.7	-169.2	159.7	8	112.6	R426 T427 F428 R437 L630 Y639 V643 R644 Y646	R426-R430 WeakPolarHBondContact O-CB 3.45Å; R426-R430 PolarHBondContact O-N 3.34Å; T427-R430 PolarHBondContact O-N 2.81Å; F428-R430 VanDerWaalsContact C-N 3.34Å; F428-R430 PolarHBondContact O-N 2.72Å; R430-R437 VanDerWaalsContact NH1-CZ 3.31Å; R430-L630 HydrophobicContact CB-CD1 4.41Å; R430-Y639 HydrophobicContact CB-CE1 3.86Å; R430-Y639 HydrophobicContact CG-CE1 4.09Å; R430-V643 HydrophobicContact CG-CB 4.44Å; R430-V643 HydrophobicContact CG-CG1 3.36Å; R430-V643 HydrophobicContact CG-CG2 4.27Å; R430-R644 PolarHBondContact NH2-O 2.71Å; R430-R644 PolarHBondContact O-NE 3.35Å; R430-R644 PolarHBondContact O-NH2 3.03Å; R430-Y646 VanDerWaalsContact NH1-CZ 3.3Å
431	N	93.8	Very high	94.5	Very high	2 Å²	2	21.6 Å²	21.6	1%	0.011	11%	0.107	C	C	.	.	H	α-helix	trans	-81.2	-33.3	-178.6	-72.4	-4.2	0	0	0	112.4	T360 L362 T427 F428 V642 V643 R644	T360-N431 PolarHBondContact O-ND2 3.44Å; L362-N431 HydrophobicContact CD1-CB 3.96Å; L362-N431 HydrophobicContact CG-CB 4.39Å; T427-N431 WeakPolarHBondContact O-CB 3.3Å; T427-N431 PolarHBondContact O-N 3.15Å; F428-N431 PolarHBondContact O-N 3.02Å; N431-V642 PolarHBondContact ND2-O 2.87Å; N431-V642 VanDerWaalsContact ND2-O 3.1Å; N431-V643 WeakPolarHBondContact OD1-CA 3.19Å; N431-R644 WeakPolarHBondContact O-CD 3.39Å; N431-R644 PolarHBondContact O-NE 3.02Å; N431-R644 VanDerWaalsContact O-NE 3.15Å; N431-R644 PolarHBondContact O-NH1 2.76Å; N431-R644 PolarHBondContact OD1-N 2.99Å
432	M	91.4	Very high	94.5	Very high	39 Å²	39	24.8 Å²	24.8	19%	0.192	13%	0.126	C	C	.	.	H	α-helix	trans	-87.1	-47	-177.7	-61.7	-51.6	121.4	0	0	113.7	S298 F361 L362 F428	S298-M432 WeakPolarHBondContact CB-SD 3.26Å; F361-M432 HydrophobicContact CB-CE 3.76Å; L362-M432 HydrophobicContact CD1-CE 4.33Å; L362-M432 HydrophobicContact CD2-CE 3.3Å; L362-M432 HydrophobicContact CD2-SD 4.06Å; L362-M432 HydrophobicContact CG-CE 3.6Å; F428-M432 HydrophobicContact CD1-CG 4.41Å; F428-M432 HydrophobicContact CD2-CG 3.96Å; F428-M432 HydrophobicContact CE1-CG 4.13Å; F428-M432 HydrophobicContact CE2-CG 3.65Å; F428-M432 HydrophobicContact CG-CG 4.32Å; F428-M432 HydrophobicContact CZ-CG 3.72Å; F428-M432 WeakPolarHBondContact O-CB 3.39Å; F428-M432 VanDerWaalsContact O-CG 3.22Å; F428-M432 WeakPolarHBondContact O-CG 3.46Å; F428-M432 PolarHBondContact O-N 3.45Å
433	Y	91.6	Very high	94.6	Very high	24 Å²	24	23.5 Å²	23.5	9%	0.094	12%	0.122	C	C	.	.			trans	-105.8	151.3	-168.1	-58.3	-78.6	0	0	0	112.4	F428 V429 R437 I440 E616 R644	F428-Y433 AromaticContact CE1-CE2 3.88Å; F428-Y433 HydrophobicContact CE1-CE2 3.88Å; V429-Y433 HydrophobicContact CB-CD2 4.46Å; V429-Y433 HydrophobicContact CG1-CD2 4.25Å; V429-Y433 HydrophobicContact CG2-CD2 4.49Å; V429-Y433 PolarHBondContact O-N 2.93Å; Y433-R437 VanDerWaalsContact O-CZ 3.29Å; Y433-R437 PolarHBondContact O-NE 3.42Å; Y433-R437 PolarHBondContact O-NH2 2.77Å; Y433-I440 HydrophobicContact CD1-CD1 3.8Å; Y433-I440 HydrophobicContact CD2-CD1 4.17Å; Y433-I440 HydrophobicContact CD2-CG2 3.81Å; Y433-I440 HydrophobicContact CE1-CD1 4.38Å; Y433-I440 HydrophobicContact CE2-CG2 3.79Å; Y433-I440 HydrophobicContact CG-CD1 3.68Å; Y433-I440 HydrophobicContact CG-CG2 4.4Å; Y433-E616 HydrophobicContact CD1-CB 4.35Å; Y433-E616 HydrophobicContact CD1-CG 4.36Å; Y433-E616 WeakPolarHBondContact CD1-OE2 3.17Å; Y433-R644 PolarHBondContact O-NH2 3.28Å
434	S	88.2	Confident	94.6	Very high	50 Å²	50	23 Å²	23	35%	0.35	12%	0.117	S	C	.	.	S	Bend	trans	-103.2	-33.2	176.5	-60.2	0	0	0	0	113	E616	S434-E616 PolarHBondContact N-OE1 3.33Å; S434-E616 VanDerWaalsContact N-OE1 3.14Å
435	F	90.8	Very high	94.6	Very high	51 Å²	51	24.2 Å²	24.2	22%	0.224	13%	0.125	C	C	.	.	S	Bend	trans	-115.5	160.1	-172.9	-54.4	-78.4	0	0	0	112	R437 I440 E616 G619 R620 H628	F435-R437 PolarHBondContact O-N 3.19Å; F435-I440 WeakPolarHBondContact O-CD1 3.21Å; F435-E616 HydrophobicContact CB-CG 4.25Å; F435-E616 HydrophobicContact CD2-CG 4.08Å; F435-G619 WeakPolarHBondContact CD1-O 3.23Å; F435-R620 HydrophobicContact CD2-CG 4.19Å; F435-R620 HydrophobicContact CE2-CG 3.8Å; F435-R620 HydrophobicContact CZ-CG 4.18Å; F435-H628 AromaticContact CD1-CD2 3.64Å; F435-H628 AromaticContact CD1-CE1 3.93Å; F435-H628 AromaticContact CD1-CG 3.94Å; F435-H628 AromaticContact CD1-NE2 3.63Å
436	H	91.8	Very high	94.5	Very high	14 Å²	14	28.4 Å²	28.4	7%	0.065	15%	0.147	C	C	.	.			trans	43.9	39.5	173.9	-62.3	-61.8	0	0	0	115.6	T438 E439 I440 L615 T618 G619 E622 H628	H436-T438 PolarHBondContact O-N 2.95Å; H436-E439 VanDerWaalsContact CA-OE2 3.26Å; H436-E439 WeakPolarHBondContact CA-OE2 3.31Å; H436-E439 HydrophobicContact CB-CB 4.35Å; H436-E439 IonicContact ND1-OE2 3.96Å; H436-E439 PolarHBondContact O-N 2.97Å; H436-I440 WeakPolarHBondContact O-CB 3.15Å; H436-I440 VanDerWaalsContact O-CG1 3.29Å; H436-I440 WeakPolarHBondContact O-CG1 3.39Å; H436-I440 PolarHBondContact O-N 3.16Å; H436-L615 HydrophobicContact CB-CG 4.45Å; H436-L615 PolarHBondContact CD2-O 3.04Å; H436-T618 PolarHBondContact CD2-OG1 3.33Å; H436-T618 PolarHBondContact NE2-OG1 3.42Å; H436-G619 VanDerWaalsContact CD2-CA 3.44Å; H436-G619 WeakPolarHBondContact CD2-CA 3.49Å; H436-G619 PolarHBondContact CD2-N 2.85Å; H436-G619 WeakPolarHBondContact NE2-CA 3.18Å; H436-G619 PolarHBondContact NE2-N 3.4Å; H436-E622 VanDerWaalsContact CE1-CD 3.4Å; H436-E622 IonicContact CE1-OE1 3.25Å; H436-E622 PolarHBondContact CE1-OE1 3.35Å; H436-E622 VanDerWaalsContact CE1-OE1 3.32Å; H436-E622 IonicContact CE1-OE2 3.66Å; H436-E622 PolarHBondContact CE1-OE2 3.46Å; H436-E622 VanDerWaalsContact CE1-OE2 3.23Å; H436-E622 IonicContact ND1-OE2 3.54Å; H436-E622 IonicContact NE2-OE1 3.56Å; H436-H628 PolarHBondContact N-ND1 3.24Å
437	R	93.5	Very high	94.5	Very high	16 Å²	16	29.5 Å²	29.5	6%	0.06	15%	0.153	C	C	.	.	H	α-helix	trans	-62.5	-32.1	-171.3	-68.4	-175.3	-179.4	120.6	-0	112.6	V429 R430 Y433 F435 F441 H628 L630	V429-R437 HydrophobicContact CG1-CB 3.6Å; V429-R437 HydrophobicContact CG1-CG 3.82Å; V429-R437 WeakPolarHBondContact CG1-O 3.43Å; R430-R437 VanDerWaalsContact NH1-CZ 3.31Å; Y433-R437 VanDerWaalsContact O-CZ 3.29Å; Y433-R437 PolarHBondContact O-NE 3.42Å; Y433-R437 PolarHBondContact O-NH2 2.77Å; F435-R437 PolarHBondContact O-N 3.19Å; R437-F441 WeakPolarHBondContact O-CB 3.31Å; R437-F441 PolarHBondContact O-N 2.91Å; R437-H628 WeakPolarHBondContact CB-O 3.49Å; R437-H628 WeakPolarHBondContact CD-O 3.46Å; R437-H628 WeakPolarHBondContact CG-O 3.42Å; R437-L630 HydrophobicContact CB-CD2 4.07Å; R437-L630 HydrophobicContact CB-CG 3.86Å; R437-L630 WeakPolarHBondContact O-CD2 3.01Å
438	T	94.5	Very high	94.5	Very high	30 Å²	30	30.2 Å²	30.2	18%	0.184	16%	0.156	C	C	.	.	H	α-helix	trans	-68.4	-45.6	179.2	-58.2	0	0	0	0	111.1	H436 F441 N442 L629 P631	H436-T438 PolarHBondContact O-N 2.95Å; T438-F441 PolarHBondContact O-N 3.33Å; T438-N442 WeakPolarHBondContact O-CB 3.3Å; T438-N442 VanDerWaalsContact O-CG 3.25Å; T438-N442 PolarHBondContact O-N 3.3Å; T438-N442 PolarHBondContact O-ND2 3.04Å; T438-L629 PolarHBondContact OG1-O 3.09Å; T438-P631 HydrophobicContact CG2-CG 4.43Å; T438-P631 WeakPolarHBondContact OG1-CD 3.44Å
439	E	94.4	Very high	94.3	Very high	82 Å²	82	31.2 Å²	31.2	38%	0.383	16%	0.162	S	C	.	.	H	α-helix	trans	-65.9	-45.3	178.8	-62.9	70.5	-156.9	0	0	110.7	H436 F441 N442 A443 L615	H436-E439 VanDerWaalsContact CA-OE2 3.26Å; H436-E439 WeakPolarHBondContact CA-OE2 3.31Å; H436-E439 HydrophobicContact CB-CB 4.35Å; H436-E439 IonicContact ND1-OE2 3.96Å; H436-E439 PolarHBondContact O-N 2.97Å; E439-F441 PolarHBondContact O-N 2.87Å; E439-N442 PolarHBondContact O-N 3.34Å; E439-A443 WeakPolarHBondContact O-CB 3.46Å; E439-A443 PolarHBondContact O-N 2.92Å; E439-L615 HydrophobicContact CB-CD1 4.49Å; E439-L615 HydrophobicContact CB-CD2 3.99Å
440	I	96.1	Very high	94	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.1	-46.9	175.7	-68.1	171.1	0	0	0	110.6	V429 Y433 F435 H436 N442 A443 I444 L612 L615 E616	V429-I440 HydrophobicContact CG1-CB 4.41Å; V429-I440 HydrophobicContact CG1-CG2 4.2Å; V429-I440 HydrophobicContact CG2-CG2 3.86Å; Y433-I440 HydrophobicContact CD1-CD1 3.8Å; Y433-I440 HydrophobicContact CD2-CD1 4.17Å; Y433-I440 HydrophobicContact CD2-CG2 3.81Å; Y433-I440 HydrophobicContact CE1-CD1 4.38Å; Y433-I440 HydrophobicContact CE2-CG2 3.79Å; Y433-I440 HydrophobicContact CG-CD1 3.68Å; Y433-I440 HydrophobicContact CG-CG2 4.4Å; F435-I440 WeakPolarHBondContact O-CD1 3.21Å; H436-I440 WeakPolarHBondContact O-CB 3.15Å; H436-I440 VanDerWaalsContact O-CG1 3.29Å; H436-I440 WeakPolarHBondContact O-CG1 3.39Å; H436-I440 PolarHBondContact O-N 3.16Å; I440-N442 PolarHBondContact O-N 3.05Å; I440-A443 PolarHBondContact O-N 2.97Å; I440-I444 HydrophobicContact CG2-CD1 3.89Å; I440-I444 VanDerWaalsContact O-CG1 3.31Å; I440-I444 WeakPolarHBondContact O-CG1 3.49Å; I440-I444 PolarHBondContact O-N 3.33Å; I440-L612 HydrophobicContact CG1-CD2 4.4Å; I440-L612 HydrophobicContact CG2-CD1 4.44Å; I440-L612 HydrophobicContact CG2-CD2 4.13Å; I440-L615 HydrophobicContact CG1-CD2 3.74Å; I440-L615 HydrophobicContact CG1-CG 4.22Å; I440-E616 HydrophobicContact CD1-CB 4.39Å
441	F	97.1	Very high	93.8	Very high	24 Å²	24	41.5 Å²	41.5	11%	0.105	21%	0.205	C	C	.	.	H	α-helix	trans	-57.5	-48.7	176.8	168.5	-95.4	0	0	0	111.6	D422 R426 V429 R437 T438 E439 A443 I444 V445 L630	D422-F441 HydrophobicContact CB-CE2 4.25Å; D422-F441 HydrophobicContact CB-CZ 3.98Å; R426-F441 HydrophobicContact CG-CD2 3.86Å; R426-F441 HydrophobicContact CG-CE2 3.65Å; R426-F441 HydrophobicContact CG-CZ 4.32Å; V429-F441 HydrophobicContact CG2-CB 4.29Å; R437-F441 WeakPolarHBondContact O-CB 3.31Å; R437-F441 PolarHBondContact O-N 2.91Å; T438-F441 PolarHBondContact O-N 3.33Å; E439-F441 PolarHBondContact O-N 2.87Å; F441-A443 VanDerWaalsContact C-N 3.31Å; F441-A443 PolarHBondContact O-N 3.1Å; F441-I444 PolarHBondContact O-N 2.94Å; F441-V445 HydrophobicContact CE1-CG2 4.07Å; F441-V445 HydrophobicContact CE2-CG2 4.09Å; F441-V445 HydrophobicContact CZ-CG2 3.83Å; F441-V445 WeakPolarHBondContact O-CG2 3.46Å; F441-V445 PolarHBondContact O-N 2.84Å; F441-L630 HydrophobicContact CB-CD2 3.87Å; F441-L630 HydrophobicContact CG-CD2 4.28Å
442	N	97	Very high	93.5	Very high	89 Å²	89	52.4 Å²	52.4	48%	0.476	25%	0.247	S	C	.	.	H	α-helix	trans	-64.1	-37.4	179.1	-70.3	-28.8	0	0	0	112.1	T438 E439 I440 V445 N446	T438-N442 WeakPolarHBondContact O-CB 3.3Å; T438-N442 VanDerWaalsContact O-CG 3.25Å; T438-N442 PolarHBondContact O-N 3.3Å; T438-N442 PolarHBondContact O-ND2 3.04Å; E439-N442 PolarHBondContact O-N 3.34Å; I440-N442 PolarHBondContact O-N 3.05Å; N442-V445 PolarHBondContact O-N 3.11Å; N442-N446 WeakPolarHBondContact O-CB 3.48Å; N442-N446 PolarHBondContact O-N 3.38Å
443	A	97.5	Very high	93.1	Very high	16 Å²	16	54 Å²	54	13%	0.132	26%	0.257	C	S	.	.	H	α-helix	trans	-63.2	-44.6	176.7	0	0	0	0	0	111.8	E439 I440 F441 N446 E447 F607 F611 L612	E439-A443 WeakPolarHBondContact O-CB 3.46Å; E439-A443 PolarHBondContact O-N 2.92Å; I440-A443 PolarHBondContact O-N 2.97Å; F441-A443 VanDerWaalsContact C-N 3.31Å; F441-A443 PolarHBondContact O-N 3.1Å; A443-N446 PolarHBondContact O-N 3.18Å; A443-E447 WeakPolarHBondContact O-CB 3.18Å; A443-E447 PolarHBondContact O-N 2.82Å; A443-F607 HydrophobicContact CB-CE2 4.1Å; A443-F607 HydrophobicContact CB-CZ 4.24Å; A443-F611 HydrophobicContact CB-CE1 3.94Å; A443-L612 HydrophobicContact CB-CD2 4.14Å
444	I	97.4	Very high	92.5	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-45.3	176.6	-64.8	164.1	0	0	0	110.7	Y425 F428 V429 I440 F441 N446 E447 Y448 F607 W608 L612	Y425-I444 HydrophobicContact CD1-CG2 4.09Å; Y425-I444 HydrophobicContact CD2-CG2 3.88Å; Y425-I444 HydrophobicContact CE1-CG2 4.03Å; Y425-I444 HydrophobicContact CE2-CG2 3.79Å; Y425-I444 HydrophobicContact CG-CG2 4.03Å; F428-I444 HydrophobicContact CD1-CD1 4.25Å; F428-I444 HydrophobicContact CE1-CD1 4.36Å; V429-I444 HydrophobicContact CG2-CD1 3.64Å; I440-I444 HydrophobicContact CG2-CD1 3.89Å; I440-I444 VanDerWaalsContact O-CG1 3.31Å; I440-I444 WeakPolarHBondContact O-CG1 3.49Å; I440-I444 PolarHBondContact O-N 3.33Å; F441-I444 PolarHBondContact O-N 2.94Å; I444-N446 VanDerWaalsContact C-N 3.3Å; I444-N446 PolarHBondContact O-N 2.86Å; I444-E447 PolarHBondContact O-N 2.98Å; I444-Y448 PolarHBondContact O-N 3.15Å; I444-Y448 VanDerWaalsContact O-N 3.13Å; I444-F607 HydrophobicContact CG1-CE1 4.14Å; I444-F607 HydrophobicContact CG1-CZ 3.98Å; I444-W608 HydrophobicContact CD1-CH2 3.77Å; I444-W608 HydrophobicContact CD1-CZ3 4.1Å; I444-W608 HydrophobicContact CG1-CH2 3.73Å; I444-W608 HydrophobicContact CG1-CZ3 4.24Å; I444-W608 HydrophobicContact CG2-CH2 4.26Å; I444-L612 HydrophobicContact CD1-CD1 4.42Å; I444-L612 HydrophobicContact CG1-CD1 4.14Å
445	V	96.2	Very high	91.8	Very high	27 Å²	27	57 Å²	57	16%	0.164	29%	0.286	C	S	.	.	H	α-helix	trans	-58.6	-44.5	176.6	171.6	0	0	0	0	110.7	Y425 F441 N442 N449	Y425-V445 HydrophobicContact CD2-CG2 3.77Å; Y425-V445 HydrophobicContact CE2-CG2 4.2Å; F441-V445 HydrophobicContact CE1-CG2 4.07Å; F441-V445 HydrophobicContact CE2-CG2 4.09Å; F441-V445 HydrophobicContact CZ-CG2 3.83Å; F441-V445 WeakPolarHBondContact O-CG2 3.46Å; F441-V445 PolarHBondContact O-N 2.84Å; N442-V445 PolarHBondContact O-N 3.11Å; V445-N449 WeakPolarHBondContact O-CB 3.36Å; V445-N449 PolarHBondContact O-N 3.44Å
446	N	95.7	Very high	91.5	Very high	91 Å²	91	59.1 Å²	59.1	49%	0.487	30%	0.297	S	S	.	.	H	α-helix	trans	-65.5	-43.9	-179.7	179.9	82.1	0	0	0	112.8	N442 A443 I444 W451	N442-N446 WeakPolarHBondContact O-CB 3.48Å; N442-N446 PolarHBondContact O-N 3.38Å; A443-N446 PolarHBondContact O-N 3.18Å; I444-N446 VanDerWaalsContact C-N 3.3Å; I444-N446 PolarHBondContact O-N 2.86Å; N446-W451 PolarHBondContact O-NE1 3.49Å
447	E	96.3	Very high	91.5	Very high	47 Å²	47	63.6 Å²	63.6	22%	0.22	32%	0.317	C	S	.	.	H	α-helix	trans	-65.1	-45.5	-176.6	-177	61.9	-159.5	0	0	112.2	A443 I444 H603 F607	A443-E447 WeakPolarHBondContact O-CB 3.18Å; A443-E447 PolarHBondContact O-N 2.82Å; I444-E447 PolarHBondContact O-N 2.98Å; E447-H603 IonicContact OE1-CE1 2.87Å; E447-H603 PolarHBondContact OE1-CE1 3.06Å; E447-H603 IonicContact OE1-ND1 2.91Å; E447-H603 PolarHBondContact OE1-ND1 3.11Å; E447-H603 IonicContact OE2-CE1 3.62Å; E447-F607 HydrophobicContact CB-CD2 4.3Å; E447-F607 HydrophobicContact CB-CE1 4.3Å; E447-F607 HydrophobicContact CB-CE2 4.02Å; E447-F607 HydrophobicContact CB-CZ 4.02Å; E447-F607 HydrophobicContact CG-CB 4.46Å; E447-F607 HydrophobicContact CG-CD1 4Å; E447-F607 HydrophobicContact CG-CD2 4.04Å; E447-F607 HydrophobicContact CG-CE1 4.2Å; E447-F607 HydrophobicContact CG-CE2 4.24Å; E447-F607 HydrophobicContact CG-CG 3.91Å; E447-F607 HydrophobicContact CG-CZ 4.32Å
448	Y	95.5	Very high	91.6	Very high	15 Å²	15	65.2 Å²	65.2	6%	0.059	33%	0.33	C	S	.	.	S	Bend	trans	-96.6	7.2	-174.7	-76.5	-89.9	0	0	0	114.4	I444 S464 E467 A468 D471 F607 W608	I444-Y448 PolarHBondContact O-N 3.15Å; I444-Y448 VanDerWaalsContact O-N 3.13Å; Y448-S464 WeakPolarHBondContact O-CB 3.31Å; Y448-S464 PolarHBondContact O-OG 3.38Å; Y448-S464 VanDerWaalsContact O-OG 3.06Å; Y448-E467 HydrophobicContact CD1-CB 4.28Å; Y448-E467 HydrophobicContact CE1-CB 4.09Å; Y448-A468 HydrophobicContact CD1-CB 3.6Å; Y448-A468 HydrophobicContact CD2-CB 3.68Å; Y448-A468 HydrophobicContact CE1-CB 3.82Å; Y448-A468 HydrophobicContact CE2-CB 3.89Å; Y448-A468 HydrophobicContact CG-CB 3.53Å; Y448-D471 VanDerWaalsContact OH-CB 3.31Å; Y448-D471 WeakPolarHBondContact OH-CB 3.28Å; Y448-D471 PolarHBondContact OH-OD2 3.15Å; Y448-F607 HydrophobicContact CE2-CD1 4.49Å; Y448-F607 HydrophobicContact CE2-CE1 4.44Å; Y448-W608 AromaticContact CE2-CE2 3.98Å; Y448-W608 AromaticContact CE2-CZ2 3.8Å; Y448-W608 HydrophobicContact CE2-CZ2 3.8Å; Y448-W608 AromaticContact CE2-NE1 3.65Å; Y448-W608 AromaticContact CZ-NE1 3.65Å; Y448-W608 PolarHBondContact OH-NE1 3.07Å
449	N	92.7	Very high	91.5	Very high	31 Å²	31	66 Å²	66	17%	0.166	33%	0.333	C	S	.	.	S	Bend	trans	-78	126.9	173.3	-172.4	78.9	0	0	0	110.2	V445 W451	V445-N449 WeakPolarHBondContact O-CB 3.36Å; V445-N449 PolarHBondContact O-N 3.44Å; N449-W451 HydrophobicContact CB-CZ2 4.34Å; N449-W451 PolarHBondContact O-N 3.43Å; N449-W451 PolarHBondContact O-NE1 3.12Å
450	D	88	Confident	91.5	Very high	54 Å²	54	63.8 Å²	63.8	29%	0.289	32%	0.324	S	S	.	.			trans	-72.2	93.1	173	-176.3	-1.7	0	0	0	110.1	Y452 N453 T460	D450-Y452 PolarHBondContact O-N 3.5Å; D450-Y452 WeakPolarHBondContact OD1-CA 3.34Å; D450-Y452 WeakPolarHBondContact OD1-CB 3.19Å; D450-Y452 PolarHBondContact OD1-N 3.39Å; D450-N453 CarbonylContact O-C 3.59Å; D450-N453 VanDerWaalsContact O-C 3.22Å; D450-N453 PolarHBondContact O-N 3.12Å; D450-N453 VanDerWaalsContact O-O 3.14Å; D450-N453 PolarHBondContact OD1-N 3.24Å; D450-N453 VanDerWaalsContact OD1-N 3.16Å; D450-N453 WeakPolarHBondContact OD2-CB 3.27Å; D450-T460 HydrophobicContact CB-CG2 3.93Å
451	W	89.7	Confident	91.4	Very high	168 Å²	168	64.2 Å²	64.2	64%	0.636	33%	0.327	S	S	*	.	S	Bend	trans	-69.8	-15.8	178.5	-65	102.4	0	0	0	113.5	N446 N449	N446-W451 PolarHBondContact O-NE1 3.49Å; N449-W451 HydrophobicContact CB-CZ2 4.34Å; N449-W451 PolarHBondContact O-N 3.43Å; N449-W451 PolarHBondContact O-NE1 3.12Å
452	Y	87.4	Confident	91.3	Very high	231 Å²	231	63.2 Å²	63.2	91%	0.906	32%	0.323	S	S	*	.	S	Bend	trans	-79.3	-31.7	174.3	-66.7	-79.2	0	0	0	111.9	D450 P454	D450-Y452 PolarHBondContact O-N 3.5Å; D450-Y452 WeakPolarHBondContact OD1-CA 3.34Å; D450-Y452 WeakPolarHBondContact OD1-CB 3.19Å; D450-Y452 PolarHBondContact OD1-N 3.39Å; Y452-P454 WeakPolarHBondContact O-CD 3.49Å
453	N	84.2	Confident	91.2	Very high	72 Å²	72	61.1 Å²	61.1	39%	0.385	31%	0.312	S	S	.	.			trans	-117.1	79.1	173	-169.2	12.7	0	0	0	111.2	D450 G455	D450-N453 CarbonylContact O-C 3.59Å; D450-N453 VanDerWaalsContact O-C 3.22Å; D450-N453 PolarHBondContact O-N 3.12Å; D450-N453 VanDerWaalsContact O-O 3.14Å; D450-N453 PolarHBondContact OD1-N 3.24Å; D450-N453 VanDerWaalsContact OD1-N 3.16Å; D450-N453 WeakPolarHBondContact OD2-CB 3.27Å; N453-G455 PolarHBondContact O-N 3.2Å; N453-G455 VanDerWaalsContact O-N 3.08Å
454	P	77.4	Confident	91.1	Very high	97 Å²	97	61.4 Å²	61.4	63%	0.63	31%	0.312	S	S	*	.			trans	-66.5	-13.9	-179.2	29.3	-36.4	0	0	0	112.7	Y452 Q456	Y452-P454 WeakPolarHBondContact O-CD 3.49Å; P454-Q456 PolarHBondContact O-N 3.19Å
455	G	75	Confident	91.1	Very high	42 Å²	42	61.3 Å²	61.3	43%	0.433	31%	0.312	S	S	.	.	S	Bend	trans	-67.1	97.4	166.4	0	0	0	0	0	108	N453 H457	N453-G455 PolarHBondContact O-N 3.2Å; N453-G455 VanDerWaalsContact O-N 3.08Å; G455-H457 PolarHBondContact O-N 2.84Å
456	Q	83.6	Confident	91	Very high	95 Å²	95	60 Å²	60	44%	0.444	30%	0.304	S	S	.	.			trans	-64.4	61	179.2	-68.4	171.7	-25.8	0	0	111.4	V418 P454 V461	V418-Q456 HydrophobicContact CG2-CB 4.26Å; V418-Q456 HydrophobicContact CG2-CG 4.47Å; P454-Q456 PolarHBondContact O-N 3.19Å; Q456-V461 HydrophobicContact CB-CG2 3.98Å
457	H	92.5	Very high	91	Very high	107 Å²	107	58.7 Å²	58.7	50%	0.495	30%	0.295	S	S	.	.			trans	-63.6	133.8	178.7	-175.9	-90.3	0	0	0	107.9	G455 I459 T460 V461	G455-H457 PolarHBondContact O-N 2.84Å; H457-I459 PolarHBondContact ND1-N 2.85Å; H457-I459 PolarHBondContact O-N 2.78Å; H457-T460 PolarHBondContact O-N 3.49Å; H457-V461 PolarHBondContact O-N 3.32Å
458	P	94.7	Very high	91.1	Very high	50 Å²	50	56.5 Å²	56.5	33%	0.325	29%	0.285	S	S	.	.	H	α-helix	trans	-53.6	-35.6	-171	-31.1	36.2	0	0	0	114.7	Y414 G415 L416 R462	Y414-P458 WeakPolarHBondContact O-CB 3.32Å; G415-P458 CarbonylContact C-O 3.22Å; G415-P458 VanDerWaalsContact CA-O 3.25Å; G415-P458 WeakPolarHBondContact CA-O 3.45Å; L416-P458 PolarHBondContact N-O 3.15Å; L416-P458 VanDerWaalsContact O-CA 3.28Å; L416-P458 WeakPolarHBondContact O-CA 3.23Å; P458-R462 WeakPolarHBondContact O-CB 3.25Å; P458-R462 PolarHBondContact O-N 3.11Å
459	I	93.8	Very high	91.2	Very high	48 Å²	48	56 Å²	56	25%	0.246	28%	0.283	C	S	.	.	H	α-helix	trans	-68.9	-40.7	177.6	-59.7	-62.6	0	0	0	112.3	H457 V461 R462 D463	H457-I459 PolarHBondContact ND1-N 2.85Å; H457-I459 PolarHBondContact O-N 2.78Å; I459-V461 VanDerWaalsContact C-N 3.35Å; I459-R462 WeakPolarHBondContact O-CB 3.17Å; I459-R462 PolarHBondContact O-N 3.5Å; I459-D463 VanDerWaalsContact O-CG 3.29Å; I459-D463 PolarHBondContact O-N 2.65Å
460	T	93.4	Very high	91.4	Very high	34 Å²	34	54.6 Å²	54.6	21%	0.209	28%	0.276	C	S	.	.	H	α-helix	trans	-65.5	-42.6	176.4	-56.1	0	0	0	0	110.3	D450 H457 R462 D463 S464	D450-T460 HydrophobicContact CB-CG2 3.93Å; H457-T460 PolarHBondContact O-N 3.49Å; T460-R462 VanDerWaalsContact C-N 3.33Å; T460-R462 PolarHBondContact O-N 3.07Å; T460-D463 PolarHBondContact O-N 3.2Å; T460-S464 WeakPolarHBondContact O-CB 3.5Å; T460-S464 PolarHBondContact O-N 2.78Å; T460-S464 PolarHBondContact O-OG 3.08Å
461	V	95.3	Very high	91.9	Very high	10 Å²	10	52.1 Å²	52.1	6%	0.061	26%	0.263	C	S	.	.	H	α-helix	trans	-62.4	-41.5	175.7	179.4	0	0	0	0	111.2	L416 R421 Q456 H457 I459 V465	L416-V461 HydrophobicContact CB-CB 4.42Å; L416-V461 HydrophobicContact CB-CG1 3.9Å; L416-V461 VanDerWaalsContact O-CB 3.28Å; L416-V461 WeakPolarHBondContact O-CB 3.36Å; L416-V461 WeakPolarHBondContact O-CG1 3.18Å; R421-V461 HydrophobicContact CB-CG1 3.75Å; R421-V461 HydrophobicContact CG-CG1 4.17Å; Q456-V461 HydrophobicContact CB-CG2 3.98Å; H457-V461 PolarHBondContact O-N 3.32Å; I459-V461 VanDerWaalsContact C-N 3.35Å; V461-V465 HydrophobicContact CG1-CG2 4.49Å; V461-V465 WeakPolarHBondContact O-CB 3.29Å; V461-V465 VanDerWaalsContact O-CG2 3.26Å; V461-V465 WeakPolarHBondContact O-CG2 3.32Å; V461-V465 PolarHBondContact O-N 3.49Å
462	R	95.1	Very high	92.2	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-57	-50	173.2	177.7	-154.7	69.4	-177	3.6	111.8	L407 H411 L412 L416 P458 I459 T460 V465 L466 Y521	L407-R462 HydrophobicContact CD1-CG 4.3Å; H411-R462 WeakPolarHBondContact O-CD 2.95Å; L412-R462 WeakPolarHBondContact O-CD 3.44Å; L412-R462 PolarHBondContact O-NH1 2.86Å; L416-R462 HydrophobicContact CB-CB 4.5Å; L416-R462 HydrophobicContact CG-CB 4.29Å; P458-R462 WeakPolarHBondContact O-CB 3.25Å; P458-R462 PolarHBondContact O-N 3.11Å; I459-R462 WeakPolarHBondContact O-CB 3.17Å; I459-R462 PolarHBondContact O-N 3.5Å; T460-R462 VanDerWaalsContact C-N 3.33Å; T460-R462 PolarHBondContact O-N 3.07Å; R462-V465 PolarHBondContact O-N 3.27Å; R462-L466 HydrophobicContact CG-CD1 4.14Å; R462-L466 WeakPolarHBondContact O-CB 3.27Å; R462-L466 WeakPolarHBondContact O-CG 3.33Å; R462-L466 PolarHBondContact O-N 3.39Å; R462-Y521 PolarHBondContact NH1-O 2.77Å
463	D	94.7	Very high	92.7	Very high	46 Å²	46	33.9 Å²	33.9	25%	0.246	20%	0.195	C	C	.	.	H	α-helix	trans	-64.6	-45.5	-177.1	-68.1	-5.1	0	0	0	111	I459 T460 V465 L466 E467 L523	I459-D463 VanDerWaalsContact O-CG 3.29Å; I459-D463 PolarHBondContact O-N 2.65Å; T460-D463 PolarHBondContact O-N 3.2Å; D463-V465 VanDerWaalsContact C-N 3.34Å; D463-V465 PolarHBondContact O-N 3.11Å; D463-L466 PolarHBondContact O-N 2.85Å; D463-E467 WeakPolarHBondContact O-CB 3.48Å; D463-E467 WeakPolarHBondContact O-CG 3.45Å; D463-E467 PolarHBondContact O-N 3.38Å; D463-L523 WeakPolarHBondContact OD1-CD1 3.47Å
464	S	94.6	Very high	93.3	Very high	21 Å²	21	30.8 Å²	30.8	15%	0.147	18%	0.178	C	C	.	.	H	α-helix	trans	-57.1	-43.7	173.1	-71.4	0	0	0	0	112.9	Y448 T460 A468	Y448-S464 WeakPolarHBondContact O-CB 3.31Å; Y448-S464 PolarHBondContact O-OG 3.38Å; Y448-S464 VanDerWaalsContact O-OG 3.06Å; T460-S464 WeakPolarHBondContact O-CB 3.5Å; T460-S464 PolarHBondContact O-N 2.78Å; T460-S464 PolarHBondContact O-OG 3.08Å; S464-A468 WeakPolarHBondContact O-CB 3.41Å; S464-A468 PolarHBondContact O-N 3.43Å
