A0A3Q0KDJ0_SCHMA Loading...

DNA repair and recombination protein rad54-related

AlphaFold DB , UniProt , Accession A0A3Q0KDJ0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,043 aa.

						>A0A3Q0KDJ0_SCHMA|A0A3Q0KDJ0
MRRSAAPSRTSQSQDLSINPNPVKTTEYRSVLHCSSSPKMNNMPTNSDLSHATKCSSYFEAVYAKASNKKHKRWEGDGFVEVEGRIIKLINEDLKVIASASGHKLAFLNEVDIGSVVHIGSYEAELISLIEKPQLVNISSKSNNIEALHAPVENSTRKPSAKPSFSPKTNSKSKLDESWGYSNRLIMPKPPANCIWSQNPDNLPIVDVVLESKFASRLQPHQCEGIIFLYKCLMGFQPYVALNESDAQSTYGCILADEMGLGKTVQAIATIWLLIRQGPYGGRPVIRRCLIVTPGTLIQNWLKEFSKWLGREQLPVYCVDQNHSVKNYLTMSSDAPQVILMSYEMFLQHTSEIYEISDLDMVVCDEGHRLKNSNINTTMALCRLRARRRLLLTGTPLQNHLNELWSLANFCVPGRLTSSLEEFRRQFVIPLLNNRNLVQNVKINLHNAINDDDDDDDDCDSWNYTDYEKNSDDLESPSAKLFRLLNSFFLRRTCDVIAPKLTDKTEHVLFCRPSKLQTDLEAILTQWMNNEFNLSRSESLKLFLCDDDCEDFVESVEGISSSRSKHHSSILSVITAFRKLHNHPYLLRNYLIQSNSIQNQLADRLPTKLTADLLHLLNSEPSLVAQDLCYTNLNEFVQLSGKFHVLYIMLKRLFDKELSSSSKSNSNTANVQKKPRLSNSSSKNNLHTNDRLVLVSNFTQTLNLLEKLCNLVTGQPSLRLDGQITNKQRAEVVQRINDPKSHDRILLLSSRAGGVGLNLIGANYLILFDMDWNPANDAQAMARIWRPGQSRSVNLYRLVTASGMEERIFQRQAAKLALTSQTLVNTSMYNENLLKFVEKKKEPDKNLGILTRDELKELFLLPNTSTGSWTHELIQCNCNQSLENKSFTPSPSISSLSDIETYDSADQNVVKTFIDYSYELGDKENMKEIESSEHTTGITNDENEDDEYSNIRLFQLGPANPCITDSLKSPKSQFTYLKQQSSSISTITSKLPSSDSLGFLLNWKHSFSSEQIDQLNDRLLITHQSDPMKSLINCIFTLNSKAS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.8	Very low	35.3	Very low	247 Å²	247	161 Å²	161	100%	1.217	88%	0.879	S	S	*	*				0	119.1	0	-75	175	161.6	0	0	107.7
2	R	34.6	Very low	35.1	Very low	234 Å²	234	164 Å²	164	88%	0.883	88%	0.882	S	S	*	*			cis	-147.3	123	-8.2	-102.8	-178.3	173.4	175.1	-2	106.8
3	R	36.4	Very low	34.7	Very low	228 Å²	228	159.8 Å²	159.8	86%	0.86	87%	0.873	S	S	*	*			trans	52.9	114.1	139.5	-63.2	-178.6	177.8	-164.1	-2.6	121.2
4	S	37.7	Very low	34.6	Very low	118 Å²	118	162.1 Å²	162.1	83%	0.825	88%	0.875	S	S	*	*				86.2	137	78.2	-56.9	0	0	0	0	111.6
5	A	39.2	Very low	34.3	Very low	103 Å²	103	161.6 Å²	161.6	85%	0.851	87%	0.872	S	S	*	*			cis	-162.4	157.5	31.7	0	0	0	0	0	112.9
6	A	35	Very low	34.3	Very low	94 Å²	94	161.8 Å²	161.8	78%	0.777	87%	0.871	S	S	*	*			trans	-120.4	163.2	151.8	0	0	0	0	0	107.7
7	P	43.6	Very low	34	Very low	134 Å²	134	158.9 Å²	158.9	87%	0.87	87%	0.867	S	S	*	*			trans	-125.8	159.1	153.5	28.7	-10.9	0	0	0	113.9
8	S	33.7	Very low	34	Very low	114 Å²	114	158.8 Å²	158.8	80%	0.797	86%	0.863	S	S	*	*			trans	-103.8	165.9	-157.8	44.4	0	0	0	0	114.9
9	R	31.5	Very low	33.7	Very low	241 Å²	241	157.4 Å²	157.4	91%	0.909	86%	0.855	S	S	*	*			trans	-44.8	147.9	165.2	-69.9	172.8	167.8	177.3	-5.3	114.3
10	T	33.4	Very low	33.8	Very low	146 Å²	146	155.5 Å²	155.5	90%	0.896	85%	0.85	S	S	*	*			trans	-149.3	131.8	142.2	20.4	0	0	0	0	110.1
11	S	29.8	Very low	33.6	Very low	112 Å²	112	154.2 Å²	154.2	78%	0.783	84%	0.843	S	S	*	*			trans	-85.1	138.5	171.3	46.7	0	0	0	0	110.4
12	Q	33.1	Very low	33.7	Very low	197 Å²	197	147.3 Å²	147.3	92%	0.921	82%	0.816	S	S	*	*			trans	-151.7	118.9	152.8	-107.2	174.1	12.3	0	0	109.7
13	S	29.4	Very low	33.6	Very low	109 Å²	109	142.8 Å²	142.8	76%	0.762	82%	0.815	S	S	*	*			trans	-68.3	135.1	165.1	45.4	0	0	0	0	110.9
14	Q	33.3	Very low	33.1	Very low	193 Å²	193	141 Å²	141	90%	0.902	81%	0.813	S	S	*	*			trans	-141.1	114.8	149.1	-85.7	-169.9	-23.1	0	0	109.1
15	D	29.8	Very low	32.8	Very low	154 Å²	154	141.2 Å²	141.2	82%	0.824	81%	0.809	S	S	*	*			trans	-60.1	127.7	163.6	-65.3	-58	0	0	0	110.1
16	L	34.1	Very low	32.4	Very low	165 Å²	165	142 Å²	142	86%	0.864	80%	0.804	S	S	*	*			trans	-140.4	95.4	150.7	-84	175.5	0	0	0	108.5
17	S	29.2	Very low	32	Very low	113 Å²	113	146 Å²	146	79%	0.79	81%	0.806	S	S	*	*			trans	-65.3	118.3	163.8	51.9	0	0	0	0	110.8
18	I	34.2	Very low	31.4	Very low	157 Å²	157	148.7 Å²	148.7	81%	0.805	80%	0.801	S	S	*	*			trans	-138.1	105.4	151.5	-59	-178.5	0	0	0	107.6
19	N	28.5	Very low	31.3	Very low	131 Å²	131	153.3 Å²	153.3	70%	0.701	80%	0.8	S	S	*	*			trans	-81.8	140.5	163.7	-142.1	-9.4	0	0	0	106.8	N21	N19-N21 PolarHBondContact OD1-N 2.78Å
20	P	36.6	Very low	31.3	Very low	119 Å²	119	146.4 Å²	146.4	77%	0.773	79%	0.789	S	S	*	*				-137	104.2	120	31.2	-15.2	0	0	0	111.5
21	N	28.5	Very low	31.2	Very low	129 Å²	129	145.1 Å²	145.1	69%	0.69	78%	0.781	S	S	*	*			trans	-28.4	170.7	138	-119.2	5.2	0	0	0	115.3	N19	N19-N21 PolarHBondContact OD1-N 2.78Å
22	P	36.3	Very low	31.3	Very low	102 Å²	102	146.9 Å²	146.9	66%	0.662	78%	0.781	S	S	*	*				-124.4	169.3	-91.4	34.3	-15.6	0	0	0	112.4
23	V	32.6	Very low	31.2	Very low	140 Å²	140	145.7 Å²	145.7	85%	0.848	78%	0.775	S	S	*	*			trans	-130	108.5	167	-178.4	0	0	0	0	110.9
24	K	26.2	Very low	31.1	Very low	191 Å²	191	145.6 Å²	145.6	83%	0.83	77%	0.773	S	S	*	*			trans	-74	147	157.6	-66.9	173.4	173.7	178.7	0	109.2
25	T	30.5	Very low	31.1	Very low	121 Å²	121	141.2 Å²	141.2	74%	0.742	76%	0.764	S	S	*	*			trans	166.6	136.2	146.9	33.7	0	0	0	0	105.4
26	T	31.1	Very low	31.3	Very low	119 Å²	119	139.1 Å²	139.1	73%	0.73	76%	0.761	S	S	*	*			cis	-175.3	116.2	30.1	-1.7	0	0	0	0	105.4
27	E	26.4	Very low	31.1	Very low	178 Å²	178	136.5 Å²	136.5	83%	0.832	76%	0.757	S	S	*	*				37.7	125	104.4	-78.5	-170.2	174.9	0	0	117.8
28	Y	31.7	Very low	31.4	Very low	191 Å²	191	136 Å²	136	75%	0.749	75%	0.751	S	S	*	*			trans	-150.1	115.2	143.5	-105.9	-80.1	0	0	0	112
29	R	30.3	Very low	31.2	Very low	211 Å²	211	137.9 Å²	137.9	80%	0.796	75%	0.753	S	S	*	*			trans	64.2	136.9	143.1	-77.4	177.6	-177.3	155.8	-4	119.2
30	S	32.4	Very low	31.4	Very low	97 Å²	97	139.1 Å²	139.1	68%	0.678	76%	0.757	S	S	*	*			cis	-175.7	132.4	14.4	34.7	0	0	0	0	112.9
31	V	31	Very low	31.1	Very low	118 Å²	118	139.4 Å²	139.4	72%	0.715	75%	0.751	S	S	*	*				50.2	121.5	126.4	-149.1	0	0	0	0	118.5
32	L	32.6	Very low	31.3	Very low	149 Å²	149	140.6 Å²	140.6	78%	0.78	76%	0.758	S	S	*	*				-178.1	124.5	79.2	-82.5	156.3	0	0	0	110
33	H	30.1	Very low	31.1	Very low	172 Å²	172	143.2 Å²	143.2	80%	0.796	76%	0.763	S	S	*	*				53.3	131.2	103.6	-81.3	-74.1	0	0	0	116.5
34	C	28	Very low	31.2	Very low	107 Å²	107	141.7 Å²	141.7	72%	0.723	76%	0.756	S	S	*	*				-173	149.7	52.4	-150	0	0	0	0	114.3