465	V	96.5	Very high	94.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.1	-50.3	176.8	168.7	0	0	0	0	110.4	L416 R421 I424 Y425 V461 R462 D463 E467 A468 I469	L416-V465 HydrophobicContact CD1-CB 3.73Å; L416-V465 HydrophobicContact CD1-CG1 3.79Å; L416-V465 HydrophobicContact CD1-CG2 3.78Å; R421-V465 HydrophobicContact CB-CG2 3.95Å; R421-V465 HydrophobicContact CG-CG2 3.54Å; I424-V465 HydrophobicContact CD1-CG1 4.07Å; I424-V465 HydrophobicContact CG2-CG1 4.09Å; Y425-V465 HydrophobicContact CE1-CG1 4.46Å; Y425-V465 HydrophobicContact CE1-CG2 4.2Å; V461-V465 HydrophobicContact CG1-CG2 4.49Å; V461-V465 WeakPolarHBondContact O-CB 3.29Å; V461-V465 VanDerWaalsContact O-CG2 3.26Å; V461-V465 WeakPolarHBondContact O-CG2 3.32Å; V461-V465 PolarHBondContact O-N 3.49Å; R462-V465 PolarHBondContact O-N 3.27Å; D463-V465 VanDerWaalsContact C-N 3.34Å; D463-V465 PolarHBondContact O-N 3.11Å; V465-E467 VanDerWaalsContact C-N 3.25Å; V465-E467 PolarHBondContact O-N 3.2Å; V465-A468 WeakPolarHBondContact O-CB 3.41Å; V465-A468 PolarHBondContact O-N 2.9Å; V465-A468 VanDerWaalsContact O-N 3.07Å; V465-I469 VanDerWaalsContact O-CG1 3.28Å; V465-I469 WeakPolarHBondContact O-CG1 3.03Å; V465-I469 PolarHBondContact O-N 3.37Å
466	L	96	Very high	95.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-56	-42.2	179.3	-82.3	174.8	0	0	0	111.7	L407 L412 R462 D463 S470 L523	L407-L466 HydrophobicContact CD1-CD1 4.26Å; L407-L466 HydrophobicContact CD1-CD2 3.47Å; L407-L466 VanDerWaalsContact CD1-CD2 3.47Å; L407-L466 HydrophobicContact CD1-CG 3.62Å; L407-L466 HydrophobicContact CG-CD2 3.86Å; L412-L466 HydrophobicContact CD2-CD1 4.11Å; R462-L466 HydrophobicContact CG-CD1 4.14Å; R462-L466 WeakPolarHBondContact O-CB 3.27Å; R462-L466 WeakPolarHBondContact O-CG 3.33Å; R462-L466 PolarHBondContact O-N 3.39Å; D463-L466 PolarHBondContact O-N 2.85Å; L466-S470 WeakPolarHBondContact O-CB 3.5Å; L466-S470 PolarHBondContact O-N 2.86Å; L466-S470 PolarHBondContact O-OG 3.45Å; L466-L523 HydrophobicContact CD1-CD1 4.18Å; L466-L523 HydrophobicContact CD1-CD2 3.89Å
467	E	95.8	Very high	96	Very high	63 Å²	63	20.9 Å²	20.9	29%	0.294	11%	0.114	S	C	.	.	H	α-helix	trans	-62	-48.8	174	-75.6	-173.1	-175.6	0	0	111.8	Y448 D463 V465 I469 S470 D471 R601	Y448-E467 HydrophobicContact CD1-CB 4.28Å; Y448-E467 HydrophobicContact CE1-CB 4.09Å; D463-E467 WeakPolarHBondContact O-CB 3.48Å; D463-E467 WeakPolarHBondContact O-CG 3.45Å; D463-E467 PolarHBondContact O-N 3.38Å; V465-E467 VanDerWaalsContact C-N 3.25Å; V465-E467 PolarHBondContact O-N 3.2Å; E467-I469 PolarHBondContact O-N 2.91Å; E467-S470 PolarHBondContact O-N 3.46Å; E467-D471 WeakPolarHBondContact O-CB 3.34Å; E467-D471 PolarHBondContact O-N 2.81Å; E467-R601 IonicContact OE2-CZ 3.96Å; E467-R601 IonicContact OE2-NH1 3.7Å; E467-R601 IonicContact OE2-NH2 3.72Å; E467-R601 PolarHBondContact OE2-NH2 2.89Å
468	A	97.3	Very high	96.2	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.008	9%	0.091	C	C	.	.	H	α-helix	trans	-58.4	-49.7	179.9	0	0	0	0	0	112.8	Y425 Y448 S464 V465 D471 A472	Y425-A468 HydrophobicContact CE1-CB 3.89Å; Y425-A468 WeakPolarHBondContact OH-CB 3.05Å; Y448-A468 HydrophobicContact CD1-CB 3.6Å; Y448-A468 HydrophobicContact CD2-CB 3.68Å; Y448-A468 HydrophobicContact CE1-CB 3.82Å; Y448-A468 HydrophobicContact CE2-CB 3.89Å; Y448-A468 HydrophobicContact CG-CB 3.53Å; S464-A468 WeakPolarHBondContact O-CB 3.41Å; S464-A468 PolarHBondContact O-N 3.43Å; V465-A468 WeakPolarHBondContact O-CB 3.41Å; V465-A468 PolarHBondContact O-N 2.9Å; V465-A468 VanDerWaalsContact O-N 3.07Å; A468-D471 PolarHBondContact O-N 3.25Å; A468-A472 VanDerWaalsContact O-CB 3.31Å; A468-A472 WeakPolarHBondContact O-CB 3.38Å; A468-A472 PolarHBondContact O-N 3.11Å
469	I	96.9	Very high	96.2	Very high	3 Å²	3	15.5 Å²	15.5	2%	0.015	9%	0.088	C	C	.	.	H	α-helix	trans	-74.9	-29.6	-178.6	60.5	164.5	0	0	0	112.3	A403 Q406 L407 I424 V465 E467 L473	A403-I469 HydrophobicContact CB-CB 4.19Å; A403-I469 HydrophobicContact CB-CD1 3.66Å; A403-I469 HydrophobicContact CB-CG1 3.54Å; Q406-I469 HydrophobicContact CB-CD1 3.93Å; Q406-I469 HydrophobicContact CG-CD1 4.44Å; L407-I469 HydrophobicContact CD2-CD1 4.44Å; I424-I469 HydrophobicContact CG2-CG2 4.22Å; V465-I469 VanDerWaalsContact O-CG1 3.28Å; V465-I469 WeakPolarHBondContact O-CG1 3.03Å; V465-I469 PolarHBondContact O-N 3.37Å; E467-I469 PolarHBondContact O-N 2.91Å; I469-L473 HydrophobicContact CB-CD1 4.35Å; I469-L473 VanDerWaalsContact O-CB 3.26Å; I469-L473 WeakPolarHBondContact O-CB 3.35Å; I469-L473 VanDerWaalsContact O-CG 3.23Å; I469-L473 WeakPolarHBondContact O-CG 3.44Å; I469-L473 PolarHBondContact O-N 2.65Å
470	S	97.7	Very high	96.3	Very high	2 Å²	2	16 Å²	16	1%	0.014	9%	0.088	C	C	.	.	H	α-helix	trans	-66.1	-43	172.1	-61.7	0	0	0	0	111	E402 A403 L466 E467 Y474 L475	E402-S470 PolarHBondContact N-OG 3.2Å; A403-S470 WeakPolarHBondContact CB-OG 3.39Å; A403-S470 PolarHBondContact N-OG 3.28Å; L466-S470 WeakPolarHBondContact O-CB 3.5Å; L466-S470 PolarHBondContact O-N 2.86Å; L466-S470 PolarHBondContact O-OG 3.45Å; E467-S470 PolarHBondContact O-N 3.46Å; S470-Y474 WeakPolarHBondContact O-CB 3.4Å; S470-Y474 PolarHBondContact O-N 3.25Å; S470-Y474 VanDerWaalsContact O-N 3.14Å; S470-L475 PolarHBondContact O-N 2.94Å; S470-L475 VanDerWaalsContact O-N 3.15Å
471	D	97.9	Very high	96.4	Very high	2 Å²	2	14.3 Å²	14.3	1%	0.011	8%	0.078	C	C	.	.	I	π-helix	trans	-65	-47.2	178.3	-68	-11.5	0	0	0	110.8	Y448 E467 A468 L475 A476 R601 I605	Y448-D471 VanDerWaalsContact OH-CB 3.31Å; Y448-D471 WeakPolarHBondContact OH-CB 3.28Å; Y448-D471 PolarHBondContact OH-OD2 3.15Å; E467-D471 WeakPolarHBondContact O-CB 3.34Å; E467-D471 PolarHBondContact O-N 2.81Å; A468-D471 PolarHBondContact O-N 3.25Å; D471-L475 PolarHBondContact O-N 2.7Å; D471-A476 VanDerWaalsContact O-CB 3.23Å; D471-A476 WeakPolarHBondContact O-CB 3.36Å; D471-A476 PolarHBondContact O-N 2.84Å; D471-R601 WeakPolarHBondContact OD1-CD 3.38Å; D471-R601 IonicContact OD1-CZ 3.91Å; D471-R601 IonicContact OD1-NE 3.23Å; D471-R601 PolarHBondContact OD1-NE 2.72Å; D471-R601 IonicContact OD1-NH1 3.98Å; D471-R601 PolarHBondContact OD1-NH1 3.42Å; D471-R601 IonicContact OD2-CZ 2.81Å; D471-R601 IonicContact OD2-NE 2.65Å; D471-R601 PolarHBondContact OD2-NE 3.26Å; D471-R601 VanDerWaalsContact OD2-NE 3.12Å; D471-R601 IonicContact OD2-NH1 2.77Å; D471-R601 PolarHBondContact OD2-NH1 2.97Å; D471-R601 VanDerWaalsContact OD2-NH1 3.12Å; D471-R601 IonicContact OD2-NH2 3.91Å; D471-R601 PolarHBondContact OD2-NH2 3.29Å; D471-I605 HydrophobicContact CB-CD1 4.34Å
472	A	97.2	Very high	96.3	Very high	15 Å²	15	15.1 Å²	15.1	12%	0.124	8%	0.083	C	C	.	.	I	π-helix	trans	-68.2	-43.6	-176.2	0	0	0	0	0	113.9	F428 A468 P477 W608	F428-A472 HydrophobicContact CE1-CB 4.35Å; F428-A472 HydrophobicContact CE2-CB 3.89Å; F428-A472 HydrophobicContact CZ-CB 3.55Å; A468-A472 VanDerWaalsContact O-CB 3.31Å; A468-A472 WeakPolarHBondContact O-CB 3.38Å; A468-A472 PolarHBondContact O-N 3.11Å; A472-P477 WeakPolarHBondContact O-CD 3.34Å; A472-W608 HydrophobicContact CB-CD2 3.9Å; A472-W608 HydrophobicContact CB-CE3 3.87Å; A472-W608 HydrophobicContact CB-CH2 3.75Å; A472-W608 HydrophobicContact CB-CZ2 3.74Å; A472-W608 HydrophobicContact CB-CZ3 3.82Å
473	L	96.9	Very high	96.2	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.005	11%	0.106	C	C	.	.	I	π-helix	trans	-84.9	-26.7	-173.4	-61.7	174.2	0	0	0	113.1	S297 S298 W299 F361 Q406 F428 I469	S297-L473 PolarHBondContact OG-O 3.44Å; S297-L473 VanDerWaalsContact OG-O 3.12Å; S298-L473 VanDerWaalsContact OG-CD2 3.27Å; S298-L473 WeakPolarHBondContact OG-CD2 3.47Å; W299-L473 PolarHBondContact NE1-O 3.1Å; F361-L473 HydrophobicContact CB-CD2 3.93Å; F361-L473 HydrophobicContact CD1-CD1 3.63Å; F361-L473 HydrophobicContact CD1-CD2 4.43Å; F361-L473 HydrophobicContact CE1-CD1 4.16Å; F361-L473 HydrophobicContact CG-CD1 4.35Å; F361-L473 HydrophobicContact CG-CD2 4.36Å; Q406-L473 HydrophobicContact CG-CD1 4.4Å; F428-L473 HydrophobicContact CD2-CD2 4.32Å; F428-L473 HydrophobicContact CE2-CD2 3.79Å; F428-L473 HydrophobicContact CE2-CG 4.39Å; I469-L473 HydrophobicContact CB-CD1 4.35Å; I469-L473 VanDerWaalsContact O-CB 3.26Å; I469-L473 WeakPolarHBondContact O-CB 3.35Å; I469-L473 VanDerWaalsContact O-CG 3.23Å; I469-L473 WeakPolarHBondContact O-CG 3.44Å; I469-L473 PolarHBondContact O-N 2.65Å
474	Y	97.7	Very high	96.1	Very high	8 Å²	8	20.3 Å²	20.3	3%	0.031	10%	0.101	C	C	.	.	I	π-helix	trans	-127.4	-62.9	-169.6	-57.7	-88.3	0	0	0	112.7	G292 W299 E402 A403 S470 P477 L478 H528	G292-Y474 WeakPolarHBondContact O-CD1 3.35Å; G292-Y474 WeakPolarHBondContact O-CE1 3.41Å; W299-Y474 AromaticContact CZ2-CD1 3.85Å; W299-Y474 HydrophobicContact CZ2-CD1 3.85Å; W299-Y474 AromaticContact CZ2-CE1 3.6Å; W299-Y474 HydrophobicContact CZ2-CE1 3.6Å; E402-Y474 HydrophobicContact CB-CD1 3.96Å; E402-Y474 HydrophobicContact CB-CD2 3.37Å; E402-Y474 HydrophobicContact CB-CE1 4.44Å; E402-Y474 HydrophobicContact CB-CE2 3.93Å; E402-Y474 HydrophobicContact CB-CG 3.4Å; E402-Y474 HydrophobicContact CG-CD1 4.42Å; E402-Y474 HydrophobicContact CG-CD2 4.41Å; E402-Y474 HydrophobicContact CG-CG 3.98Å; A403-Y474 HydrophobicContact CB-CD2 4.36Å; A403-Y474 HydrophobicContact CB-CE2 3.97Å; S470-Y474 WeakPolarHBondContact O-CB 3.4Å; S470-Y474 PolarHBondContact O-N 3.25Å; S470-Y474 VanDerWaalsContact O-N 3.14Å; Y474-P477 WeakPolarHBondContact O-CD 3.41Å; Y474-L478 VanDerWaalsContact O-CB 3.29Å; Y474-L478 WeakPolarHBondContact O-CB 3.28Å; Y474-L478 VanDerWaalsContact O-CG 3.24Å; Y474-L478 WeakPolarHBondContact O-CG 3.45Å; Y474-L478 PolarHBondContact O-N 3.37Å; Y474-H528 AromaticContact CE1-CE1 3.96Å
475	L	97.1	Very high	96	Very high	12 Å²	12	19.3 Å²	19.3	6%	0.063	9%	0.094	C	C	.	.	I	π-helix	trans	-71	-40	-166.7	-169.9	60.1	0	0	0	113.5	A398 S470 D471 T479 F508 Y600 R601 I605	A398-L475 HydrophobicContact CB-CD1 4.32Å; S470-L475 PolarHBondContact O-N 2.94Å; S470-L475 VanDerWaalsContact O-N 3.15Å; D471-L475 PolarHBondContact O-N 2.7Å; L475-T479 VanDerWaalsContact O-CB 3.23Å; L475-T479 WeakPolarHBondContact O-CB 3.33Å; L475-T479 PolarHBondContact O-N 2.74Å; L475-T479 PolarHBondContact O-OG1 2.9Å; L475-F508 HydrophobicContact CD1-CZ 3.87Å; L475-Y600 HydrophobicContact CD1-CD1 4.38Å; L475-Y600 HydrophobicContact CD1-CE1 4.39Å; L475-Y600 HydrophobicContact CD2-CD1 3.92Å; L475-Y600 HydrophobicContact CD2-CE1 3.61Å; L475-R601 HydrophobicContact CD2-CB 4.28Å; L475-R601 HydrophobicContact CD2-CG 4.32Å; L475-I605 HydrophobicContact CB-CD1 3.94Å; L475-I605 HydrophobicContact CD2-CD1 3.83Å; L475-I605 HydrophobicContact CD2-CG1 4.3Å; L475-I605 HydrophobicContact CG-CD1 3.66Å; L475-I605 HydrophobicContact CG-CG1 4.28Å
476	A	97.5	Very high	95.6	Very high	2 Å²	2	21.5 Å²	21.5	2%	0.017	11%	0.112	C	C	.	.	H	α-helix	trans	-67.9	-47.6	178.8	0	0	0	0	0	112.1	D471 T479 K480 I605 W608 N609	D471-A476 VanDerWaalsContact O-CB 3.23Å; D471-A476 WeakPolarHBondContact O-CB 3.36Å; D471-A476 PolarHBondContact O-N 2.84Å; A476-T479 PolarHBondContact O-N 3.29Å; A476-K480 WeakPolarHBondContact O-CB 3.48Å; A476-K480 PolarHBondContact O-N 3.02Å; A476-I605 HydrophobicContact CB-CD1 3.91Å; A476-I605 HydrophobicContact CB-CG2 4.5Å; A476-W608 HydrophobicContact CB-CB 3.59Å; A476-W608 HydrophobicContact CB-CG 4.17Å; A476-N609 PolarHBondContact O-ND2 3.22Å; A476-N609 PolarHBondContact O-OD1 3.41Å
477	P	97.2	Very high	94.8	Very high	12 Å²	12	26.6 Å²	26.6	8%	0.078	14%	0.136	C	C	.	.	H	α-helix	trans	-55.8	-49.5	170.2	-27.8	35	0	0	0	113.5	S294 L296 A472 Y474 T479 K480 V481	S294-P477 WeakPolarHBondContact OG-CB 3.21Å; L296-P477 HydrophobicContact CB-CB 4.03Å; A472-P477 WeakPolarHBondContact O-CD 3.34Å; Y474-P477 WeakPolarHBondContact O-CD 3.41Å; P477-T479 PolarHBondContact O-N 3.43Å; P477-K480 WeakPolarHBondContact O-CB 3.35Å; P477-K480 PolarHBondContact O-N 2.94Å; P477-V481 WeakPolarHBondContact O-CG2 3.38Å; P477-V481 PolarHBondContact O-N 3.19Å
478	L	96.9	Very high	93.1	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-58.9	-46.7	178.9	-80.4	176	0	0	0	111.8	G293 V396 A398 Y474 K480 V481 V482	G293-L478 WeakPolarHBondContact O-CD2 3.44Å; V396-L478 HydrophobicContact CG1-CB 4.23Å; V396-L478 HydrophobicContact CG1-CD1 4.25Å; V396-L478 HydrophobicContact CG1-CD2 3.58Å; V396-L478 HydrophobicContact CG1-CG 4.25Å; A398-L478 HydrophobicContact CB-CD1 4.1Å; Y474-L478 VanDerWaalsContact O-CB 3.29Å; Y474-L478 WeakPolarHBondContact O-CB 3.28Å; Y474-L478 VanDerWaalsContact O-CG 3.24Å; Y474-L478 WeakPolarHBondContact O-CG 3.45Å; Y474-L478 PolarHBondContact O-N 3.37Å; L478-K480 VanDerWaalsContact C-N 3.3Å; L478-K480 PolarHBondContact O-N 3.03Å; L478-V481 PolarHBondContact O-N 3.11Å; L478-V482 WeakPolarHBondContact O-CG2 3.44Å; L478-V482 PolarHBondContact O-N 3.41Å
479	T	95.5	Very high	90.9	Very high	44 Å²	44	30.1 Å²	30.1	27%	0.27	15%	0.152	S	C	.	.	H	α-helix	trans	-66.1	-35.1	179.9	-58.1	0	0	0	0	111.5	L475 A476 P477 V482 R483 I605	L475-T479 VanDerWaalsContact O-CB 3.23Å; L475-T479 WeakPolarHBondContact O-CB 3.33Å; L475-T479 PolarHBondContact O-N 2.74Å; L475-T479 PolarHBondContact O-OG1 2.9Å; A476-T479 PolarHBondContact O-N 3.29Å; P477-T479 PolarHBondContact O-N 3.43Å; T479-V482 PolarHBondContact O-N 2.95Å; T479-R483 VanDerWaalsContact O-CB 3.26Å; T479-R483 WeakPolarHBondContact O-CB 3.43Å; T479-R483 PolarHBondContact O-N 3.2Å; T479-I605 HydrophobicContact CG2-CG2 3.86Å
480	K	94.9	Very high	88.4	Confident	57 Å²	57	32 Å²	32	25%	0.248	16%	0.164	C	C	.	.	H	α-helix	trans	-63.3	-45.6	172.7	-174.1	169.3	178	178.7	0	110.9	L296 E383 A476 P477 L478 R483 L484	L296-K480 HydrophobicContact CD1-CB 4.15Å; L296-K480 HydrophobicContact CD1-CD 3.93Å; L296-K480 HydrophobicContact CD1-CG 3.86Å; E383-K480 WeakPolarHBondContact OE1-CE 3.05Å; E383-K480 IonicContact OE1-NZ 3.99Å; E383-K480 PolarHBondContact OE1-NZ 3.13Å; A476-K480 WeakPolarHBondContact O-CB 3.48Å; A476-K480 PolarHBondContact O-N 3.02Å; P477-K480 WeakPolarHBondContact O-CB 3.35Å; P477-K480 PolarHBondContact O-N 2.94Å; L478-K480 VanDerWaalsContact C-N 3.3Å; L478-K480 PolarHBondContact O-N 3.03Å; K480-R483 PolarHBondContact O-N 3.31Å; K480-L484 HydrophobicContact CG-CD1 4.06Å; K480-L484 HydrophobicContact CG-CG 4.46Å; K480-L484 WeakPolarHBondContact O-CB 3.4Å; K480-L484 VanDerWaalsContact O-CG 3.28Å; K480-L484 WeakPolarHBondContact O-CG 3.27Å; K480-L484 PolarHBondContact O-N 3.32Å
481	V	95.5	Very high	85.5	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.3	-49	174.6	172.9	0	0	0	0	111.5	L290 L296 L382 F389 L394 P477 L478 R483 L484 H485	L290-V481 HydrophobicContact CD1-CG1 4.41Å; L296-V481 HydrophobicContact CB-CG2 4.43Å; L296-V481 HydrophobicContact CD1-CG2 3.66Å; L296-V481 HydrophobicContact CG-CG2 3.83Å; L382-V481 HydrophobicContact CD1-CG2 4.17Å; F389-V481 HydrophobicContact CE2-CG1 3.91Å; F389-V481 HydrophobicContact CZ-CG1 3.65Å; L394-V481 HydrophobicContact CD2-CG1 4.22Å; P477-V481 WeakPolarHBondContact O-CG2 3.38Å; P477-V481 PolarHBondContact O-N 3.19Å; L478-V481 PolarHBondContact O-N 3.11Å; V481-R483 VanDerWaalsContact C-N 3.31Å; V481-R483 PolarHBondContact O-N 3.45Å; V481-L484 PolarHBondContact O-N 3.45Å; V481-H485 WeakPolarHBondContact O-CB 3.32Å; V481-H485 PolarHBondContact O-N 3.43Å
482	V	94.4	Very high	82.9	Confident	26 Å²	26	41.4 Å²	41.4	16%	0.158	24%	0.238	C	C	.	.	H	α-helix	trans	-57.4	-45.5	177.2	169.1	0	0	0	0	111	V396 L478 T479 H485 A486 T506 F508	V396-V482 HydrophobicContact CB-CG2 3.89Å; V396-V482 HydrophobicContact CG1-CG2 4.17Å; V396-V482 HydrophobicContact CG2-CG2 3.62Å; L478-V482 WeakPolarHBondContact O-CG2 3.44Å; L478-V482 PolarHBondContact O-N 3.41Å; T479-V482 PolarHBondContact O-N 2.95Å; V482-H485 PolarHBondContact O-N 3.48Å; V482-A486 WeakPolarHBondContact O-CB 3.23Å; V482-A486 PolarHBondContact O-N 2.8Å; V482-T506 HydrophobicContact CB-CG2 4.49Å; V482-T506 HydrophobicContact CG1-CG2 3.88Å; V482-F508 HydrophobicContact CG2-CD2 3.9Å
483	R	92.5	Very high	80.6	Confident	131 Å²	131	44 Å²	44	49%	0.494	27%	0.266	S	S	.	.	H	α-helix	trans	-61.8	-48.9	177.7	178.2	178.1	169.9	154.9	1.4	111.4	T479 K480 V481 H485 A486 Q487	T479-R483 VanDerWaalsContact O-CB 3.26Å; T479-R483 WeakPolarHBondContact O-CB 3.43Å; T479-R483 PolarHBondContact O-N 3.2Å; K480-R483 PolarHBondContact O-N 3.31Å; V481-R483 VanDerWaalsContact C-N 3.31Å; V481-R483 PolarHBondContact O-N 3.45Å; R483-H485 VanDerWaalsContact C-N 3.31Å; R483-H485 PolarHBondContact O-N 3.12Å; R483-A486 CarbonylContact O-C 3.37Å; R483-A486 PolarHBondContact O-N 3.5Å; R483-Q487 HydrophobicContact CG-CG 3.94Å; R483-Q487 VanDerWaalsContact NE-CD 3.28Å; R483-Q487 WeakPolarHBondContact O-CB 3.33Å; R483-Q487 VanDerWaalsContact O-CG 3.25Å; R483-Q487 WeakPolarHBondContact O-CG 3.43Å; R483-Q487 PolarHBondContact O-N 3.36Å
484	L	92.1	Very high	78.2	Confident	26 Å²	26	48 Å²	48	14%	0.136	29%	0.29	C	S	.	.	H	α-helix	trans	-63.9	-37.1	179	-67.5	173.6	0	0	0	111.9	L382 E383 F389 Q390 K480 V481 A486	L382-L484 HydrophobicContact CB-CD1 3.84Å; E383-L484 HydrophobicContact CG-CD1 3.83Å; E383-L484 HydrophobicContact CG-CD2 3.81Å; E383-L484 HydrophobicContact CG-CG 4.5Å; F389-L484 HydrophobicContact CE1-CB 4.48Å; Q390-L484 PolarHBondContact NE2-O 3.16Å; K480-L484 HydrophobicContact CG-CD1 4.06Å; K480-L484 HydrophobicContact CG-CG 4.46Å; K480-L484 WeakPolarHBondContact O-CB 3.4Å; K480-L484 VanDerWaalsContact O-CG 3.28Å; K480-L484 WeakPolarHBondContact O-CG 3.27Å; K480-L484 PolarHBondContact O-N 3.32Å; V481-L484 PolarHBondContact O-N 3.45Å; L484-A486 VanDerWaalsContact C-N 3.33Å; L484-A486 PolarHBondContact O-N 3.22Å
485	H	93	Very high	76.1	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-66.1	-36.1	174.8	-164.1	-98.3	0	0	0	112.2	F389 I392 L394 V481 V482 R483 R503 T506	F389-H485 AromaticContact CD1-CD2 3.94Å; F389-H485 VanDerWaalsContact CE1-CA 3.47Å; F389-H485 HydrophobicContact CE1-CB 3.57Å; F389-H485 AromaticContact CE1-CD2 3.59Å; F389-H485 AromaticContact CE1-CG 3.97Å; F389-H485 HydrophobicContact CE2-CB 4.45Å; F389-H485 AromaticContact CE2-CD2 3.76Å; F389-H485 HydrophobicContact CZ-CB 3.47Å; F389-H485 VanDerWaalsContact CZ-CB 3.47Å; F389-H485 AromaticContact CZ-CD2 3.5Å; F389-H485 AromaticContact CZ-CG 3.83Å; F389-H485 PolarHBondContact O-CD2 2.92Å; F389-H485 PolarHBondContact O-NE2 3.12Å; I392-H485 PolarHBondContact O-CE1 2.87Å; I392-H485 PolarHBondContact O-NE2 3.23Å; L394-H485 HydrophobicContact CD2-CB 3.86Å; V481-H485 WeakPolarHBondContact O-CB 3.32Å; V481-H485 PolarHBondContact O-N 3.43Å; V482-H485 PolarHBondContact O-N 3.48Å; R483-H485 VanDerWaalsContact C-N 3.31Å; R483-H485 PolarHBondContact O-N 3.12Å; H485-R503 PolarHBondContact O-NE 3.23Å; H485-R503 PolarHBondContact O-NH2 3.02Å; H485-T506 HydrophobicContact CB-CG2 4.37Å; H485-T506 PolarHBondContact ND1-OG1 3.4Å
486	A	88.9	Confident	73.9	Confident	47 Å²	47	61.9 Å²	61.9	39%	0.388	35%	0.348	S	S	.	.	H	α-helix	trans	-92.1	-14.2	-177.3	0	0	0	0	0	115.1	V482 R483 L484 R503	V482-A486 WeakPolarHBondContact O-CB 3.23Å; V482-A486 PolarHBondContact O-N 2.8Å; R483-A486 CarbonylContact O-C 3.37Å; R483-A486 PolarHBondContact O-N 3.5Å; L484-A486 VanDerWaalsContact C-N 3.33Å; L484-A486 PolarHBondContact O-N 3.22Å; A486-R503 VanDerWaalsContact C-CZ 3.43Å; A486-R503 PolarHBondContact O-NH1 2.78Å; A486-R503 PolarHBondContact O-NH2 3.32Å
487	Q	77.5	Confident	71.8	Confident	107 Å²	107	62.5 Å²	62.5	50%	0.5	35%	0.352	S	S	.	.	H	α-helix	trans	-94	-22.6	-178	-78.8	-173.6	-19.5	0	0	117.6	R483	R483-Q487 HydrophobicContact CG-CG 3.94Å; R483-Q487 VanDerWaalsContact NE-CD 3.28Å; R483-Q487 WeakPolarHBondContact O-CB 3.33Å; R483-Q487 VanDerWaalsContact O-CG 3.25Å; R483-Q487 WeakPolarHBondContact O-CG 3.43Å; R483-Q487 PolarHBondContact O-N 3.36Å
488	G	60.6	Low	69.8	Low	8 Å²	8	70.3 Å²	70.3	8%	0.082	39%	0.387	C	S	.	.			trans	23.2	107.3	164.9	0	0	0	0	0	115.8	T490 R503	G488-T490 PolarHBondContact O-N 2.82Å; G488-R503 VanDerWaalsContact CA-NH2 3.29Å
489	K	52	Low	67.8	Low	129 Å²	129	75 Å²	75	56%	0.561	41%	0.412	S	S	*	.	S	Bend	trans	-50.3	6.9	-162.5	-70.8	-178	175.9	177.4	0	119	E383 N384 P491	E383-K489 WeakPolarHBondContact O-CE 3.45Å; E383-K489 PolarHBondContact O-NZ 2.95Å; N384-K489 PolarHBondContact O-NZ 2.95Å; K489-P491 WeakPolarHBondContact O-CD 3.26Å
490	T	43.7	Very low	66	Low	42 Å²	42	74.9 Å²	74.9	26%	0.258	42%	0.42	S	S	.	.			trans	-82.5	110.9	173	46.2	0	0	0	0	111.6	G488 G492 V494	G488-T490 PolarHBondContact O-N 2.82Å; T490-G492 PolarHBondContact O-N 3.26Å; T490-V494 PolarHBondContact OG1-O 2.91Å
491	P	36.2	Very low	64.4	Low	132 Å²	132	74.3 Å²	74.3	86%	0.857	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	123.3	166.3	-8.9	26.8	0	0	0	107.9	K489	K489-P491 WeakPolarHBondContact O-CD 3.26Å
492	G	44.5	Very low	63	Low	70 Å²	70	81.2 Å²	81.2	72%	0.722	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	121.3	13.8	171.5	0	0	0	0	0	117.6	T490 V494	T490-G492 PolarHBondContact O-N 3.26Å; G492-V494 PolarHBondContact O-N 3.43Å
493	G	47.2	Very low	62.3	Low	70 Å²	70	82.6 Å²	82.6	72%	0.722	46%	0.456	S	S	*	.			trans	69.1	17.8	170.1	0	0	0	0	0	114.8	H495	G493-H495 PolarHBondContact O-N 3.02Å
494	V	46.7	Very low	62	Low	84 Å²	84	76.5 Å²	76.5	51%	0.509	43%	0.434	S	S	.	.			trans	-77.2	117.1	175.8	-172.9	0	0	0	0	108.3	T490 G492 R496	T490-V494 PolarHBondContact OG1-O 2.91Å; G492-V494 PolarHBondContact O-N 3.43Å; V494-R496 HydrophobicContact CG1-CB 4.02Å; V494-R496 HydrophobicContact CG1-CG 4.46Å; V494-R496 PolarHBondContact O-N 3.14Å
495	H	54	Low	61.9	Low	149 Å²	149	79.3 Å²	79.3	69%	0.69	45%	0.445	S	S	*	.	S	Bend	trans	-66.2	15.9	177.1	-76.3	-75.1	0	0	0	115	G493 R503	G493-H495 PolarHBondContact O-N 3.02Å; H495-R503 PolarHBondContact O-N 3.34Å; H495-R503 VanDerWaalsContact O-N 3.14Å
496	R	51.6	Low	61.9	Low	163 Å²	163	81.2 Å²	81.2	62%	0.615	46%	0.457	S	S	*	.	B	Isolated β-bridge	trans	-112	132.3	177.4	-68.7	-178.8	172.4	170.3	-3	108.9	V494 T501	V494-R496 HydrophobicContact CG1-CB 4.02Å; V494-R496 HydrophobicContact CG1-CG 4.46Å; V494-R496 PolarHBondContact O-N 3.14Å; R496-T501 WeakPolarHBondContact CA-O 3.44Å
497	T	53.8	Low	62.1	Low	16 Å²	16	81.3 Å²	81.3	10%	0.098	45%	0.448	C	S	.	.			trans	-61.8	167	164.5	46.2	0	0	0	0	110.2	D499 G500 T501	T497-D499 WeakPolarHBondContact CB-OD1 3.4Å; T497-D499 PolarHBondContact O-N 3.06Å; T497-D499 VanDerWaalsContact O-N 3.1Å; T497-D499 PolarHBondContact OG1-OD1 3.17Å; T497-G500 PolarHBondContact O-N 3.12Å; T497-T501 PolarHBondContact N-O 3.42Å; T497-T501 VanDerWaalsContact N-O 3.08Å; T497-T501 WeakPolarHBondContact OG1-CA 3.24Å; T497-T501 PolarHBondContact OG1-N 3.24Å; T497-T501 PolarHBondContact OG1-O 2.9Å; T497-T501 PolarHBondContact OG1-OG1 3.41Å
498	E	54.5	Low	62.9	Low	176 Å²	176	79.6 Å²	79.6	82%	0.822	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-25.1	-179.9	-71.5	180	169.2	0	0	113.3
499	D	55.4	Low	64.5	Low	97 Å²	97	80.8 Å²	80.8	52%	0.519	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	4.5	176.3	58.5	5.9	0	0	0	114	T497 T501	T497-D499 WeakPolarHBondContact CB-OD1 3.4Å; T497-D499 PolarHBondContact O-N 3.06Å; T497-D499 VanDerWaalsContact O-N 3.1Å; T497-D499 PolarHBondContact OG1-OD1 3.17Å; D499-T501 VanDerWaalsContact C-N 3.35Å; D499-T501 PolarHBondContact OD1-N 2.83Å; D499-T501 PolarHBondContact OD1-OG1 3.26Å
500	G	56.6	Low	66.5	Low	42 Å²	42	77.3 Å²	77.3	43%	0.433	43%	0.429	S	S	.	.	S	Bend	trans	83.4	1.7	176.6	0	0	0	0	0	115.3	T497	T497-G500 PolarHBondContact O-N 3.12Å