35	S	32.7	Very low	31.3	Very low	101 Å²	101	137.1 Å²	137.1	71%	0.706	75%	0.745	S	S	*	*			trans	50.6	144	143.9	60.2	0	0	0	0	122
36	S	33.6	Very low	31.3	Very low	111 Å²	111	138.6 Å²	138.6	78%	0.776	75%	0.748	S	S	*	*			cis	-175.4	152.5	15.4	32	0	0	0	0	110.3
37	S	29.5	Very low	31.2	Very low	109 Å²	109	137.1 Å²	137.1	76%	0.762	74%	0.742	S	S	*	*			trans	-63.9	-168.1	174.8	58.2	0	0	0	0	116.5
38	P	35.8	Very low	31.4	Very low	103 Å²	103	135.8 Å²	135.8	67%	0.669	74%	0.741	S	S	*	*			cis	-142.1	167.2	-7.8	24.9	1.3	0	0	0	118.3
39	K	31	Very low	31.3	Very low	196 Å²	196	134.5 Å²	134.5	85%	0.852	75%	0.746	S	S	*	*			trans	41.9	129.7	137.3	-56.7	172.9	179.2	178.5	0	122.8
40	M	33	Very low	31.2	Very low	158 Å²	158	129.5 Å²	129.5	78%	0.778	74%	0.744	S	S	*	*				161.8	123	103.1	-85.1	-165.6	74.3	0	0	114.2
41	N	30.6	Very low	31	Very low	124 Å²	124	134.2 Å²	134.2	66%	0.663	75%	0.754	S	S	*	*			trans	55.9	127.7	134.7	-66.2	2.7	0	0	0	125
42	N	32.9	Very low	31	Very low	154 Å²	154	133.5 Å²	133.5	82%	0.824	76%	0.761	S	S	*	*			trans	98.3	113.3	135.8	-67.6	-5.1	0	0	0	121.5
43	M	30.1	Very low	31	Very low	157 Å²	157	132.9 Å²	132.9	77%	0.773	76%	0.764	S	S	*	*			trans	-37	164.3	148.2	-88.9	171.6	75.6	0	0	114.5	T45	M43-T45 HydrophobicContact CE-CG2 3.5Å
44	P	35.6	Very low	31.4	Very low	109 Å²	109	133.1 Å²	133.1	71%	0.708	76%	0.762	S	S	*	*			cis	-142.4	143.3	42.9	21.2	6.2	0	0	0	116.7
45	T	28.7	Very low	32.3	Very low	95 Å²	95	133.6 Å²	133.6	58%	0.583	77%	0.766	S	S	*	*				57.2	128.4	100.9	70.3	0	0	0	0	120.1	M43	M43-T45 HydrophobicContact CE-CG2 3.5Å
46	N	29.9	Very low	33.9	Very low	152 Å²	152	131.6 Å²	131.6	81%	0.813	75%	0.751	S	S	*	*			trans	73.6	142.5	152.2	-59.1	-13.8	0	0	0	116.5
47	S	29.7	Very low	36.1	Very low	87 Å²	87	128.5 Å²	128.5	61%	0.608	73%	0.73	S	S	*	*			cis	-174.5	145.9	-8.6	45.2	0	0	0	0	103.3
48	D	31.1	Very low	38.8	Very low	151 Å²	151	124.2 Å²	124.2	81%	0.807	70%	0.697	S	S	*	*			trans	161.9	136.1	132.5	-77.2	-9.8	0	0	0	111.4
49	L	29.2	Very low	41.3	Very low	163 Å²	163	120.1 Å²	120.1	85%	0.853	67%	0.669	S	S	*	*			trans	-77.9	160.5	-167.5	-81.9	79.8	0	0	0	113
50	S	27.6	Very low	44	Very low	107 Å²	107	114.4 Å²	114.4	75%	0.748	65%	0.645	S	S	*	*			trans	102.6	128.7	149	77.1	0	0	0	0	116.9
51	H	28.9	Very low	46.6	Very low	195 Å²	195	106.9 Å²	106.9	90%	0.903	61%	0.608	S	S	*	*			trans	84.6	77.2	-173.5	-61.8	-74.8	0	0	0	116.6
52	A	29.8	Very low	49.5	Very low	103 Å²	103	102.1 Å²	102.1	85%	0.851	58%	0.584	S	S	*	*			trans	-130.8	122.9	161	0	0	0	0	0	110.4
53	T	32.5	Very low	52.3	Low	137 Å²	137	95.9 Å²	95.9	84%	0.84	55%	0.549	S	S	*	.			trans	-53.7	139.5	-174.4	-6.2	0	0	0	0	113.1	C55	T53-C55 PolarHBondContact O-N 3.35Å
54	K	38.2	Very low	55.2	Low	177 Å²	177	88.5 Å²	88.5	77%	0.77	51%	0.513	S	S	*	.			trans	-60.2	100.3	169.3	-86.2	-173	168.3	-155.9	0	109.6	S56 E83	K54-S56 PolarHBondContact O-N 2.97Å; K54-E83 IonicContact NZ-OE1 3.68Å; K54-E83 PolarHBondContact NZ-OE1 2.89Å; K54-E83 VanDerWaalsContact NZ-OE1 3.1Å
55	C	47.5	Very low	57.6	Low	117 Å²	117	88.7 Å²	88.7	79%	0.791	50%	0.502	S	S	*	.			trans	-78.9	103.1	165.1	-95.3	0	0	0	0	108.9	T53	T53-C55 PolarHBondContact O-N 3.35Å
56	S	66.5	Low	60.2	Low	58 Å²	58	86.6 Å²	86.6	41%	0.406	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	123.1	163.3	57.2	0	0	0	0	108.4	K54 V82	K54-S56 PolarHBondContact O-N 2.97Å; S56-V82 WeakPolarHBondContact CA-O 3.48Å
57	S	79.7	Confident	62.6	Low	47 Å²	47	81.2 Å²	81.2	33%	0.329	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	135.3	177.2	-44.5	0	0	0	0	109.1	V82	S57-V82 PolarHBondContact N-O 3.04Å; S57-V82 PolarHBondContact O-N 2.76Å
58	Y	86.9	Confident	64.9	Low	19 Å²	19	85.6 Å²	85.6	8%	0.075	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127	176.3	-128.6	-98.3	0	0	0	108.5	F79 E81 I90 I130 K132	Y58-F79 HydrophobicContact CD1-CB 4.08Å; Y58-F79 HydrophobicContact CE1-CB 3.62Å; Y58-F79 HydrophobicContact CE1-CG 4.14Å; Y58-E81 HydrophobicContact CD2-CB 3.83Å; Y58-E81 HydrophobicContact CD2-CG 3.74Å; Y58-E81 HydrophobicContact CE2-CB 3.48Å; Y58-E81 VanDerWaalsContact CE2-CB 3.48Å; Y58-E81 HydrophobicContact CE2-CG 3.49Å; Y58-E81 VanDerWaalsContact CE2-CG 3.49Å; Y58-I90 WeakPolarHBondContact OH-CD1 3.43Å; Y58-I130 VanDerWaalsContact CB-O 3.29Å; Y58-I130 WeakPolarHBondContact CB-O 3.38Å; Y58-I130 PolarHBondContact O-N 3.26Å; Y58-K132 HydrophobicContact CD2-CB 4.2Å; Y58-K132 HydrophobicContact CD2-CD 4.29Å; Y58-K132 HydrophobicContact CD2-CG 4.12Å; Y58-K132 HydrophobicContact CE2-CB 4.37Å; Y58-K132 HydrophobicContact CE2-CD 3.94Å; Y58-K132 HydrophobicContact CE2-CG 3.79Å
59	F	87.3	Confident	67	Low	16 Å²	16	85.7 Å²	85.7	7%	0.07	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	142.3	-179.2	-61.5	-90.3	0	0	0	110.6	F79 V80 V82 L126 S128 L129	F59-F79 CarbonylContact O-C 3.56Å; F59-F79 WeakPolarHBondContact O-CA 3.04Å; F59-V80 HydrophobicContact CB-CB 4.44Å; F59-V80 PolarHBondContact N-O 3.12Å; F59-V80 PolarHBondContact O-N 2.9Å; F59-V82 HydrophobicContact CD2-CG2 3.96Å; F59-V82 HydrophobicContact CE2-CG2 3.74Å; F59-L126 HydrophobicContact CB-CB 4.39Å; F59-L126 HydrophobicContact CB-CD1 4.24Å; F59-L126 HydrophobicContact CB-CD2 3.8Å; F59-L126 HydrophobicContact CB-CG 4.37Å; F59-L126 HydrophobicContact CD1-CB 4.38Å; F59-L126 HydrophobicContact CD1-CD1 3.86Å; F59-L126 HydrophobicContact CD2-CD1 3.96Å; F59-L126 HydrophobicContact CE1-CD1 4.11Å; F59-L126 HydrophobicContact CE2-CD1 4.2Å; F59-L126 HydrophobicContact CG-CD1 3.77Å; F59-L126 HydrophobicContact CG-CD2 4.23Å; F59-L126 HydrophobicContact CG-CG 4.41Å; F59-L126 HydrophobicContact CZ-CD1 4.27Å; F59-S128 CarbonylContact C-O 3.46Å; F59-S128 WeakPolarHBondContact CA-O 3.37Å; F59-L129 HydrophobicContact CD1-CB 4.38Å; F59-L129 HydrophobicContact CD1-CD1 3.71Å; F59-L129 HydrophobicContact CE1-CB 4.48Å; F59-L129 HydrophobicContact CE1-CD1 3.36Å; F59-L129 HydrophobicContact CE2-CD1 4.25Å; F59-L129 HydrophobicContact CG-CD1 4.29Å; F59-L129 HydrophobicContact CZ-CD1 3.67Å
60	E	88.7	Confident	69	Low	77 Å²	77	87.9 Å²	87.9	36%	0.36	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	136.1	159.5	-158.7	173.9	-165.9	0	0	108.5	L126 I127 S128 I130	E60-L126 CarbonylContact O-C 3.56Å; E60-I127 HydrophobicContact CB-CB 4.35Å; E60-I127 HydrophobicContact CG-CD1 4.35Å; E60-I127 PolarHBondContact O-N 2.77Å; E60-S128 VanDerWaalsContact CB-OG 3.28Å; E60-S128 WeakPolarHBondContact CB-OG 3.32Å; E60-S128 PolarHBondContact N-O 3.04Å; E60-S128 PolarHBondContact OE2-OG 3.2Å; E60-I130 HydrophobicContact CB-CD1 3.62Å; E60-I130 HydrophobicContact CB-CG1 4.04Å; E60-I130 HydrophobicContact CG-CD1 4.13Å
61	A	88.4	Confident	71.1	Confident	0 Å²	0	90.9 Å²	90.9	0%	0	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	141.6	-179	0	0	0	0	0	112.6	G78 V80 A124 E125 L126	A61-G78 PolarHBondContact N-O 2.69Å; A61-G78 CarbonylContact O-C 3.56Å; A61-G78 PolarHBondContact O-N 3.43Å; A61-G78 VanDerWaalsContact O-O 3.05Å; A61-V80 HydrophobicContact CB-CB 4.48Å; A61-V80 HydrophobicContact CB-CG2 3.64Å; A61-A124 HydrophobicContact CB-CB 4.05Å; A61-E125 CarbonylContact C-O 3.58Å; A61-E125 WeakPolarHBondContact CA-O 3.25Å; A61-E125 WeakPolarHBondContact CB-O 3.44Å; A61-L126 HydrophobicContact CB-CD2 3.85Å
62	V	91	Very high	73	Confident	24 Å²	24	85.8 Å²	85.8	15%	0.145	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	133.3	165.3	-141.1	0	0	0	0	107.6	W74 D77 A124 E125 I127	V62-W74 HydrophobicContact CB-CB 4.29Å; V62-W74 HydrophobicContact CB-CD2 3.9Å; V62-W74 HydrophobicContact CB-CE3 3.95Å; V62-W74 HydrophobicContact CB-CG 4.03Å; V62-W74 HydrophobicContact CG1-CB 3.42Å; V62-W74 VanDerWaalsContact CG1-CB 3.42Å; V62-W74 HydrophobicContact CG1-CD2 4.02Å; V62-W74 HydrophobicContact CG1-CE3 4.3Å; V62-W74 HydrophobicContact CG1-CG 3.63Å; V62-W74 VanDerWaalsContact O-CZ3 3.25Å; V62-W74 WeakPolarHBondContact O-CZ3 3.17Å; V62-D77 WeakPolarHBondContact CG1-OD1 3.21Å; V62-A124 CarbonylContact O-C 3.57Å; V62-A124 WeakPolarHBondContact O-CA 3.07Å; V62-E125 PolarHBondContact N-O 3.23Å; V62-E125 PolarHBondContact O-N 3.48Å; V62-I127 HydrophobicContact CG2-CD1 3.4Å; V62-I127 VanDerWaalsContact CG2-CD1 3.4Å; V62-I127 HydrophobicContact CG2-CG1 3.76Å
63	Y	91.6	Very high	75.4	Confident	22 Å²	22	91.9 Å²	91.9	9%	0.086	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	148.8	-179.7	69.8	-95.5	0	0	0	113.3	E75 G76 D77 L89 N91 I97 Y122 E123	Y63-E75 HydrophobicContact CE2-CB 4.4Å; Y63-E75 PolarHBondContact O-N 3.23Å; Y63-G76 VanDerWaalsContact CD1-O 3.31Å; Y63-G76 WeakPolarHBondContact CD1-O 3.13Å; Y63-G76 PolarHBondContact N-O 3.41Å; Y63-G76 PolarHBondContact O-N 3.05Å; Y63-D77 WeakPolarHBondContact CE1-O 3.35Å; Y63-L89 HydrophobicContact CD1-CD1 4.02Å; Y63-L89 HydrophobicContact CD1-CD2 4.25Å; Y63-L89 HydrophobicContact CD1-CG 4.42Å; Y63-L89 HydrophobicContact CD2-CD2 4.04Å; Y63-L89 HydrophobicContact CG-CD1 4.14Å; Y63-L89 HydrophobicContact CG-CD2 3.74Å; Y63-L89 HydrophobicContact CG-CG 4.38Å; Y63-N91 PolarHBondContact OH-OD1 3.43Å; Y63-I97 HydrophobicContact CD1-CD1 4.28Å; Y63-I97 HydrophobicContact CD2-CD1 4.43Å; Y63-I97 HydrophobicContact CE1-CD1 3.6Å; Y63-I97 HydrophobicContact CE2-CD1 3.83Å; Y63-I97 WeakPolarHBondContact OH-CD1 3.33Å; Y63-Y122 AromaticContact CD2-CD1 3.92Å; Y63-Y122 HydrophobicContact CD2-CD1 3.92Å; Y63-Y122 HydrophobicContact CD2-CE1 4.29Å; Y63-Y122 HydrophobicContact CE2-CE1 4.43Å; Y63-E123 CarbonylContact C-O 3.47Å; Y63-E123 VanDerWaalsContact CA-O 3.28Å; Y63-E123 WeakPolarHBondContact CA-O 3.49Å
64	A	89.7	Confident	77.9	Confident	3 Å²	3	89.5 Å²	89.5	3%	0.025	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	163.1	175.8	0	0	0	0	0	109.9	W74 Y122 E123	A64-W74 HydrophobicContact CB-CD2 4.46Å; A64-W74 HydrophobicContact CB-CE3 3.69Å; A64-W74 HydrophobicContact CB-CZ3 4.08Å; A64-Y122 CarbonylContact O-C 3.55Å; A64-Y122 VanDerWaalsContact O-CA 3.22Å; A64-Y122 WeakPolarHBondContact O-CA 3.29Å; A64-E123 HydrophobicContact CB-CG 4.31Å; A64-E123 PolarHBondContact N-O 3.11Å; A64-E123 PolarHBondContact O-N 2.95Å
65	K	87.4	Confident	79.9	Confident	112 Å²	112	86 Å²	86	49%	0.487	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	132.9	164.2	-77.7	173.6	-171.6	164.1	0	110.2	S67 E75 Y122	K65-S67 PolarHBondContact O-N 3.49Å; K65-E75 WeakPolarHBondContact CD-OE1 3.38Å; K65-Y122 HydrophobicContact CG-CD1 4.1Å; K65-Y122 HydrophobicContact CG-CE1 3.79Å
66	A	82.4	Confident	81.7	Confident	51 Å²	51	81.5 Å²	81.5	42%	0.421	40%	0.395	S	S	.	.			trans	-53.8	120.7	-178.2	0	0	0	0	0	111.5	S121 E123	A66-S121 PolarHBondContact N-O 3.46Å; A66-E123 WeakPolarHBondContact CA-OE1 3.31Å
67	S	80	Confident	82.8	Confident	40 Å²	40	82.6 Å²	82.6	28%	0.28	40%	0.396	S	S	.	.			trans	-139.2	145.7	-178.4	-163.8	0	0	0	0	113.1	K65 K69 K72 E123	K65-S67 PolarHBondContact O-N 3.49Å; S67-K69 VanDerWaalsContact C-N 3.29Å; S67-K69 PolarHBondContact O-N 3.38Å; S67-K69 WeakPolarHBondContact OG-CG 3.28Å; S67-K72 WeakPolarHBondContact O-CE 3.45Å; S67-K72 PolarHBondContact O-NZ 2.7Å; S67-K72 VanDerWaalsContact O-NZ 3.1Å; S67-E123 PolarHBondContact N-OE1 3.06Å
68	N	78.3	Confident	83.2	Confident	179 Å²	179	80.4 Å²	80.4	96%	0.957	38%	0.381	S	S	*	.			trans	-89.4	15	174.4	-66.8	-7.9	0	0	0	113.3
69	K	75.4	Confident	83.4	Confident	153 Å²	153	81.7 Å²	81.7	67%	0.665	39%	0.387	S	S	*	.			trans	-74.9	138.8	179.7	-70.1	176.6	-177.4	175.7	0	111.2	S67 H71	S67-K69 VanDerWaalsContact C-N 3.29Å; S67-K69 PolarHBondContact O-N 3.38Å; S67-K69 WeakPolarHBondContact OG-CG 3.28Å; K69-H71 VanDerWaalsContact C-N 3.27Å; K69-H71 PolarHBondContact O-N 3.39Å
70	K	72.4	Confident	83.5	Confident	208 Å²	208	81 Å²	81	90%	0.904	38%	0.384	S	S	*	.	S	Bend	trans	-62.5	-28.8	-179.8	-146.5	-179.9	-173.9	-176.2	0	113.9
71	H	71.6	Confident	83.4	Confident	171 Å²	171	77.6 Å²	77.6	79%	0.792	37%	0.368	S	S	*	.	S	Bend	trans	-116.9	107.9	171	-65	-70.9	0	0	0	108.9	K69	K69-H71 VanDerWaalsContact C-N 3.27Å; K69-H71 PolarHBondContact O-N 3.39Å