501	T	61.1	Low	69	Low	46 Å²	46	76 Å²	76	28%	0.282	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-72.6	148.8	176.9	71.9	0	0	0	0	111.5	E391 R496 T497 D499 R503	E391-T501 WeakPolarHBondContact CG-OG1 3.28Å; E391-T501 WeakPolarHBondContact OE1-CG2 3.35Å; E391-T501 PolarHBondContact OE1-OG1 3Å; R496-T501 WeakPolarHBondContact CA-O 3.44Å; T497-T501 PolarHBondContact N-O 3.42Å; T497-T501 VanDerWaalsContact N-O 3.08Å; T497-T501 WeakPolarHBondContact OG1-CA 3.24Å; T497-T501 PolarHBondContact OG1-N 3.24Å; T497-T501 PolarHBondContact OG1-O 2.9Å; T497-T501 PolarHBondContact OG1-OG1 3.41Å; D499-T501 VanDerWaalsContact C-N 3.35Å; D499-T501 PolarHBondContact OD1-N 2.83Å; D499-T501 PolarHBondContact OD1-OG1 3.26Å; T501-R503 PolarHBondContact O-N 3.01Å
502	Q	67.3	Low	71.6	Confident	144 Å²	144	72.2 Å²	72.2	67%	0.673	40%	0.396	S	S	*	.	B	Isolated β-bridge	trans	-73.9	123.9	179.2	-77.9	-172.2	-5.9	0	0	109.6
503	R	78.8	Confident	73.9	Confident	56 Å²	56	71.2 Å²	71.2	21%	0.211	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-63.6	137.3	173.3	-169.8	-162.5	-176.4	141.4	29.2	111.6	H485 A486 G488 H495 T501	H485-R503 PolarHBondContact O-NE 3.23Å; H485-R503 PolarHBondContact O-NH2 3.02Å; A486-R503 VanDerWaalsContact C-CZ 3.43Å; A486-R503 PolarHBondContact O-NH1 2.78Å; A486-R503 PolarHBondContact O-NH2 3.32Å; G488-R503 VanDerWaalsContact CA-NH2 3.29Å; H495-R503 PolarHBondContact O-N 3.34Å; H495-R503 VanDerWaalsContact O-N 3.14Å; T501-R503 PolarHBondContact O-N 3.01Å
504	G	87.1	Confident	76	Confident	3 Å²	3	72.1 Å²	72.1	3%	0.031	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-65.4	149.3	170.8	0	0	0	0	0	112.8	Q390 D393	Q390-G504 PolarHBondContact O-N 2.88Å; D393-G504 WeakPolarHBondContact OD1-CA 3.35Å
505	K	90.5	Very high	78	Confident	85 Å²	85	68.1 Å²	68.1	37%	0.37	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-80.6	151.7	176.4	-66.6	166.8	-176.4	176.6	0	110.4	D393 L394 F507 G579 Q580	D393-K505 CarbonylContact C-O 3.46Å; D393-K505 PolarHBondContact OD1-N 3.14Å; L394-K505 PolarHBondContact N-O 2.91Å; K505-F507 HydrophobicContact CB-CE2 3.75Å; K505-F507 HydrophobicContact CB-CZ 4.27Å; K505-G579 WeakPolarHBondContact CD-O 3.26Å; K505-Q580 VanDerWaalsContact NZ-CG 3.25Å
506	T	92.5	Very high	79.6	Confident	40 Å²	40	62.8 Å²	62.8	25%	0.245	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130.3	-179.7	-39.7	0	0	0	0	110	L394 V482 H485	L394-T506 HydrophobicContact CD2-CG2 4.41Å; L394-T506 CarbonylContact O-C 3.55Å; L394-T506 WeakPolarHBondContact O-CA 3.41Å; V482-T506 HydrophobicContact CB-CG2 4.49Å; V482-T506 HydrophobicContact CG1-CG2 3.88Å; H485-T506 HydrophobicContact CB-CG2 4.37Å; H485-T506 PolarHBondContact ND1-OG1 3.4Å
507	F	93.5	Very high	80.8	Confident	48 Å²	48	57.8 Å²	57.8	21%	0.211	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	145.8	174.9	-59.9	-84.3	0	0	0	109.7	L394 L395 V396 K505 F575 L582	L394-F507 PolarHBondContact O-N 2.84Å; L395-F507 CarbonylContact C-O 3.57Å; L395-F507 WeakPolarHBondContact CA-O 3.07Å; L395-F507 HydrophobicContact CD1-CB 3.52Å; V396-F507 PolarHBondContact N-O 3.42Å; K505-F507 HydrophobicContact CB-CE2 3.75Å; K505-F507 HydrophobicContact CB-CZ 4.27Å; F507-F575 HydrophobicContact CD2-CD2 4Å; F507-F575 AromaticContact CD2-CE2 3.82Å; F507-F575 HydrophobicContact CD2-CE2 3.82Å; F507-F575 HydrophobicContact CE2-CD2 4.21Å; F507-F575 HydrophobicContact CE2-CE2 4.15Å; F507-L582 HydrophobicContact CB-CD1 4.1Å; F507-L582 HydrophobicContact CD1-CD1 4.14Å; F507-L582 HydrophobicContact CD1-CG 4.43Å; F507-L582 HydrophobicContact CG-CD1 4.38Å
508	F	93.7	Very high	81.7	Confident	71 Å²	71	59 Å²	59	31%	0.311	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	136.3	176.7	-175.3	-89.9	0	0	0	109.2	V396 A398 L475 V482	V396-F508 HydrophobicContact CB-CD2 3.8Å; V396-F508 HydrophobicContact CB-CE2 4.38Å; V396-F508 HydrophobicContact CG1-CD2 3.63Å; V396-F508 HydrophobicContact CG1-CE2 3.7Å; V396-F508 CarbonylContact O-C 3.51Å; V396-F508 VanDerWaalsContact O-CA 3.29Å; V396-F508 WeakPolarHBondContact O-CA 3.28Å; A398-F508 HydrophobicContact CB-CZ 4.09Å; L475-F508 HydrophobicContact CD1-CZ 3.87Å; V482-F508 HydrophobicContact CG2-CD2 3.9Å
509	Y	93.8	Very high	82.7	Confident	34 Å²	34	54.5 Å²	54.5	13%	0.133	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	148.9	171.2	79.4	-85.9	0	0	0	111.2	L291 L395 V396 G397 A398 F511 D531 L568	L291-Y509 HydrophobicContact CD2-CE1 3.9Å; L291-Y509 WeakPolarHBondContact CD2-OH 3.36Å; L395-Y509 HydrophobicContact CD1-CD1 4Å; L395-Y509 HydrophobicContact CG-CD1 4.47Å; V396-Y509 VanDerWaalsContact O-CD1 3.28Å; V396-Y509 WeakPolarHBondContact O-CD1 3.22Å; V396-Y509 PolarHBondContact O-N 2.93Å; G397-Y509 WeakPolarHBondContact CA-O 2.85Å; A398-Y509 PolarHBondContact N-O 2.94Å; Y509-F511 HydrophobicContact CD2-CB 4.41Å; Y509-F511 HydrophobicContact CE2-CB 4.03Å; Y509-D531 PolarHBondContact OH-OD2 3.43Å; Y509-L568 HydrophobicContact CE2-CD1 4.32Å
510	L	94.9	Very high	84.2	Confident	55 Å²	55	51 Å²	51	29%	0.288	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	117	170.1	-179	74.9	0	0	0	107.9	A398 Y600	A398-L510 HydrophobicContact CB-CD1 4.34Å; A398-L510 CarbonylContact O-C 3.56Å; A398-L510 WeakPolarHBondContact O-CA 3.45Å; L510-Y600 HydrophobicContact CD1-CD1 4.46Å; L510-Y600 HydrophobicContact CD1-CE1 3.77Å; L510-Y600 HydrophobicContact CD2-CD1 4.21Å; L510-Y600 HydrophobicContact CD2-CD2 3.96Å; L510-Y600 HydrophobicContact CD2-CE1 3.73Å; L510-Y600 HydrophobicContact CD2-CE2 3.49Å; L510-Y600 VanDerWaalsContact CD2-CE2 3.49Å; L510-Y600 HydrophobicContact CD2-CG 4.31Å; L510-Y600 HydrophobicContact CG-CE1 4.36Å
511	F	94.8	Very high	85.8	Confident	14 Å²	14	51.7 Å²	51.7	6%	0.061	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	116.3	170.2	-172.3	-101.5	0	0	0	108.5	A398 Y509 H513 S526 E530 D531 Y534 I564 L568	A398-F511 PolarHBondContact O-N 2.83Å; Y509-F511 HydrophobicContact CD2-CB 4.41Å; Y509-F511 HydrophobicContact CE2-CB 4.03Å; F511-H513 HydrophobicContact CE1-CB 4.11Å; F511-H513 WeakPolarHBondContact CE1-O 3.42Å; F511-H513 HydrophobicContact CE2-CB 4.22Å; F511-H513 HydrophobicContact CZ-CB 3.79Å; F511-S526 WeakPolarHBondContact O-CB 3.32Å; F511-S526 PolarHBondContact O-OG 2.77Å; F511-E530 HydrophobicContact CE1-CB 4.14Å; F511-D531 HydrophobicContact CB-CB 3.98Å; F511-D531 HydrophobicContact CD1-CB 4.01Å; F511-D531 HydrophobicContact CD2-CB 4.05Å; F511-D531 HydrophobicContact CG-CB 3.75Å; F511-Y534 HydrophobicContact CE1-CD2 4.49Å; F511-Y534 HydrophobicContact CE1-CE2 4.28Å; F511-Y534 HydrophobicContact CE2-CD2 4.28Å; F511-Y534 HydrophobicContact CE2-CG 4.33Å; F511-Y534 HydrophobicContact CZ-CD1 4.48Å; F511-Y534 AromaticContact CZ-CD2 3.71Å; F511-Y534 HydrophobicContact CZ-CD2 3.71Å; F511-Y534 HydrophobicContact CZ-CE1 4.4Å; F511-Y534 AromaticContact CZ-CE2 3.65Å; F511-Y534 HydrophobicContact CZ-CE2 3.65Å; F511-Y534 HydrophobicContact CZ-CG 4.15Å; F511-I564 HydrophobicContact CE2-CG2 4.12Å; F511-L568 HydrophobicContact CE2-CD2 4.49Å
512	S	92.4	Very high	87.1	Confident	53 Å²	53	53 Å²	53	37%	0.371	30%	0.296	S	S	.	.			trans	-117.8	0.9	-175.6	59.7	0	0	0	0	114.2
513	H	91.8	Very high	88.2	Confident	50 Å²	50	46.4 Å²	46.4	23%	0.231	27%	0.266	C	S	.	.			trans	-74.8	137.9	-176.3	-178.9	75.2	0	0	0	111.9	F511 S526 Y534 E561 I564	F511-H513 HydrophobicContact CE1-CB 4.11Å; F511-H513 WeakPolarHBondContact CE1-O 3.42Å; F511-H513 HydrophobicContact CE2-CB 4.22Å; F511-H513 HydrophobicContact CZ-CB 3.79Å; H513-S526 WeakPolarHBondContact O-CB 3.01Å; H513-Y534 AromaticContact CD2-CZ 3.94Å; H513-Y534 PolarHBondContact CD2-OH 2.96Å; H513-Y534 VanDerWaalsContact CD2-OH 3.29Å; H513-E561 VanDerWaalsContact NE2-CG 3.28Å; H513-E561 WeakPolarHBondContact NE2-CG 3.44Å; H513-E561 IonicContact NE2-OE1 3.12Å; H513-I564 HydrophobicContact CB-CD1 4.34Å; H513-I564 WeakPolarHBondContact CE1-CD1 3.43Å; H513-I564 VanDerWaalsContact ND1-CD1 3.35Å; H513-I564 WeakPolarHBondContact ND1-CD1 3.15Å
514	E	90.4	Very high	88.7	Confident	88 Å²	88	51 Å²	51	41%	0.411	29%	0.287	S	S	.	.			trans	-89.4	105.6	178	-68.5	174.5	-154.2	0	0	110.2	K524 G525	E514-K524 VanDerWaalsContact OE1-CA 3.24Å; E514-K524 WeakPolarHBondContact OE1-CA 3.41Å; E514-G525 PolarHBondContact OE1-N 3.31Å
515	T	89.9	Confident	88.9	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.288	C	S	.	.			trans	-62.8	138	177.4	-53.9	0	0	0	0	111.9	R520 Y534 F555 F557	T515-R520 PolarHBondContact O-NH1 3.14Å; T515-R520 PolarHBondContact O-NH2 3.4Å; T515-Y534 WeakPolarHBondContact CB-OH 3.24Å; T515-Y534 HydrophobicContact CG2-CE2 4.38Å; T515-Y534 WeakPolarHBondContact CG2-OH 3.29Å; T515-Y534 WeakPolarHBondContact OG1-CE2 3.29Å; T515-Y534 PolarHBondContact OG1-OH 2.96Å; T515-F555 HydrophobicContact CG2-CB 4.25Å; T515-F555 HydrophobicContact CG2-CD1 3.43Å; T515-F555 VanDerWaalsContact CG2-CD1 3.43Å; T515-F555 HydrophobicContact CG2-CE1 3.93Å; T515-F555 HydrophobicContact CG2-CG 4.05Å; T515-F557 HydrophobicContact CG2-CD1 4.03Å; T515-F557 HydrophobicContact CG2-CE1 3.68Å
516	S	86.9	Confident	89.1	Confident	37 Å²	37	47 Å²	47	26%	0.259	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	147.7	178.6	-56.2	0	0	0	0	111.7	T556 N558 E561	S516-T556 WeakPolarHBondContact CB-O 3.37Å; S516-N558 PolarHBondContact OG-ND2 2.93Å; S516-E561 VanDerWaalsContact CB-OE1 3.32Å; S516-E561 WeakPolarHBondContact CB-OE1 3.25Å; S516-E561 PolarHBondContact N-OE1 3.2Å; S516-E561 PolarHBondContact OG-OE1 3.42Å
517	G	76.4	Confident	89.1	Confident	58 Å²	58	45.2 Å²	45.2	60%	0.598	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.6	-15.1	168.2	0	0	0	0	0	116.9
518	N	72.9	Confident	89.2	Confident	42 Å²	42	43.5 Å²	43.5	23%	0.225	25%	0.252	C	S	.	.			trans	-103.2	127.4	178.9	-76	-21	0	0	0	112.7	R520 F555	N518-R520 PolarHBondContact O-N 2.92Å; N518-R520 PolarHBondContact O-NH1 3.39Å; N518-F555 VanDerWaalsContact ND2-CD1 3.31Å; N518-F555 WeakPolarHBondContact ND2-CD1 3.31Å; N518-F555 WeakPolarHBondContact ND2-CE1 3.48Å
519	P	76.8	Confident	89	Confident	82 Å²	82	41 Å²	41	53%	0.532	24%	0.244	S	C	.	.			trans	-66.9	123.3	172.4	27.6	-31.9	0	0	0	109.7	Y404 Y521	Y404-P519 PolarHBondContact OH-O 3.02Å; P519-Y521 HydrophobicContact CB-CE1 4.47Å
520	R	85	Confident	89	Confident	24 Å²	24	39.4 Å²	39.4	9%	0.091	24%	0.238	C	C	.	.			trans	-111	11	174.7	-61.7	-178	-172.9	76.7	7.9	112.8	T515 N518 G522 L523 E530	T515-R520 PolarHBondContact O-NH1 3.14Å; T515-R520 PolarHBondContact O-NH2 3.4Å; N518-R520 PolarHBondContact O-N 2.92Å; N518-R520 PolarHBondContact O-NH1 3.39Å; R520-G522 PolarHBondContact O-N 2.91Å; R520-G522 VanDerWaalsContact O-N 3.12Å; R520-L523 HydrophobicContact CB-CB 4.21Å; R520-L523 WeakPolarHBondContact O-CB 3.25Å; R520-L523 PolarHBondContact O-N 3.43Å; R520-E530 IonicContact CZ-OE1 3.12Å; R520-E530 IonicContact CZ-OE2 3Å; R520-E530 IonicContact NE-OE1 3.84Å; R520-E530 IonicContact NE-OE2 3.96Å; R520-E530 VanDerWaalsContact NH2-CD 3.31Å; R520-E530 IonicContact NH2-OE1 2.82Å; R520-E530 PolarHBondContact NH2-OE1 3.33Å; R520-E530 IonicContact NH2-OE2 2.73Å; R520-E530 PolarHBondContact NH2-OE2 3.47Å
521	Y	90.7	Very high	88.9	Confident	56 Å²	56	37 Å²	37	22%	0.22	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	43.6	177.6	-49.6	-70.6	0	0	0	113.5	E116 L412 Q413 R462 P519 L523	E116-Y521 PolarHBondContact OE2-OH 3.35Å; L412-Y521 HydrophobicContact CB-CD2 3.69Å; L412-Y521 HydrophobicContact CB-CE2 3.96Å; L412-Y521 WeakPolarHBondContact O-CB 3.33Å; Q413-Y521 HydrophobicContact CB-CD1 3.75Å; Q413-Y521 HydrophobicContact CB-CE1 3.84Å; Q413-Y521 HydrophobicContact CB-CG 4.13Å; Q413-Y521 HydrophobicContact CG-CD1 3.76Å; Q413-Y521 HydrophobicContact CG-CE1 3.88Å; R462-Y521 PolarHBondContact NH1-O 2.77Å; P519-Y521 HydrophobicContact CB-CE1 4.47Å; Y521-L523 VanDerWaalsContact C-N 3.28Å; Y521-L523 PolarHBondContact O-N 2.89Å
522	G	88.2	Confident	88.9	Confident	73 Å²	73	36.6 Å²	36.6	75%	0.753	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	80	-3.7	-179.2	0	0	0	0	0	115.8	R520 K524	R520-G522 PolarHBondContact O-N 2.91Å; R520-G522 VanDerWaalsContact O-N 3.12Å; G522-K524 PolarHBondContact O-N 3.22Å
523	L	90.8	Very high	89	Confident	6 Å²	6	34.1 Å²	34.1	3%	0.031	21%	0.206	C	C	.	.			trans	-67.8	129.5	175.4	-169.7	71.9	0	0	0	110.4	H401 Y404 D463 L466 R520 Y521 I527	H401-L523 HydrophobicContact CB-CD2 4.13Å; Y404-L523 HydrophobicContact CD2-CD2 3.72Å; Y404-L523 HydrophobicContact CE2-CD2 4.01Å; D463-L523 WeakPolarHBondContact OD1-CD1 3.47Å; L466-L523 HydrophobicContact CD1-CD1 4.18Å; L466-L523 HydrophobicContact CD1-CD2 3.89Å; R520-L523 HydrophobicContact CB-CB 4.21Å; R520-L523 WeakPolarHBondContact O-CB 3.25Å; R520-L523 PolarHBondContact O-N 3.43Å; Y521-L523 VanDerWaalsContact C-N 3.28Å; Y521-L523 PolarHBondContact O-N 2.89Å; L523-I527 HydrophobicContact CD2-CG2 4.42Å
524	K	90.5	Very high	89.2	Confident	152 Å²	152	31.7 Å²	31.7	66%	0.661	20%	0.195	S	C	*	.			trans	-97.4	137	-179.5	-65.7	-175.6	-179.7	178.4	0	112.6	K400 H401 E514 G522	K400-K524 WeakPolarHBondContact CD-O 3.26Å; K400-K524 PolarHBondContact NZ-O 2.7Å; K400-K524 VanDerWaalsContact NZ-O 3.11Å; H401-K524 PolarHBondContact NE2-O 2.9Å; E514-K524 VanDerWaalsContact OE1-CA 3.24Å; E514-K524 WeakPolarHBondContact OE1-CA 3.41Å; G522-K524 PolarHBondContact O-N 3.22Å
525	G	90.9	Very high	89.4	Confident	4 Å²	4	27.7 Å²	27.7	4%	0.041	18%	0.176	C	C	.	.	S	Bend	trans	98.6	178.8	-178.1	0	0	0	0	0	113.9	E514	E514-G525 PolarHBondContact OE1-N 3.31Å
526	S	93.8	Very high	89.7	Confident	0 Å²	0	28 Å²	28	0%	0	18%	0.178	C	C	.	.			trans	-72.1	153.9	-179.5	58.1	0	0	0	0	112.6	T399 K400 H401 F511 H513 E530	T399-S526 WeakPolarHBondContact CB-OG 3.5Å; K400-S526 PolarHBondContact N-OG 2.91Å; H401-S526 PolarHBondContact N-O 3.17Å; F511-S526 WeakPolarHBondContact O-CB 3.32Å; F511-S526 PolarHBondContact O-OG 2.77Å; H513-S526 WeakPolarHBondContact O-CB 3.01Å; S526-E530 WeakPolarHBondContact CA-OE2 3.31Å
527	I	94	Very high	90	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.01	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-111.7	171.6	170.4	61.5	174.5	0	0	0	110	T399 H401 Y404 L523 A529 E530	T399-I527 WeakPolarHBondContact CG2-O 3.28Å; T399-I527 PolarHBondContact OG1-O 3.02Å; H401-I527 HydrophobicContact CB-CG2 4.3Å; Y404-I527 HydrophobicContact CD1-CB 4.23Å; Y404-I527 HydrophobicContact CD1-CD1 3.78Å; Y404-I527 HydrophobicContact CD1-CG2 4.17Å; Y404-I527 HydrophobicContact CD2-CB 4.36Å; Y404-I527 HydrophobicContact CD2-CG2 3.51Å; Y404-I527 HydrophobicContact CE1-CD1 3.85Å; Y404-I527 HydrophobicContact CE2-CG2 4.07Å; Y404-I527 HydrophobicContact CG-CB 3.88Å; Y404-I527 HydrophobicContact CG-CD1 4.26Å; Y404-I527 HydrophobicContact CG-CG2 3.55Å; L523-I527 HydrophobicContact CD2-CG2 4.42Å; I527-A529 PolarHBondContact O-N 2.66Å; I527-E530 HydrophobicContact CG1-CG 3.64Å; I527-E530 WeakPolarHBondContact CG1-OE1 3.48Å; I527-E530 PolarHBondContact N-OE2 2.68Å; I527-E530 VanDerWaalsContact N-OE2 3.11Å; I527-E530 WeakPolarHBondContact O-CB 3.25Å; I527-E530 WeakPolarHBondContact O-CG 3.26Å; I527-E530 PolarHBondContact O-N 3.43Å
528	H	93.5	Very high	90.7	Very high	12 Å²	12	24.1 Å²	24.1	6%	0.056	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-43.3	133	-177	-167.3	59.4	0	0	0	113.8	R117 D262 T399 H401 E402 Y474 E530	R117-H528 VanDerWaalsContact CZ-O 3.29Å; R117-H528 PolarHBondContact NH1-O 3.17Å; R117-H528 PolarHBondContact NH2-O 3.27Å; D262-H528 IonicContact OD1-CE1 3.69Å; D262-H528 IonicContact OD1-NE2 4Å; T399-H528 PolarHBondContact OG1-N 3.29Å; H401-H528 PolarHBondContact O-N 3.2Å; E402-H528 WeakPolarHBondContact O-CB 3.2Å; E402-H528 IonicContact OE2-CE1 2.79Å; E402-H528 IonicContact OE2-CG 3.5Å; E402-H528 IonicContact OE2-ND1 3.73Å; E402-H528 PolarHBondContact OE2-ND1 2.83Å; Y474-H528 AromaticContact CE1-CE1 3.96Å; H528-E530 PolarHBondContact O-N 2.82Å; H528-E530 VanDerWaalsContact O-N 3.15Å
529	A	91.1	Very high	91.6	Very high	19 Å²	19	22.2 Å²	22.2	16%	0.157	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	15.1	175	0	0	0	0	0	116.9	I527 D531 L532	I527-A529 PolarHBondContact O-N 2.66Å; A529-D531 VanDerWaalsContact C-N 3.26Å; A529-D531 PolarHBondContact O-N 3.29Å; A529-L532 HydrophobicContact CB-CD1 3.78Å; A529-L532 HydrophobicContact CB-CG 4.18Å; A529-L532 PolarHBondContact O-N 3.37Å
530	E	92.2	Very high	92.2	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.108	C	C	.	.			trans	-71.5	-17.4	175.8	-75.9	-165.3	148.6	0	0	114.3	F511 R520 S526 I527 H528 P533 Y534 F555	F511-E530 HydrophobicContact CE1-CB 4.14Å; R520-E530 IonicContact CZ-OE1 3.12Å; R520-E530 IonicContact CZ-OE2 3Å; R520-E530 IonicContact NE-OE1 3.84Å; R520-E530 IonicContact NE-OE2 3.96Å; R520-E530 VanDerWaalsContact NH2-CD 3.31Å; R520-E530 IonicContact NH2-OE1 2.82Å; R520-E530 PolarHBondContact NH2-OE1 3.33Å; R520-E530 IonicContact NH2-OE2 2.73Å; R520-E530 PolarHBondContact NH2-OE2 3.47Å; S526-E530 WeakPolarHBondContact CA-OE2 3.31Å; I527-E530 HydrophobicContact CG1-CG 3.64Å; I527-E530 WeakPolarHBondContact CG1-OE1 3.48Å; I527-E530 PolarHBondContact N-OE2 2.68Å; I527-E530 VanDerWaalsContact N-OE2 3.11Å; I527-E530 WeakPolarHBondContact O-CB 3.25Å; I527-E530 WeakPolarHBondContact O-CG 3.26Å; I527-E530 PolarHBondContact O-N 3.43Å; H528-E530 PolarHBondContact O-N 2.82Å; H528-E530 VanDerWaalsContact O-N 3.15Å; E530-P533 WeakPolarHBondContact O-CD 3.46Å; E530-P533 WeakPolarHBondContact O-CG 3.44Å; E530-Y534 WeakPolarHBondContact O-CD2 3.21Å; E530-Y534 WeakPolarHBondContact O-CE2 3.22Å; E530-F555 HydrophobicContact CG-CE1 4.24Å; E530-F555 HydrophobicContact CG-CZ 4.14Å
531	D	94.7	Very high	92.2	Very high	4 Å²	4	18.4 Å²	18.4	2%	0.021	11%	0.107	C	C	.	.	S	Bend	trans	-72.9	-33.1	174	58.8	-19.8	0	0	0	113	Y509 F511 A529 Y534 I535	Y509-D531 PolarHBondContact OH-OD2 3.43Å; F511-D531 HydrophobicContact CB-CB 3.98Å; F511-D531 HydrophobicContact CD1-CB 4.01Å; F511-D531 HydrophobicContact CD2-CB 4.05Å; F511-D531 HydrophobicContact CG-CB 3.75Å; A529-D531 VanDerWaalsContact C-N 3.26Å; A529-D531 PolarHBondContact O-N 3.29Å; D531-Y534 WeakPolarHBondContact O-CA 3.38Å; D531-Y534 WeakPolarHBondContact O-CB 3.47Å; D531-Y534 PolarHBondContact O-N 3Å; D531-I535 PolarHBondContact O-N 3.43Å
532	L	94.9	Very high	91.5	Very high	7 Å²	7	20 Å²	20	4%	0.037	12%	0.119	C	C	.	.	H	α-helix	trans	-50.8	-51.3	-177.9	-63.5	-175.4	0	0	0	115.4	W261 L291 A529 Y534 I535 L536 F553	W261-L532 HydrophobicContact CB-CD1 4.21Å; W261-L532 HydrophobicContact CB-CD2 3.99Å; W261-L532 HydrophobicContact CD2-CD1 3.54Å; W261-L532 HydrophobicContact CD2-CD2 4.05Å; W261-L532 HydrophobicContact CD2-CG 4.47Å; W261-L532 HydrophobicContact CE3-CD1 4.02Å; W261-L532 HydrophobicContact CE3-CD2 3.86Å; W261-L532 HydrophobicContact CG-CD1 3.6Å; W261-L532 HydrophobicContact CG-CD2 4.12Å; W261-L532 HydrophobicContact CG-CG 4.45Å; W261-L532 HydrophobicContact CZ2-CD1 4.42Å; L291-L532 HydrophobicContact CD1-CD2 3.48Å; L291-L532 VanDerWaalsContact CD1-CD2 3.48Å; A529-L532 HydrophobicContact CB-CD1 3.78Å; A529-L532 HydrophobicContact CB-CG 4.18Å; A529-L532 PolarHBondContact O-N 3.37Å; L532-Y534 PolarHBondContact O-N 3.28Å; L532-I535 PolarHBondContact O-N 3.3Å; L532-I535 VanDerWaalsContact O-N 3.12Å; L532-L536 PolarHBondContact O-N 3.45Å; L532-F553 HydrophobicContact CB-CE1 4.17Å; L532-F553 HydrophobicContact CB-CZ 3.9Å
533	P	93.9	Very high	90.5	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.8	-30.1	178.9	22.8	-33.7	0	0	0	112.6	E530 G537 Y538 P539 F553 F555 F557	E530-P533 WeakPolarHBondContact O-CD 3.46Å; E530-P533 WeakPolarHBondContact O-CG 3.44Å; P533-G537 PolarHBondContact O-N 3.22Å; P533-Y538 HydrophobicContact CB-CD2 4.43Å; P533-Y538 HydrophobicContact CB-CG 4.45Å; P533-Y538 PolarHBondContact O-N 2.7Å; P533-P539 WeakPolarHBondContact O-CD 3.39Å; P533-F553 HydrophobicContact CB-CD1 4.25Å; P533-F553 HydrophobicContact CB-CD2 4.15Å; P533-F553 HydrophobicContact CB-CE1 4.36Å; P533-F553 HydrophobicContact CB-CE2 4.28Å; P533-F553 HydrophobicContact CB-CG 4.13Å; P533-F553 HydrophobicContact CB-CZ 4.38Å; P533-F553 HydrophobicContact CG-CD1 4.38Å; P533-F553 HydrophobicContact CG-CE1 4.4Å; P533-F555 HydrophobicContact CG-CD2 4.12Å; P533-F555 HydrophobicContact CG-CE2 3.97Å; P533-F557 HydrophobicContact CB-CE1 4.42Å; P533-F557 HydrophobicContact CB-CZ 3.74Å; P533-F557 HydrophobicContact CG-CE1 4.49Å; P533-F557 HydrophobicContact CG-CZ 4.16Å
534	Y	94.9	Very high	89.6	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-72.4	-37.6	175.9	-62.9	-102	0	0	0	111.4	F511 H513 T515 E530 D531 L532 L536 G537 P539 F557 E561 I564 S565 M569	F511-Y534 HydrophobicContact CE1-CD2 4.49Å; F511-Y534 HydrophobicContact CE1-CE2 4.28Å; F511-Y534 HydrophobicContact CE2-CD2 4.28Å; F511-Y534 HydrophobicContact CE2-CG 4.33Å; F511-Y534 HydrophobicContact CZ-CD1 4.48Å; F511-Y534 AromaticContact CZ-CD2 3.71Å; F511-Y534 HydrophobicContact CZ-CD2 3.71Å; F511-Y534 HydrophobicContact CZ-CE1 4.4Å; F511-Y534 AromaticContact CZ-CE2 3.65Å; F511-Y534 HydrophobicContact CZ-CE2 3.65Å; F511-Y534 HydrophobicContact CZ-CG 4.15Å; H513-Y534 AromaticContact CD2-CZ 3.94Å; H513-Y534 PolarHBondContact CD2-OH 2.96Å; H513-Y534 VanDerWaalsContact CD2-OH 3.29Å; T515-Y534 WeakPolarHBondContact CB-OH 3.24Å; T515-Y534 HydrophobicContact CG2-CE2 4.38Å; T515-Y534 WeakPolarHBondContact CG2-OH 3.29Å; T515-Y534 WeakPolarHBondContact OG1-CE2 3.29Å; T515-Y534 PolarHBondContact OG1-OH 2.96Å; E530-Y534 WeakPolarHBondContact O-CD2 3.21Å; E530-Y534 WeakPolarHBondContact O-CE2 3.22Å; D531-Y534 WeakPolarHBondContact O-CA 3.38Å; D531-Y534 WeakPolarHBondContact O-CB 3.47Å; D531-Y534 PolarHBondContact O-N 3Å; L532-Y534 PolarHBondContact O-N 3.28Å; Y534-L536 VanDerWaalsContact C-N 3.34Å; Y534-G537 PolarHBondContact O-N 3.21Å; Y534-P539 HydrophobicContact CD1-CG 4Å; Y534-P539 HydrophobicContact CE1-CG 4.22Å; Y534-P539 HydrophobicContact CG-CG 4.38Å; Y534-F557 HydrophobicContact CE2-CE1 4.25Å; Y534-E561 HydrophobicContact CE1-CB 3.76Å; Y534-E561 HydrophobicContact CE1-CG 3.93Å; Y534-E561 WeakPolarHBondContact OH-CG 3.49Å; Y534-I564 HydrophobicContact CD1-CB 4.03Å; Y534-I564 HydrophobicContact CD1-CG2 3.7Å; Y534-I564 HydrophobicContact CE1-CB 4.11Å; Y534-I564 HydrophobicContact CE1-CG2 3.95Å; Y534-S565 PolarHBondContact O-OG 3.01Å; Y534-M569 WeakPolarHBondContact O-CG 3.15Å
535	I	95.9	Very high	88.5	Confident	3 Å²	3	24.9 Å²	24.9	2%	0.015	14%	0.137	C	C	.	.	H	α-helix	trans	-64.5	-38.9	174	-66	173.3	0	0	0	111.2	L198 L259 L291 D531 L532 L568 M569 I572	L198-I535 HydrophobicContact CD2-CG2 4.36Å; L259-I535 HydrophobicContact CD1-CG2 4.19Å; L291-I535 HydrophobicContact CD1-CD1 3.44Å; L291-I535 VanDerWaalsContact CD1-CD1 3.44Å; L291-I535 HydrophobicContact CD2-CD1 4.37Å; D531-I535 PolarHBondContact O-N 3.43Å; L532-I535 PolarHBondContact O-N 3.3Å; L532-I535 VanDerWaalsContact O-N 3.12Å; I535-L568 HydrophobicContact CD1-CD2 4.36Å; I535-L568 HydrophobicContact CG1-CD2 3.47Å; I535-L568 VanDerWaalsContact CG1-CD2 3.47Å; I535-L568 HydrophobicContact CG1-CG 3.79Å; I535-M569 VanDerWaalsContact O-CG 3.31Å; I535-M569 WeakPolarHBondContact O-CG 3.25Å; I535-I572 HydrophobicContact CD1-CD1 4.34Å; I535-I572 HydrophobicContact CG1-CD1 4.5Å; I535-I572 HydrophobicContact CG1-CG1 4.17Å; I535-I572 HydrophobicContact CG2-CG1 4.05Å; I535-I572 HydrophobicContact CG2-CG2 4.33Å