72	K	68.6	Low	83.3	Confident	88 Å²	88	78.1 Å²	78.1	38%	0.383	37%	0.372	S	S	.	.			trans	-85.4	144.6	173.2	-81.5	174.3	-177.1	174.4	0	110.4	S67 E123	S67-K72 WeakPolarHBondContact O-CE 3.45Å; S67-K72 PolarHBondContact O-NZ 2.7Å; S67-K72 VanDerWaalsContact O-NZ 3.1Å; K72-E123 WeakPolarHBondContact CD-OE1 3.48Å; K72-E123 WeakPolarHBondContact CE-OE1 3.06Å; K72-E123 IonicContact NZ-OE1 2.83Å; K72-E123 PolarHBondContact NZ-OE1 3.08Å; K72-E123 IonicContact NZ-OE2 3.7Å; K72-E123 PolarHBondContact NZ-OE2 3.38Å
73	R	79.1	Confident	82.7	Confident	231 Å²	231	80 Å²	80	87%	0.872	38%	0.379	S	S	*	.			trans	-108.3	121.9	164.3	-77.4	-175.4	170.9	-170.1	-4.4	106.4
74	W	84.7	Confident	81.9	Confident	87 Å²	87	81 Å²	81	33%	0.33	40%	0.395	S	S	.	.			trans	-67.9	136.4	171.7	-62.3	109.3	0	0	0	109.8	V62 A64 E123 E125	V62-W74 HydrophobicContact CB-CB 4.29Å; V62-W74 HydrophobicContact CB-CD2 3.9Å; V62-W74 HydrophobicContact CB-CE3 3.95Å; V62-W74 HydrophobicContact CB-CG 4.03Å; V62-W74 HydrophobicContact CG1-CB 3.42Å; V62-W74 VanDerWaalsContact CG1-CB 3.42Å; V62-W74 HydrophobicContact CG1-CD2 4.02Å; V62-W74 HydrophobicContact CG1-CE3 4.3Å; V62-W74 HydrophobicContact CG1-CG 3.63Å; V62-W74 VanDerWaalsContact O-CZ3 3.25Å; V62-W74 WeakPolarHBondContact O-CZ3 3.17Å; A64-W74 HydrophobicContact CB-CD2 4.46Å; A64-W74 HydrophobicContact CB-CE3 3.69Å; A64-W74 HydrophobicContact CB-CZ3 4.08Å; W74-E123 HydrophobicContact CZ3-CG 4.34Å; W74-E125 HydrophobicContact CH2-CB 3.54Å; W74-E125 HydrophobicContact CZ2-CB 3.76Å; W74-E125 WeakPolarHBondContact CZ2-OE2 3.5Å; W74-E125 HydrophobicContact CZ3-CB 4.24Å
75	E	81.7	Confident	81.4	Confident	104 Å²	104	88.8 Å²	88.8	49%	0.486	42%	0.424	S	S	.	.			trans	-86.6	-27.8	-174.7	-71.3	-170.8	165.5	0	0	112.5	Y63 K65	Y63-E75 HydrophobicContact CE2-CB 4.4Å; Y63-E75 PolarHBondContact O-N 3.23Å; K65-E75 WeakPolarHBondContact CD-OE1 3.38Å
76	G	84.8	Confident	81.1	Confident	21 Å²	21	86.7 Å²	86.7	22%	0.216	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.8	171.9	176.4	0	0	0	0	0	113	Y63	Y63-G76 VanDerWaalsContact CD1-O 3.31Å; Y63-G76 WeakPolarHBondContact CD1-O 3.13Å; Y63-G76 PolarHBondContact N-O 3.41Å; Y63-G76 PolarHBondContact O-N 3.05Å
77	D	89.1	Confident	81.3	Confident	81 Å²	81	84.3 Å²	84.3	43%	0.433	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	146	174.3	-60.2	-36.4	0	0	0	109.6	V62 Y63 N91 E92	V62-D77 WeakPolarHBondContact CG1-OD1 3.21Å; Y63-D77 WeakPolarHBondContact CE1-O 3.35Å; D77-N91 PolarHBondContact O-OD1 3.42Å; D77-E92 WeakPolarHBondContact O-CG 3.21Å
78	G	88.8	Confident	81.8	Confident	2 Å²	2	84.8 Å²	84.8	2%	0.021	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	-168.5	-179.6	0	0	0	0	0	112.6	A61 I90	A61-G78 PolarHBondContact N-O 2.69Å; A61-G78 CarbonylContact O-C 3.56Å; A61-G78 PolarHBondContact O-N 3.43Å; A61-G78 VanDerWaalsContact O-O 3.05Å; G78-I90 CarbonylContact C-O 3.56Å; G78-I90 VanDerWaalsContact CA-O 3.25Å; G78-I90 WeakPolarHBondContact CA-O 3.47Å
79	F	90.3	Very high	82.3	Confident	46 Å²	46	76.2 Å²	76.2	20%	0.202	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	139.1	-179.5	-50.7	-78.1	0	0	0	110.6	Y58 F59 L89 I90 I130	Y58-F79 HydrophobicContact CD1-CB 4.08Å; Y58-F79 HydrophobicContact CE1-CB 3.62Å; Y58-F79 HydrophobicContact CE1-CG 4.14Å; F59-F79 CarbonylContact O-C 3.56Å; F59-F79 WeakPolarHBondContact O-CA 3.04Å; F79-L89 CarbonylContact O-C 3.53Å; F79-I90 HydrophobicContact CB-CB 4.38Å; F79-I90 PolarHBondContact N-O 3.32Å; F79-I90 PolarHBondContact O-N 2.8Å; F79-I130 HydrophobicContact CD1-CD1 3.57Å; F79-I130 HydrophobicContact CE1-CD1 3.5Å
80	V	88.8	Confident	83	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	114	172.6	176.3	0	0	0	0	108.9	F59 A61 V82 I87 K88 L89 I119 A124 L126	F59-V80 HydrophobicContact CB-CB 4.44Å; F59-V80 PolarHBondContact N-O 3.12Å; F59-V80 PolarHBondContact O-N 2.9Å; A61-V80 HydrophobicContact CB-CB 4.48Å; A61-V80 HydrophobicContact CB-CG2 3.64Å; V80-V82 HydrophobicContact CG1-CG2 4.25Å; V80-I87 HydrophobicContact CG1-CD1 4.35Å; V80-I87 HydrophobicContact CG1-CG2 4.01Å; V80-K88 CarbonylContact C-O 3.47Å; V80-K88 WeakPolarHBondContact CA-O 3.45Å; V80-L89 HydrophobicContact CG2-CD1 3.78Å; V80-I119 HydrophobicContact CG1-CD1 4.01Å; V80-I119 HydrophobicContact CG2-CD1 3.77Å; V80-A124 HydrophobicContact CG2-CB 3.9Å; V80-L126 HydrophobicContact CB-CD2 3.82Å; V80-L126 HydrophobicContact CG1-CD2 4.19Å; V80-L126 HydrophobicContact CG2-CD2 3.86Å
81	E	87.6	Confident	83.7	Confident	7 Å²	7	61.4 Å²	61.4	3%	0.033	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	118.6	172.1	-178	-179.2	-132.8	0	0	109.1	Y58 I87 K88 I90 K132	Y58-E81 HydrophobicContact CD2-CB 3.83Å; Y58-E81 HydrophobicContact CD2-CG 3.74Å; Y58-E81 HydrophobicContact CE2-CB 3.48Å; Y58-E81 VanDerWaalsContact CE2-CB 3.48Å; Y58-E81 HydrophobicContact CE2-CG 3.49Å; Y58-E81 VanDerWaalsContact CE2-CG 3.49Å; E81-I87 WeakPolarHBondContact O-CA 3.45Å; E81-K88 HydrophobicContact CB-CB 4.39Å; E81-K88 PolarHBondContact N-O 3.43Å; E81-K88 PolarHBondContact O-N 3.05Å; E81-K88 IonicContact OE2-NZ 3.1Å; E81-K88 PolarHBondContact OE2-NZ 3.42Å; E81-I90 HydrophobicContact CB-CD1 4.12Å; E81-K132 WeakPolarHBondContact OE1-CE 3.39Å; E81-K132 IonicContact OE1-NZ 2.67Å; E81-K132 PolarHBondContact OE1-NZ 3.29Å
82	V	85.2	Confident	84.2	Confident	11 Å²	11	59.2 Å²	59.2	7%	0.067	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	104.9	171.9	-168.4	0	0	0	0	108.4	S56 S57 F59 V80 I87 L108	S56-V82 WeakPolarHBondContact CA-O 3.48Å; S57-V82 PolarHBondContact N-O 3.04Å; S57-V82 PolarHBondContact O-N 2.76Å; F59-V82 HydrophobicContact CD2-CG2 3.96Å; F59-V82 HydrophobicContact CE2-CG2 3.74Å; V80-V82 HydrophobicContact CG1-CG2 4.25Å; V82-I87 HydrophobicContact CB-CG1 4.21Å; V82-I87 HydrophobicContact CG1-CD1 4.4Å; V82-I87 HydrophobicContact CG1-CG1 3.98Å; V82-I87 HydrophobicContact CG2-CD1 3.89Å; V82-I87 HydrophobicContact CG2-CG1 3.85Å; V82-L108 HydrophobicContact CG1-CB 4.3Å; V82-L108 HydrophobicContact CG1-CD2 4.12Å
83	E	79.7	Confident	84.8	Confident	64 Å²	64	60.8 Å²	60.8	30%	0.299	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	99.2	173.4	-164.5	-176.9	179.9	0	0	109.3	K54 R85 I86	K54-E83 IonicContact NZ-OE1 3.68Å; K54-E83 PolarHBondContact NZ-OE1 2.89Å; K54-E83 VanDerWaalsContact NZ-OE1 3.1Å; E83-R85 PolarHBondContact O-N 2.78Å; E83-R85 VanDerWaalsContact O-N 3.08Å; E83-I86 PolarHBondContact N-O 2.83Å; E83-I86 PolarHBondContact O-N 2.67Å
84	G	74.7	Confident	84.7	Confident	42 Å²	42	53.6 Å²	53.6	43%	0.433	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	-104.7	178.1	0	0	0	0	0	113.7	L108	G84-L108 WeakPolarHBondContact O-CD1 3.21Å
85	R	79.9	Confident	84.6	Confident	167 Å²	167	56.5 Å²	56.5	63%	0.63	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	6.7	177.5	-66.3	-177	-173.8	177.6	2.4	113.1	E83 G102 L105	E83-R85 PolarHBondContact O-N 2.78Å; E83-R85 VanDerWaalsContact O-N 3.08Å; R85-G102 PolarHBondContact O-N 3.14Å; R85-L105 HydrophobicContact CG-CD1 3.44Å; R85-L105 VanDerWaalsContact CG-CD1 3.44Å
86	I	80.8	Confident	84.8	Confident	68 Å²	68	55.5 Å²	55.5	35%	0.349	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.1	-176.4	-53.7	174.4	0	0	0	107.6	E83 K88 A100	E83-I86 PolarHBondContact N-O 2.83Å; E83-I86 PolarHBondContact O-N 2.67Å; I86-K88 HydrophobicContact CG2-CG 4.1Å; I86-A100 WeakPolarHBondContact CA-O 3.44Å
87	I	86.9	Confident	84.8	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	128.9	168.4	-90.8	-167.5	0	0	0	108.5	V80 E81 V82 S99 A100 L108 V117 I119	V80-I87 HydrophobicContact CG1-CD1 4.35Å; V80-I87 HydrophobicContact CG1-CG2 4.01Å; E81-I87 WeakPolarHBondContact O-CA 3.45Å; V82-I87 HydrophobicContact CB-CG1 4.21Å; V82-I87 HydrophobicContact CG1-CD1 4.4Å; V82-I87 HydrophobicContact CG1-CG1 3.98Å; V82-I87 HydrophobicContact CG2-CD1 3.89Å; V82-I87 HydrophobicContact CG2-CG1 3.85Å; I87-S99 CarbonylContact O-C 3.57Å; I87-S99 WeakPolarHBondContact O-CA 3.21Å; I87-A100 PolarHBondContact N-O 3.22Å; I87-A100 PolarHBondContact O-N 3.1Å; I87-L108 HydrophobicContact CD1-CD2 3.18Å; I87-L108 HydrophobicContact CG1-CD2 3.63Å; I87-V117 HydrophobicContact CD1-CG1 3.66Å; I87-I119 HydrophobicContact CG2-CB 4.23Å; I87-I119 HydrophobicContact CG2-CD1 3.3Å; I87-I119 HydrophobicContact CG2-CG1 3.44Å; I87-I119 VanDerWaalsContact CG2-CG1 3.44Å; I87-I119 HydrophobicContact CG2-CG2 3.84Å
88	K	88.7	Confident	84.6	Confident	50 Å²	50	53.9 Å²	53.9	22%	0.217	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130	174.4	-56.5	-178.2	-155.8	137.5	0	109.6	V80 E81 I86 I90 V96 A98	V80-K88 CarbonylContact C-O 3.47Å; V80-K88 WeakPolarHBondContact CA-O 3.45Å; E81-K88 HydrophobicContact CB-CB 4.39Å; E81-K88 PolarHBondContact N-O 3.43Å; E81-K88 PolarHBondContact O-N 3.05Å; E81-K88 IonicContact OE2-NZ 3.1Å; E81-K88 PolarHBondContact OE2-NZ 3.42Å; I86-K88 HydrophobicContact CG2-CG 4.1Å; K88-I90 HydrophobicContact CB-CG1 4.41Å; K88-V96 HydrophobicContact CB-CG1 4.25Å; K88-V96 HydrophobicContact CD-CG2 4.49Å; K88-A98 CarbonylContact C-O 3.55Å; K88-A98 WeakPolarHBondContact CA-O 3.27Å
89	L	90.4	Very high	84.4	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	126.3	167	-178.4	66.1	0	0	0	108.6	Y63 F79 V80 V96 I97 A98 I119 Y122 A124	Y63-L89 HydrophobicContact CD1-CD1 4.02Å; Y63-L89 HydrophobicContact CD1-CD2 4.25Å; Y63-L89 HydrophobicContact CD1-CG 4.42Å; Y63-L89 HydrophobicContact CD2-CD2 4.04Å; Y63-L89 HydrophobicContact CG-CD1 4.14Å; Y63-L89 HydrophobicContact CG-CD2 3.74Å; Y63-L89 HydrophobicContact CG-CG 4.38Å; F79-L89 CarbonylContact O-C 3.53Å; V80-L89 HydrophobicContact CG2-CD1 3.78Å; L89-V96 CarbonylContact O-C 3.53Å; L89-V96 WeakPolarHBondContact O-CA 3.32Å; L89-I97 HydrophobicContact CD2-CB 4.22Å; L89-I97 HydrophobicContact CD2-CD1 4.25Å; L89-I97 HydrophobicContact CD2-CG2 4.32Å; L89-I97 HydrophobicContact CG-CB 4.32Å; L89-I97 HydrophobicContact CG-CD1 4.2Å; L89-I97 PolarHBondContact O-N 3.07Å; L89-A98 HydrophobicContact CB-CB 4.34Å; L89-A98 PolarHBondContact N-O 2.83Å; L89-A98 PolarHBondContact O-N 3.45Å; L89-I119 HydrophobicContact CB-CD1 3.88Å; L89-I119 HydrophobicContact CB-CG2 4.18Å; L89-I119 HydrophobicContact CD1-CD1 4.42Å; L89-Y122 HydrophobicContact CD2-CG 4.06Å; L89-A124 HydrophobicContact CD1-CB 4.08Å
90	I	89.1	Confident	84	Confident	9 Å²	9	55.8 Å²	55.8	5%	0.046	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	129.8	-174.2	-58.8	170.6	0	0	0	107.6	Y58 G78 F79 E81 K88 L94 K95 V96	Y58-I90 WeakPolarHBondContact OH-CD1 3.43Å; G78-I90 CarbonylContact C-O 3.56Å; G78-I90 VanDerWaalsContact CA-O 3.25Å; G78-I90 WeakPolarHBondContact CA-O 3.47Å; F79-I90 HydrophobicContact CB-CB 4.38Å; F79-I90 PolarHBondContact N-O 3.32Å; F79-I90 PolarHBondContact O-N 2.8Å; E81-I90 HydrophobicContact CB-CD1 4.12Å; K88-I90 HydrophobicContact CB-CG1 4.41Å; I90-L94 HydrophobicContact CG2-CD2 4.48Å; I90-K95 CarbonylContact C-O 3.58Å; I90-K95 WeakPolarHBondContact CA-O 3.23Å; I90-V96 HydrophobicContact CG1-CG2 4.14Å
91	N	86.6	Confident	83.4	Confident	40 Å²	40	60.7 Å²	60.7	21%	0.214	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	172.2	176.8	-155.2	1.1	0	0	0	111.7	Y63 D77 D93 L94 K95 I97	Y63-N91 PolarHBondContact OH-OD1 3.43Å; D77-N91 PolarHBondContact O-OD1 3.42Å; N91-D93 PolarHBondContact O-N 3.45Å; N91-D93 VanDerWaalsContact O-N 3.17Å; N91-L94 PolarHBondContact O-N 3.03Å; N91-K95 PolarHBondContact N-O 3.32Å; N91-I97 HydrophobicContact CB-CD1 3.59Å; N91-I97 HydrophobicContact CB-CG1 3.9Å
92	E	83.8	Confident	82.4	Confident	126 Å²	126	63.5 Å²	63.5	59%	0.589	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-33.8	169.3	-63.1	-175.1	149.6	0	0	113	D77 L94	D77-E92 WeakPolarHBondContact O-CG 3.21Å; E92-L94 PolarHBondContact O-N 3.01Å
93	D	79.9	Confident	81.3	Confident	121 Å²	121	65.5 Å²	65.5	65%	0.647	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	8.1	175.1	-68.1	-33.2	0	0	0	114.5	N91 K95	N91-D93 PolarHBondContact O-N 3.45Å; N91-D93 VanDerWaalsContact O-N 3.17Å; D93-K95 PolarHBondContact O-N 3.37Å; D93-K95 VanDerWaalsContact O-N 3.11Å