536	L	95.1	Very high	87.5	Confident	7 Å²	7	25.5 Å²	25.5	4%	0.037	14%	0.14	C	C	.	.	H	α-helix	trans	-85.1	-7.9	-178.4	-66.9	174.7	0	0	0	113.7	I179 Y193 L198 L532 Y534 Y538 F553	I179-L536 HydrophobicContact CD1-CD2 3.82Å; Y193-L536 HydrophobicContact CD1-CD1 3.86Å; Y193-L536 HydrophobicContact CG-CD1 4.45Å; L198-L536 HydrophobicContact CD2-CD2 4.45Å; L532-L536 PolarHBondContact O-N 3.45Å; Y534-L536 VanDerWaalsContact C-N 3.34Å; L536-Y538 HydrophobicContact CB-CD2 3.7Å; L536-Y538 HydrophobicContact CB-CE2 3.71Å; L536-Y538 HydrophobicContact CD1-CE2 4.06Å; L536-F553 HydrophobicContact CD1-CE2 3.91Å; L536-F553 HydrophobicContact CD1-CZ 4.23Å
537	G	93.5	Very high	86.1	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.9	15.4	174.5	0	0	0	0	0	115.3	I197 P533 Y534 P539 L540 S565 M569	I197-G537 WeakPolarHBondContact CD1-O 3.31Å; P533-G537 PolarHBondContact O-N 3.22Å; Y534-G537 PolarHBondContact O-N 3.21Å; G537-P539 VanDerWaalsContact C-CD 3.49Å; G537-L540 WeakPolarHBondContact O-CB 3.43Å; G537-L540 PolarHBondContact O-N 3.38Å; G537-L540 VanDerWaalsContact O-N 3.07Å; G537-S565 WeakPolarHBondContact CA-OG 3.35Å; G537-M569 WeakPolarHBondContact CA-SD 3.44Å
538	Y	91.6	Very high	84.9	Confident	13 Å²	13	26.9 Å²	26.9	5%	0.051	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-56.9	-38.7	-179	-82.5	-97.1	0	0	0	114.4	P533 L536 L540 L541 P546 N551 F553	P533-Y538 HydrophobicContact CB-CD2 4.43Å; P533-Y538 HydrophobicContact CB-CG 4.45Å; P533-Y538 PolarHBondContact O-N 2.7Å; L536-Y538 HydrophobicContact CB-CD2 3.7Å; L536-Y538 HydrophobicContact CB-CE2 3.71Å; L536-Y538 HydrophobicContact CD1-CE2 4.06Å; Y538-L540 PolarHBondContact O-N 2.78Å; Y538-L540 VanDerWaalsContact O-N 3.09Å; Y538-L541 HydrophobicContact CD1-CD1 3.99Å; Y538-L541 HydrophobicContact CE1-CD1 4.4Å; Y538-L541 WeakPolarHBondContact O-CB 3.28Å; Y538-L541 PolarHBondContact O-N 3.12Å; Y538-P546 HydrophobicContact CE1-CB 4.2Å; Y538-P546 HydrophobicContact CE1-CG 4.21Å; Y538-N551 WeakPolarHBondContact CE1-OD1 3.27Å; Y538-F553 HydrophobicContact CD1-CD2 4.06Å; Y538-F553 AromaticContact CD2-CD2 3.7Å; Y538-F553 HydrophobicContact CD2-CD2 3.7Å; Y538-F553 AromaticContact CD2-CE2 3.83Å; Y538-F553 HydrophobicContact CD2-CE2 3.83Å; Y538-F553 AromaticContact CE1-CD2 3.86Å; Y538-F553 HydrophobicContact CE1-CD2 3.86Å; Y538-F553 AromaticContact CE2-CD2 3.48Å; Y538-F553 HydrophobicContact CE2-CD2 3.48Å; Y538-F553 VanDerWaalsContact CE2-CD2 3.48Å; Y538-F553 AromaticContact CE2-CE2 3.46Å; Y538-F553 HydrophobicContact CE2-CE2 3.46Å; Y538-F553 VanDerWaalsContact CE2-CE2 3.46Å; Y538-F553 AromaticContact CG-CD2 3.97Å; Y538-F553 HydrophobicContact CG-CD2 3.97Å; Y538-F553 AromaticContact CZ-CD2 3.56Å; Y538-F553 AromaticContact CZ-CE2 3.9Å
539	P	91.4	Very high	83.6	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.013	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-56.5	-26.6	175.9	-30.1	38.6	0	0	0	114.3	P533 Y534 G537 L541 F557 E561 R562	P533-P539 WeakPolarHBondContact O-CD 3.39Å; Y534-P539 HydrophobicContact CD1-CG 4Å; Y534-P539 HydrophobicContact CE1-CG 4.22Å; Y534-P539 HydrophobicContact CG-CG 4.38Å; G537-P539 VanDerWaalsContact C-CD 3.49Å; P539-L541 VanDerWaalsContact C-N 3.31Å; P539-L541 PolarHBondContact O-N 2.7Å; P539-F557 HydrophobicContact CB-CB 4.07Å; P539-F557 HydrophobicContact CB-CD1 4.22Å; P539-F557 HydrophobicContact CB-CD2 4.33Å; P539-F557 HydrophobicContact CB-CG 3.95Å; P539-F557 HydrophobicContact CG-CB 4.45Å; P539-F557 HydrophobicContact CG-CD1 3.67Å; P539-F557 HydrophobicContact CG-CD2 4.12Å; P539-F557 HydrophobicContact CG-CE1 3.82Å; P539-F557 HydrophobicContact CG-CE2 4.27Å; P539-F557 HydrophobicContact CG-CG 3.82Å; P539-F557 HydrophobicContact CG-CZ 4.12Å; P539-E561 HydrophobicContact CB-CB 4.5Å; P539-R562 HydrophobicContact CB-CG 4.33Å; P539-R562 WeakPolarHBondContact O-CG 3.3Å; P539-R562 PolarHBondContact O-NE 3.46Å; P539-R562 VanDerWaalsContact O-NE 3.15Å
540	L	90.8	Very high	82.5	Confident	14 Å²	14	36.5 Å²	36.5	7%	0.073	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-72.3	-23.5	179.6	-76.9	69.8	0	0	0	112.7	L48 I197 Y201 G537 Y538 N542 S565 E566 M569	L48-L540 HydrophobicContact CD1-CB 4.43Å; L48-L540 WeakPolarHBondContact CD2-O 3.3Å; I197-L540 HydrophobicContact CG2-CD2 4.21Å; Y201-L540 HydrophobicContact CD2-CD2 4.41Å; G537-L540 WeakPolarHBondContact O-CB 3.43Å; G537-L540 PolarHBondContact O-N 3.38Å; G537-L540 VanDerWaalsContact O-N 3.07Å; Y538-L540 PolarHBondContact O-N 2.78Å; Y538-L540 VanDerWaalsContact O-N 3.09Å; L540-N542 PolarHBondContact O-N 3.2Å; L540-N542 VanDerWaalsContact O-N 3.13Å; L540-S565 WeakPolarHBondContact CD1-OG 3.49Å; L540-E566 HydrophobicContact CD1-CG 4.27Å; L540-E566 HydrophobicContact CD2-CG 4.39Å; L540-M569 HydrophobicContact CD1-CE 3.52Å; L540-M569 HydrophobicContact CD2-CE 3.68Å; L540-M569 HydrophobicContact CG-CE 4.25Å
541	L	84.7	Confident	81.7	Confident	12 Å²	12	38.7 Å²	38.7	6%	0.063	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-64.8	-15.8	-179.4	-72.2	169.6	0	0	0	113.4	I197 Y538 P539 N543 Q544 P546	I197-L541 HydrophobicContact CD1-CD1 4.28Å; I197-L541 HydrophobicContact CD1-CD2 3.54Å; I197-L541 HydrophobicContact CD1-CG 3.53Å; Y538-L541 HydrophobicContact CD1-CD1 3.99Å; Y538-L541 HydrophobicContact CE1-CD1 4.4Å; Y538-L541 WeakPolarHBondContact O-CB 3.28Å; Y538-L541 PolarHBondContact O-N 3.12Å; P539-L541 VanDerWaalsContact C-N 3.31Å; P539-L541 PolarHBondContact O-N 2.7Å; L541-N543 VanDerWaalsContact C-N 3.32Å; L541-N543 PolarHBondContact O-N 3.46Å; L541-Q544 WeakPolarHBondContact O-CB 3.14Å; L541-Q544 VanDerWaalsContact O-CG 3.24Å; L541-Q544 WeakPolarHBondContact O-CG 3.29Å; L541-Q544 PolarHBondContact O-N 3.07Å; L541-P546 HydrophobicContact CD1-CB 3.97Å
542	N	74.8	Confident	80.8	Confident	89 Å²	89	39 Å²	39	48%	0.476	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	48	178.6	-172.4	26.6	0	0	0	112.7	L540 Q544 R562	L540-N542 PolarHBondContact O-N 3.2Å; L540-N542 VanDerWaalsContact O-N 3.13Å; N542-Q544 PolarHBondContact O-N 2.93Å; N542-Q544 VanDerWaalsContact O-N 3.13Å; N542-R562 PolarHBondContact OD1-NH2 3Å
543	N	67.7	Low	80.2	Confident	115 Å²	115	40 Å²	40	62%	0.615	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	14.1	-175.7	-54.5	-25.5	0	0	0	114.9	L541	L541-N543 VanDerWaalsContact C-N 3.32Å; L541-N543 PolarHBondContact O-N 3.46Å
544	Q	71.8	Confident	79.4	Confident	117 Å²	117	44.7 Å²	44.7	55%	0.547	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-74.1	146.9	163	-60.6	-58.5	-70.6	0	0	109.4	L541 N542	L541-Q544 WeakPolarHBondContact O-CB 3.14Å; L541-Q544 VanDerWaalsContact O-CG 3.24Å; L541-Q544 WeakPolarHBondContact O-CG 3.29Å; L541-Q544 PolarHBondContact O-N 3.07Å; N542-Q544 PolarHBondContact O-N 2.93Å; N542-Q544 VanDerWaalsContact O-N 3.13Å
545	P	67.2	Low	78.5	Confident	102 Å²	102	45.9 Å²	45.9	66%	0.662	24%	0.242	S	C	*	.	P	Polyproline II helix	trans	-60.6	147.8	173.5	26.6	-33.6	0	0	0	110.1
546	P	70.5	Confident	77.8	Confident	17 Å²	17	49.8 Å²	49.8	11%	0.11	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-60.8	168.9	170	25.2	-29.9	0	0	0	110.8	D194 Y538 L541 I548 N551	D194-P546 HydrophobicContact CB-CB 4.21Å; Y538-P546 HydrophobicContact CE1-CB 4.2Å; Y538-P546 HydrophobicContact CE1-CG 4.21Å; L541-P546 HydrophobicContact CD1-CB 3.97Å; P546-I548 HydrophobicContact CB-CG1 4.49Å; P546-I548 PolarHBondContact O-N 2.66Å; P546-N551 HydrophobicContact CG-CB 3.87Å
547	S	63.4	Low	77.4	Confident	29 Å²	29	50.7 Å²	50.7	20%	0.203	27%	0.27	C	S	.	.	S	Bend	trans	-74.9	-16	-177	70.2	0	0	0	0	113.6	R41 Q55 D194 S196	R41-S547 PolarHBondContact NH2-O 2.51Å; Q55-S547 PolarHBondContact NE2-OG 3.16Å; D194-S547 VanDerWaalsContact CG-OG 3.28Å; D194-S547 PolarHBondContact OD1-OG 3.17Å; D194-S547 WeakPolarHBondContact OD2-CB 3.35Å; D194-S547 PolarHBondContact OD2-N 2.97Å; D194-S547 PolarHBondContact OD2-OG 3.02Å; S196-S547 PolarHBondContact OG-OG 2.99Å
548	I	70.1	Confident	77.1	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.015	28%	0.284	C	S	.	.	S	Bend	trans	-98.9	146.5	169.8	68.1	174.4	0	0	0	108.1	M90 F142 D194 P546 L550	M90-I548 HydrophobicContact CE-CB 3.71Å; M90-I548 HydrophobicContact CE-CD1 3.7Å; M90-I548 HydrophobicContact CE-CG1 4.29Å; M90-I548 HydrophobicContact CE-CG2 3.53Å; F142-I548 HydrophobicContact CE1-CG2 4.31Å; D194-I548 HydrophobicContact CB-CD1 3.72Å; D194-I548 HydrophobicContact CB-CG1 3.8Å; P546-I548 HydrophobicContact CB-CG1 4.49Å; P546-I548 PolarHBondContact O-N 2.66Å; I548-L550 WeakPolarHBondContact CD1-O 3.07Å; I548-L550 WeakPolarHBondContact CG1-O 3.46Å; I548-L550 PolarHBondContact O-N 3.08Å
549	E	65.3	Low	76.9	Confident	194 Å²	194	61 Å²	61	91%	0.907	32%	0.317	S	S	*	.	S	Bend	trans	-66.9	-22.2	-174.6	-62.3	-175.4	167.3	0	0	113.4
550	L	68.2	Low	76.8	Confident	39 Å²	39	67.6 Å²	67.6	20%	0.204	35%	0.348	C	S	.	.			trans	-100.4	127.9	-173.5	-58.6	172.3	0	0	0	110.5	M128 T191 L192 I548	M128-L550 HydrophobicContact CB-CD2 3.81Å; M128-L550 HydrophobicContact CG-CD2 3.81Å; T191-L550 HydrophobicContact CG2-CD1 3.76Å; L192-L550 HydrophobicContact CD2-CB 4.09Å; L192-L550 HydrophobicContact CD2-CD1 4.46Å; I548-L550 WeakPolarHBondContact CD1-O 3.07Å; I548-L550 WeakPolarHBondContact CG1-O 3.46Å; I548-L550 PolarHBondContact O-N 3.08Å
551	N	75.5	Confident	76.8	Confident	45 Å²	45	67 Å²	67	24%	0.241	35%	0.345	C	S	.	.			trans	-126.5	115	178.3	-178	10	0	0	0	110.5	M128 Y538 P546 F553	M128-N551 VanDerWaalsContact CE-O 3.25Å; M128-N551 WeakPolarHBondContact CE-O 3.21Å; Y538-N551 WeakPolarHBondContact CE1-OD1 3.27Å; P546-N551 HydrophobicContact CG-CB 3.87Å; N551-F553 PolarHBondContact ND2-O 3.24Å; N551-F553 PolarHBondContact O-N 2.99Å; N551-F553 WeakPolarHBondContact OD1-CB 3.41Å; N551-F553 PolarHBondContact OD1-N 3.49Å; N551-F553 PolarHBondContact OD1-O 3.29Å
552	A	76.8	Confident	77	Confident	12 Å²	12	69.3 Å²	69.3	10%	0.099	35%	0.353	C	S	.	.			trans	-66.1	-25	176.1	0	0	0	0	0	113.4	L192 Y193	L192-A552 HydrophobicContact CB-CB 4.21Å; Y193-A552 HydrophobicContact CE1-CB 3.97Å
553	F	81.4	Confident	77.7	Confident	26 Å²	26	69.2 Å²	69.2	11%	0.114	36%	0.355	C	S	.	.			trans	-100.7	131.4	-166.2	-61.7	-57.8	0	0	0	112.7	Y193 L532 P533 L536 Y538 N551 F555	Y193-F553 HydrophobicContact CD1-CE2 4.26Å; Y193-F553 HydrophobicContact CD1-CZ 4.22Å; Y193-F553 HydrophobicContact CE1-CE2 4.44Å; Y193-F553 HydrophobicContact CE1-CZ 4.05Å; L532-F553 HydrophobicContact CB-CE1 4.17Å; L532-F553 HydrophobicContact CB-CZ 3.9Å; P533-F553 HydrophobicContact CB-CD1 4.25Å; P533-F553 HydrophobicContact CB-CD2 4.15Å; P533-F553 HydrophobicContact CB-CE1 4.36Å; P533-F553 HydrophobicContact CB-CE2 4.28Å; P533-F553 HydrophobicContact CB-CG 4.13Å; P533-F553 HydrophobicContact CB-CZ 4.38Å; P533-F553 HydrophobicContact CG-CD1 4.38Å; P533-F553 HydrophobicContact CG-CE1 4.4Å; L536-F553 HydrophobicContact CD1-CE2 3.91Å; L536-F553 HydrophobicContact CD1-CZ 4.23Å; Y538-F553 HydrophobicContact CD1-CD2 4.06Å; Y538-F553 AromaticContact CD2-CD2 3.7Å; Y538-F553 HydrophobicContact CD2-CD2 3.7Å; Y538-F553 AromaticContact CD2-CE2 3.83Å; Y538-F553 HydrophobicContact CD2-CE2 3.83Å; Y538-F553 AromaticContact CE1-CD2 3.86Å; Y538-F553 HydrophobicContact CE1-CD2 3.86Å; Y538-F553 AromaticContact CE2-CD2 3.48Å; Y538-F553 HydrophobicContact CE2-CD2 3.48Å; Y538-F553 VanDerWaalsContact CE2-CD2 3.48Å; Y538-F553 AromaticContact CE2-CE2 3.46Å; Y538-F553 HydrophobicContact CE2-CE2 3.46Å; Y538-F553 VanDerWaalsContact CE2-CE2 3.46Å; Y538-F553 AromaticContact CG-CD2 3.97Å; Y538-F553 HydrophobicContact CG-CD2 3.97Å; Y538-F553 AromaticContact CZ-CD2 3.56Å; Y538-F553 AromaticContact CZ-CE2 3.9Å; N551-F553 PolarHBondContact ND2-O 3.24Å; N551-F553 PolarHBondContact O-N 2.99Å; N551-F553 WeakPolarHBondContact OD1-CB 3.41Å; N551-F553 PolarHBondContact OD1-N 3.49Å; N551-F553 PolarHBondContact OD1-O 3.29Å; F553-F555 HydrophobicContact CB-CD2 3.92Å; F553-F555 HydrophobicContact CB-CE2 4.41Å; F553-F555 HydrophobicContact CD1-CD2 4.17Å; F553-F555 AromaticContact CD1-CE2 3.83Å; F553-F555 HydrophobicContact CD1-CE2 3.83Å; F553-F555 HydrophobicContact CG-CD2 4.37Å; F553-F555 HydrophobicContact CG-CE2 4.48Å
554	D	77.4	Confident	78.9	Confident	100 Å²	100	66 Å²	66	54%	0.535	34%	0.338	S	S	.	.			trans	-118.4	56.9	177.7	-167.8	15.3	0	0	0	109.5	R124	R124-D554 IonicContact CZ-OD2 3.33Å; R124-D554 IonicContact NE-OD2 3.21Å; R124-D554 VanDerWaalsContact NH1-CB 3.34Å; R124-D554 IonicContact NH1-OD2 2.8Å; R124-D554 PolarHBondContact NH1-OD2 2.78Å
555	F	76.6	Confident	79.9	Confident	25 Å²	25	60.5 Å²	60.5	11%	0.11	31%	0.312	C	S	.	.			trans	-112.7	143.6	179.4	-65.5	-82	0	0	0	109.9	T515 N518 E530 P533 F553 F557	T515-F555 HydrophobicContact CG2-CB 4.25Å; T515-F555 HydrophobicContact CG2-CD1 3.43Å; T515-F555 VanDerWaalsContact CG2-CD1 3.43Å; T515-F555 HydrophobicContact CG2-CE1 3.93Å; T515-F555 HydrophobicContact CG2-CG 4.05Å; N518-F555 VanDerWaalsContact ND2-CD1 3.31Å; N518-F555 WeakPolarHBondContact ND2-CD1 3.31Å; N518-F555 WeakPolarHBondContact ND2-CE1 3.48Å; E530-F555 HydrophobicContact CG-CE1 4.24Å; E530-F555 HydrophobicContact CG-CZ 4.14Å; P533-F555 HydrophobicContact CG-CD2 4.12Å; P533-F555 HydrophobicContact CG-CE2 3.97Å; F553-F555 HydrophobicContact CB-CD2 3.92Å; F553-F555 HydrophobicContact CB-CE2 4.41Å; F553-F555 HydrophobicContact CD1-CD2 4.17Å; F553-F555 AromaticContact CD1-CE2 3.83Å; F553-F555 HydrophobicContact CD1-CE2 3.83Å; F553-F555 HydrophobicContact CG-CD2 4.37Å; F553-F555 HydrophobicContact CG-CE2 4.48Å; F555-F557 HydrophobicContact CB-CD1 4.42Å; F555-F557 HydrophobicContact CB-CD2 4.45Å; F555-F557 HydrophobicContact CB-CE1 3.72Å; F555-F557 HydrophobicContact CB-CE2 3.75Å; F555-F557 HydrophobicContact CB-CZ 3.34Å; F555-F557 HydrophobicContact CD2-CZ 4.1Å; F555-F557 HydrophobicContact CG-CE1 4.26Å; F555-F557 AromaticContact CG-CZ 3.97Å; F555-F557 HydrophobicContact CG-CZ 3.97Å
556	T	80.8	Confident	81.1	Confident	84 Å²	84	59.5 Å²	59.5	52%	0.515	30%	0.298	S	S	.	.			trans	-103.4	120	168.3	55.5	0	0	0	0	108.9	S516	S516-T556 WeakPolarHBondContact CB-O 3.37Å
557	F	86.7	Confident	82	Confident	27 Å²	27	60.3 Å²	60.3	12%	0.118	30%	0.303	C	S	.	.			trans	-99.5	138.4	-174.5	-58	-75.2	0	0	0	113.7	T515 P533 Y534 P539 F555 E561	T515-F557 HydrophobicContact CG2-CD1 4.03Å; T515-F557 HydrophobicContact CG2-CE1 3.68Å; P533-F557 HydrophobicContact CB-CE1 4.42Å; P533-F557 HydrophobicContact CB-CZ 3.74Å; P533-F557 HydrophobicContact CG-CE1 4.49Å; P533-F557 HydrophobicContact CG-CZ 4.16Å; Y534-F557 HydrophobicContact CE2-CE1 4.25Å; P539-F557 HydrophobicContact CB-CB 4.07Å; P539-F557 HydrophobicContact CB-CD1 4.22Å; P539-F557 HydrophobicContact CB-CD2 4.33Å; P539-F557 HydrophobicContact CB-CG 3.95Å; P539-F557 HydrophobicContact CG-CB 4.45Å; P539-F557 HydrophobicContact CG-CD1 3.67Å; P539-F557 HydrophobicContact CG-CD2 4.12Å; P539-F557 HydrophobicContact CG-CE1 3.82Å; P539-F557 HydrophobicContact CG-CE2 4.27Å; P539-F557 HydrophobicContact CG-CG 3.82Å; P539-F557 HydrophobicContact CG-CZ 4.12Å; F555-F557 HydrophobicContact CB-CD1 4.42Å; F555-F557 HydrophobicContact CB-CD2 4.45Å; F555-F557 HydrophobicContact CB-CE1 3.72Å; F555-F557 HydrophobicContact CB-CE2 3.75Å; F555-F557 HydrophobicContact CB-CZ 3.34Å; F555-F557 HydrophobicContact CD2-CZ 4.1Å; F555-F557 HydrophobicContact CG-CE1 4.26Å; F555-F557 AromaticContact CG-CZ 3.97Å; F555-F557 HydrophobicContact CG-CZ 3.97Å; F557-E561 WeakPolarHBondContact CA-OE2 3.31Å; F557-E561 HydrophobicContact CB-CB 4.38Å; F557-E561 WeakPolarHBondContact CB-OE2 3.32Å; F557-E561 HydrophobicContact CD1-CB 4.33Å; F557-E561 WeakPolarHBondContact CD1-OE2 3.33Å
558	N	87.5	Confident	83.4	Confident	53 Å²	53	59.6 Å²	59.6	28%	0.283	30%	0.297	S	S	.	.			trans	-86.5	176	172.4	76.9	43.2	0	0	0	111.5	S516 Q560 E561	S516-N558 PolarHBondContact OG-ND2 2.93Å; N558-Q560 WeakPolarHBondContact OD1-CA 3.44Å; N558-Q560 WeakPolarHBondContact OD1-CB 3.24Å; N558-Q560 PolarHBondContact OD1-N 2.93Å; N558-E561 PolarHBondContact N-OE2 2.76Å; N558-E561 PolarHBondContact ND2-OE1 3.34Å; N558-E561 WeakPolarHBondContact OD1-CG 3.23Å; N558-E561 PolarHBondContact OD1-N 3.37Å
559	K	86.8	Confident	84.5	Confident	175 Å²	175	59.5 Å²	59.5	76%	0.761	30%	0.296	S	S	*	.	H	α-helix	trans	-68.7	-33.8	-178.6	-68.2	-176.9	-179.1	178.3	0	113.6	E561 R562	K559-E561 VanDerWaalsContact C-N 3.33Å; K559-R562 WeakPolarHBondContact O-CB 3.19Å; K559-R562 PolarHBondContact O-N 2.84Å
560	Q	88	Confident	85.8	Confident	142 Å²	142	54.3 Å²	54.3	66%	0.664	27%	0.268	S	S	*	.	H	α-helix	trans	-67.8	-37.3	179.5	-63.7	177.7	-16	0	0	111	N558 R562 V563 I564	N558-Q560 WeakPolarHBondContact OD1-CA 3.44Å; N558-Q560 WeakPolarHBondContact OD1-CB 3.24Å; N558-Q560 PolarHBondContact OD1-N 2.93Å; Q560-R562 PolarHBondContact O-N 3.42Å; Q560-V563 WeakPolarHBondContact O-CB 3.23Å; Q560-V563 PolarHBondContact O-N 2.91Å; Q560-I564 PolarHBondContact O-N 3.18Å
561	E	90.7	Very high	86.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.1	-24.8	178.7	-73.2	165	174	0	0	113.2	H513 S516 Y534 P539 F557 N558 K559 I564 S565	H513-E561 VanDerWaalsContact NE2-CG 3.28Å; H513-E561 WeakPolarHBondContact NE2-CG 3.44Å; H513-E561 IonicContact NE2-OE1 3.12Å; S516-E561 VanDerWaalsContact CB-OE1 3.32Å; S516-E561 WeakPolarHBondContact CB-OE1 3.25Å; S516-E561 PolarHBondContact N-OE1 3.2Å; S516-E561 PolarHBondContact OG-OE1 3.42Å; Y534-E561 HydrophobicContact CE1-CB 3.76Å; Y534-E561 HydrophobicContact CE1-CG 3.93Å; Y534-E561 WeakPolarHBondContact OH-CG 3.49Å; P539-E561 HydrophobicContact CB-CB 4.5Å; F557-E561 WeakPolarHBondContact CA-OE2 3.31Å; F557-E561 HydrophobicContact CB-CB 4.38Å; F557-E561 WeakPolarHBondContact CB-OE2 3.32Å; F557-E561 HydrophobicContact CD1-CB 4.33Å; F557-E561 WeakPolarHBondContact CD1-OE2 3.33Å; N558-E561 PolarHBondContact N-OE2 2.76Å; N558-E561 PolarHBondContact ND2-OE1 3.34Å; N558-E561 WeakPolarHBondContact OD1-CG 3.23Å; N558-E561 PolarHBondContact OD1-N 3.37Å; K559-E561 VanDerWaalsContact C-N 3.33Å; E561-I564 PolarHBondContact O-N 3.44Å; E561-S565 WeakPolarHBondContact O-CB 3.2Å; E561-S565 PolarHBondContact O-N 2.8Å
562	R	90.3	Very high	87.8	Confident	62 Å²	62	51.7 Å²	51.7	23%	0.234	25%	0.253	C	S	.	.	H	α-helix	trans	-62.3	-46.2	170.1	-58.6	-163.4	-179.3	150	21.6	112.2	P539 N542 K559 Q560 I564 S565 E566	P539-R562 HydrophobicContact CB-CG 4.33Å; P539-R562 WeakPolarHBondContact O-CG 3.3Å; P539-R562 PolarHBondContact O-NE 3.46Å; P539-R562 VanDerWaalsContact O-NE 3.15Å; N542-R562 PolarHBondContact OD1-NH2 3Å; K559-R562 WeakPolarHBondContact O-CB 3.19Å; K559-R562 PolarHBondContact O-N 2.84Å; Q560-R562 PolarHBondContact O-N 3.42Å; R562-I564 VanDerWaalsContact C-N 3.29Å; R562-I564 PolarHBondContact O-N 3.35Å; R562-S565 PolarHBondContact O-N 3.47Å; R562-E566 WeakPolarHBondContact O-CG 3.34Å; R562-E566 PolarHBondContact O-N 2.99Å
563	V	89.9	Confident	88.6	Confident	86 Å²	86	51.2 Å²	51.2	52%	0.521	25%	0.249	S	C	.	.	H	α-helix	trans	-63.5	-41.3	179.5	-176.9	0	0	0	0	109.8	Q560 S565 E566 V567	Q560-V563 WeakPolarHBondContact O-CB 3.23Å; Q560-V563 PolarHBondContact O-N 2.91Å; V563-S565 VanDerWaalsContact C-N 3.33Å; V563-S565 PolarHBondContact O-N 2.89Å; V563-E566 PolarHBondContact O-N 2.95Å; V563-V567 WeakPolarHBondContact O-CG2 3.38Å; V563-V567 PolarHBondContact O-N 2.79Å
564	I	91.5	Very high	89.2	Confident	49 Å²	49	52.3 Å²	52.3	25%	0.251	26%	0.256	S	S	.	.	H	α-helix	trans	-61.5	-43.7	175.9	-61.5	174.1	0	0	0	110.8	F511 H513 Y534 Q560 E561 R562 V567 L568	F511-I564 HydrophobicContact CE2-CG2 4.12Å; H513-I564 HydrophobicContact CB-CD1 4.34Å; H513-I564 WeakPolarHBondContact CE1-CD1 3.43Å; H513-I564 VanDerWaalsContact ND1-CD1 3.35Å; H513-I564 WeakPolarHBondContact ND1-CD1 3.15Å; Y534-I564 HydrophobicContact CD1-CB 4.03Å; Y534-I564 HydrophobicContact CD1-CG2 3.7Å; Y534-I564 HydrophobicContact CE1-CB 4.11Å; Y534-I564 HydrophobicContact CE1-CG2 3.95Å; Q560-I564 PolarHBondContact O-N 3.18Å; E561-I564 PolarHBondContact O-N 3.44Å; R562-I564 VanDerWaalsContact C-N 3.29Å; R562-I564 PolarHBondContact O-N 3.35Å; I564-V567 PolarHBondContact O-N 2.9Å; I564-L568 WeakPolarHBondContact O-CB 3.45Å; I564-L568 PolarHBondContact O-N 3.49Å
565	S	93.3	Very high	90	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.2	-41.7	177.4	-178.7	0	0	0	0	112.4	Y534 G537 L540 E561 R562 V563 V567 L568 M569	Y534-S565 PolarHBondContact O-OG 3.01Å; G537-S565 WeakPolarHBondContact CA-OG 3.35Å; L540-S565 WeakPolarHBondContact CD1-OG 3.49Å; E561-S565 WeakPolarHBondContact O-CB 3.2Å; E561-S565 PolarHBondContact O-N 2.8Å; R562-S565 PolarHBondContact O-N 3.47Å; V563-S565 VanDerWaalsContact C-N 3.33Å; V563-S565 PolarHBondContact O-N 2.89Å; S565-V567 VanDerWaalsContact C-N 3.35Å; S565-V567 PolarHBondContact O-N 2.74Å; S565-L568 PolarHBondContact O-N 3.15Å; S565-M569 VanDerWaalsContact O-CB 3.32Å; S565-M569 WeakPolarHBondContact O-CB 3.43Å; S565-M569 VanDerWaalsContact O-CG 3.3Å; S565-M569 WeakPolarHBondContact O-CG 3.37Å; S565-M569 PolarHBondContact O-N 3.25Å
566	E	91.7	Very high	90.9	Very high	81 Å²	81	46.6 Å²	46.6	38%	0.379	23%	0.226	S	C	.	.	H	α-helix	trans	-59.4	-44.4	174.3	-73.5	177.7	-173.8	0	0	112.1	Y201 L540 R562 V563 R570	Y201-E566 HydrophobicContact CE2-CB 4.47Å; Y201-E566 HydrophobicContact CE2-CG 4.08Å; Y201-E566 PolarHBondContact OH-O 2.97Å; L540-E566 HydrophobicContact CD1-CG 4.27Å; L540-E566 HydrophobicContact CD2-CG 4.39Å; R562-E566 WeakPolarHBondContact O-CG 3.34Å; R562-E566 PolarHBondContact O-N 2.99Å; V563-E566 PolarHBondContact O-N 2.95Å; E566-R570 VanDerWaalsContact O-CB 3.3Å; E566-R570 WeakPolarHBondContact O-CB 3.34Å; E566-R570 PolarHBondContact O-N 3.08Å
567	V	90	Very high	91.5	Very high	34 Å²	34	46.1 Å²	46.1	21%	0.206	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-48.6	177	171.8	0	0	0	0	110.8	V563 I564 S565 R570 Y571	V563-V567 WeakPolarHBondContact O-CG2 3.38Å; V563-V567 PolarHBondContact O-N 2.79Å; I564-V567 PolarHBondContact O-N 2.9Å; S565-V567 VanDerWaalsContact C-N 3.35Å; S565-V567 PolarHBondContact O-N 2.74Å; V567-R570 WeakPolarHBondContact O-CB 3.28Å; V567-R570 PolarHBondContact O-N 3.15Å; V567-Y571 HydrophobicContact CG1-CD2 3.97Å; V567-Y571 HydrophobicContact CG1-CE2 3.43Å; V567-Y571 VanDerWaalsContact CG1-CE2 3.43Å; V567-Y571 PolarHBondContact O-N 3.06Å
568	L	92.2	Very high	91.6	Very high	15 Å²	15	47.3 Å²	47.3	8%	0.079	23%	0.228	C	C	.	.	H	α-helix	trans	-68	-43.8	-177.4	-168.9	60.1	0	0	0	112.1	Y509 F511 I535 I564 S565 R570 Y571 I572	Y509-L568 HydrophobicContact CE2-CD1 4.32Å; F511-L568 HydrophobicContact CE2-CD2 4.49Å; I535-L568 HydrophobicContact CD1-CD2 4.36Å; I535-L568 HydrophobicContact CG1-CD2 3.47Å; I535-L568 VanDerWaalsContact CG1-CD2 3.47Å; I535-L568 HydrophobicContact CG1-CG 3.79Å; I564-L568 WeakPolarHBondContact O-CB 3.45Å; I564-L568 PolarHBondContact O-N 3.49Å; S565-L568 PolarHBondContact O-N 3.15Å; L568-R570 VanDerWaalsContact C-N 3.26Å; L568-R570 PolarHBondContact O-N 3.45Å; L568-Y571 WeakPolarHBondContact O-CB 3.29Å; L568-Y571 PolarHBondContact O-N 3.14Å; L568-Y571 VanDerWaalsContact O-N 3.16Å; L568-I572 WeakPolarHBondContact O-CG1 3.41Å; L568-I572 PolarHBondContact O-N 3.3Å
569	M	93.9	Very high	91.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-57.9	-40	173.6	-77.2	-167.3	-68.3	0	0	111.9	I197 L198 Y201 Y534 I535 G537 L540 S565 I572 A573	I197-M569 HydrophobicContact CG2-CE 4.38Å; I197-M569 HydrophobicContact CG2-SD 3.99Å; L198-M569 HydrophobicContact CD1-CB 4.17Å; L198-M569 HydrophobicContact CD1-CG 4.05Å; L198-M569 HydrophobicContact CD1-SD 4.44Å; Y201-M569 HydrophobicContact CD1-CB 3.89Å; Y201-M569 HydrophobicContact CD1-CE 4.29Å; Y201-M569 HydrophobicContact CD1-SD 4.47Å; Y201-M569 HydrophobicContact CD2-CE 4.06Å; Y201-M569 HydrophobicContact CE1-CB 4.06Å; Y201-M569 HydrophobicContact CE2-CE 4.36Å; Y201-M569 HydrophobicContact CG-CE 4.04Å; Y201-M569 HydrophobicContact CG-SD 4.33Å; Y534-M569 WeakPolarHBondContact O-CG 3.15Å; I535-M569 VanDerWaalsContact O-CG 3.31Å; I535-M569 WeakPolarHBondContact O-CG 3.25Å; G537-M569 WeakPolarHBondContact CA-SD 3.44Å; L540-M569 HydrophobicContact CD1-CE 3.52Å; L540-M569 HydrophobicContact CD2-CE 3.68Å; L540-M569 HydrophobicContact CG-CE 4.25Å; S565-M569 VanDerWaalsContact O-CB 3.32Å; S565-M569 WeakPolarHBondContact O-CB 3.43Å; S565-M569 VanDerWaalsContact O-CG 3.3Å; S565-M569 WeakPolarHBondContact O-CG 3.37Å; S565-M569 PolarHBondContact O-N 3.25Å; M569-I572 PolarHBondContact O-N 2.99Å; M569-A573 WeakPolarHBondContact O-CB 3.41Å; M569-A573 PolarHBondContact O-N 2.92Å