94	L	77.2	Confident	80.4	Confident	80 Å²	80	70.9 Å²	70.9	42%	0.419	39%	0.387	S	S	.	.	S	Bend	trans	57.7	20.7	-174	-61.3	170.9	0	0	0	114.5	I90 N91 E92 P133 L135	I90-L94 HydrophobicContact CG2-CD2 4.48Å; N91-L94 PolarHBondContact O-N 3.03Å; E92-L94 PolarHBondContact O-N 3.01Å; L94-P133 HydrophobicContact CD2-CG 4Å; L94-L135 HydrophobicContact CD1-CD1 4.47Å
95	K	82.9	Confident	79.8	Confident	147 Å²	147	72.6 Å²	72.6	64%	0.639	39%	0.386	S	S	*	.			trans	-92.4	132	173.4	-72.9	-179.1	-178.1	169.1	0	110.9	I90 N91 D93 I97	I90-K95 CarbonylContact C-O 3.58Å; I90-K95 WeakPolarHBondContact CA-O 3.23Å; N91-K95 PolarHBondContact N-O 3.32Å; D93-K95 PolarHBondContact O-N 3.37Å; D93-K95 VanDerWaalsContact O-N 3.11Å; K95-I97 PolarHBondContact O-N 3.27Å
96	V	86	Confident	78.8	Confident	84 Å²	84	67.7 Å²	67.7	51%	0.509	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	115.2	175.1	-176.5	0	0	0	0	109.7	K88 L89 I90	K88-V96 HydrophobicContact CB-CG1 4.25Å; K88-V96 HydrophobicContact CD-CG2 4.49Å; L89-V96 CarbonylContact O-C 3.53Å; L89-V96 WeakPolarHBondContact O-CA 3.32Å; I90-V96 HydrophobicContact CG1-CG2 4.14Å
97	I	84.8	Confident	78.1	Confident	54 Å²	54	69.1 Å²	69.1	28%	0.277	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-44.5	177.9	-60	163.3	0	0	0	110.6	Y63 L89 N91 K95 Y122	Y63-I97 HydrophobicContact CD1-CD1 4.28Å; Y63-I97 HydrophobicContact CD2-CD1 4.43Å; Y63-I97 HydrophobicContact CE1-CD1 3.6Å; Y63-I97 HydrophobicContact CE2-CD1 3.83Å; Y63-I97 WeakPolarHBondContact OH-CD1 3.33Å; L89-I97 HydrophobicContact CD2-CB 4.22Å; L89-I97 HydrophobicContact CD2-CD1 4.25Å; L89-I97 HydrophobicContact CD2-CG2 4.32Å; L89-I97 HydrophobicContact CG-CB 4.32Å; L89-I97 HydrophobicContact CG-CD1 4.2Å; L89-I97 PolarHBondContact O-N 3.07Å; N91-I97 HydrophobicContact CB-CD1 3.59Å; N91-I97 HydrophobicContact CB-CG1 3.9Å; K95-I97 PolarHBondContact O-N 3.27Å; I97-Y122 HydrophobicContact CG2-CD2 4.02Å; I97-Y122 HydrophobicContact CG2-CE1 4.27Å; I97-Y122 HydrophobicContact CG2-CE2 3.52Å
98	A	83.7	Confident	77	Confident	13 Å²	13	69.7 Å²	69.7	11%	0.107	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	147.3	-177.8	0	0	0	0	0	110.2	K88 L89 I119 Y122	K88-A98 CarbonylContact C-O 3.55Å; K88-A98 WeakPolarHBondContact CA-O 3.27Å; L89-A98 HydrophobicContact CB-CB 4.34Å; L89-A98 PolarHBondContact N-O 2.83Å; L89-A98 PolarHBondContact O-N 3.45Å; A98-I119 HydrophobicContact CB-CG2 3.83Å; A98-I119 WeakPolarHBondContact CB-O 3.35Å; A98-Y122 HydrophobicContact CB-CD2 3.88Å
99	S	85.4	Confident	75.8	Confident	72 Å²	72	73.4 Å²	73.4	50%	0.503	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	129.5	174.2	-175.8	0	0	0	0	108.1	I87	I87-S99 CarbonylContact O-C 3.57Å; I87-S99 WeakPolarHBondContact O-CA 3.21Å
100	A	81.6	Confident	74.8	Confident	17 Å²	17	80.5 Å²	80.5	14%	0.14	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	134.9	174.8	0	0	0	0	0	109.3	I86 I87 I119	I86-A100 WeakPolarHBondContact CA-O 3.44Å; I87-A100 PolarHBondContact N-O 3.22Å; I87-A100 PolarHBondContact O-N 3.1Å; A100-I119 HydrophobicContact CB-CG2 4.2Å
101	S	77.4	Confident	73.8	Confident	102 Å²	102	80.8 Å²	80.8	71%	0.713	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	143.7	170.4	63.5	0	0	0	0	108.5
102	G	65	Low	73.1	Confident	66 Å²	66	84.6 Å²	84.6	68%	0.68	47%	0.466	S	S	*	.			trans	112	4.2	174.2	0	0	0	0	0	116.5	R85	R85-G102 PolarHBondContact O-N 3.14Å
103	H	63.7	Low	72.9	Confident	53 Å²	53	83.9 Å²	83.9	25%	0.245	47%	0.465	C	S	.	.			trans	-63.4	141.2	169	-77.2	-65.5	0	0	0	110.6	L105 L108 H118	H103-L105 PolarHBondContact O-N 2.89Å; H103-L108 HydrophobicContact CB-CD1 3.8Å; H103-L108 HydrophobicContact CB-CD2 4.03Å; H103-L108 HydrophobicContact CB-CG 3.79Å; H103-H118 PolarHBondContact NE2-O 3.4Å
104	K	60.1	Low	72.7	Confident	177 Å²	177	80.1 Å²	80.1	77%	0.77	46%	0.455	S	S	*	.			trans	-60.4	132.2	176.2	-78.8	-178.3	179	176.6	0	108.7	A106 F107 L108	K104-A106 PolarHBondContact O-N 3.29Å; K104-A106 VanDerWaalsContact O-N 3.11Å; K104-F107 WeakPolarHBondContact O-CB 3.43Å; K104-F107 PolarHBondContact O-N 3.49Å; K104-L108 PolarHBondContact O-N 3.03Å
105	L	61.3	Low	72.9	Confident	79 Å²	79	78.1 Å²	78.1	41%	0.414	45%	0.447	S	S	.	.	H	α-helix	trans	-55.8	-32.3	-179.1	-147.2	84.6	0	0	0	112.3	R85 H103 L108 N109	R85-L105 HydrophobicContact CG-CD1 3.44Å; R85-L105 VanDerWaalsContact CG-CD1 3.44Å; H103-L105 PolarHBondContact O-N 2.89Å; L105-L108 PolarHBondContact O-N 3.45Å; L105-N109 WeakPolarHBondContact O-CB 3.08Å; L105-N109 PolarHBondContact O-N 3.38Å
106	A	60.4	Low	73	Confident	63 Å²	63	74 Å²	74	52%	0.521	44%	0.435	S	S	.	.	H	α-helix	trans	-61.9	-43.7	174.8	0	0	0	0	0	112.6	K104 N109 E110	K104-A106 PolarHBondContact O-N 3.29Å; K104-A106 VanDerWaalsContact O-N 3.11Å; A106-N109 PolarHBondContact O-N 3.48Å; A106-E110 WeakPolarHBondContact O-CG 3.25Å; A106-E110 PolarHBondContact O-N 3.36Å
107	F	65.6	Low	73	Confident	98 Å²	98	70 Å²	70	43%	0.43	41%	0.411	S	S	.	.	H	α-helix	trans	-66.8	-39.6	178.2	178.2	-100.8	0	0	0	111.6	K104 N109 E110 V111 V117	K104-F107 WeakPolarHBondContact O-CB 3.43Å; K104-F107 PolarHBondContact O-N 3.49Å; F107-N109 VanDerWaalsContact C-N 3.34Å; F107-E110 PolarHBondContact O-N 3.29Å; F107-V111 WeakPolarHBondContact O-CG2 3.39Å; F107-V111 PolarHBondContact O-N 3.38Å; F107-V117 HydrophobicContact CE1-CG1 4.32Å
108	L	64	Low	73	Confident	12 Å²	12	72.3 Å²	72.3	6%	0.063	42%	0.42	C	S	.	.	H	α-helix	trans	-71.8	-26.2	179.5	-69.4	176.8	0	0	0	113.8	V82 G84 I87 H103 K104 L105	V82-L108 HydrophobicContact CG1-CB 4.3Å; V82-L108 HydrophobicContact CG1-CD2 4.12Å; G84-L108 WeakPolarHBondContact O-CD1 3.21Å; I87-L108 HydrophobicContact CD1-CD2 3.18Å; I87-L108 HydrophobicContact CG1-CD2 3.63Å; H103-L108 HydrophobicContact CB-CD1 3.8Å; H103-L108 HydrophobicContact CB-CD2 4.03Å; H103-L108 HydrophobicContact CB-CG 3.79Å; K104-L108 PolarHBondContact O-N 3.03Å; L105-L108 PolarHBondContact O-N 3.45Å
109	N	63.9	Low	73.1	Confident	129 Å²	129	71.7 Å²	71.7	69%	0.69	42%	0.415	S	S	*	.	H	α-helix	trans	-83.7	-17.3	175.6	-76	-4.8	0	0	0	113.1	L105 A106 F107	L105-N109 WeakPolarHBondContact O-CB 3.08Å; L105-N109 PolarHBondContact O-N 3.38Å; A106-N109 PolarHBondContact O-N 3.48Å; F107-N109 VanDerWaalsContact C-N 3.34Å