570	R	92	Very high	90.8	Very high	86 Å²	86	41.8 Å²	41.8	33%	0.325	20%	0.204	S	C	.	.	H	α-helix	trans	-64	-43	177	-176.5	174	-177.1	154	-1.4	111.9	Y201 E566 V567 L568 A573 N574 Y585	Y201-R570 HydrophobicContact CE1-CB 4.26Å; E566-R570 VanDerWaalsContact O-CB 3.3Å; E566-R570 WeakPolarHBondContact O-CB 3.34Å; E566-R570 PolarHBondContact O-N 3.08Å; V567-R570 WeakPolarHBondContact O-CB 3.28Å; V567-R570 PolarHBondContact O-N 3.15Å; L568-R570 VanDerWaalsContact C-N 3.26Å; L568-R570 PolarHBondContact O-N 3.45Å; R570-A573 PolarHBondContact O-N 3.15Å; R570-N574 VanDerWaalsContact O-CB 3.3Å; R570-N574 WeakPolarHBondContact O-CB 3.24Å; R570-N574 PolarHBondContact O-N 3.4Å; R570-N574 PolarHBondContact O-OD1 3.19Å; R570-Y585 VanDerWaalsContact CZ-CD2 3.45Å; R570-Y585 PolarHBondContact NH1-OH 3.34Å
571	Y	91.5	Very high	89.5	Confident	27 Å²	27	40.9 Å²	40.9	11%	0.106	20%	0.2	C	C	.	.	H	α-helix	trans	-60.8	-48.2	175.6	-75.3	-22.3	0	0	0	112.7	V567 L568 N574 F575 L582 P594	V567-Y571 HydrophobicContact CG1-CD2 3.97Å; V567-Y571 HydrophobicContact CG1-CE2 3.43Å; V567-Y571 VanDerWaalsContact CG1-CE2 3.43Å; V567-Y571 PolarHBondContact O-N 3.06Å; L568-Y571 WeakPolarHBondContact O-CB 3.29Å; L568-Y571 PolarHBondContact O-N 3.14Å; L568-Y571 VanDerWaalsContact O-N 3.16Å; Y571-N574 PolarHBondContact O-N 2.89Å; Y571-F575 WeakPolarHBondContact O-CB 3.39Å; Y571-F575 PolarHBondContact O-N 3.19Å; Y571-L582 HydrophobicContact CD1-CB 4.14Å; Y571-L582 HydrophobicContact CD1-CD2 3.7Å; Y571-L582 HydrophobicContact CD2-CD2 4.01Å; Y571-L582 HydrophobicContact CE1-CB 4.23Å; Y571-L582 WeakPolarHBondContact CE1-O 3.33Å; Y571-L582 HydrophobicContact CG-CD2 3.41Å; Y571-L582 VanDerWaalsContact CG-CD2 3.41Å; Y571-L582 PolarHBondContact OH-O 3.44Å; Y571-P594 HydrophobicContact CE2-CG 4.33Å; Y571-P594 VanDerWaalsContact OH-CG 3.29Å; Y571-P594 WeakPolarHBondContact OH-CG 3.46Å
572	I	94.9	Very high	88.2	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-61.6	-47.7	176.2	-62.3	-66.8	0	0	0	110.4	L177 I289 L395 I535 L568 M569 N574 F575 V576	L177-I572 HydrophobicContact CD2-CG2 4.33Å; I289-I572 HydrophobicContact CD1-CD1 4.1Å; I289-I572 HydrophobicContact CD1-CG2 4.08Å; I289-I572 HydrophobicContact CG2-CD1 4.41Å; L395-I572 HydrophobicContact CD2-CD1 3.74Å; I535-I572 HydrophobicContact CD1-CD1 4.34Å; I535-I572 HydrophobicContact CG1-CD1 4.5Å; I535-I572 HydrophobicContact CG1-CG1 4.17Å; I535-I572 HydrophobicContact CG2-CG1 4.05Å; I535-I572 HydrophobicContact CG2-CG2 4.33Å; L568-I572 WeakPolarHBondContact O-CG1 3.41Å; L568-I572 PolarHBondContact O-N 3.3Å; M569-I572 PolarHBondContact O-N 2.99Å; I572-N574 VanDerWaalsContact C-N 3.35Å; I572-N574 PolarHBondContact O-N 3.37Å; I572-F575 PolarHBondContact O-N 3.31Å; I572-V576 HydrophobicContact CG2-CG2 4.36Å; I572-V576 WeakPolarHBondContact O-CB 3.36Å; I572-V576 VanDerWaalsContact O-CG2 3.22Å; I572-V576 WeakPolarHBondContact O-CG2 3.47Å; I572-V576 PolarHBondContact O-N 3Å
573	A	94.4	Very high	86.5	Confident	2 Å²	2	42.9 Å²	42.9	2%	0.017	22%	0.217	C	C	.	.	H	α-helix	trans	-63	-38.5	179.7	0	0	0	0	0	112.9	L204 M569 R570 K577	L204-A573 HydrophobicContact CD2-CB 3.84Å; M569-A573 WeakPolarHBondContact O-CB 3.41Å; M569-A573 PolarHBondContact O-N 2.92Å; R570-A573 PolarHBondContact O-N 3.15Å; A573-K577 WeakPolarHBondContact O-CB 3.1Å; A573-K577 WeakPolarHBondContact O-CD 3.39Å; A573-K577 WeakPolarHBondContact O-CG 3.24Å; A573-K577 PolarHBondContact O-N 3.27Å
574	N	92.8	Very high	84.7	Confident	50 Å²	50	41.8 Å²	41.8	27%	0.267	22%	0.223	S	C	.	.	H	α-helix	trans	-65.8	-46.3	175.9	-77.8	-3.8	0	0	0	111.3	R570 Y571 I572 V576 K577 S578	R570-N574 VanDerWaalsContact O-CB 3.3Å; R570-N574 WeakPolarHBondContact O-CB 3.24Å; R570-N574 PolarHBondContact O-N 3.4Å; R570-N574 PolarHBondContact O-OD1 3.19Å; Y571-N574 PolarHBondContact O-N 2.89Å; I572-N574 VanDerWaalsContact C-N 3.35Å; I572-N574 PolarHBondContact O-N 3.37Å; N574-V576 VanDerWaalsContact C-N 3.33Å; N574-V576 PolarHBondContact O-N 3.39Å; N574-K577 PolarHBondContact O-N 3.04Å; N574-K577 VanDerWaalsContact O-N 3.16Å; N574-S578 PolarHBondContact O-N 3.21Å; N574-S578 PolarHBondContact O-OG 3.19Å; N574-S578 VanDerWaalsContact O-OG 3.08Å
575	F	94.7	Very high	82.7	Confident	5 Å²	5	43.9 Å²	43.9	2%	0.022	23%	0.229	C	C	.	.	H	α-helix	trans	-58.7	-45.9	176	-179	-99.1	0	0	0	111.5	T257 R287 I289 D393 L395 F507 Y571 I572 K577 G579	T257-F575 HydrophobicContact CG2-CD1 4.48Å; T257-F575 HydrophobicContact CG2-CE1 4.27Å; R287-F575 HydrophobicContact CB-CE1 3.85Å; R287-F575 HydrophobicContact CB-CZ 4.1Å; R287-F575 WeakPolarHBondContact CD-O 3.47Å; R287-F575 PolarHBondContact NE-O 3.25Å; I289-F575 HydrophobicContact CD1-CD1 3.84Å; I289-F575 HydrophobicContact CD1-CE1 4.2Å; I289-F575 HydrophobicContact CG1-CD1 3.74Å; I289-F575 HydrophobicContact CG1-CE1 3.58Å; D393-F575 HydrophobicContact CB-CE2 4.05Å; D393-F575 HydrophobicContact CB-CZ 3.97Å; D393-F575 WeakPolarHBondContact O-CZ 3.39Å; L395-F575 HydrophobicContact CB-CD1 4.09Å; L395-F575 HydrophobicContact CB-CD2 4.11Å; L395-F575 HydrophobicContact CB-CE1 3.8Å; L395-F575 HydrophobicContact CB-CE2 3.84Å; L395-F575 HydrophobicContact CB-CG 4.22Å; L395-F575 HydrophobicContact CB-CZ 3.66Å; L395-F575 HydrophobicContact CD2-CB 4.44Å; L395-F575 HydrophobicContact CD2-CD1 4.29Å; L395-F575 HydrophobicContact CD2-CG 4.21Å; F507-F575 HydrophobicContact CD2-CD2 4Å; F507-F575 AromaticContact CD2-CE2 3.82Å; F507-F575 HydrophobicContact CD2-CE2 3.82Å; F507-F575 HydrophobicContact CE2-CD2 4.21Å; F507-F575 HydrophobicContact CE2-CE2 4.15Å; Y571-F575 WeakPolarHBondContact O-CB 3.39Å; Y571-F575 PolarHBondContact O-N 3.19Å; I572-F575 PolarHBondContact O-N 3.31Å; F575-K577 VanDerWaalsContact C-N 3.29Å; F575-K577 PolarHBondContact O-N 3.33Å; F575-G579 WeakPolarHBondContact O-CA 3.42Å; F575-G579 PolarHBondContact O-N 3.22Å
576	V	95.7	Very high	80.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.7	-34.1	176.9	171.3	0	0	0	0	112.5	P175 L177 L204 T257 R287 I289 I572 N574	P175-V576 HydrophobicContact CB-CG1 3.87Å; P175-V576 HydrophobicContact CG-CG1 4.16Å; L177-V576 HydrophobicContact CB-CG1 4.34Å; L177-V576 HydrophobicContact CB-CG2 4.35Å; L177-V576 HydrophobicContact CD1-CG2 3.89Å; L177-V576 HydrophobicContact CD2-CG2 4.48Å; L177-V576 HydrophobicContact CG-CG2 4.48Å; L204-V576 HydrophobicContact CD2-CB 4.24Å; L204-V576 HydrophobicContact CD2-CG1 4.05Å; T257-V576 HydrophobicContact CG2-CG2 3.94Å; R287-V576 PolarHBondContact NH1-O 3.41Å; I289-V576 HydrophobicContact CD1-CG2 4.31Å; I572-V576 HydrophobicContact CG2-CG2 4.36Å; I572-V576 WeakPolarHBondContact O-CB 3.36Å; I572-V576 VanDerWaalsContact O-CG2 3.22Å; I572-V576 WeakPolarHBondContact O-CG2 3.47Å; I572-V576 PolarHBondContact O-N 3Å; N574-V576 VanDerWaalsContact C-N 3.33Å; N574-V576 PolarHBondContact O-N 3.39Å
577	K	92.8	Very high	78.6	Confident	74 Å²	74	52 Å²	52	32%	0.322	27%	0.267	S	S	.	.	H	α-helix	trans	-75.6	-58.2	178.1	-75.5	163.4	-174.1	171.4	0	112.6	P175 G202 R287 A573 N574 F575	P175-K577 HydrophobicContact CG-CG 3.7Å; G202-K577 WeakPolarHBondContact O-CE 3.3Å; G202-K577 PolarHBondContact O-NZ 3.25Å; R287-K577 PolarHBondContact NH1-O 3.44Å; R287-K577 PolarHBondContact NH2-O 3.49Å; A573-K577 WeakPolarHBondContact O-CB 3.1Å; A573-K577 WeakPolarHBondContact O-CD 3.39Å; A573-K577 WeakPolarHBondContact O-CG 3.24Å; A573-K577 PolarHBondContact O-N 3.27Å; N574-K577 PolarHBondContact O-N 3.04Å; N574-K577 VanDerWaalsContact O-N 3.16Å; F575-K577 VanDerWaalsContact C-N 3.29Å; F575-K577 PolarHBondContact O-N 3.33Å
578	S	88.1	Confident	76.4	Confident	51 Å²	51	53.8 Å²	53.8	36%	0.357	29%	0.286	S	S	.	.	H	α-helix	trans	-118.1	-14.3	-163	61.6	0	0	0	0	114.2	R287 N574 Q580	R287-S578 PolarHBondContact NH2-O 2.63Å; N574-S578 PolarHBondContact O-N 3.21Å; N574-S578 PolarHBondContact O-OG 3.19Å; N574-S578 VanDerWaalsContact O-OG 3.08Å; S578-Q580 PolarHBondContact O-N 2.72Å; S578-Q580 WeakPolarHBondContact OG-CB 3.47Å; S578-Q580 PolarHBondContact OG-N 2.94Å; S578-Q580 VanDerWaalsContact OG-N 3.12Å
579	G	84.6	Confident	74.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.296	C	S	.	.	S	Bend	trans	60.8	18.4	-166.4	0	0	0	0	0	112.5	K505 F575	K505-G579 WeakPolarHBondContact CD-O 3.26Å; F575-G579 WeakPolarHBondContact O-CA 3.42Å; F575-G579 PolarHBondContact O-N 3.22Å
580	Q	73.6	Confident	72.3	Confident	112 Å²	112	59 Å²	59	52%	0.523	33%	0.326	S	S	.	.			trans	-119	137.9	-176.7	-69.9	-177.4	7	0	0	112.3	K505 S578	K505-Q580 VanDerWaalsContact NZ-CG 3.25Å; S578-Q580 PolarHBondContact O-N 2.72Å; S578-Q580 WeakPolarHBondContact OG-CB 3.47Å; S578-Q580 PolarHBondContact OG-N 2.94Å; S578-Q580 VanDerWaalsContact OG-N 3.12Å
581	E	61.6	Low	70.5	Confident	124 Å²	124	67 Å²	67	58%	0.579	36%	0.356	S	S	*	.			trans	44	110.9	160.5	-72.5	-168.5	-160.6	0	0	119.9	T583	E581-T583 VanDerWaalsContact CB-OG1 3.25Å; E581-T583 WeakPolarHBondContact CB-OG1 3.46Å; E581-T583 VanDerWaalsContact CD-OG1 3.23Å; E581-T583 VanDerWaalsContact CG-OG1 3.25Å; E581-T583 WeakPolarHBondContact CG-OG1 3.46Å; E581-T583 PolarHBondContact O-N 3.06Å; E581-T583 PolarHBondContact OE2-OG1 2.73Å
582	L	61.9	Low	69	Low	38 Å²	38	71.3 Å²	71.3	20%	0.199	38%	0.381	C	S	.	.	S	Bend	trans	-74.5	-2.8	157.7	-61.3	168.4	0	0	0	112.4	L395 F507 Y571	L395-L582 HydrophobicContact CD1-CD1 4.24Å; F507-L582 HydrophobicContact CB-CD1 4.1Å; F507-L582 HydrophobicContact CD1-CD1 4.14Å; F507-L582 HydrophobicContact CD1-CG 4.43Å; F507-L582 HydrophobicContact CG-CD1 4.38Å; Y571-L582 HydrophobicContact CD1-CB 4.14Å; Y571-L582 HydrophobicContact CD1-CD2 3.7Å; Y571-L582 HydrophobicContact CD2-CD2 4.01Å; Y571-L582 HydrophobicContact CE1-CB 4.23Å; Y571-L582 WeakPolarHBondContact CE1-O 3.33Å; Y571-L582 HydrophobicContact CG-CD2 3.41Å; Y571-L582 VanDerWaalsContact CG-CD2 3.41Å; Y571-L582 PolarHBondContact OH-O 3.44Å
583	T	54.5	Low	67.4	Low	65 Å²	65	78.9 Å²	78.9	40%	0.399	41%	0.411	S	S	.	.			trans	-91.8	-25.1	-160.5	34	0	0	0	0	114.9	E581 Y585 I586	E581-T583 VanDerWaalsContact CB-OG1 3.25Å; E581-T583 WeakPolarHBondContact CB-OG1 3.46Å; E581-T583 VanDerWaalsContact CD-OG1 3.23Å; E581-T583 VanDerWaalsContact CG-OG1 3.25Å; E581-T583 WeakPolarHBondContact CG-OG1 3.46Å; E581-T583 PolarHBondContact O-N 3.06Å; E581-T583 PolarHBondContact OE2-OG1 2.73Å; T583-Y585 PolarHBondContact O-N 2.89Å; T583-I586 HydrophobicContact CG2-CD1 4.07Å; T583-I586 PolarHBondContact O-N 3.4Å; T583-I586 VanDerWaalsContact O-N 3.12Å
584	G	52.2	Low	66.3	Low	63 Å²	63	80.9 Å²	80.9	65%	0.649	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-0	-171	0	0	0	0	0	117
585	Y	50	Low	65.7	Low	94 Å²	94	85.2 Å²	85.2	37%	0.369	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.2	-5.1	177.4	-110.4	-106.5	0	0	0	115.2	R570 T583 E587 A588 A589	R570-Y585 VanDerWaalsContact CZ-CD2 3.45Å; R570-Y585 PolarHBondContact NH1-OH 3.34Å; T583-Y585 PolarHBondContact O-N 2.89Å; Y585-E587 PolarHBondContact O-N 3.37Å; Y585-E587 VanDerWaalsContact O-N 3.16Å; Y585-A588 HydrophobicContact CD1-CB 4.17Å; Y585-A588 HydrophobicContact CE1-CB 4.27Å; Y585-A588 PolarHBondContact O-N 2.87Å; Y585-A589 PolarHBondContact O-N 3.5Å
586	I	52.7	Low	65.1	Low	55 Å²	55	89.8 Å²	89.8	28%	0.282	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-27.4	176.8	-58.5	-176.6	0	0	0	110.4	T583 P594 V596	T583-I586 HydrophobicContact CG2-CD1 4.07Å; T583-I586 PolarHBondContact O-N 3.4Å; T583-I586 VanDerWaalsContact O-N 3.12Å; I586-P594 HydrophobicContact CG1-CG 4.26Å; I586-V596 HydrophobicContact CD1-CG2 3.61Å
587	E	45.5	Very low	64.5	Low	195 Å²	195	95.1 Å²	95.1	91%	0.911	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-14.3	178.6	-62.2	-177.8	164.3	0	0	114.2	Y585	Y585-E587 PolarHBondContact O-N 3.37Å; Y585-E587 VanDerWaalsContact O-N 3.16Å
588	A	45.8	Very low	64.3	Low	73 Å²	73	95.4 Å²	95.4	60%	0.603	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	-17.4	-173.3	0	0	0	0	0	114.4	Y585	Y585-A588 HydrophobicContact CD1-CB 4.17Å; Y585-A588 HydrophobicContact CE1-CB 4.27Å; Y585-A588 PolarHBondContact O-N 2.87Å
589	A	49.9	Very low	64.2	Low	34 Å²	34	101.7 Å²	101.7	28%	0.281	53%	0.529	S	S	.	.	S	Bend	trans	-92	144.3	172.1	0	0	0	0	0	110.2	Y585	Y585-A589 PolarHBondContact O-N 3.5Å
590	S	50.1	Low	64.5	Low	91 Å²	91	105.8 Å²	105.8	64%	0.636	55%	0.545	S	S	*	.			trans	-19.8	144.6	174.4	176.4	0	0	0	0	117.3	D592 Y593	S590-D592 PolarHBondContact O-N 3.12Å; S590-Y593 PolarHBondContact O-N 3.23Å
591	R	52.8	Low	65.5	Low	253 Å²	253	102.2 Å²	102.2	96%	0.955	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	-13.8	-176.4	-84.5	-174.7	175.7	-178.5	-1.7	117.5
592	D	60.1	Low	67	Low	117 Å²	117	98.5 Å²	98.5	63%	0.626	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	-26.7	-172.7	-61.7	-38.8	0	0	0	115.1	S590	S590-D592 PolarHBondContact O-N 3.12Å
593	Y	61.6	Low	68.7	Low	161 Å²	161	102.6 Å²	102.6	63%	0.631	54%	0.535	S	S	*	.	S	Bend	trans	-155.7	145.2	-176.5	-68.1	-82	0	0	0	113.2	S590	S590-Y593 PolarHBondContact O-N 3.23Å
594	P	70.7	Confident	70.7	Confident	43 Å²	43	102 Å²	102	28%	0.279	53%	0.528	S	S	.	.	S	Bend	cis	-73.5	144	-1.2	27	-29.8	0	0	0	112.7	Y571 I586	Y571-P594 HydrophobicContact CE2-CG 4.33Å; Y571-P594 VanDerWaalsContact OH-CG 3.29Å; Y571-P594 WeakPolarHBondContact OH-CG 3.46Å; I586-P594 HydrophobicContact CG1-CG 4.26Å
595	K	79.9	Confident	72.8	Confident	141 Å²	141	99.4 Å²	99.4	61%	0.613	50%	0.499	S	S	*	.			trans	-109.3	137.2	179.7	-175.9	-170.3	173.7	-148	0	109.9	D597	K595-D597 IonicContact NZ-OD2 3.32Å; K595-D597 PolarHBondContact NZ-OD2 2.74Å
596	V	83	Confident	75	Confident	101 Å²	101	96.8 Å²	96.8	61%	0.612	50%	0.497	S	S	*	.			trans	-84.5	129	166.2	-177.1	0	0	0	0	108.5	I586	I586-V596 HydrophobicContact CD1-CG2 3.61Å
597	D	84	Confident	77.2	Confident	113 Å²	113	94.9 Å²	94.9	60%	0.604	49%	0.487	S	S	*	.			trans	-128.6	170.5	174.1	-138.2	-39	0	0	0	110.4	K595	K595-D597 IonicContact NZ-OD2 3.32Å; K595-D597 PolarHBondContact NZ-OD2 2.74Å
598	S	86.9	Confident	79.6	Confident	80 Å²	80	86.3 Å²	86.3	56%	0.559	45%	0.446	S	S	*	.	S	Bend	trans	-134.7	152.2	178.9	-63.6	0	0	0	0	110.4	Y600	S598-Y600 VanDerWaalsContact C-N 3.34Å; S598-Y600 PolarHBondContact O-N 3.28Å
599	F	87.2	Confident	82	Confident	182 Å²	182	84.7 Å²	84.7	80%	0.798	43%	0.427	S	S	*	.			trans	60.6	35.5	173.7	-49.9	-75.3	0	0	0	115	R601 A602	F599-R601 PolarHBondContact O-N 3.26Å; F599-R601 VanDerWaalsContact O-N 3.07Å; F599-A602 HydrophobicContact CB-CB 3.85Å; F599-A602 HydrophobicContact CD1-CB 4.49Å; F599-A602 WeakPolarHBondContact O-CB 3.36Å; F599-A602 PolarHBondContact O-N 2.81Å; F599-A602 VanDerWaalsContact O-N 3.12Å
600	Y	91.5	Very high	84.2	Confident	86 Å²	86	86.9 Å²	86.9	34%	0.337	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	117	174.9	-177.6	-112.4	0	0	0	110.8	L475 L510 S598 A602	L475-Y600 HydrophobicContact CD1-CD1 4.38Å; L475-Y600 HydrophobicContact CD1-CE1 4.39Å; L475-Y600 HydrophobicContact CD2-CD1 3.92Å; L475-Y600 HydrophobicContact CD2-CE1 3.61Å; L510-Y600 HydrophobicContact CD1-CD1 4.46Å; L510-Y600 HydrophobicContact CD1-CE1 3.77Å; L510-Y600 HydrophobicContact CD2-CD1 4.21Å; L510-Y600 HydrophobicContact CD2-CD2 3.96Å; L510-Y600 HydrophobicContact CD2-CE1 3.73Å; L510-Y600 HydrophobicContact CD2-CE2 3.49Å; L510-Y600 VanDerWaalsContact CD2-CE2 3.49Å; L510-Y600 HydrophobicContact CD2-CG 4.31Å; L510-Y600 HydrophobicContact CG-CE1 4.36Å; S598-Y600 VanDerWaalsContact C-N 3.34Å; S598-Y600 PolarHBondContact O-N 3.28Å; Y600-A602 PolarHBondContact O-N 2.88Å
601	R	93.7	Very high	86.4	Confident	37 Å²	37	87.6 Å²	87.6	14%	0.14	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	32.9	-177.6	-54.8	-162.8	75.5	152.7	16.6	115.1	E467 D471 L475 F599 H603 E604 I605	E467-R601 IonicContact OE2-CZ 3.96Å; E467-R601 IonicContact OE2-NH1 3.7Å; E467-R601 IonicContact OE2-NH2 3.72Å; E467-R601 PolarHBondContact OE2-NH2 2.89Å; D471-R601 WeakPolarHBondContact OD1-CD 3.38Å; D471-R601 IonicContact OD1-CZ 3.91Å; D471-R601 IonicContact OD1-NE 3.23Å; D471-R601 PolarHBondContact OD1-NE 2.72Å; D471-R601 IonicContact OD1-NH1 3.98Å; D471-R601 PolarHBondContact OD1-NH1 3.42Å; D471-R601 IonicContact OD2-CZ 2.81Å; D471-R601 IonicContact OD2-NE 2.65Å; D471-R601 PolarHBondContact OD2-NE 3.26Å; D471-R601 VanDerWaalsContact OD2-NE 3.12Å; D471-R601 IonicContact OD2-NH1 2.77Å; D471-R601 PolarHBondContact OD2-NH1 2.97Å; D471-R601 VanDerWaalsContact OD2-NH1 3.12Å; D471-R601 IonicContact OD2-NH2 3.91Å; D471-R601 PolarHBondContact OD2-NH2 3.29Å; L475-R601 HydrophobicContact CD2-CB 4.28Å; L475-R601 HydrophobicContact CD2-CG 4.32Å; F599-R601 PolarHBondContact O-N 3.26Å; F599-R601 VanDerWaalsContact O-N 3.07Å; R601-H603 PolarHBondContact O-N 2.87Å; R601-H603 VanDerWaalsContact O-N 3.09Å; R601-E604 VanDerWaalsContact C-OE2 3.24Å; R601-E604 VanDerWaalsContact CA-OE2 3.26Å; R601-E604 WeakPolarHBondContact CA-OE2 3.47Å; R601-E604 HydrophobicContact CB-CB 4.48Å; R601-E604 PolarHBondContact O-N 3.11Å; R601-I605 HydrophobicContact CB-CG1 4.2Å; R601-I605 WeakPolarHBondContact O-CB 3.46Å; R601-I605 VanDerWaalsContact O-CG1 3.24Å; R601-I605 WeakPolarHBondContact O-CG1 3.38Å; R601-I605 PolarHBondContact O-N 3.34Å
602	A	94.2	Very high	88.4	Confident	47 Å²	47	75.5 Å²	75.5	39%	0.388	38%	0.381	S	S	.	.	H	α-helix	trans	-58.8	-29.3	-171.7	0	0	0	0	0	114.3	F599 Y600 A606	F599-A602 HydrophobicContact CB-CB 3.85Å; F599-A602 HydrophobicContact CD1-CB 4.49Å; F599-A602 WeakPolarHBondContact O-CB 3.36Å; F599-A602 PolarHBondContact O-N 2.81Å; F599-A602 VanDerWaalsContact O-N 3.12Å; Y600-A602 PolarHBondContact O-N 2.88Å; A602-A606 VanDerWaalsContact O-CB 3.27Å; A602-A606 WeakPolarHBondContact O-CB 3.46Å; A602-A606 PolarHBondContact O-N 2.89Å
603	H	95.7	Very high	89.9	Confident	123 Å²	123	72.6 Å²	72.6	57%	0.569	37%	0.368	S	S	*	.	H	α-helix	trans	-68.1	-54.7	176.9	179.2	-104.2	0	0	0	111.4	E447 R601 I605 A606 F607	E447-H603 IonicContact OE1-CE1 2.87Å; E447-H603 PolarHBondContact OE1-CE1 3.06Å; E447-H603 IonicContact OE1-ND1 2.91Å; E447-H603 PolarHBondContact OE1-ND1 3.11Å; E447-H603 IonicContact OE2-CE1 3.62Å; R601-H603 PolarHBondContact O-N 2.87Å; R601-H603 VanDerWaalsContact O-N 3.09Å; H603-I605 VanDerWaalsContact C-N 3.31Å; H603-I605 PolarHBondContact O-N 3.47Å; H603-A606 WeakPolarHBondContact O-CB 3.4Å; H603-A606 PolarHBondContact O-N 2.99Å; H603-F607 PolarHBondContact O-N 3.33Å
604	E	96.8	Very high	91.4	Very high	52 Å²	52	68.2 Å²	68.2	24%	0.243	36%	0.361	C	S	.	.	H	α-helix	trans	-63.2	-40.4	-178.7	-61	78.5	-175	0	0	110.5	R601 A606 F607 W608	R601-E604 VanDerWaalsContact C-OE2 3.24Å; R601-E604 VanDerWaalsContact CA-OE2 3.26Å; R601-E604 WeakPolarHBondContact CA-OE2 3.47Å; R601-E604 HydrophobicContact CB-CB 4.48Å; R601-E604 PolarHBondContact O-N 3.11Å; E604-A606 VanDerWaalsContact C-N 3.32Å; E604-A606 PolarHBondContact O-N 2.92Å; E604-F607 WeakPolarHBondContact O-CB 3.08Å; E604-F607 PolarHBondContact O-N 3.38Å; E604-W608 PolarHBondContact O-N 3.42Å; E604-W608 VanDerWaalsContact O-N 3.11Å
605	I	96.7	Very high	92.4	Very high	9 Å²	9	68 Å²	68	5%	0.046	36%	0.358	C	S	.	.	H	α-helix	trans	-66.2	-34.1	175.4	-61.4	-49.4	0	0	0	112	D471 L475 A476 T479 R601 H603 N609	D471-I605 HydrophobicContact CB-CD1 4.34Å; L475-I605 HydrophobicContact CB-CD1 3.94Å; L475-I605 HydrophobicContact CD2-CD1 3.83Å; L475-I605 HydrophobicContact CD2-CG1 4.3Å; L475-I605 HydrophobicContact CG-CD1 3.66Å; L475-I605 HydrophobicContact CG-CG1 4.28Å; A476-I605 HydrophobicContact CB-CD1 3.91Å; A476-I605 HydrophobicContact CB-CG2 4.5Å; T479-I605 HydrophobicContact CG2-CG2 3.86Å; R601-I605 HydrophobicContact CB-CG1 4.2Å; R601-I605 WeakPolarHBondContact O-CB 3.46Å; R601-I605 VanDerWaalsContact O-CG1 3.24Å; R601-I605 WeakPolarHBondContact O-CG1 3.38Å; R601-I605 PolarHBondContact O-N 3.34Å; H603-I605 VanDerWaalsContact C-N 3.31Å; H603-I605 PolarHBondContact O-N 3.47Å; I605-N609 VanDerWaalsContact CG2-ND2 3.34Å; I605-N609 WeakPolarHBondContact CG2-ND2 3.48Å; I605-N609 VanDerWaalsContact O-CB 3.28Å; I605-N609 WeakPolarHBondContact O-CB 3.26Å; I605-N609 PolarHBondContact O-N 2.94Å
606	A	97.1	Very high	92.9	Very high	39 Å²	39	63.2 Å²	63.2	32%	0.322	34%	0.337	S	S	.	.	H	α-helix	trans	-69.7	-34.2	173.5	0	0	0	0	0	112.3	A602 H603 E604 N610 F611	A602-A606 VanDerWaalsContact O-CB 3.27Å; A602-A606 WeakPolarHBondContact O-CB 3.46Å; A602-A606 PolarHBondContact O-N 2.89Å; H603-A606 WeakPolarHBondContact O-CB 3.4Å; H603-A606 PolarHBondContact O-N 2.99Å; E604-A606 VanDerWaalsContact C-N 3.32Å; E604-A606 PolarHBondContact O-N 2.92Å; A606-N610 WeakPolarHBondContact O-CA 3.49Å; A606-N610 VanDerWaalsContact O-CB 3.28Å; A606-N610 WeakPolarHBondContact O-CB 3.2Å; A606-N610 PolarHBondContact O-N 3.46Å; A606-F611 PolarHBondContact O-N 2.95Å
607	F	98	Very high	93.1	Very high	16 Å²	16	61.3 Å²	61.3	7%	0.07	33%	0.328	C	S	.	.	I	π-helix	trans	-58.2	-50	172.2	167.7	-96.3	0	0	0	111.2	A443 I444 E447 Y448 H603 E604 F611 L612	A443-F607 HydrophobicContact CB-CE2 4.1Å; A443-F607 HydrophobicContact CB-CZ 4.24Å; I444-F607 HydrophobicContact CG1-CE1 4.14Å; I444-F607 HydrophobicContact CG1-CZ 3.98Å; E447-F607 HydrophobicContact CB-CD2 4.3Å; E447-F607 HydrophobicContact CB-CE1 4.3Å; E447-F607 HydrophobicContact CB-CE2 4.02Å; E447-F607 HydrophobicContact CB-CZ 4.02Å; E447-F607 HydrophobicContact CG-CB 4.46Å; E447-F607 HydrophobicContact CG-CD1 4Å; E447-F607 HydrophobicContact CG-CD2 4.04Å; E447-F607 HydrophobicContact CG-CE1 4.2Å; E447-F607 HydrophobicContact CG-CE2 4.24Å; E447-F607 HydrophobicContact CG-CG 3.91Å; E447-F607 HydrophobicContact CG-CZ 4.32Å; Y448-F607 HydrophobicContact CE2-CD1 4.49Å; Y448-F607 HydrophobicContact CE2-CE1 4.44Å; H603-F607 PolarHBondContact O-N 3.33Å; E604-F607 WeakPolarHBondContact O-CB 3.08Å; E604-F607 PolarHBondContact O-N 3.38Å; F607-F611 HydrophobicContact CD2-CB 4.42Å; F607-F611 AromaticContact CD2-CD1 3.7Å; F607-F611 HydrophobicContact CD2-CD1 3.7Å; F607-F611 HydrophobicContact CD2-CE1 4.44Å; F607-F611 HydrophobicContact CD2-CG 4.38Å; F607-F611 AromaticContact CE2-CD1 3.65Å; F607-F611 HydrophobicContact CE2-CD1 3.65Å; F607-F611 HydrophobicContact CE2-CE1 4.03Å; F607-F611 WeakPolarHBondContact O-CB 3.31Å; F607-F611 PolarHBondContact O-N 2.91Å; F607-L612 HydrophobicContact CD1-CD1 4.28Å; F607-L612 HydrophobicContact CD1-CG 4.43Å; F607-L612 HydrophobicContact CE1-CD1 3.56Å; F607-L612 HydrophobicContact CE1-CD2 4.39Å; F607-L612 HydrophobicContact CE1-CG 3.93Å; F607-L612 HydrophobicContact CE2-CD2 3.95Å; F607-L612 HydrophobicContact CE2-CG 4.1Å; F607-L612 HydrophobicContact CZ-CD1 3.72Å; F607-L612 HydrophobicContact CZ-CD2 3.71Å; F607-L612 HydrophobicContact CZ-CG 3.74Å; F607-L612 PolarHBondContact O-N 3.27Å; F607-L612 VanDerWaalsContact O-N 3.09Å