110	E	68	Low	72.9	Confident	148 Å²	148	71.2 Å²	71.2	69%	0.692	42%	0.422	S	S	*	.	S	Bend	trans	-102.1	12.7	179.1	-73.2	178.7	172.1	0	0	113	A106 F107 D112	A106-E110 WeakPolarHBondContact O-CG 3.25Å; A106-E110 PolarHBondContact O-N 3.36Å; F107-E110 PolarHBondContact O-N 3.29Å; E110-D112 PolarHBondContact O-N 3.22Å
111	V	68.6	Low	73.1	Confident	16 Å²	16	73.9 Å²	73.9	10%	0.097	44%	0.439	C	S	.	.			trans	-76.8	102	-178.7	-159.5	0	0	0	0	110.3	F107 V117 L126	F107-V111 WeakPolarHBondContact O-CG2 3.39Å; F107-V111 PolarHBondContact O-N 3.38Å; V111-V117 HydrophobicContact CG1-CG2 3.85Å; V111-L126 HydrophobicContact CB-CD1 4.31Å; V111-L126 HydrophobicContact CG1-CD1 3.36Å; V111-L126 HydrophobicContact CG1-CG 4.42Å
112	D	72.5	Confident	73.7	Confident	120 Å²	120	71.2 Å²	71.2	64%	0.642	41%	0.414	S	S	*	.			trans	-84.5	158.6	173.3	-74.8	-33.1	0	0	0	112	E110 G114 S115	E110-D112 PolarHBondContact O-N 3.22Å; D112-G114 PolarHBondContact O-N 3.36Å; D112-S115 PolarHBondContact N-OG 2.99Å; D112-S115 WeakPolarHBondContact O-CB 3.32Å; D112-S115 PolarHBondContact O-N 3.1Å; D112-S115 VanDerWaalsContact O-N 3.08Å; D112-S115 PolarHBondContact O-OG 3.46Å
113	I	78.6	Confident	74.9	Confident	110 Å²	110	68.1 Å²	68.1	56%	0.564	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	132.9	169.8	-62.6	166.7	0	0	0	109.2	I127	I113-I127 WeakPolarHBondContact CG2-O 3.37Å
114	G	76.7	Confident	76	Confident	42 Å²	42	65.6 Å²	65.6	43%	0.433	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.6	-6.2	-173.2	0	0	0	0	0	114.6	D112 L126	D112-G114 PolarHBondContact O-N 3.36Å; G114-L126 PolarHBondContact N-O 2.85Å
115	S	81.5	Confident	77.4	Confident	38 Å²	38	60.6 Å²	60.6	27%	0.266	35%	0.349	S	S	.	.			trans	-74.6	136.2	175.7	-55.4	0	0	0	0	111.6	D112 L126	D112-S115 PolarHBondContact N-OG 2.99Å; D112-S115 WeakPolarHBondContact O-CB 3.32Å; D112-S115 PolarHBondContact O-N 3.1Å; D112-S115 VanDerWaalsContact O-N 3.08Å; D112-S115 PolarHBondContact O-OG 3.46Å; S115-L126 PolarHBondContact O-N 3.27Å; S115-L126 VanDerWaalsContact O-N 3.12Å
116	V	85.1	Confident	78.7	Confident	62 Å²	62	56.9 Å²	56.9	38%	0.376	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	112	173.1	-176.4	0	0	0	0	110.1	E123 A124 E125	V116-E123 HydrophobicContact CG1-CB 4Å; V116-A124 CarbonylContact C-O 3.46Å; V116-A124 WeakPolarHBondContact CA-O 3.48Å; V116-E125 HydrophobicContact CG2-CB 4.15Å; V116-E125 HydrophobicContact CG2-CG 4.19Å
117	V	84.6	Confident	79.9	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	131.7	-177.2	-158.9	0	0	0	0	110.5	I87 F107 V111 E123 A124 L126	I87-V117 HydrophobicContact CD1-CG1 3.66Å; F107-V117 HydrophobicContact CE1-CG1 4.32Å; V111-V117 HydrophobicContact CG1-CG2 3.85Å; V117-E123 CarbonylContact O-C 3.58Å; V117-E123 WeakPolarHBondContact O-CA 3.25Å; V117-A124 PolarHBondContact N-O 3.24Å; V117-A124 PolarHBondContact O-N 2.94Å; V117-L126 HydrophobicContact CG2-CD1 3.98Å; V117-L126 HydrophobicContact CG2-CD2 4.13Å; V117-L126 HydrophobicContact CG2-CG 3.89Å
118	H	85.3	Confident	80.8	Confident	101 Å²	101	54.6 Å²	54.6	47%	0.468	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	122.1	176.6	-74.4	63.2	0	0	0	111.1	H103 E123	H103-H118 PolarHBondContact NE2-O 3.4Å; H118-E123 IonicContact CE1-OE2 3.63Å; H118-E123 IonicContact NE2-OE2 2.8Å
119	I	85.8	Confident	81.8	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	89.5	-175.1	-44.1	178.1	0	0	0	109.1	V80 I87 L89 A98 A100 S121 Y122 A124	V80-I119 HydrophobicContact CG1-CD1 4.01Å; V80-I119 HydrophobicContact CG2-CD1 3.77Å; I87-I119 HydrophobicContact CG2-CB 4.23Å; I87-I119 HydrophobicContact CG2-CD1 3.3Å; I87-I119 HydrophobicContact CG2-CG1 3.44Å; I87-I119 VanDerWaalsContact CG2-CG1 3.44Å; I87-I119 HydrophobicContact CG2-CG2 3.84Å; L89-I119 HydrophobicContact CB-CD1 3.88Å; L89-I119 HydrophobicContact CB-CG2 4.18Å; L89-I119 HydrophobicContact CD1-CD1 4.42Å; A98-I119 HydrophobicContact CB-CG2 3.83Å; A98-I119 WeakPolarHBondContact CB-O 3.35Å; A100-I119 HydrophobicContact CB-CG2 4.2Å; I119-S121 PolarHBondContact O-N 3.4Å; I119-Y122 CarbonylContact C-O 3.57Å; I119-Y122 PolarHBondContact N-O 2.81Å; I119-Y122 PolarHBondContact O-N 3.16Å; I119-A124 HydrophobicContact CD1-CB 4.13Å
120	G	82.5	Confident	82.5	Confident	63 Å²	63	56.2 Å²	56.2	65%	0.649	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	-117.1	-176.5	0	0	0	0	0	111.6
121	S	84.5	Confident	82.8	Confident	73 Å²	73	57.7 Å²	57.7	51%	0.51	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-3.1	175.1	54.5	0	0	0	0	114	A66 I119	A66-S121 PolarHBondContact N-O 3.46Å; I119-S121 PolarHBondContact O-N 3.4Å
122	Y	89.8	Confident	82.9	Confident	45 Å²	45	62.5 Å²	62.5	18%	0.176	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	151.6	-178.4	-64.3	-89.4	0	0	0	110.8	Y63 A64 K65 L89 I97 A98 I119	Y63-Y122 AromaticContact CD2-CD1 3.92Å; Y63-Y122 HydrophobicContact CD2-CD1 3.92Å; Y63-Y122 HydrophobicContact CD2-CE1 4.29Å; Y63-Y122 HydrophobicContact CE2-CE1 4.43Å; A64-Y122 CarbonylContact O-C 3.55Å; A64-Y122 VanDerWaalsContact O-CA 3.22Å; A64-Y122 WeakPolarHBondContact O-CA 3.29Å; K65-Y122 HydrophobicContact CG-CD1 4.1Å; K65-Y122 HydrophobicContact CG-CE1 3.79Å; L89-Y122 HydrophobicContact CD2-CG 4.06Å; I97-Y122 HydrophobicContact CG2-CD2 4.02Å; I97-Y122 HydrophobicContact CG2-CE1 4.27Å; I97-Y122 HydrophobicContact CG2-CE2 3.52Å; A98-Y122 HydrophobicContact CB-CD2 3.88Å; I119-Y122 CarbonylContact C-O 3.57Å; I119-Y122 PolarHBondContact N-O 2.81Å; I119-Y122 PolarHBondContact O-N 3.16Å