608	W	97.3	Very high	93.3	Very high	15 Å²	15	59.5 Å²	59.5	6%	0.057	32%	0.322	C	S	.	.	I	π-helix	trans	-69.8	-44.3	178.9	-69.1	111.9	0	0	0	113.9	F428 I444 Y448 A472 A476 E604 L612 P613	F428-W608 AromaticContact CE1-CH2 3.88Å; F428-W608 HydrophobicContact CE1-CH2 3.88Å; F428-W608 AromaticContact CE1-CZ3 3.63Å; F428-W608 HydrophobicContact CE1-CZ3 3.63Å; F428-W608 HydrophobicContact CZ-CH2 4.35Å; F428-W608 HydrophobicContact CZ-CZ3 4Å; I444-W608 HydrophobicContact CD1-CH2 3.77Å; I444-W608 HydrophobicContact CD1-CZ3 4.1Å; I444-W608 HydrophobicContact CG1-CH2 3.73Å; I444-W608 HydrophobicContact CG1-CZ3 4.24Å; I444-W608 HydrophobicContact CG2-CH2 4.26Å; Y448-W608 AromaticContact CE2-CE2 3.98Å; Y448-W608 AromaticContact CE2-CZ2 3.8Å; Y448-W608 HydrophobicContact CE2-CZ2 3.8Å; Y448-W608 AromaticContact CE2-NE1 3.65Å; Y448-W608 AromaticContact CZ-NE1 3.65Å; Y448-W608 PolarHBondContact OH-NE1 3.07Å; A472-W608 HydrophobicContact CB-CD2 3.9Å; A472-W608 HydrophobicContact CB-CE3 3.87Å; A472-W608 HydrophobicContact CB-CH2 3.75Å; A472-W608 HydrophobicContact CB-CZ2 3.74Å; A472-W608 HydrophobicContact CB-CZ3 3.82Å; A476-W608 HydrophobicContact CB-CB 3.59Å; A476-W608 HydrophobicContact CB-CG 4.17Å; E604-W608 PolarHBondContact O-N 3.42Å; E604-W608 VanDerWaalsContact O-N 3.11Å; W608-L612 HydrophobicContact CD2-CD1 4.3Å; W608-L612 HydrophobicContact CE3-CD1 3.41Å; W608-L612 VanDerWaalsContact CE3-CD1 3.41Å; W608-L612 HydrophobicContact CH2-CD1 4.16Å; W608-L612 HydrophobicContact CZ3-CD1 3.3Å; W608-P613 WeakPolarHBondContact O-CD 3.44Å; W608-P613 WeakPolarHBondContact O-CG 3.32Å
609	N	95.2	Very high	93.1	Very high	38 Å²	38	55.7 Å²	55.7	20%	0.203	30%	0.295	C	S	.	.	I	π-helix	trans	-85.2	-20.2	-172.5	-77.3	-30.5	0	0	0	114.2	A476 I605	A476-N609 PolarHBondContact O-ND2 3.22Å; A476-N609 PolarHBondContact O-OD1 3.41Å; I605-N609 VanDerWaalsContact CG2-ND2 3.34Å; I605-N609 WeakPolarHBondContact CG2-ND2 3.48Å; I605-N609 VanDerWaalsContact O-CB 3.28Å; I605-N609 WeakPolarHBondContact O-CB 3.26Å; I605-N609 PolarHBondContact O-N 2.94Å
610	N	95.4	Very high	92.7	Very high	81 Å²	81	55.9 Å²	55.9	43%	0.433	29%	0.29	S	S	.	.	I	π-helix	trans	-122.8	-55	-175.9	-50	-45.9	0	0	0	112.8	A606 S614	A606-N610 WeakPolarHBondContact O-CA 3.49Å; A606-N610 VanDerWaalsContact O-CB 3.28Å; A606-N610 WeakPolarHBondContact O-CB 3.2Å; A606-N610 PolarHBondContact O-N 3.46Å; N610-S614 WeakPolarHBondContact O-CB 3.26Å; N610-S614 PolarHBondContact O-N 3.35Å; N610-S614 PolarHBondContact O-OG 3.4Å
611	F	96.8	Very high	92.1	Very high	105 Å²	105	57.9 Å²	57.9	46%	0.461	31%	0.311	S	S	.	.	I	π-helix	trans	-67.9	-54.4	-171.2	175.4	-100.7	0	0	0	112.3	A443 A606 F607 S614 L615	A443-F611 HydrophobicContact CB-CE1 3.94Å; A606-F611 PolarHBondContact O-N 2.95Å; F607-F611 HydrophobicContact CD2-CB 4.42Å; F607-F611 AromaticContact CD2-CD1 3.7Å; F607-F611 HydrophobicContact CD2-CD1 3.7Å; F607-F611 HydrophobicContact CD2-CE1 4.44Å; F607-F611 HydrophobicContact CD2-CG 4.38Å; F607-F611 AromaticContact CE2-CD1 3.65Å; F607-F611 HydrophobicContact CE2-CD1 3.65Å; F607-F611 HydrophobicContact CE2-CE1 4.03Å; F607-F611 WeakPolarHBondContact O-CB 3.31Å; F607-F611 PolarHBondContact O-N 2.91Å; F611-S614 WeakPolarHBondContact O-CB 3.29Å; F611-S614 PolarHBondContact O-N 2.79Å; F611-L615 HydrophobicContact CE1-CD2 4.44Å; F611-L615 PolarHBondContact O-N 2.93Å
612	L	95.1	Very high	91.3	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-63.6	-43.1	-178.3	-67.7	-174.6	0	0	0	113.7	I440 A443 I444 F607 W608 S614 L615 E616	I440-L612 HydrophobicContact CG1-CD2 4.4Å; I440-L612 HydrophobicContact CG2-CD1 4.44Å; I440-L612 HydrophobicContact CG2-CD2 4.13Å; A443-L612 HydrophobicContact CB-CD2 4.14Å; I444-L612 HydrophobicContact CD1-CD1 4.42Å; I444-L612 HydrophobicContact CG1-CD1 4.14Å; F607-L612 HydrophobicContact CD1-CD1 4.28Å; F607-L612 HydrophobicContact CD1-CG 4.43Å; F607-L612 HydrophobicContact CE1-CD1 3.56Å; F607-L612 HydrophobicContact CE1-CD2 4.39Å; F607-L612 HydrophobicContact CE1-CG 3.93Å; F607-L612 HydrophobicContact CE2-CD2 3.95Å; F607-L612 HydrophobicContact CE2-CG 4.1Å; F607-L612 HydrophobicContact CZ-CD1 3.72Å; F607-L612 HydrophobicContact CZ-CD2 3.71Å; F607-L612 HydrophobicContact CZ-CG 3.74Å; F607-L612 PolarHBondContact O-N 3.27Å; F607-L612 VanDerWaalsContact O-N 3.09Å; W608-L612 HydrophobicContact CD2-CD1 4.3Å; W608-L612 HydrophobicContact CE3-CD1 3.41Å; W608-L612 VanDerWaalsContact CE3-CD1 3.41Å; W608-L612 HydrophobicContact CH2-CD1 4.16Å; W608-L612 HydrophobicContact CZ3-CD1 3.3Å; L612-S614 VanDerWaalsContact C-N 3.28Å; L612-S614 PolarHBondContact O-N 3.47Å; L612-L615 PolarHBondContact O-N 3Å; L612-E616 PolarHBondContact O-N 2.82Å
613	P	92.2	Very high	90.2	Very high	56 Å²	56	64 Å²	64	36%	0.364	35%	0.347	S	S	.	.	H	α-helix	trans	-60.2	-37.2	173.6	-27.7	36.8	0	0	0	113.1	W608 E616 S617	W608-P613 WeakPolarHBondContact O-CD 3.44Å; W608-P613 WeakPolarHBondContact O-CG 3.32Å; P613-E616 PolarHBondContact O-N 3.12Å; P613-S617 WeakPolarHBondContact O-CB 3.48Å; P613-S617 PolarHBondContact O-N 2.77Å
614	S	92.5	Very high	89.4	Confident	69 Å²	69	60.9 Å²	60.9	48%	0.483	34%	0.335	S	S	.	.	H	α-helix	trans	-63.4	-44.6	175.4	-58.4	0	0	0	0	110.9	N610 F611 L612 S617 T618	N610-S614 WeakPolarHBondContact O-CB 3.26Å; N610-S614 PolarHBondContact O-N 3.35Å; N610-S614 PolarHBondContact O-OG 3.4Å; F611-S614 WeakPolarHBondContact O-CB 3.29Å; F611-S614 PolarHBondContact O-N 2.79Å; L612-S614 VanDerWaalsContact C-N 3.28Å; L612-S614 PolarHBondContact O-N 3.47Å; S614-S617 PolarHBondContact O-N 3.18Å; S614-S617 PolarHBondContact O-OG 2.98Å; S614-T618 PolarHBondContact O-N 3.42Å
615	L	91.5	Very high	88.5	Confident	39 Å²	39	61.9 Å²	61.9	20%	0.204	35%	0.346	C	S	.	.	H	α-helix	trans	-63.9	-39.9	176.3	-177.8	62	0	0	0	112.4	H436 E439 I440 F611 L612 S617 T618	H436-L615 HydrophobicContact CB-CG 4.45Å; H436-L615 PolarHBondContact CD2-O 3.04Å; E439-L615 HydrophobicContact CB-CD1 4.49Å; E439-L615 HydrophobicContact CB-CD2 3.99Å; I440-L615 HydrophobicContact CG1-CD2 3.74Å; I440-L615 HydrophobicContact CG1-CG 4.22Å; F611-L615 HydrophobicContact CE1-CD2 4.44Å; F611-L615 PolarHBondContact O-N 2.93Å; L612-L615 PolarHBondContact O-N 3Å; L615-S617 VanDerWaalsContact C-N 3.34Å; L615-T618 PolarHBondContact O-OG1 3.31Å
616	E	89.6	Confident	87.7	Confident	40 Å²	40	66.4 Å²	66.4	19%	0.187	37%	0.367	C	S	.	.	H	α-helix	trans	-65.8	-39.7	176.1	-178	176.8	-149.6	0	0	111.7	Y433 S434 F435 I440 L612 P613 T618 G619	Y433-E616 HydrophobicContact CD1-CB 4.35Å; Y433-E616 HydrophobicContact CD1-CG 4.36Å; Y433-E616 WeakPolarHBondContact CD1-OE2 3.17Å; S434-E616 PolarHBondContact N-OE1 3.33Å; S434-E616 VanDerWaalsContact N-OE1 3.14Å; F435-E616 HydrophobicContact CB-CG 4.25Å; F435-E616 HydrophobicContact CD2-CG 4.08Å; I440-E616 HydrophobicContact CD1-CB 4.39Å; L612-E616 PolarHBondContact O-N 2.82Å; P613-E616 PolarHBondContact O-N 3.12Å; E616-T618 VanDerWaalsContact C-N 3.26Å; E616-T618 PolarHBondContact O-N 3.12Å; E616-G619 PolarHBondContact O-N 2.56Å; E616-G619 VanDerWaalsContact O-N 3.15Å
617	S	88.3	Confident	86.9	Confident	61 Å²	61	70.1 Å²	70.1	43%	0.427	38%	0.377	S	S	.	.	H	α-helix	trans	-62.6	-30.7	-174.7	74.3	0	0	0	0	113.6	P613 S614 L615 G619 R620	P613-S617 WeakPolarHBondContact O-CB 3.48Å; P613-S617 PolarHBondContact O-N 2.77Å; S614-S617 PolarHBondContact O-N 3.18Å; S614-S617 PolarHBondContact O-OG 2.98Å; L615-S617 VanDerWaalsContact C-N 3.34Å; S617-G619 PolarHBondContact O-N 3.43Å; S617-R620 PolarHBondContact O-N 3.04Å
618	T	87.8	Confident	86.4	Confident	75 Å²	75	69.9 Å²	69.9	46%	0.46	38%	0.376	S	S	.	.	H	α-helix	trans	-67.5	-24	178.7	56.3	0	0	0	0	113	H436 S614 L615 E616 R620 T621	H436-T618 PolarHBondContact CD2-OG1 3.33Å; H436-T618 PolarHBondContact NE2-OG1 3.42Å; S614-T618 PolarHBondContact O-N 3.42Å; L615-T618 PolarHBondContact O-OG1 3.31Å; E616-T618 VanDerWaalsContact C-N 3.26Å; E616-T618 PolarHBondContact O-N 3.12Å; T618-R620 VanDerWaalsContact C-N 3.27Å; T618-R620 PolarHBondContact O-N 3.32Å; T618-T621 PolarHBondContact O-OG1 2.94Å; T618-T621 VanDerWaalsContact O-OG1 3.04Å
619	G	82.2	Confident	85.9	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-78.5	-12.1	-177.2	0	0	0	0	0	114	F435 H436 E616 S617 T621 E622	F435-G619 WeakPolarHBondContact CD1-O 3.23Å; H436-G619 VanDerWaalsContact CD2-CA 3.44Å; H436-G619 WeakPolarHBondContact CD2-CA 3.49Å; H436-G619 PolarHBondContact CD2-N 2.85Å; H436-G619 WeakPolarHBondContact NE2-CA 3.18Å; H436-G619 PolarHBondContact NE2-N 3.4Å; E616-G619 PolarHBondContact O-N 2.56Å; E616-G619 VanDerWaalsContact O-N 3.15Å; S617-G619 PolarHBondContact O-N 3.43Å; G619-T621 PolarHBondContact O-N 3.49Å; G619-E622 PolarHBondContact O-N 3.26Å
620	R	80	Confident	85.6	Confident	185 Å²	185	68.5 Å²	68.5	70%	0.698	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-66.1	-19.1	178.8	-65.1	-177.6	-178.8	-175.4	0.9	113.1	F435 S617 T618	F435-R620 HydrophobicContact CD2-CG 4.19Å; F435-R620 HydrophobicContact CE2-CG 3.8Å; F435-R620 HydrophobicContact CZ-CG 4.18Å; S617-R620 PolarHBondContact O-N 3.04Å; T618-R620 VanDerWaalsContact C-N 3.27Å; T618-R620 PolarHBondContact O-N 3.32Å
621	T	78.9	Confident	85.3	Confident	128 Å²	128	68.2 Å²	68.2	79%	0.785	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-98.5	-8.1	179.9	56.1	0	0	0	0	113.2	T618 G619	T618-T621 PolarHBondContact O-OG1 2.94Å; T618-T621 VanDerWaalsContact O-OG1 3.04Å; G619-T621 PolarHBondContact O-N 3.49Å
622	E	76.4	Confident	84.8	Confident	90 Å²	90	68.9 Å²	68.9	42%	0.421	38%	0.377	S	S	.	.			trans	-81.2	139.8	-178.6	-68.2	-169.5	167.7	0	0	111.8	H436 G619 H628	H436-E622 VanDerWaalsContact CE1-CD 3.4Å; H436-E622 IonicContact CE1-OE1 3.25Å; H436-E622 PolarHBondContact CE1-OE1 3.35Å; H436-E622 VanDerWaalsContact CE1-OE1 3.32Å; H436-E622 IonicContact CE1-OE2 3.66Å; H436-E622 PolarHBondContact CE1-OE2 3.46Å; H436-E622 VanDerWaalsContact CE1-OE2 3.23Å; H436-E622 IonicContact ND1-OE2 3.54Å; H436-E622 IonicContact NE2-OE1 3.56Å; G619-E622 PolarHBondContact O-N 3.26Å; E622-H628 IonicContact OE2-CE1 2.94Å; E622-H628 PolarHBondContact OE2-CE1 3.18Å; E622-H628 IonicContact OE2-ND1 3.76Å
623	S	71	Confident	84.4	Confident	122 Å²	122	71.4 Å²	71.4	85%	0.853	39%	0.389	S	S	*	.	S	Bend	trans	-90.8	-25.5	-172.1	57.3	0	0	0	0	114.2	P625	S623-P625 VanDerWaalsContact O-CD 3.29Å; S623-P625 WeakPolarHBondContact O-CD 3.48Å
624	N	79.6	Confident	84.1	Confident	58 Å²	58	76.1 Å²	76.1	31%	0.31	40%	0.404	S	S	.	.			trans	-96.2	107.1	-176.1	175.1	14.4	0	0	0	111.1	E626 H627	N624-E626 PolarHBondContact O-N 3.4Å; N624-E626 VanDerWaalsContact O-N 3.15Å; N624-E626 WeakPolarHBondContact OD1-CB 3.28Å; N624-E626 PolarHBondContact OD1-N 2.94Å; N624-E626 VanDerWaalsContact OD1-N 3.08Å; N624-H627 PolarHBondContact ND2-CD2 3Å; N624-H627 PolarHBondContact ND2-NE2 3.2Å; N624-H627 PolarHBondContact O-N 3.46Å
625	P	77.3	Confident	84	Confident	73 Å²	73	75.6 Å²	75.6	47%	0.474	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-65.4	-20.4	-175.2	27.8	-35.8	0	0	0	113.6	S623 H627 H628	S623-P625 VanDerWaalsContact O-CD 3.29Å; S623-P625 WeakPolarHBondContact O-CD 3.48Å; P625-H627 VanDerWaalsContact C-N 3.33Å; P625-H627 PolarHBondContact O-N 2.82Å; P625-H628 PolarHBondContact O-N 3.42Å
626	E	78.7	Confident	83.8	Confident	105 Å²	105	82.6 Å²	82.6	49%	0.491	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-65.8	-33.4	-179.6	-66.8	-170.3	155.5	0	0	112.8	N624 H628 L629 F653	N624-E626 PolarHBondContact O-N 3.4Å; N624-E626 VanDerWaalsContact O-N 3.15Å; N624-E626 WeakPolarHBondContact OD1-CB 3.28Å; N624-E626 PolarHBondContact OD1-N 2.94Å; N624-E626 VanDerWaalsContact OD1-N 3.08Å; E626-H628 PolarHBondContact O-N 3.11Å; E626-H628 VanDerWaalsContact O-N 3.14Å; E626-L629 WeakPolarHBondContact O-CB 3.27Å; E626-L629 PolarHBondContact O-N 3.12Å; E626-F653 HydrophobicContact CG-CZ 4.33Å; E626-F653 WeakPolarHBondContact OE1-CZ 3.34Å
627	H	81.8	Confident	83.8	Confident	117 Å²	117	86.6 Å²	86.6	54%	0.542	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-64.3	-19.8	179.5	-69.7	-74.6	0	0	0	112.9	N624 P625 L629	N624-H627 PolarHBondContact ND2-CD2 3Å; N624-H627 PolarHBondContact ND2-NE2 3.2Å; N624-H627 PolarHBondContact O-N 3.46Å; P625-H627 VanDerWaalsContact C-N 3.33Å; P625-H627 PolarHBondContact O-N 2.82Å; H627-L629 VanDerWaalsContact C-N 3.33Å
628	H	85.9	Confident	84	Confident	11 Å²	11	84.5 Å²	84.5	5%	0.051	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-88	-2.5	178.9	-54.3	-39.7	0	0	0	113.5	F435 H436 R437 E622 P625 E626	F435-H628 AromaticContact CD1-CD2 3.64Å; F435-H628 AromaticContact CD1-CE1 3.93Å; F435-H628 AromaticContact CD1-CG 3.94Å; F435-H628 AromaticContact CD1-NE2 3.63Å; H436-H628 PolarHBondContact N-ND1 3.24Å; R437-H628 WeakPolarHBondContact CB-O 3.49Å; R437-H628 WeakPolarHBondContact CD-O 3.46Å; R437-H628 WeakPolarHBondContact CG-O 3.42Å; E622-H628 IonicContact OE2-CE1 2.94Å; E622-H628 PolarHBondContact OE2-CE1 3.18Å; E622-H628 IonicContact OE2-ND1 3.76Å; P625-H628 PolarHBondContact O-N 3.42Å; E626-H628 PolarHBondContact O-N 3.11Å; E626-H628 VanDerWaalsContact O-N 3.14Å
629	L	86.9	Confident	84.3	Confident	20 Å²	20	82.1 Å²	82.1	11%	0.105	42%	0.415	C	S	.	.	S	Bend	trans	-92	145	180	-56	-178.4	0	0	0	110.7	T438 E626 H627 Y646 P652	T438-L629 PolarHBondContact OG1-O 3.09Å; E626-L629 WeakPolarHBondContact O-CB 3.27Å; E626-L629 PolarHBondContact O-N 3.12Å; H627-L629 VanDerWaalsContact C-N 3.33Å; L629-Y646 HydrophobicContact CD2-CE1 4.08Å; L629-P652 HydrophobicContact CD1-CG 4.24Å
630	L	90.4	Very high	84.7	Confident	3 Å²	3	84.3 Å²	84.3	2%	0.016	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-66.9	147.9	169	-73.2	166.3	0	0	0	109.8	R426 R430 R437 F441 Q632 H633 Y639	R426-L630 HydrophobicContact CB-CD1 4.02Å; R426-L630 HydrophobicContact CG-CD1 4.15Å; R430-L630 HydrophobicContact CB-CD1 4.41Å; R437-L630 HydrophobicContact CB-CD2 4.07Å; R437-L630 HydrophobicContact CB-CG 3.86Å; R437-L630 WeakPolarHBondContact O-CD2 3.01Å; F441-L630 HydrophobicContact CB-CD2 3.87Å; F441-L630 HydrophobicContact CG-CD2 4.28Å; L630-Q632 PolarHBondContact O-N 3.35Å; L630-H633 WeakPolarHBondContact O-CB 3.43Å; L630-H633 PolarHBondContact O-N 3.14Å; L630-H633 PolarHBondContact O-ND1 3.21Å; L630-Y639 HydrophobicContact CD1-CE1 4.09Å
631	P	89	Confident	85.2	Confident	76 Å²	76	78.1 Å²	78.1	49%	0.494	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	142.1	167.9	-23.4	33.8	0	0	0	109.9	R426 T438 H633	R426-P631 VanDerWaalsContact CZ-O 3.28Å; R426-P631 PolarHBondContact NH1-O 3.07Å; R426-P631 PolarHBondContact NH2-O 2.93Å; T438-P631 HydrophobicContact CG2-CG 4.43Å; T438-P631 WeakPolarHBondContact OG1-CD 3.44Å; P631-H633 PolarHBondContact O-N 3.23Å
632	Q	86.6	Confident	85.8	Confident	118 Å²	118	74.2 Å²	74.2	55%	0.551	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	31.5	179.2	-52.9	172.5	20.6	0	0	114.1	L630 F634 L635	L630-Q632 PolarHBondContact O-N 3.35Å; Q632-F634 PolarHBondContact O-N 2.93Å; Q632-F634 VanDerWaalsContact O-N 3.08Å; Q632-L635 HydrophobicContact CB-CB 4.47Å; Q632-L635 HydrophobicContact CB-CD1 3.87Å; Q632-L635 HydrophobicContact CB-CG 4.16Å; Q632-L635 HydrophobicContact CG-CD1 4.24Å; Q632-L635 WeakPolarHBondContact O-CB 3.39Å; Q632-L635 PolarHBondContact O-N 3.26Å
633	H	85.1	Confident	86.5	Confident	54 Å²	54	72 Å²	72	25%	0.25	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.4	-178	61.5	-89.7	0	0	0	114.7	L630 P631 Y639 Y646	L630-H633 WeakPolarHBondContact O-CB 3.43Å; L630-H633 PolarHBondContact O-N 3.14Å; L630-H633 PolarHBondContact O-ND1 3.21Å; P631-H633 PolarHBondContact O-N 3.23Å; H633-Y639 WeakPolarHBondContact CA-OH 3.28Å; H633-Y639 WeakPolarHBondContact O-CE2 3.42Å; H633-Y646 PolarHBondContact CD2-OH 2.92Å; H633-Y646 VanDerWaalsContact CD2-OH 3.24Å
634	F	87	Confident	87.2	Confident	154 Å²	154	68.5 Å²	68.5	68%	0.675	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-17.9	175.5	59.9	-91.7	0	0	0	113.1	Q632 K636	Q632-F634 PolarHBondContact O-N 2.93Å; Q632-F634 VanDerWaalsContact O-N 3.08Å; F634-K636 PolarHBondContact O-N 3.33Å
635	L	89.8	Confident	87.1	Confident	58 Å²	58	68.8 Å²	68.8	30%	0.304	36%	0.36	S	S	.	.			trans	-79.6	103.3	-178.9	-68.7	-174.1	0	0	0	110.4	Q632 N637 S638	Q632-L635 HydrophobicContact CB-CB 4.47Å; Q632-L635 HydrophobicContact CB-CD1 3.87Å; Q632-L635 HydrophobicContact CB-CG 4.16Å; Q632-L635 HydrophobicContact CG-CD1 4.24Å; Q632-L635 WeakPolarHBondContact O-CB 3.39Å; Q632-L635 PolarHBondContact O-N 3.26Å; L635-N637 PolarHBondContact O-N 3.06Å; L635-S638 VanDerWaalsContact O-CB 3.3Å; L635-S638 WeakPolarHBondContact O-CB 3.33Å; L635-S638 PolarHBondContact O-N 3.07Å; L635-S638 PolarHBondContact O-OG 3.09Å
636	K	87	Confident	86.8	Confident	186 Å²	186	68.3 Å²	68.3	81%	0.809	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-56.5	-35.2	178.7	-172.4	173.8	-178.8	173.7	0	113	F634 S638 Y639	F634-K636 PolarHBondContact O-N 3.33Å; K636-S638 PolarHBondContact O-N 2.94Å; K636-Y639 PolarHBondContact O-N 2.96Å
637	N	89.8	Confident	86.1	Confident	124 Å²	124	68.4 Å²	68.4	66%	0.663	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-75.5	-2.9	178	67.3	-17.8	0	0	0	114.2	L635 Y639	L635-N637 PolarHBondContact O-N 3.06Å; N637-Y639 VanDerWaalsContact C-N 3.26Å
638	S	92.3	Very high	84.3	Confident	17 Å²	17	68.4 Å²	68.4	12%	0.119	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-84.3	-1.5	172	77.8	0	0	0	0	113.2	R426 L635 K636	R426-S638 WeakPolarHBondContact CD-O 3.28Å; R426-S638 PolarHBondContact NE-O 3.05Å; R426-S638 VanDerWaalsContact NE-O 3.12Å; R426-S638 PolarHBondContact NE-OG 3.12Å; R426-S638 PolarHBondContact NH2-OG 3.2Å; L635-S638 VanDerWaalsContact O-CB 3.3Å; L635-S638 WeakPolarHBondContact O-CB 3.33Å; L635-S638 PolarHBondContact O-N 3.07Å; L635-S638 PolarHBondContact O-OG 3.09Å; K636-S638 PolarHBondContact O-N 2.94Å
639	Y	93.7	Very high	82.3	Confident	25 Å²	25	71.6 Å²	71.6	10%	0.098	40%	0.397	C	S	.	.	S	Bend	trans	-120.2	156.6	-177.7	-63.1	-74.7	0	0	0	111.3	R426 R430 L630 H633 K636 N637 V643	R426-Y639 HydrophobicContact CB-CD1 3.89Å; R426-Y639 HydrophobicContact CB-CE1 3.87Å; R430-Y639 HydrophobicContact CB-CE1 3.86Å; R430-Y639 HydrophobicContact CG-CE1 4.09Å; L630-Y639 HydrophobicContact CD1-CE1 4.09Å; H633-Y639 WeakPolarHBondContact CA-OH 3.28Å; H633-Y639 WeakPolarHBondContact O-CE2 3.42Å; K636-Y639 PolarHBondContact O-N 2.96Å; N637-Y639 VanDerWaalsContact C-N 3.26Å; Y639-V643 HydrophobicContact CD1-CG2 3.81Å; Y639-V643 HydrophobicContact CD2-CG2 4.02Å; Y639-V643 HydrophobicContact CE1-CG2 4.38Å; Y639-V643 HydrophobicContact CG-CG2 3.6Å
640	F	92.5	Very high	80.3	Confident	46 Å²	46	77.7 Å²	77.7	20%	0.202	42%	0.423	C	S	.	.	S	Bend	trans	-100.4	118	174.3	172.4	-98.7	0	0	0	109.5	T360 F361 A423 I424 T427	T360-F640 HydrophobicContact CG2-CD1 4.02Å; T360-F640 HydrophobicContact CG2-CE1 3.99Å; T360-F640 PolarHBondContact OG1-O 3.32Å; F361-F640 HydrophobicContact CZ-CD1 4.46Å; A423-F640 HydrophobicContact CB-CB 4.26Å; A423-F640 PolarHBondContact O-N 3.05Å; I424-F640 HydrophobicContact CG1-CB 3.96Å; I424-F640 HydrophobicContact CG1-CD1 4.03Å; I424-F640 HydrophobicContact CG1-CD2 3.99Å; I424-F640 HydrophobicContact CG1-CG 3.71Å; T427-F640 WeakPolarHBondContact CG2-O 3.48Å; T427-F640 PolarHBondContact OG1-N 3.23Å; T427-F640 PolarHBondContact OG1-O 3.49Å
641	G	89.6	Confident	78.1	Confident	56 Å²	56	82 Å²	82	58%	0.577	44%	0.443	S	S	*	.	S	Bend	trans	69.8	-143.2	179.3	0	0	0	0	0	113.7
642	V	90.3	Very high	76.2	Confident	46 Å²	46	80.5 Å²	80.5	28%	0.279	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-99.6	130.6	-171.9	179.4	0	0	0	0	110.8	D357 T360 N431	D357-V642 HydrophobicContact CB-CG1 3.99Å; T360-V642 PolarHBondContact N-O 3.1Å; T360-V642 PolarHBondContact OG1-N 3.38Å; T360-V642 PolarHBondContact OG1-O 3.25Å; N431-V642 PolarHBondContact ND2-O 2.87Å; N431-V642 VanDerWaalsContact ND2-O 3.1Å
643	V	91.3	Very high	74.4	Confident	44 Å²	44	80.2 Å²	80.2	27%	0.267	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-97.2	139.1	175.1	168.2	0	0	0	0	109.7	T427 R430 N431 Y639	T427-V643 HydrophobicContact CG2-CG2 4.38Å; R430-V643 HydrophobicContact CG-CB 4.44Å; R430-V643 HydrophobicContact CG-CG1 3.36Å; R430-V643 HydrophobicContact CG-CG2 4.27Å; N431-V643 WeakPolarHBondContact OD1-CA 3.19Å; Y639-V643 HydrophobicContact CD1-CG2 3.81Å; Y639-V643 HydrophobicContact CD2-CG2 4.02Å; Y639-V643 HydrophobicContact CE1-CG2 4.38Å; Y639-V643 HydrophobicContact CG-CG2 3.6Å
644	R	87	Confident	72.7	Confident	47 Å²	47	82.9 Å²	82.9	18%	0.177	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-59.6	141.7	174.4	69.6	177.1	174.2	169	-4.7	111.5	P359 R430 N431 Y433	P359-R644 HydrophobicContact CB-CB 4.3Å; P359-R644 HydrophobicContact CG-CB 4.4Å; R430-R644 PolarHBondContact NH2-O 2.71Å; R430-R644 PolarHBondContact O-NE 3.35Å; R430-R644 PolarHBondContact O-NH2 3.03Å; N431-R644 WeakPolarHBondContact O-CD 3.39Å; N431-R644 PolarHBondContact O-NE 3.02Å; N431-R644 VanDerWaalsContact O-NE 3.15Å; N431-R644 PolarHBondContact O-NH1 2.76Å; N431-R644 PolarHBondContact OD1-N 2.99Å; Y433-R644 PolarHBondContact O-NH2 3.28Å
645	P	77.5	Confident	70.9	Confident	64 Å²	64	80.8 Å²	80.8	42%	0.416	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-52	151.5	171.6	-27	36.2	0	0	0	112.2	E307	E307-P645 VanDerWaalsContact OE1-CG 3.32Å; E307-P645 WeakPolarHBondContact OE1-CG 3.2Å
646	Y	71.2	Confident	69	Low	64 Å²	64	83.4 Å²	83.4	25%	0.251	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-71.4	133	165.6	-74.5	-94.1	0	0	0	108	R430 L629 H633 V648	R430-Y646 VanDerWaalsContact NH1-CZ 3.3Å; L629-Y646 HydrophobicContact CD2-CE1 4.08Å; H633-Y646 PolarHBondContact CD2-OH 2.92Å; H633-Y646 VanDerWaalsContact CD2-OH 3.24Å; Y646-V648 PolarHBondContact O-N 3Å; Y646-V648 VanDerWaalsContact O-N 3.11Å
647	D	62.5	Low	67.5	Low	107 Å²	107	80.5 Å²	80.5	57%	0.572	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-53.8	117.8	169.4	-172.6	-2.7	0	0	0	108.3	G649 K650 M651	D647-G649 PolarHBondContact O-N 3.45Å; D647-G649 VanDerWaalsContact O-N 3.13Å; D647-K650 HydrophobicContact CB-CB 4.37Å; D647-K650 CarbonylContact O-C 3.52Å; D647-K650 WeakPolarHBondContact O-CA 3.38Å; D647-K650 PolarHBondContact O-N 3.04Å; D647-M651 PolarHBondContact O-N 3.32Å; D647-M651 VanDerWaalsContact O-N 3.11Å
648	V	45	Very low	65.9	Low	116 Å²	116	82.2 Å²	82.2	70%	0.703	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-63.3	-25.3	-165.6	-161.9	0	0	0	0	111.4	Y646 K650 M651	Y646-V648 PolarHBondContact O-N 3Å; Y646-V648 VanDerWaalsContact O-N 3.11Å; V648-K650 VanDerWaalsContact C-N 3.26Å; V648-K650 PolarHBondContact O-N 2.91Å; V648-M651 HydrophobicContact CG1-CE 4.29Å; V648-M651 HydrophobicContact CG1-SD 4.48Å; V648-M651 HydrophobicContact CG2-CE 4.36Å
649	G	43.4	Very low	64.1	Low	78 Å²	78	86.5 Å²	86.5	80%	0.804	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-76.3	-8.4	172	0	0	0	0	0	114.9	D647	D647-G649 PolarHBondContact O-N 3.45Å; D647-G649 VanDerWaalsContact O-N 3.13Å
650	K	45.4	Very low	62.3	Low	149 Å²	149	91.2 Å²	91.2	65%	0.648	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-126.2	16.3	179.2	-62.5	179.8	-178.5	169.7	0	112.3	D647 V648 P652	D647-K650 HydrophobicContact CB-CB 4.37Å; D647-K650 CarbonylContact O-C 3.52Å; D647-K650 WeakPolarHBondContact O-CA 3.38Å; D647-K650 PolarHBondContact O-N 3.04Å; V648-K650 VanDerWaalsContact C-N 3.26Å; V648-K650 PolarHBondContact O-N 2.91Å; K650-P652 WeakPolarHBondContact O-CD 3.38Å
651	M	44.8	Very low	60.8	Low	92 Å²	92	95 Å²	95	45%	0.453	57%	0.573	S	S	.	*			trans	-64.3	116.2	169.3	-86.4	-173.5	-161.8	0	0	108.2	D647 V648 F653	D647-M651 PolarHBondContact O-N 3.32Å; D647-M651 VanDerWaalsContact O-N 3.11Å; V648-M651 HydrophobicContact CG1-CE 4.29Å; V648-M651 HydrophobicContact CG1-SD 4.48Å; V648-M651 HydrophobicContact CG2-CE 4.36Å; M651-F653 PolarHBondContact O-N 3.25Å
652	P	48.6	Very low	59.6	Low	45 Å²	45	98.2 Å²	98.2	29%	0.292	58%	0.583	S	S	.	*	S	Bend	trans	-73.1	-17.5	-177.2	27	-29.3	0	0	0	112	L629 K650	L629-P652 HydrophobicContact CD1-CG 4.24Å; K650-P652 WeakPolarHBondContact O-CD 3.38Å
653	F	47.9	Very low	58.1	Low	112 Å²	112	100.8 Å²	100.8	49%	0.491	59%	0.594	S	S	.	*	S	Bend	trans	-145.4	141.6	-177	-55.8	-71.4	0	0	0	112.9	E626 M651	E626-F653 HydrophobicContact CG-CZ 4.33Å; E626-F653 WeakPolarHBondContact OE1-CZ 3.34Å; M651-F653 PolarHBondContact O-N 3.25Å
654	P	49.7	Very low	56.5	Low	111 Å²	111	102.7 Å²	102.7	72%	0.721	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-60.9	147.5	163.5	27.6	-32.4	0	0	0	109.4
655	P	49.3	Very low	55.3	Low	109 Å²	109	106.2 Å²	106.2	71%	0.708	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-55.5	144.3	173	23.8	-32.2	0	0	0	109.7
656	P	50.2	Low	54.7	Low	114 Å²	114	111.1 Å²	111.1	74%	0.74	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-55.2	142.9	177.7	21.1	-30.6	0	0	0	110.1	L658	P656-L658 PolarHBondContact O-N 2.94Å
657	P	55.3	Low	53.9	Low	125 Å²	125	112.2 Å²	112.2	81%	0.812	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-55.8	134.1	-178.9	21.2	-31	0	0	0	110
658	L	55.8	Low	53.6	Low	159 Å²	159	110 Å²	110	83%	0.832	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-50.9	141.4	172.8	-76.1	159.9	0	0	0	109.2	P656	P656-L658 PolarHBondContact O-N 2.94Å
659	P	55.7	Low	54.1	Low	108 Å²	108	109 Å²	109	70%	0.701	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-54.7	137.1	173.6	23.1	-31.6	0	0	0	108.9	T661	P659-T661 PolarHBondContact O-N 3.06Å
660	P	54.3	Low	54.7	Low	124 Å²	124	111.2 Å²	111.2	81%	0.805	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-56	127.1	-176.9	20.7	-30.9	0	0	0	109.5
661	T	62.2	Low	55.2	Low	126 Å²	126	109.6 Å²	109.6	77%	0.773	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-53.9	133.6	168.7	28.5	0	0	0	0	108.5	P659 I663	P659-T661 PolarHBondContact O-N 3.06Å; T661-I663 PolarHBondContact O-N 3.22Å
662	P	64.1	Low	55.6	Low	122 Å²	122	112.5 Å²	112.5	79%	0.792	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-57.2	129.3	178.6	20.3	-29.3	0	0	0	109.6
663	I	58.1	Low	55.7	Low	101 Å²	101	117.2 Å²	117.2	52%	0.518	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-56.2	129.7	179.2	-58.3	169.9	0	0	0	108	T661 T665 L667	T661-I663 PolarHBondContact O-N 3.22Å; I663-T665 PolarHBondContact O-N 3.13Å; I663-L667 HydrophobicContact CG2-CB 3.52Å; I663-L667 HydrophobicContact CG2-CD1 4.44Å
664	P	58.5	Low	55.6	Low	84 Å²	84	120 Å²	120	55%	0.545	69%	0.686	S	S	.	*	P	Polyproline II helix	trans	-52.4	137	174.5	-24.2	32.4	0	0	0	110.7	E666 L667	P664-E666 PolarHBondContact O-N 2.86Å; P664-L667 HydrophobicContact CG-CD1 4.48Å; P664-L667 PolarHBondContact O-N 2.93Å
665	T	62.2	Low	55	Low	120 Å²	120	124.1 Å²	124.1	74%	0.736	70%	0.695	S	S	*	*	H	α-helix	trans	-55.8	-25.1	-171.1	-38.9	0	0	0	0	113.5	I663 T668 T669	I663-T665 PolarHBondContact O-N 3.13Å; T665-T668 WeakPolarHBondContact CA-OG1 3.45Å; T665-T668 PolarHBondContact O-N 3.42Å; T665-T668 PolarHBondContact O-OG1 3.3Å; T665-T669 PolarHBondContact O-OG1 2.94Å
666	E	65.3	Low	54.5	Low	167 Å²	167	124.9 Å²	124.9	78%	0.78	70%	0.7	S	S	*	*	H	α-helix	trans	-69.5	-28.8	177.2	-62.9	-177.2	167.1	0	0	113.7	P664	P664-E666 PolarHBondContact O-N 2.86Å
667	L	53.4	Low	53.9	Low	88 Å²	88	124.1 Å²	124.1	46%	0.461	70%	0.704	S	S	.	*	H	α-helix	trans	-81.5	-23.9	177.4	-90.3	150.2	0	0	0	112.4	I663 P664 T669 I670 L671	I663-L667 HydrophobicContact CG2-CB 3.52Å; I663-L667 HydrophobicContact CG2-CD1 4.44Å; P664-L667 HydrophobicContact CG-CD1 4.48Å; P664-L667 PolarHBondContact O-N 2.93Å; L667-T669 VanDerWaalsContact C-N 3.28Å; L667-T669 PolarHBondContact O-N 3.39Å; L667-I670 PolarHBondContact O-N 3.42Å; L667-L671 PolarHBondContact O-N 2.87Å
668	T	55.6	Low	52.8	Low	60 Å²	60	126.7 Å²	126.7	37%	0.368	71%	0.705	S	S	.	*	H	α-helix	trans	-67.8	-30.5	179.9	-16.4	0	0	0	0	111.7	T665 Q672	T665-T668 WeakPolarHBondContact CA-OG1 3.45Å; T665-T668 PolarHBondContact O-N 3.42Å; T665-T668 PolarHBondContact O-OG1 3.3Å; T668-Q672 WeakPolarHBondContact O-CG 3.49Å
669	T	57	Low	51.8	Low	96 Å²	96	125.2 Å²	125.2	59%	0.589	70%	0.702	S	S	*	*	H	α-helix	trans	-75.9	-28.8	178.7	-19.6	0	0	0	0	112.8	T665 L667	T665-T669 PolarHBondContact O-OG1 2.94Å; L667-T669 VanDerWaalsContact C-N 3.28Å; L667-T669 PolarHBondContact O-N 3.39Å
670	I	55.3	Low	50.6	Low	124 Å²	124	128.9 Å²	128.9	64%	0.636	71%	0.707	S	S	*	*	H	α-helix	trans	-78.7	-37.5	179.2	-60.8	175.8	0	0	0	110.7	L667 Q672	L667-I670 PolarHBondContact O-N 3.42Å; I670-Q672 PolarHBondContact O-N 3.28Å
671	L	55	Low	49.7	Very low	114 Å²	114	130.5 Å²	130.5	60%	0.597	71%	0.707	S	S	*	*	H	α-helix	trans	-75.8	-18.6	-177.2	-72.6	166.1	0	0	0	114.1	L667 N673	L667-L671 PolarHBondContact O-N 2.87Å; L671-N673 VanDerWaalsContact C-N 3.27Å; L671-N673 PolarHBondContact O-N 2.91Å
672	Q	54.4	Low	48.4	Very low	154 Å²	154	130.3 Å²	130.3	72%	0.72	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-10.5	177.2	-78.5	-179.9	-18.4	0	0	114.2	T668 I670	T668-Q672 WeakPolarHBondContact O-CG 3.49Å; I670-Q672 PolarHBondContact O-N 3.28Å
673	N	50.5	Low	46.9	Very low	144 Å²	144	130.4 Å²	130.4	77%	0.77	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	13.8	-177.3	-80.8	-17.2	0	0	0	115.2	L671	L671-N673 VanDerWaalsContact C-N 3.27Å; L671-N673 PolarHBondContact O-N 2.91Å
674	Q	45.9	Very low	45.8	Very low	170 Å²	170	135.4 Å²	135.4	79%	0.794	73%	0.728	S	S	*	*			trans	-131.5	100.3	173.5	-69.6	-168.5	-18.4	0	0	112.1
675	Q	37.1	Very low	44.4	Very low	197 Å²	197	141.1 Å²	141.1	92%	0.921	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-74.2	126.9	165.5	-80.4	175.9	-27.7	0	0	109.9
676	P	38.9	Very low	43	Very low	125 Å²	125	144.7 Å²	144.7	81%	0.812	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-84.8	134.6	171.5	15.3	-2	0	0	0	111.4
677	A	37.7	Very low	41.6	Very low	99 Å²	99	140.7 Å²	140.7	82%	0.818	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-64.2	138.3	173.2	0	0	0	0	0	111.9
678	Q	32.1	Very low	40.5	Very low	178 Å²	178	142.3 Å²	142.3	83%	0.832	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-71.8	136.9	176.2	-67.5	-158	-22.5	0	0	112.4
679	V	33.6	Very low	39.3	Very low	129 Å²	129	145.5 Å²	145.5	78%	0.782	79%	0.792	S	S	*	*			trans	-119.4	112.7	159.9	179.1	0	0	0	0	108.4	I681	V679-I681 HydrophobicContact CG1-CG1 4.31Å
680	K	30.3	Very low	38.1	Very low	185 Å²	185	145 Å²	145	80%	0.804	81%	0.805	S	S	*	*			trans	-81.5	130.6	168.7	-98.7	174.8	173.2	174.3	0	109
681	I	36.8	Very low	36.7	Very low	157 Å²	157	144.4 Å²	144.4	81%	0.805	81%	0.812	S	S	*	*			trans	-125.2	124.1	159.8	-59.6	-179.5	0	0	0	108.1	V679	V679-I681 HydrophobicContact CG1-CG1 4.31Å
682	T	33.9	Very low	35.5	Very low	123 Å²	123	148.3 Å²	148.3	76%	0.755	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-85.5	143	-175.3	-41.3	0	0	0	0	110.6
683	P	32.7	Very low	34.5	Very low	124 Å²	124	145.7 Å²	145.7	81%	0.805	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-88.2	135.3	-179.4	32.4	-30.5	0	0	0	112.7
684	Q	34.8	Very low	33.8	Very low	205 Å²	205	143.9 Å²	143.9	96%	0.958	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-99	146	167.4	-84.6	-172.9	-53.6	0	0	111.5
685	K	30.1	Very low	33.3	Very low	205 Å²	205	143.8 Å²	143.8	89%	0.891	82%	0.824	S	S	*	*			trans	-129	121.8	-172.3	-171.4	-172.2	-168.5	-176.4	0	107.7
686	E	33.6	Very low	33.3	Very low	195 Å²	195	141.6 Å²	141.6	91%	0.911	81%	0.814	S	S	*	*			trans	-169.2	148.7	164.2	-98.4	166.4	-158.1	0	0	104.6
687	A	35.2	Very low	33.4	Very low	83 Å²	83	139.9 Å²	139.9	69%	0.686	80%	0.802	S	S	*	*			cis	179.7	117.8	-21.9	0	0	0	0	0	104.7
688	S	29.1	Very low	33.7	Very low	121 Å²	121	138.6 Å²	138.6	85%	0.846	79%	0.791	S	S	*	*			trans	37.6	118	154.7	62.6	0	0	0	0	122.1
689	S	32.3	Very low	34.6	Very low	128 Å²	128	133.9 Å²	133.9	90%	0.895	77%	0.774	S	S	*	*				-173.8	132.7	120.9	59.5	0	0	0	0	111.6
690	G	30.2	Very low	35.6	Very low	84 Å²	84	132.3 Å²	132.3	87%	0.866	76%	0.761	S	S	*	*			trans	110.2	73.9	154.8	0	0	0	0	0	117.6
691	S	27.3	Very low	37.2	Very low	112 Å²	112	132.3 Å²	132.3	78%	0.783	76%	0.758	S	S	*	*			trans	-83.1	123.9	161.4	52.6	0	0	0	0	110.6
692	Q	29.8	Very low	39	Very low	196 Å²	196	128.1 Å²	128.1	92%	0.916	74%	0.742	S	S	*	*			trans	174	95.1	153.6	-99.9	165.6	15.4	0	0	109.5
693	S	33.2	Very low	41	Very low	99 Å²	99	125.4 Å²	125.4	69%	0.692	73%	0.726	S	S	*	*	S	Bend	trans	-172.4	-6.5	159	62.5	0	0	0	0	115.1
694	S	35.9	Very low	43.2	Very low	107 Å²	107	124.6 Å²	124.6	75%	0.748	71%	0.713	S	S	*	*	S	Bend	trans	-105.5	7.7	-173.6	-40.3	0	0	0	0	115.3
695	Q	34	Very low	45.5	Very low	167 Å²	167	120 Å²	120	78%	0.78	70%	0.695	S	S	*	*	S	Bend	trans	-110.9	-14.7	-177.7	-128.3	166	-10.7	0	0	113.5	T699	Q695-T699 PolarHBondContact O-OG1 3.31Å
696	E	37	Very low	48	Very low	151 Å²	151	113.6 Å²	113.6	71%	0.706	68%	0.676	S	S	*	*	H	α-helix	trans	-77.7	-34	179.2	-80.5	-179	145.6	0	0	113.3	T699 N700	E696-T699 PolarHBondContact O-N 3.16Å; E696-N700 PolarHBondContact O-N 3.41Å; E696-N700 PolarHBondContact O-ND2 3.01Å
697	T	42.2	Very low	50.7	Low	90 Å²	90	108.5 Å²	108.5	55%	0.552	66%	0.658	S	S	*	*	H	α-helix	trans	-69.7	-36.9	-180	30.6	0	0	0	0	112.9	T699 N700 Y701	T697-T699 VanDerWaalsContact C-N 3.32Å; T697-T699 PolarHBondContact O-N 3.33Å; T697-N700 PolarHBondContact O-N 2.64Å; T697-Y701 VanDerWaalsContact O-CD2 3.31Å; T697-Y701 WeakPolarHBondContact O-CD2 3.31Å; T697-Y701 PolarHBondContact O-N 2.97Å
698	A	44.2	Very low	53.2	Low	71 Å²	71	108.8 Å²	108.8	59%	0.587	65%	0.651	S	S	*	*	H	α-helix	trans	-68.9	-29.4	177.6	0	0	0	0	0	113.2
699	T	49.7	Very low	56.2	Low	79 Å²	79	107.8 Å²	107.8	49%	0.485	64%	0.635	S	S	.	*	H	α-helix	trans	-79	-28.5	-178.7	-37.8	0	0	0	0	112	Q695 E696 T697 S702 T703	Q695-T699 PolarHBondContact O-OG1 3.31Å; E696-T699 PolarHBondContact O-N 3.16Å; T697-T699 VanDerWaalsContact C-N 3.32Å; T697-T699 PolarHBondContact O-N 3.33Å; T699-S702 PolarHBondContact O-OG 3.03Å; T699-T703 WeakPolarHBondContact O-CG2 3.35Å; T699-T703 PolarHBondContact O-N 3.49Å; T699-T703 PolarHBondContact O-OG1 2.95Å
700	N	56.2	Low	59	Low	97 Å²	97	104.5 Å²	104.5	52%	0.519	62%	0.616	S	S	.	*	H	α-helix	trans	-74.2	-34.1	176.5	-70.9	-16.3	0	0	0	112.9	E696 T697 T703 I704	E696-N700 PolarHBondContact O-N 3.41Å; E696-N700 PolarHBondContact O-ND2 3.01Å; T697-N700 PolarHBondContact O-N 2.64Å; N700-T703 WeakPolarHBondContact CA-OG1 3.35Å; N700-T703 PolarHBondContact O-OG1 3.34Å; N700-I704 WeakPolarHBondContact O-CD1 3.39Å; N700-I704 VanDerWaalsContact O-CG1 3.28Å; N700-I704 WeakPolarHBondContact O-CG1 3.28Å; N700-I704 PolarHBondContact O-N 3.43Å
701	Y	62.5	Low	62	Low	184 Å²	184	104.4 Å²	104.4	72%	0.722	60%	0.598	S	S	*	*	H	α-helix	trans	-71.2	-34.7	175.9	-82.2	-79.2	0	0	0	113	T697 L705	T697-Y701 VanDerWaalsContact O-CD2 3.31Å; T697-Y701 WeakPolarHBondContact O-CD2 3.31Å; T697-Y701 PolarHBondContact O-N 2.97Å; Y701-L705 WeakPolarHBondContact O-CB 3.36Å; Y701-L705 PolarHBondContact O-N 3.35Å; Y701-L705 VanDerWaalsContact O-N 3.12Å
702	S	75.4	Confident	65.2	Low	70 Å²	70	101 Å²	101	49%	0.49	58%	0.581	S	S	.	*	H	α-helix	trans	-72	-35.2	179.2	86.1	0	0	0	0	112.6	T699 S706	T699-S702 PolarHBondContact O-OG 3.03Å; S702-S706 WeakPolarHBondContact O-CB 3.5Å; S702-S706 PolarHBondContact O-N 2.86Å; S702-S706 PolarHBondContact O-OG 3.49Å
703	T	75.8	Confident	68.2	Low	66 Å²	66	94.9 Å²	94.9	41%	0.405	56%	0.559	S	S	.	*	H	α-helix	trans	-69.3	-46.5	177.6	45.9	0	0	0	0	111.1	T699 N700 L705 S706 V707	T699-T703 WeakPolarHBondContact O-CG2 3.35Å; T699-T703 PolarHBondContact O-N 3.49Å; T699-T703 PolarHBondContact O-OG1 2.95Å; N700-T703 WeakPolarHBondContact CA-OG1 3.35Å; N700-T703 PolarHBondContact O-OG1 3.34Å; T703-L705 PolarHBondContact O-N 3.08Å; T703-S706 PolarHBondContact O-N 2.93Å; T703-S706 PolarHBondContact O-OG 3Å; T703-V707 WeakPolarHBondContact O-CG2 3.43Å; T703-V707 PolarHBondContact O-N 3.26Å
704	I	78.1	Confident	71.1	Confident	106 Å²	106	93 Å²	93	54%	0.544	55%	0.55	S	S	.	.	H	α-helix	trans	-59.6	-44.9	175.8	-66.7	167.7	0	0	0	111.1	N700 S706 V707 T708	N700-I704 WeakPolarHBondContact O-CD1 3.39Å; N700-I704 VanDerWaalsContact O-CG1 3.28Å; N700-I704 WeakPolarHBondContact O-CG1 3.28Å; N700-I704 PolarHBondContact O-N 3.43Å; I704-S706 PolarHBondContact O-N 2.94Å; I704-V707 PolarHBondContact O-N 3.36Å; I704-T708 PolarHBondContact O-N 3.43Å; I704-T708 PolarHBondContact O-OG1 3.47Å
705	L	83.5	Confident	73.8	Confident	110 Å²	110	92.5 Å²	92.5	58%	0.576	54%	0.538	S	S	*	.	H	α-helix	trans	-62.1	-43.6	177.6	-173.9	66.5	0	0	0	111.9	Y701 T703 V707 T708 I709	Y701-L705 WeakPolarHBondContact O-CB 3.36Å; Y701-L705 PolarHBondContact O-N 3.35Å; Y701-L705 VanDerWaalsContact O-N 3.12Å; T703-L705 PolarHBondContact O-N 3.08Å; L705-V707 PolarHBondContact O-N 3.43Å; L705-T708 PolarHBondContact O-N 3.2Å; L705-I709 HydrophobicContact CD1-CD1 4.31Å; L705-I709 HydrophobicContact CG-CD1 4Å; L705-I709 WeakPolarHBondContact O-CG1 3.33Å; L705-I709 PolarHBondContact O-N 3.32Å
706	S	83.7	Confident	76.7	Confident	69 Å²	69	90 Å²	90	48%	0.483	53%	0.529	S	S	.	.	H	α-helix	trans	-64.3	-39.1	179.6	72.4	0	0	0	0	113.1	S702 T703 I704 A710	S702-S706 WeakPolarHBondContact O-CB 3.5Å; S702-S706 PolarHBondContact O-N 2.86Å; S702-S706 PolarHBondContact O-OG 3.49Å; T703-S706 PolarHBondContact O-N 2.93Å; T703-S706 PolarHBondContact O-OG 3Å; I704-S706 PolarHBondContact O-N 2.94Å; S706-A710 WeakPolarHBondContact O-CB 3.49Å; S706-A710 PolarHBondContact O-N 2.85Å
707	V	88.4	Confident	79.4	Confident	88 Å²	88	87.4 Å²	87.4	53%	0.533	52%	0.519	S	S	.	.	H	α-helix	trans	-67.9	-41.7	177.1	173.6	0	0	0	0	110.4	T703 I704 L705 I709 A710 V711	T703-V707 WeakPolarHBondContact O-CG2 3.43Å; T703-V707 PolarHBondContact O-N 3.26Å; I704-V707 PolarHBondContact O-N 3.36Å; L705-V707 PolarHBondContact O-N 3.43Å; V707-I709 PolarHBondContact O-N 3.42Å; V707-A710 PolarHBondContact O-N 3.12Å; V707-V711 HydrophobicContact CG1-CG2 4.4Å; V707-V711 WeakPolarHBondContact O-CG2 3.41Å; V707-V711 PolarHBondContact O-N 3.24Å
708	T	88.3	Confident	81.9	Confident	89 Å²	89	88 Å²	88	55%	0.546	52%	0.519	S	S	.	.	H	α-helix	trans	-63.8	-42.4	179.7	-43.8	0	0	0	0	111.5	I704 L705 V711 G712	I704-T708 PolarHBondContact O-N 3.43Å; I704-T708 PolarHBondContact O-OG1 3.47Å; L705-T708 PolarHBondContact O-N 3.2Å; T708-V711 PolarHBondContact O-N 3.48Å; T708-G712 PolarHBondContact O-N 2.77Å
709	I	92.1	Very high	84.1	Confident	101 Å²	101	89.4 Å²	89.4	52%	0.518	52%	0.516	S	S	.	.	H	α-helix	trans	-64.1	-42.5	175.2	-67.1	168.2	0	0	0	110.9	L705 V707 G712 C713	L705-I709 HydrophobicContact CD1-CD1 4.31Å; L705-I709 HydrophobicContact CG-CD1 4Å; L705-I709 WeakPolarHBondContact O-CG1 3.33Å; L705-I709 PolarHBondContact O-N 3.32Å; V707-I709 PolarHBondContact O-N 3.42Å; I709-G712 PolarHBondContact O-N 3.24Å; I709-C713 PolarHBondContact O-N 3.39Å; I709-C713 PolarHBondContact O-SG 3.42Å
710	A	90.7	Very high	86.2	Confident	59 Å²	59	91 Å²	91	49%	0.488	52%	0.521	S	S	.	.	H	α-helix	trans	-63.1	-43.5	178.9	0	0	0	0	0	112.4	S706 V707 C713 A714	S706-A710 WeakPolarHBondContact O-CB 3.49Å; S706-A710 PolarHBondContact O-N 2.85Å; V707-A710 PolarHBondContact O-N 3.12Å; A710-C713 PolarHBondContact O-N 2.99Å; A710-A714 WeakPolarHBondContact O-CB 3.48Å; A710-A714 PolarHBondContact O-N 3.02Å
711	V	94.5	Very high	88	Confident	81 Å²	81	91.9 Å²	91.9	49%	0.491	53%	0.525	S	S	.	.	H	α-helix	trans	-64.7	-42.5	176	174.7	0	0	0	0	110.9	V707 T708 C713 A714 L715	V707-V711 HydrophobicContact CG1-CG2 4.4Å; V707-V711 WeakPolarHBondContact O-CG2 3.41Å; V707-V711 PolarHBondContact O-N 3.24Å; T708-V711 PolarHBondContact O-N 3.48Å; V711-C713 PolarHBondContact O-N 2.67Å; V711-A714 PolarHBondContact O-N 3.4Å; V711-L715 HydrophobicContact CG1-CD1 4.11Å; V711-L715 WeakPolarHBondContact O-CG 3.41Å; V711-L715 PolarHBondContact O-N 3.46Å
712	G	93.9	Very high	89.4	Confident	41 Å²	41	86.9 Å²	86.9	42%	0.423	51%	0.514	S	S	.	.	H	α-helix	trans	-59.4	-45.4	175.4	0	0	0	0	0	113.1	T708 I709 L715 L716	T708-G712 PolarHBondContact O-N 2.77Å; I709-G712 PolarHBondContact O-N 3.24Å; G712-L715 PolarHBondContact O-N 2.79Å; G712-L716 PolarHBondContact O-N 3.03Å
713	C	92.9	Very high	90.2	Very high	67 Å²	67	91 Å²	91	45%	0.453	52%	0.523	S	S	.	.	H	α-helix	trans	-64.8	-39.7	176.1	-74	0	0	0	0	112.6	I709 A710 V711 L716 I717	I709-C713 PolarHBondContact O-N 3.39Å; I709-C713 PolarHBondContact O-SG 3.42Å; A710-C713 PolarHBondContact O-N 2.99Å; V711-C713 PolarHBondContact O-N 2.67Å; C713-L716 PolarHBondContact O-N 3.47Å; C713-I717 WeakPolarHBondContact O-CG1 3.41Å; C713-I717 PolarHBondContact O-N 3.47Å
714	A	93.2	Very high	90.9	Very high	60 Å²	60	90.6 Å²	90.6	50%	0.496	53%	0.526	S	S	.	.	H	α-helix	trans	-63.9	-42.4	177.7	0	0	0	0	0	112	A710 V711 I717 L718	A710-A714 WeakPolarHBondContact O-CB 3.48Å; A710-A714 PolarHBondContact O-N 3.02Å; V711-A714 PolarHBondContact O-N 3.4Å; A714-I717 PolarHBondContact O-N 3.33Å; A714-L718 WeakPolarHBondContact O-CB 3.34Å; A714-L718 PolarHBondContact O-N 3.43Å
715	L	94.4	Very high	91.5	Very high	96 Å²	96	87.4 Å²	87.4	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-66.7	-37.2	176.2	-70.2	172.8	0	0	0	112.3	V711 G712 L718 N719	V711-L715 HydrophobicContact CG1-CD1 4.11Å; V711-L715 WeakPolarHBondContact O-CG 3.41Å; V711-L715 PolarHBondContact O-N 3.46Å; G712-L715 PolarHBondContact O-N 2.79Å; L715-L718 PolarHBondContact O-N 3.02Å; L715-N719 WeakPolarHBondContact O-CB 3.46Å; L715-N719 PolarHBondContact O-N 3.04Å; L715-N719 PolarHBondContact O-ND2 3.49Å
716	L	94.2	Very high	91.7	Very high	114 Å²	114	86.8 Å²	86.8	60%	0.597	52%	0.516	S	S	*	.	H	α-helix	trans	-62.1	-46.6	174.4	-169.2	93	0	0	0	111.5	G712 C713 N719 L720	G712-L716 PolarHBondContact O-N 3.03Å; C713-L716 PolarHBondContact O-N 3.47Å; L716-N719 PolarHBondContact O-N 2.99Å; L716-L720 HydrophobicContact CD2-CD1 4.49Å; L716-L720 HydrophobicContact CG-CD1 4.49Å; L716-L720 PolarHBondContact O-N 3.45Å
717	I	94	Very high	91.9	Very high	98 Å²	98	91.1 Å²	91.1	50%	0.503	52%	0.523	S	S	.	.	H	α-helix	trans	-63.9	-42.5	178.1	-67.7	167.8	0	0	0	110.5	C713 A714 N719 L720 L721	C713-I717 WeakPolarHBondContact O-CG1 3.41Å; C713-I717 PolarHBondContact O-N 3.47Å; A714-I717 PolarHBondContact O-N 3.33Å; I717-N719 PolarHBondContact O-N 3.44Å; I717-L720 PolarHBondContact O-N 3.03Å; I717-L721 HydrophobicContact CG2-CD1 4.06Å; I717-L721 HydrophobicContact CG2-CG 4.4Å; I717-L721 WeakPolarHBondContact O-CG 3.34Å; I717-L721 PolarHBondContact O-N 2.95Å
718	L	94.3	Very high	91.7	Very high	102 Å²	102	95.7 Å²	95.7	53%	0.534	53%	0.53	S	S	.	.	H	α-helix	trans	-58.7	-47.8	176.4	-167.2	90.3	0	0	0	111.2	A714 L715 L720 L721 V722	A714-L718 WeakPolarHBondContact O-CB 3.34Å; A714-L718 PolarHBondContact O-N 3.43Å; L715-L718 PolarHBondContact O-N 3.02Å; L718-L720 PolarHBondContact O-N 3.04Å; L718-L721 PolarHBondContact O-N 3.49Å; L718-V722 WeakPolarHBondContact O-CG2 3.4Å; L718-V722 PolarHBondContact O-N 3.33Å
719	N	90.7	Very high	91.3	Very high	100 Å²	100	97.3 Å²	97.3	54%	0.535	53%	0.532	S	S	.	.	H	α-helix	trans	-63.7	-38	178.9	-77.5	-34.2	0	0	0	112.5	L715 L716 I717 V722 F723	L715-N719 WeakPolarHBondContact O-CB 3.46Å; L715-N719 PolarHBondContact O-N 3.04Å; L715-N719 PolarHBondContact O-ND2 3.49Å; L716-N719 PolarHBondContact O-N 2.99Å; I717-N719 PolarHBondContact O-N 3.44Å; N719-V722 PolarHBondContact O-N 3.43Å; N719-F723 PolarHBondContact O-N 3.04Å
720	L	94.1	Very high	90.8	Very high	112 Å²	112	101.6 Å²	101.6	59%	0.586	54%	0.541	S	S	*	.	H	α-helix	trans	-63.7	-40.9	173.4	-80.8	167.1	0	0	0	112.3	L716 I717 L718 F723 A724	L716-L720 HydrophobicContact CD2-CD1 4.49Å; L716-L720 HydrophobicContact CG-CD1 4.49Å; L716-L720 PolarHBondContact O-N 3.45Å; I717-L720 PolarHBondContact O-N 3.03Å; L718-L720 PolarHBondContact O-N 3.04Å; L720-F723 PolarHBondContact O-N 3.26Å; L720-A724 WeakPolarHBondContact O-CB 3.34Å; L720-A724 PolarHBondContact O-N 3.24Å
721	L	93.5	Very high	90.3	Very high	117 Å²	117	102.5 Å²	102.5	61%	0.613	54%	0.536	S	S	*	.	H	α-helix	trans	-67.8	-39.3	177.5	-70.2	174	0	0	0	112.2	I717 L718 A724 G725	I717-L721 HydrophobicContact CG2-CD1 4.06Å; I717-L721 HydrophobicContact CG2-CG 4.4Å; I717-L721 WeakPolarHBondContact O-CG 3.34Å; I717-L721 PolarHBondContact O-N 2.95Å; L718-L721 PolarHBondContact O-N 3.49Å; L721-A724 PolarHBondContact O-N 3.03Å; L721-G725 PolarHBondContact O-N 2.99Å
722	V	92.9	Very high	89.2	Confident	78 Å²	78	108.1 Å²	108.1	47%	0.473	55%	0.548	S	S	.	.	H	α-helix	trans	-63.2	-45.9	174.4	172.2	0	0	0	0	110.6	L718 N719 A724 G725 I726	L718-V722 WeakPolarHBondContact O-CG2 3.4Å; L718-V722 PolarHBondContact O-N 3.33Å; N719-V722 PolarHBondContact O-N 3.43Å; V722-A724 PolarHBondContact O-N 3.41Å; V722-G725 PolarHBondContact O-N 3.46Å; V722-I726 HydrophobicContact CG1-CD1 3.96Å; V722-I726 WeakPolarHBondContact O-CG1 3.34Å; V722-I726 PolarHBondContact O-N 3.4Å
723	F	91.3	Very high	87.8	Confident	158 Å²	158	113.3 Å²	113.3	69%	0.693	56%	0.561	S	S	*	*	H	α-helix	trans	-61.7	-43.6	176	-111.5	-81.9	0	0	0	112.4	N719 L720 G725 I726 Y727	N719-F723 PolarHBondContact O-N 3.04Å; L720-F723 PolarHBondContact O-N 3.26Å; F723-G725 VanDerWaalsContact C-N 3.3Å; F723-G725 PolarHBondContact O-N 3.03Å; F723-I726 PolarHBondContact O-N 2.95Å; F723-Y727 WeakPolarHBondContact O-CB 3.33Å; F723-Y727 PolarHBondContact O-N 2.99Å
724	A	90.5	Very high	86.2	Confident	56 Å²	56	120.5 Å²	120.5	46%	0.463	58%	0.579	S	S	.	*	H	α-helix	trans	-62.1	-38.6	175	0	0	0	0	0	111.7	L720 L721 V722 Y727 R728	L720-A724 WeakPolarHBondContact O-CB 3.34Å; L720-A724 PolarHBondContact O-N 3.24Å; L721-A724 PolarHBondContact O-N 3.03Å; V722-A724 PolarHBondContact O-N 3.41Å; A724-Y727 PolarHBondContact O-N 3.44Å; A724-R728 WeakPolarHBondContact O-CB 3.4Å; A724-R728 PolarHBondContact O-N 3.21Å
725	G	90.5	Very high	84.5	Confident	40 Å²	40	125.5 Å²	125.5	41%	0.412	59%	0.589	S	S	.	*	H	α-helix	trans	-61.3	-49.7	174.5	0	0	0	0	0	112.8	L721 V722 F723 Y727 R728 Q729	L721-G725 PolarHBondContact O-N 2.99Å; V722-G725 PolarHBondContact O-N 3.46Å; F723-G725 VanDerWaalsContact C-N 3.3Å; F723-G725 PolarHBondContact O-N 3.03Å; G725-Y727 VanDerWaalsContact C-N 3.34Å; G725-Y727 PolarHBondContact O-N 3.3Å; G725-R728 PolarHBondContact O-N 2.97Å; G725-Q729 WeakPolarHBondContact O-CB 3.45Å; G725-Q729 PolarHBondContact O-N 3.36Å
726	I	88.7	Confident	82.5	Confident	96 Å²	96	123.6 Å²	123.6	49%	0.492	59%	0.592	S	S	.	*	H	α-helix	trans	-63.3	-41.6	177.3	-65.6	169.2	0	0	0	110.7	V722 F723 R728 Q729 R730	V722-I726 HydrophobicContact CG1-CD1 3.96Å; V722-I726 WeakPolarHBondContact O-CG1 3.34Å; V722-I726 PolarHBondContact O-N 3.4Å; F723-I726 PolarHBondContact O-N 2.95Å; I726-R728 PolarHBondContact O-N 2.96Å; I726-Q729 PolarHBondContact O-N 3.29Å; I726-R730 WeakPolarHBondContact O-CB 3.41Å; I726-R730 PolarHBondContact O-N 2.94Å
727	Y	87.8	Confident	80	Confident	161 Å²	161	127.5 Å²	127.5	63%	0.631	61%	0.605	S	S	*	*	H	α-helix	trans	-61.1	-45.6	177.3	-170.8	-92	0	0	0	111.4	F723 A724 G725 Q729 R730 E731	F723-Y727 WeakPolarHBondContact O-CB 3.33Å; F723-Y727 PolarHBondContact O-N 2.99Å; A724-Y727 PolarHBondContact O-N 3.44Å; G725-Y727 VanDerWaalsContact C-N 3.34Å; G725-Y727 PolarHBondContact O-N 3.3Å; Y727-Q729 VanDerWaalsContact C-N 3.34Å; Y727-Q729 PolarHBondContact O-N 3.01Å; Y727-R730 PolarHBondContact O-N 3.47Å; Y727-E731 PolarHBondContact O-N 3.36Å
728	R	82.7	Confident	77.4	Confident	183 Å²	183	129 Å²	129	69%	0.691	62%	0.621	S	S	*	*	H	α-helix	trans	-67.3	-33.7	178.6	-139.6	176.5	-174.4	175.6	1.6	112.4	A724 G725 I726 R732	A724-R728 WeakPolarHBondContact O-CB 3.4Å; A724-R728 PolarHBondContact O-N 3.21Å; G725-R728 PolarHBondContact O-N 2.97Å; I726-R728 PolarHBondContact O-N 2.96Å; R728-R732 PolarHBondContact O-N 3.32Å; R728-R732 VanDerWaalsContact O-N 3.1Å
729	Q	80.9	Confident	74.4	Confident	124 Å²	124	132.9 Å²	132.9	58%	0.579	64%	0.636	S	S	*	*	H	α-helix	trans	-69.6	-41.3	174.3	-169.3	176.9	5.7	0	0	111.8	G725 I726 Y727 E731 R732 H733	G725-Q729 WeakPolarHBondContact O-CB 3.45Å; G725-Q729 PolarHBondContact O-N 3.36Å; I726-Q729 PolarHBondContact O-N 3.29Å; Y727-Q729 VanDerWaalsContact C-N 3.34Å; Y727-Q729 PolarHBondContact O-N 3.01Å; Q729-E731 VanDerWaalsContact C-N 3.33Å; Q729-E731 PolarHBondContact O-N 2.97Å; Q729-R732 PolarHBondContact O-N 3.02Å; Q729-H733 PolarHBondContact O-N 3.46Å
730	R	81.6	Confident	71.9	Confident	190 Å²	190	137.4 Å²	137.4	72%	0.717	65%	0.654	S	S	*	*	H	α-helix	trans	-64.8	-37.5	175.6	-167.9	176	-175.1	176.5	1.8	111.7	I726 Y727 H733 R734	I726-R730 WeakPolarHBondContact O-CB 3.41Å; I726-R730 PolarHBondContact O-N 2.94Å; Y727-R730 PolarHBondContact O-N 3.47Å; R730-H733 PolarHBondContact O-N 3.19Å; R730-R734 PolarHBondContact O-N 2.91Å; R730-R734 VanDerWaalsContact O-N 3.09Å
731	E	79.7	Confident	69	Low	78 Å²	78	138.4 Å²	138.4	36%	0.364	66%	0.66	S	S	.	*	H	α-helix	trans	-70.8	-37.5	177.3	-153.7	-174	156.7	0	0	112.5	Y727 Q729 H733 R734 K735	Y727-E731 PolarHBondContact O-N 3.36Å; Q729-E731 VanDerWaalsContact C-N 3.33Å; Q729-E731 PolarHBondContact O-N 2.97Å; E731-H733 VanDerWaalsContact C-N 3.35Å; E731-R734 PolarHBondContact O-N 3.41Å; E731-R734 VanDerWaalsContact O-N 3.14Å; E731-K735 PolarHBondContact O-N 3.48Å; E731-K735 VanDerWaalsContact O-N 3.11Å; E731-K735 IonicContact OE1-NZ 2.73Å; E731-K735 PolarHBondContact OE1-NZ 3.46Å
732	R	72.5	Confident	66.2	Low	200 Å²	200	138.3 Å²	138.3	76%	0.755	67%	0.669	S	S	*	*	H	α-helix	trans	-63.2	-38.2	171.3	-79.8	-173.1	174.9	-171.8	-0.8	112.5	R728 Q729 R734 K735	R728-R732 PolarHBondContact O-N 3.32Å; R728-R732 VanDerWaalsContact O-N 3.1Å; Q729-R732 PolarHBondContact O-N 3.02Å; R732-R734 VanDerWaalsContact C-N 3.27Å; R732-R734 PolarHBondContact O-N 2.96Å; R732-K735 PolarHBondContact O-N 3.49Å
733	H	63.6	Low	63.4	Low	150 Å²	150	139.6 Å²	139.6	69%	0.694	69%	0.688	S	S	*	*	H	α-helix	trans	-69	-23.7	173.3	-97.4	-79.8	0	0	0	113.7	Q729 R730 E731	Q729-H733 PolarHBondContact O-N 3.46Å; R730-H733 PolarHBondContact O-N 3.19Å; E731-H733 VanDerWaalsContact C-N 3.35Å
734	R	59.7	Low	60.6	Low	218 Å²	218	135.9 Å²	135.9	82%	0.823	69%	0.694	S	S	*	*	H	α-helix	trans	-84.3	-23.1	178.1	-129.7	176.2	173.4	-177.7	-3.6	113.5	R730 E731 R732	R730-R734 PolarHBondContact O-N 2.91Å; R730-R734 VanDerWaalsContact O-N 3.09Å; E731-R734 PolarHBondContact O-N 3.41Å; E731-R734 VanDerWaalsContact O-N 3.14Å; R732-R734 VanDerWaalsContact C-N 3.27Å; R732-R734 PolarHBondContact O-N 2.96Å
735	K	56.3	Low	58	Low	165 Å²	165	141.3 Å²	141.3	72%	0.717	71%	0.714	S	S	*	*	S	Bend	trans	-94.5	8.2	179.4	-75.4	174.2	171.2	163.9	0	114.3	E731 R732	E731-K735 PolarHBondContact O-N 3.48Å; E731-K735 VanDerWaalsContact O-N 3.11Å; E731-K735 IonicContact OE1-NZ 2.73Å; E731-K735 PolarHBondContact OE1-NZ 3.46Å; R732-K735 PolarHBondContact O-N 3.49Å
736	G	52.8	Low	55.2	Low	55 Å²	55	146.4 Å²	146.4	57%	0.567	73%	0.732	S	S	*	*	S	Bend	trans	-117	15.2	-171.1	0	0	0	0	0	117.7
737	K	41.4	Very low	52.7	Low	197 Å²	197	149 Å²	149	86%	0.857	75%	0.746	S	S	*	*			trans	-120.3	108.8	174.5	-80.9	-171.6	174.8	-175.6	0	111.7
738	P	39.4	Very low	50.1	Low	130 Å²	130	149.1 Å²	149.1	84%	0.844	75%	0.752	S	S	*	*			trans	-69.4	141.6	167.5	-11	27.1	0	0	0	110.6
739	Q	31.8	Very low	47.9	Very low	183 Å²	183	149.6 Å²	149.6	86%	0.855	76%	0.762	S	S	*	*			trans	-90.1	118.3	-178.1	-170.2	176	4.1	0	0	108.2
740	E	37.5	Very low	45.7	Very low	194 Å²	194	149.4 Å²	149.4	91%	0.907	77%	0.77	S	S	*	*			trans	-136.4	138.7	170.7	-138.8	173.8	-164.5	0	0	110.8
741	N	33.6	Very low	43.4	Very low	134 Å²	134	145.4 Å²	145.4	72%	0.717	77%	0.771	S	S	*	*			trans	-95.5	163.7	-158.3	-66.1	-46.2	0	0	0	113.7
742	S	35.4	Very low	41.5	Very low	115 Å²	115	145.7 Å²	145.7	80%	0.804	78%	0.779	S	S	*	*			trans	86.1	114.5	141.3	-56.4	0	0	0	0	121.7
743	A	33.6	Very low	39.9	Very low	105 Å²	105	146.9 Å²	146.9	87%	0.868	79%	0.785	S	S	*	*				78.9	125.3	129.9	0	0	0	0	0	122.5
744	G	33.9	Very low	38.2	Very low	80 Å²	80	147.2 Å²	147.2	83%	0.825	79%	0.792	S	S	*	*			trans	81.6	140.3	160.5	0	0	0	0	0	114.4
745	L	34.8	Very low	36.9	Very low	169 Å²	169	145.4 Å²	145.4	89%	0.885	80%	0.795	S	S	*	*			cis	-165	155.6	15.7	-170.8	75.4	0	0	0	107.8
746	L	32.7	Very low	35.7	Very low	148 Å²	148	143.8 Å²	143.8	78%	0.775	80%	0.799	S	S	*	*			trans	-40	142.2	177.3	-66.8	153	0	0	0	117.4
747	L	35.9	Very low	34.8	Very low	151 Å²	151	145.8 Å²	145.8	79%	0.791	81%	0.811	S	S	*	*				-179.7	109.3	106.4	-90.8	168.9	0	0	0	111.9
748	Q	31.7	Very low	34.2	Very low	163 Å²	163	142.5 Å²	142.5	76%	0.762	81%	0.807	S	S	*	*				40.9	109.4	126.9	-160.2	163	-3.7	0	0	120.2
749	E	37	Very low	33.9	Very low	193 Å²	193	147.1 Å²	147.1	90%	0.902	81%	0.81	S	S	*	*				-159.2	138.9	117.4	-112.3	175.8	-179	0	0	111.7
750	T	34	Very low	33.9	Very low	120 Å²	120	142 Å²	142	74%	0.736	81%	0.806	S	S	*	*			trans	-86.1	135.8	-164	42.3	0	0	0	0	113
751	S	34.1	Very low	33.6	Very low	105 Å²	105	136.1 Å²	136.1	73%	0.734	80%	0.797	S	S	*	*				93.7	161.3	69.2	-158.2	0	0	0	0	112.7
752	P	40.5	Very low	33.6	Very low	84 Å²	84	138.3 Å²	138.3	55%	0.545	81%	0.808	S	S	.	*			cis	-143.2	-175.3	-48.4	39.6	-23	0	0	0	113.1
753	Y	38.9	Very low	33.4	Very low	225 Å²	225	140 Å²	140	88%	0.882	81%	0.806	S	S	*	*				177.5	109.9	114.3	-94.8	-69.8	0	0	0	111.7
754	D	27.9	Very low	33.6	Very low	157 Å²	157	140.5 Å²	140.5	84%	0.84	80%	0.801	S	S	*	*			trans	-148.7	120.3	153.5	-149.9	1.6	0	0	0	105.4
755	M	32.7	Very low	33.4	Very low	181 Å²	181	142 Å²	142	89%	0.892	80%	0.798	S	S	*	*			trans	-175.9	123.6	155.6	-111	-168.2	-70.1	0	0	113.4
756	T	30.1	Very low	33.4	Very low	130 Å²	130	137.8 Å²	137.8	80%	0.798	80%	0.797	S	S	*	*			trans	-52.4	144.9	156.7	47.3	0	0	0	0	114
757	A	34.8	Very low	33.3	Very low	98 Å²	98	136.9 Å²	136.9	81%	0.81	80%	0.802	S	S	*	*			trans	-156.2	113.5	152.8	0	0	0	0	0	112.7
758	T	28.7	Very low	33.2	Very low	128 Å²	128	133.4 Å²	133.4	79%	0.785	80%	0.803	S	S	*	*			trans	-56.7	142.6	151.4	-36.1	0	0	0	0	110.2
759	Y	33.4	Very low	33.1	Very low	227 Å²	227	134.4 Å²	134.4	89%	0.89	81%	0.808	S	S	*	*			trans	174.4	132.9	132.1	-110	-86.8	0	0	0	110.9
760	G	30.7	Very low	32.9	Very low	76 Å²	76	136.7 Å²	136.7	78%	0.784	81%	0.81	S	S	*	*			trans	-80.1	166	173.6	0	0	0	0	0	113.4
761	G	31.2	Very low	32.7	Very low	70 Å²	70	136.7 Å²	136.7	72%	0.722	81%	0.814	S	S	*	*			trans	167.4	96.4	170.5	0	0	0	0	0	115.2
762	L	32.8	Very low	32.7	Very low	179 Å²	179	134.7 Å²	134.7	94%	0.937	81%	0.811	S	S	*	*			trans	77.9	121.9	137.8	-63.7	158.5	0	0	0	121.2
763	I	31.9	Very low	32.5	Very low	150 Å²	150	137 Å²	137	77%	0.769	83%	0.829	S	S	*	*			trans	-71.9	160.5	166.1	-36.8	175.8	0	0	0	109.5
764	P	37.2	Very low	32.1	Very low	116 Å²	116	129.4 Å²	129.4	75%	0.753	82%	0.819	S	S	*	*				-143.7	134.9	89.6	28.6	-7.8	0	0	0	116
765	S	30.3	Very low	32.4	Very low	111 Å²	111	131.1 Å²	131.1	78%	0.776	82%	0.824	S	S	*	*			trans	12.6	126.3	138.6	50.6	0	0	0	0	120.5
766	G	34.9	Very low	32.4	Very low	82 Å²	82	128.4 Å²	128.4	85%	0.845	82%	0.818	S	S	*	*			trans	-147.6	100.5	157.1	0	0	0	0	0	110.2
767	S	30.7	Very low	32.6	Very low	128 Å²	128	129.6 Å²	129.6	90%	0.895	82%	0.819	S	S	*	*			trans	-71.6	141.6	-179.8	48.1	0	0	0	0	113.4
768	G	33.7	Very low	32.9	Very low	78 Å²	78	130.4 Å²	130.4	80%	0.804	82%	0.816	S	S	*	*			trans	-159.6	92.8	166.1	0	0	0	0	0	110.9
769	Q	29.2	Very low	33.1	Very low	184 Å²	184	130 Å²	130	86%	0.86	82%	0.815	S	S	*	*			trans	-66.1	139.1	173.3	-71.2	166.9	-48.3	0	0	111.2
770	Y	33.9	Very low	33.2	Very low	242 Å²	242	123.7 Å²	123.7	95%	0.949	81%	0.81	S	S	*	*			trans	-148.7	123.7	138.2	-100.5	-77.8	0	0	0	109.9
771	S	29.9	Very low	33.4	Very low	119 Å²	119	125.5 Å²	125.5	83%	0.832	81%	0.811	S	S	*	*			trans	-91.1	154.4	-179.3	65	0	0	0	0	112.5
772	G	34	Very low	33.4	Very low	64 Å²	64	127.8 Å²	127.8	66%	0.66	81%	0.813	S	S	*	*			trans	160.8	86.1	160.5	0	0	0	0	0	109.3
773	S	35.4	Very low	33.5	Very low	131 Å²	131	126.1 Å²	126.1	92%	0.916	81%	0.81	S	S	*	*				54.9	117.4	96.1	-58.4	0	0	0	0	111.7
774	G	30.3	Very low	33.4	Very low	66 Å²	66	124.8 Å²	124.8	68%	0.68	81%	0.809	S	S	*	*			cis	152.2	134.8	11.7	0	0	0	0	0	106.3
775	M	35.7	Very low	33.1	Very low	193 Å²	193	125.8 Å²	125.8	95%	0.951	81%	0.813	S	S	*	*			trans	-171.6	144.3	150.3	-107.1	-178.3	-83.6	0	0	110.2
776	T	31.9	Very low	33	Very low	124 Å²	124	125.8 Å²	125.8	76%	0.761	81%	0.813	S	S	*	*			trans	-125.2	153.3	-146.1	23.9	0	0	0	0	112.5
777	L	34.1	Very low	32.8	Very low	156 Å²	156	129 Å²	129	82%	0.817	82%	0.816	S	S	*	*			trans	88.6	153.8	151.4	-68.3	153.8	0	0	0	119.8
778	P	41.8	Very low	32.8	Very low	115 Å²	115	133.1 Å²	133.1	75%	0.747	81%	0.812	S	S	*	*			cis	-131.6	176.2	-9	24	0.5	0	0	0	115.6
779	P	32.9	Very low	32.5	Very low	119 Å²	119	137 Å²	137	77%	0.773	81%	0.814	S	S	*	*			trans	-102.9	160.1	-169.5	38.8	-30.4	0	0	0	114.6
780	A	35.6	Very low	32.5	Very low	94 Å²	94	131.8 Å²	131.8	78%	0.777	81%	0.81	S	S	*	*			trans	-149.8	98.2	159.9	0	0	0	0	0	109.1
781	S	34.4	Very low	32.3	Very low	115 Å²	115	128 Å²	128	80%	0.804	80%	0.8	S	S	*	*				94.8	109.6	97.4	-67.7	0	0	0	0	112.7
782	P	31.8	Very low	32.2	Very low	117 Å²	117	127.2 Å²	127.2	76%	0.76	80%	0.801	S	S	*	*			trans	-94.4	142.7	173.9	35.2	-27.5	0	0	0	110.9
783	V	34.6	Very low	31.9	Very low	145 Å²	145	132.8 Å²	132.8	88%	0.879	80%	0.804	S	S	*	*			trans	-109	107.1	159.6	177.4	0	0	0	0	107.6
784	T	28.4	Very low	31.6	Very low	122 Å²	122	132.3 Å²	132.3	75%	0.748	80%	0.797	S	S	*	*			trans	-77.3	129.3	167.7	29.4	0	0	0	0	110
785	T	31.9	Very low	31.6	Very low	136 Å²	136	139.6 Å²	139.6	83%	0.834	81%	0.806	S	S	*	*			trans	-133	116.6	143.9	40.6	0	0	0	0	108.4
786	S	27.3	Very low	31.2	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	80%	0.8	S	S	*	*			trans	-65	132.3	176.4	54.6	0	0	0	0	112.1
787	V	31.8	Very low	30.9	Very low	149 Å²	149	141.6 Å²	141.6	90%	0.903	81%	0.806	S	S	*	*			trans	-131.8	123.5	147	179.7	0	0	0	0	107.4
788	R	30.9	Very low	30.6	Very low	216 Å²	216	141.5 Å²	141.5	82%	0.815	81%	0.806	S	S	*	*			trans	-70.2	145	-178.2	-77.7	173.4	168.1	172.2	-5.3	111.7
789	D	27.4	Very low	29.9	Very low	158 Å²	158	143.9 Å²	143.9	85%	0.845	81%	0.807	S	S	*	*			trans	38.3	111.4	139.1	-52.9	-35.5	0	0	0	118.4
790	G	29.4	Very low	29.7	Very low	75 Å²	75	147.2 Å²	147.2	77%	0.773	81%	0.812	S	S	*	*			trans	-168.7	80.8	170.6	0	0	0	0	0	112.1
791	E	29.6	Very low	29.2	Very low	162 Å²	162	153.1 Å²	153.1	76%	0.757	81%	0.814	S	S	*	*			trans	39.6	111.8	150.5	-63.3	-176.4	151.2	0	0	120.1	Y793	E791-Y793 PolarHBondContact O-N 2.97Å
792	A	26.4	Very low	28.9	Very low	103 Å²	103	152.5 Å²	152.5	85%	0.851	81%	0.81	S	S	*	*			trans	-66.4	115.7	164	0	0	0	0	0	111.1
793	Y	29.1	Very low	28.6	Very low	182 Å²	182	152 Å²	152	71%	0.714	81%	0.809	S	S	*	*			trans	-96.1	124.4	163.3	-84.4	-84	0	0	0	110.4	E791 Y795	E791-Y793 PolarHBondContact O-N 2.97Å; Y793-Y795 PolarHBondContact O-N 3.46Å
794	P	28.4	Very low	28.4	Very low	120 Å²	120	152 Å²	152	78%	0.779	81%	0.809	S	S	*	*			trans	-80.2	109.3	171.3	31.3	-27.2	0	0	0	108.2	M796	P794-M796 PolarHBondContact O-N 3.31Å
795	Y	29.8	Very low	28.4	Very low	220 Å²	220	149.8 Å²	149.8	86%	0.863	80%	0.804	S	S	*	*			trans	-83	114.5	168.4	-105.4	-87.8	0	0	0	110.1	Y793	Y793-Y795 PolarHBondContact O-N 3.46Å
796	M	27.4	Very low	28.2	Very low	168 Å²	168	150.8 Å²	150.8	83%	0.828	80%	0.804	S	S	*	*			trans	-53.8	140.2	172.5	-76.8	-163.1	-73.8	0	0	111.7	P794 L798	P794-M796 PolarHBondContact O-N 3.31Å; M796-L798 PolarHBondContact O-N 3.48Å
797	Q	26.2	Very low	28.2	Very low	191 Å²	191	149.3 Å²	149.3	89%	0.893	80%	0.798	S	S	*	*			trans	-51.5	105.9	158.4	-75.3	175.7	-20.1	0	0	109.5	Q799	Q797-Q799 PolarHBondContact O-N 2.89Å
798	L	27.9	Very low	28	Very low	154 Å²	154	153.8 Å²	153.8	81%	0.806	80%	0.801	S	S	*	*			trans	-79.1	97.7	163.1	-92.3	157.2	0	0	0	107.8	M796 Q800	M796-L798 PolarHBondContact O-N 3.48Å; L798-Q800 VanDerWaalsContact C-N 3.35Å; L798-Q800 PolarHBondContact O-N 3.38Å
799	Q	27.2	Very low	27.8	Very low	165 Å²	165	148.3 Å²	148.3	77%	0.771	80%	0.801	S	S	*	*			trans	-52.2	103.6	150.3	-79.7	178.4	-22.2	0	0	107.7	Q797 R801	Q797-Q799 PolarHBondContact O-N 2.89Å; Q799-R801 PolarHBondContact O-N 3.46Å
800	Q	28.2	Very low	27.8	Very low	189 Å²	189	144.1 Å²	144.1	88%	0.883	80%	0.796	S	S	*	*			trans	-67.5	86.3	159.6	-85.1	-177.4	-20.7	0	0	108	L798 S802	L798-Q800 VanDerWaalsContact C-N 3.35Å; L798-Q800 PolarHBondContact O-N 3.38Å; Q800-S802 VanDerWaalsContact C-N 3.34Å; Q800-S802 PolarHBondContact O-N 2.89Å
801	R	24.3	Very low	27.7	Very low	217 Å²	217	146.8 Å²	146.8	82%	0.819	80%	0.802	S	S	*	*			trans	-70.8	98.8	146.7	-88.7	-177.2	171.4	179.3	-1.2	106.2	Q799 S803	Q799-R801 PolarHBondContact O-N 3.46Å; R801-S803 PolarHBondContact O-N 3.44Å
802	S	28.7	Very low	27.6	Very low	102 Å²	102	142.3 Å²	142.3	71%	0.713	80%	0.8	S	S	*	*			trans	-69.3	75.9	164.8	60.3	0	0	0	0	109.3	Q800 V804	Q800-S802 VanDerWaalsContact C-N 3.34Å; Q800-S802 PolarHBondContact O-N 2.89Å; S802-V804 PolarHBondContact O-N 3.38Å
803	S	26.5	Very low	27.6	Very low	106 Å²	106	143.3 Å²	143.3	74%	0.741	80%	0.801	S	S	*	*			trans	-91.6	53.9	159.4	65.6	0	0	0	0	109.5	R801	R801-S803 PolarHBondContact O-N 3.44Å
804	V	29.5	Very low	27.6	Very low	145 Å²	145	143.1 Å²	143.1	88%	0.879	81%	0.806	S	S	*	*			trans	-145	51.4	159	-163.9	0	0	0	0	107.6	S802	S802-V804 PolarHBondContact O-N 3.38Å
805	A	28.6	Very low	27.4	Very low	77 Å²	77	146.5 Å²	146.5	64%	0.636	81%	0.812	S	S	*	*			trans	-125.3	61.8	164.7	0	0	0	0	0	106.7
806	N	27	Very low	27.3	Very low	157 Å²	157	144.8 Å²	144.8	84%	0.84	81%	0.814	S	S	*	*			trans	-157.2	67	175.1	-93.2	-23.4	0	0	0	108.3
807	A	28	Very low	27.3	Very low	79 Å²	79	144.2 Å²	144.2	65%	0.653	81%	0.813	S	S	*	*	S	Bend	trans	-155.2	19.7	165.8	0	0	0	0	0	113.7
808	Y	27.8	Very low	27.4	Very low	243 Å²	243	141 Å²	141	95%	0.953	81%	0.806	S	S	*	*	S	Bend	trans	-150.2	56.2	166	-74.6	-74	0	0	0	110.1
809	A	27.2	Very low	27.6	Very low	101 Å²	101	138.8 Å²	138.8	84%	0.835	80%	0.801	S	S	*	*			trans	-146	87.3	166.2	0	0	0	0	0	106.8
810	G	27.6	Very low	27.7	Very low	70 Å²	70	136 Å²	136	72%	0.722	80%	0.797	S	S	*	*	S	Bend	trans	176.4	98.8	-178.8	0	0	0	0	0	112.2
811	S	26.3	Very low	27.7	Very low	131 Å²	131	136.6 Å²	136.6	92%	0.916	80%	0.799	S	S	*	*			trans	57.5	98.1	142.3	162.6	0	0	0	0	116.8
812	G	27.4	Very low	28.1	Very low	68 Å²	68	134.8 Å²	134.8	70%	0.701	80%	0.8	S	S	*	*			trans	-171.8	68.5	169.4	0	0	0	0	0	112.7	Q814	G812-Q814 VanDerWaalsContact C-N 3.32Å; G812-Q814 PolarHBondContact O-N 3.49Å
813	S	26.4	Very low	28	Very low	124 Å²	124	137.6 Å²	137.6	87%	0.867	81%	0.807	S	S	*	*			trans	-56.8	94.2	159.2	48.7	0	0	0	0	109.5
814	Q	29	Very low	28.2	Very low	179 Å²	179	137 Å²	137	84%	0.836	81%	0.809	S	S	*	*			trans	-137.2	120.7	164.1	-89	-174.8	-17.9	0	0	109.6	G812 M816	G812-Q814 VanDerWaalsContact C-N 3.32Å; G812-Q814 PolarHBondContact O-N 3.49Å; Q814-M816 PolarHBondContact O-N 3.04Å
815	Q	25.3	Very low	28.1	Very low	191 Å²	191	136.1 Å²	136.1	89%	0.893	80%	0.804	S	S	*	*			trans	-47.1	120.9	173.3	-66.9	162.1	-39.9	0	0	109.9
816	M	26.3	Very low	28.2	Very low	183 Å²	183	142.6 Å²	142.6	90%	0.901	82%	0.818	S	S	*	*			trans	-108.8	113.5	161.6	-141.5	-178.6	-59.7	0	0	107.7	Q814 V818	Q814-M816 PolarHBondContact O-N 3.04Å; M816-V818 PolarHBondContact O-N 3.31Å
817	I	27.3	Very low	28.1	Very low	157 Å²	157	138.4 Å²	138.4	81%	0.805	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-60.5	121.2	-175.7	-67.6	161.4	0	0	0	108.6
818	V	28.1	Very low	28.2	Very low	124 Å²	124	142.8 Å²	142.8	75%	0.752	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-62.8	122.1	164.8	176.9	0	0	0	0	107.2	M816	M816-V818 PolarHBondContact O-N 3.31Å
819	P	33	Very low	28.2	Very low	107 Å²	107	135.4 Å²	135.4	70%	0.695	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-71.2	135.6	165.2	29.2	-26.7	0	0	0	107.9
820	P	29	Very low	28.3	Very low	107 Å²	107	139.6 Å²	139.6	70%	0.695	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-68.3	145.2	-173.8	29.4	-32.5	0	0	0	110.6	E822	P820-E822 PolarHBondContact O-N 2.86Å
821	E	28.5	Very low	28.3	Very low	200 Å²	200	145.2 Å²	145.2	94%	0.935	82%	0.824	S	S	*	*			trans	-51.7	114.8	159.6	-72.5	174.1	143.4	0	0	108.6
822	E	32.7	Very low	28.5	Very low	180 Å²	180	147.9 Å²	147.9	84%	0.841	82%	0.822	S	S	*	*			trans	-114.6	112.4	160.7	-85.2	-169.3	162.7	0	0	108.9	P820 A824	P820-E822 PolarHBondContact O-N 2.86Å; E822-A824 PolarHBondContact O-N 2.95Å
823	D	26.8	Very low	28.4	Very low	160 Å²	160	152.8 Å²	152.8	86%	0.856	83%	0.827	S	S	*	*			trans	-47.6	114.2	164.3	-74.6	-50.3	0	0	0	111.1
824	A	31.2	Very low	28.6	Very low	95 Å²	95	152.9 Å²	152.9	79%	0.785	82%	0.824	S	S	*	*			trans	-123.9	83.6	158.2	0	0	0	0	0	108.6	E822 F826	E822-A824 PolarHBondContact O-N 2.95Å; A824-F826 PolarHBondContact O-N 3.1Å
825	T	26.7	Very low	28.6	Very low	126 Å²	126	152.6 Å²	152.6	77%	0.773	82%	0.823	S	S	*	*			trans	-54.3	109.3	160.6	25.9	0	0	0	0	109.8
826	F	30.1	Very low	28.6	Very low	212 Å²	212	148.6 Å²	148.6	93%	0.93	82%	0.822	S	S	*	*			trans	-133.8	97.7	149.2	-105.7	-84.4	0	0	0	108.5	A824	A824-F826 PolarHBondContact O-N 3.1Å
827	G	25.8	Very low	28.7	Very low	70 Å²	70	147.3 Å²	147.3	72%	0.722	82%	0.818	S	S	*	*			trans	-70.6	134.9	175	0	0	0	0	0	111.3
828	I	30.7	Very low	28.8	Very low	170 Å²	170	143.5 Å²	143.5	87%	0.872	81%	0.805	S	S	*	*			trans	-128.3	116.5	138.5	-63.2	-176.9	0	0	0	106.1
829	A	26.5	Very low	29	Very low	88 Å²	88	142.9 Å²	142.9	73%	0.727	80%	0.804	S	S	*	*			trans	-63.6	135.9	-178.8	0	0	0	0	0	111.9
830	M	30.2	Very low	29.1	Very low	190 Å²	190	143.2 Å²	143.2	94%	0.936	80%	0.803	S	S	*	*				-160.4	85.6	128	-83.2	-131.4	162.8	0	0	108.5	Q832	M830-Q832 PolarHBondContact O-N 3.11Å
831	H	27.9	Very low	29.2	Very low	187 Å²	187	142.9 Å²	142.9	87%	0.866	80%	0.802	S	S	*	*			trans	-70.3	117.4	157.3	-107.6	-41.9	0	0	0	108
832	Q	29.8	Very low	29.5	Very low	187 Å²	187	139.1 Å²	139.1	87%	0.874	80%	0.795	S	S	*	*			trans	-149.6	104.1	146.1	-105.8	172.9	11.4	0	0	107.5	M830	M830-Q832 PolarHBondContact O-N 3.11Å
833	Q	25.7	Very low	29.6	Very low	172 Å²	172	138.9 Å²	138.9	80%	0.804	79%	0.787	S	S	*	*			trans	-55.7	126.5	163.2	-74	171	-45.1	0	0	108.3	Q835	Q833-Q835 PolarHBondContact O-N 3.14Å
834	P	30.5	Very low	30	Very low	125 Å²	125	139.8 Å²	139.8	81%	0.812	79%	0.785	S	S	*	*			trans	-74.6	112.5	158.6	12	2.5	0	0	0	106.6	A836	P834-A836 PolarHBondContact O-N 3.09Å
835	Q	27.8	Very low	30.1	Very low	174 Å²	174	139 Å²	139	81%	0.813	79%	0.786	S	S	*	*			trans	-47.9	131.5	162.5	-72	179.8	-19.3	0	0	108.7	Q833 I837	Q833-Q835 PolarHBondContact O-N 3.14Å; Q835-I837 PolarHBondContact O-N 3.41Å
836	A	26.9	Very low	30.2	Very low	106 Å²	106	142.7 Å²	142.7	88%	0.876	79%	0.792	S	S	*	*			trans	-57.8	98.2	176.7	0	0	0	0	0	110.3	P834	P834-A836 PolarHBondContact O-N 3.09Å
837	I	28.7	Very low	30.3	Very low	157 Å²	157	140.6 Å²	140.6	81%	0.805	79%	0.789	S	S	*	*			trans	-92.4	100.9	166.6	-60.2	174.7	0	0	0	106.4	Q835	Q835-I837 PolarHBondContact O-N 3.41Å
838	S	27.7	Very low	30.6	Very low	77 Å²	77	141.6 Å²	141.6	54%	0.538	79%	0.791	S	S	.	*			trans	-56.9	129.6	170.3	-176.6	0	0	0	0	110.8	V840	S838-V840 PolarHBondContact O-N 3.46Å; S838-V840 WeakPolarHBondContact OG-CG2 3.47Å
839	P	33.2	Very low	30.5	Very low	111 Å²	111	138.1 Å²	138.1	72%	0.721	79%	0.788	S	S	*	*			trans	-82	72.8	163.3	33.2	-28.2	0	0	0	108.3	C841	P839-C841 PolarHBondContact O-N 3.43Å
840	V	34	Very low	30.6	Very low	113 Å²	113	138.8 Å²	138.8	69%	0.685	79%	0.793	S	S	*	*			trans	-74.7	109.5	161.5	-176.9	0	0	0	0	107.2	S838 P842	S838-V840 PolarHBondContact O-N 3.46Å; S838-V840 WeakPolarHBondContact OG-CG2 3.47Å; V840-P842 WeakPolarHBondContact O-CD 3.38Å
841	C	31.5	Very low	30.8	Very low	101 Å²	101	134.7 Å²	134.7	68%	0.682	79%	0.789	S	S	*	*			trans	-61.2	115.7	167.5	-157.8	0	0	0	0	108.9	P839 R843	P839-C841 PolarHBondContact O-N 3.43Å; C841-R843 PolarHBondContact O-N 2.73Å
842	P	34.5	Very low	31	Very low	121 Å²	121	130.3 Å²	130.3	79%	0.786	79%	0.786	S	S	*	*			trans	-76.1	101.3	-178.8	28.2	-28.7	0	0	0	109.4	V840	V840-P842 WeakPolarHBondContact O-CD 3.38Å
843	R	35.1	Very low	31.2	Very low	175 Å²	175	126.1 Å²	126.1	66%	0.66	78%	0.777	S	S	*	*			trans	-70.7	127.6	161.4	-79.8	-174.8	172.8	-176.3	0.3	109.2	C841	C841-R843 PolarHBondContact O-N 2.73Å
844	H	35.9	Very low	31.7	Very low	179 Å²	179	126.5 Å²	126.5	83%	0.829	78%	0.778	S	S	*	*			trans	93.6	127.8	162.7	-47.2	107.1	0	0	0	117.6
845	G	32.2	Very low	32	Very low	78 Å²	78	125 Å²	125	80%	0.804	78%	0.776	S	S	*	*			trans	136.8	91.7	148.7	0	0	0	0	0	115.2
846	K	29.7	Very low	32.4	Very low	203 Å²	203	122 Å²	122	88%	0.883	77%	0.772	S	S	*	*			trans	-56.2	138.6	161.2	-65.4	170.5	171.8	178.1	0	110.4
847	L	32.7	Very low	32.7	Very low	169 Å²	169	126.5 Å²	126.5	89%	0.885	77%	0.772	S	S	*	*				149.3	132.5	128.9	-82.8	153.4	0	0	0	113.3
848	A	30.9	Very low	33.1	Very low	91 Å²	91	125.7 Å²	125.7	75%	0.752	78%	0.775	S	S	*	*			trans	65.9	108.5	155.3	0	0	0	0	0	117.7
849	A	29	Very low	33.4	Very low	97 Å²	97	131 Å²	131	80%	0.802	79%	0.791	S	S	*	*				66.4	109.5	62.9	0	0	0	0	0	114.8
850	A	29.6	Very low	33.6	Very low	101 Å²	101	133.3 Å²	133.3	84%	0.835	80%	0.797	S	S	*	*			trans	75.8	138.9	144.1	0	0	0	0	0	121
851	A	32.9	Very low	33.8	Very low	105 Å²	105	136.2 Å²	136.2	87%	0.868	80%	0.802	S	S	*	*			trans	77	136.2	162.1	0	0	0	0	0	116.1
852	A	32.9	Very low	34	Very low	95 Å²	95	139.5 Å²	139.5	79%	0.785	81%	0.808	S	S	*	*			cis	-166.9	161.1	-1.3	0	0	0	0	0	107.8
853	S	33.1	Very low	34.4	Very low	98 Å²	98	140.8 Å²	140.8	69%	0.685	81%	0.806	S	S	*	*			trans	-59.5	151	166.7	56	0	0	0	0	113.8
854	Q	36.7	Very low	34.3	Very low	180 Å²	180	141.5 Å²	141.5	84%	0.841	82%	0.817	S	S	*	*			trans	131.8	93.2	143.1	-71.6	172.6	-0.7	0	0	115.1
855	A	36.5	Very low	34.6	Very low	93 Å²	93	143 Å²	143	77%	0.769	84%	0.839	S	S	*	*				63.1	170	120.1	0	0	0	0	0	121
856	P	37.3	Very low	34.7	Very low	112 Å²	112	146.3 Å²	146.3	73%	0.727	84%	0.84	S	S	*	*				-140.5	172	-68.7	41.6	-25.2	0	0	0	115.8
857	K	32.9	Very low	34.9	Very low	200 Å²	200	143.3 Å²	143.3	87%	0.87	84%	0.838	S	S	*	*			trans	57.8	120.8	146	-75.9	179	179	-175.7	0	122.8
858	T	37	Very low	35.1	Very low	140 Å²	140	141.8 Å²	141.8	86%	0.859	84%	0.836	S	S	*	*			trans	-168.1	104.6	134.3	37.2	0	0	0	0	108.2
859	Q	34.7	Very low	35.3	Very low	188 Å²	188	144.8 Å²	144.8	88%	0.879	84%	0.841	S	S	*	*				60.4	119.1	98.2	-81.8	-150.9	-22.3	0	0	117.9
860	L	37.6	Very low	35.7	Very low	161 Å²	161	147.8 Å²	147.8	84%	0.843	84%	0.843	S	S	*	*			trans	159.3	100.5	144.7	-87.3	152	0	0	0	106.7
861	E	37.4	Very low	36.1	Very low	173 Å²	173	150.9 Å²	150.9	81%	0.808	84%	0.844	S	S	*	*				42.9	122.6	90.2	-76.3	-179.6	171.1	0	0	111.2
862	E	36.5	Very low	36.4	Very low	170 Å²	170	154.2 Å²	154.2	79%	0.794	84%	0.842	S	S	*	*			cis	-178.2	168.9	43.2	-156.9	173.2	-163.9	0	0	109.3
863	I	41.5	Very low	36.6	Very low	148 Å²	148	158.8 Å²	158.8	76%	0.759	85%	0.846	S	S	*	*			trans	100.9	97.1	160.2	-51.3	166.9	0	0	0	117.5
864	Q	33.8	Very low	36.9	Very low	190 Å²	190	163.8 Å²	163.8	89%	0.888	86%	0.86	S	S	*	*			trans	-73.9	139.4	151.8	-70.5	-178	-72.1	0	0	111
865	V	41.1	Very low	36.9	Very low	211 Å²	211	162.4 Å²	162.4	100%	1.279	86%	0.861	S	S	*	*			trans	-131.8	0	134.8	173.4	0	0	0	0	106.7

Retrieved 865 of 865 residues in 322.9 ms (Link to these results)

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