123	E	89.8	Confident	82.2	Confident	2 Å²	2	60 Å²	60	1%	0.009	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	137.4	165.5	59.8	-170.1	157.3	0	0	107.9	Y63 A64 A66 S67 K72 W74 V116 V117 H118	Y63-E123 CarbonylContact C-O 3.47Å; Y63-E123 VanDerWaalsContact CA-O 3.28Å; Y63-E123 WeakPolarHBondContact CA-O 3.49Å; A64-E123 HydrophobicContact CB-CG 4.31Å; A64-E123 PolarHBondContact N-O 3.11Å; A64-E123 PolarHBondContact O-N 2.95Å; A66-E123 WeakPolarHBondContact CA-OE1 3.31Å; S67-E123 PolarHBondContact N-OE1 3.06Å; K72-E123 WeakPolarHBondContact CD-OE1 3.48Å; K72-E123 WeakPolarHBondContact CE-OE1 3.06Å; K72-E123 IonicContact NZ-OE1 2.83Å; K72-E123 PolarHBondContact NZ-OE1 3.08Å; K72-E123 IonicContact NZ-OE2 3.7Å; K72-E123 PolarHBondContact NZ-OE2 3.38Å; W74-E123 HydrophobicContact CZ3-CG 4.34Å; V116-E123 HydrophobicContact CG1-CB 4Å; V117-E123 CarbonylContact O-C 3.58Å; V117-E123 WeakPolarHBondContact O-CA 3.25Å; H118-E123 IonicContact CE1-OE2 3.63Å; H118-E123 IonicContact NE2-OE2 2.8Å
124	A	88.5	Confident	80.7	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	125.3	-177.6	0	0	0	0	0	109.8	A61 V62 V80 L89 V116 V117 I119	A61-A124 HydrophobicContact CB-CB 4.05Å; V62-A124 CarbonylContact O-C 3.57Å; V62-A124 WeakPolarHBondContact O-CA 3.07Å; V80-A124 HydrophobicContact CG2-CB 3.9Å; L89-A124 HydrophobicContact CD1-CB 4.08Å; V116-A124 CarbonylContact C-O 3.46Å; V116-A124 WeakPolarHBondContact CA-O 3.48Å; V117-A124 PolarHBondContact N-O 3.24Å; V117-A124 PolarHBondContact O-N 2.94Å; I119-A124 HydrophobicContact CD1-CB 4.13Å
125	E	88.9	Confident	78.9	Confident	71 Å²	71	68.6 Å²	68.6	33%	0.332	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	120.4	173	-174.8	176.7	171.4	0	0	109.1	A61 V62 W74 V116	A61-E125 CarbonylContact C-O 3.58Å; A61-E125 WeakPolarHBondContact CA-O 3.25Å; A61-E125 WeakPolarHBondContact CB-O 3.44Å; V62-E125 PolarHBondContact N-O 3.23Å; V62-E125 PolarHBondContact O-N 3.48Å; W74-E125 HydrophobicContact CH2-CB 3.54Å; W74-E125 HydrophobicContact CZ2-CB 3.76Å; W74-E125 WeakPolarHBondContact CZ2-OE2 3.5Å; W74-E125 HydrophobicContact CZ3-CB 4.24Å; V116-E125 HydrophobicContact CG2-CB 4.15Å; V116-E125 HydrophobicContact CG2-CG 4.19Å
126	L	88.1	Confident	76.5	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.01	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	123.3	-177.8	-54.2	-172.7	0	0	0	110.9	F59 E60 A61 V80 V111 G114 S115 V117	F59-L126 HydrophobicContact CB-CB 4.39Å; F59-L126 HydrophobicContact CB-CD1 4.24Å; F59-L126 HydrophobicContact CB-CD2 3.8Å; F59-L126 HydrophobicContact CB-CG 4.37Å; F59-L126 HydrophobicContact CD1-CB 4.38Å; F59-L126 HydrophobicContact CD1-CD1 3.86Å; F59-L126 HydrophobicContact CD2-CD1 3.96Å; F59-L126 HydrophobicContact CE1-CD1 4.11Å; F59-L126 HydrophobicContact CE2-CD1 4.2Å; F59-L126 HydrophobicContact CG-CD1 3.77Å; F59-L126 HydrophobicContact CG-CD2 4.23Å; F59-L126 HydrophobicContact CG-CG 4.41Å; F59-L126 HydrophobicContact CZ-CD1 4.27Å; E60-L126 CarbonylContact O-C 3.56Å; A61-L126 HydrophobicContact CB-CD2 3.85Å; V80-L126 HydrophobicContact CB-CD2 3.82Å; V80-L126 HydrophobicContact CG1-CD2 4.19Å; V80-L126 HydrophobicContact CG2-CD2 3.86Å; V111-L126 HydrophobicContact CB-CD1 4.31Å; V111-L126 HydrophobicContact CG1-CD1 3.36Å; V111-L126 HydrophobicContact CG1-CG 4.42Å; G114-L126 PolarHBondContact N-O 2.85Å; S115-L126 PolarHBondContact O-N 3.27Å; S115-L126 VanDerWaalsContact O-N 3.12Å; V117-L126 HydrophobicContact CG2-CD1 3.98Å; V117-L126 HydrophobicContact CG2-CD2 4.13Å; V117-L126 HydrophobicContact CG2-CG 3.89Å
127	I	85.8	Confident	73.7	Confident	77 Å²	77	76.9 Å²	76.9	40%	0.395	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-48	-175.1	-50.1	171	0	0	0	111.8	E60 V62 I113	E60-I127 HydrophobicContact CB-CB 4.35Å; E60-I127 HydrophobicContact CG-CD1 4.35Å; E60-I127 PolarHBondContact O-N 2.77Å; V62-I127 HydrophobicContact CG2-CD1 3.4Å; V62-I127 VanDerWaalsContact CG2-CD1 3.4Å; V62-I127 HydrophobicContact CG2-CG1 3.76Å; I113-I127 WeakPolarHBondContact CG2-O 3.37Å
128	S	84.8	Confident	71.1	Confident	36 Å²	36	84.7 Å²	84.7	25%	0.252	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	154.6	-173.7	81.1	0	0	0	0	111.1	F59 E60	F59-S128 CarbonylContact C-O 3.46Å; F59-S128 WeakPolarHBondContact CA-O 3.37Å; E60-S128 VanDerWaalsContact CB-OG 3.28Å; E60-S128 WeakPolarHBondContact CB-OG 3.32Å; E60-S128 PolarHBondContact N-O 3.04Å; E60-S128 PolarHBondContact OE2-OG 3.2Å
129	L	84.4	Confident	68.2	Low	110 Å²	110	84.7 Å²	84.7	58%	0.576	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	129.1	173.5	-171.2	88.9	0	0	0	108.9	F59	F59-L129 HydrophobicContact CD1-CB 4.38Å; F59-L129 HydrophobicContact CD1-CD1 3.71Å; F59-L129 HydrophobicContact CE1-CB 4.48Å; F59-L129 HydrophobicContact CE1-CD1 3.36Å; F59-L129 HydrophobicContact CE2-CD1 4.25Å; F59-L129 HydrophobicContact CG-CD1 4.29Å; F59-L129 HydrophobicContact CZ-CD1 3.67Å
130	I	79.5	Confident	65.4	Low	64 Å²	64	90 Å²	90	33%	0.328	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	158.3	-177.1	-15.7	175	0	0	0	111.2	Y58 E60 F79	Y58-I130 VanDerWaalsContact CB-O 3.29Å; Y58-I130 WeakPolarHBondContact CB-O 3.38Å; Y58-I130 PolarHBondContact O-N 3.26Å; E60-I130 HydrophobicContact CB-CD1 3.62Å; E60-I130 HydrophobicContact CB-CG1 4.04Å; E60-I130 HydrophobicContact CG-CD1 4.13Å; F79-I130 HydrophobicContact CD1-CD1 3.57Å; F79-I130 HydrophobicContact CE1-CD1 3.5Å
131	E	74.4	Confident	62.9	Low	180 Å²	180	97.2 Å²	97.2	84%	0.841	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-80.1	146.5	166.3	-70.3	-173.6	165.9	0	0	111.5
132	K	69.7	Low	60.2	Low	116 Å²	116	98.2 Å²	98.2	50%	0.504	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-64.4	122.9	-175.6	-172.3	169	-178.5	164.8	0	111.4	Y58 E81 Q134	Y58-K132 HydrophobicContact CD2-CB 4.2Å; Y58-K132 HydrophobicContact CD2-CD 4.29Å; Y58-K132 HydrophobicContact CD2-CG 4.12Å; Y58-K132 HydrophobicContact CE2-CB 4.37Å; Y58-K132 HydrophobicContact CE2-CD 3.94Å; Y58-K132 HydrophobicContact CE2-CG 3.79Å; E81-K132 WeakPolarHBondContact OE1-CE 3.39Å; E81-K132 IonicContact OE1-NZ 2.67Å; E81-K132 PolarHBondContact OE1-NZ 3.29Å; K132-Q134 PolarHBondContact O-N 3.17Å
133	P	58.2	Low	57.3	Low	69 Å²	69	102.2 Å²	102.2	45%	0.448	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-67.5	129.7	180	23.8	-30.8	0	0	0	111.7	L94	L94-P133 HydrophobicContact CD2-CG 4Å
134	Q	47.5	Very low	54.4	Low	186 Å²	186	108.4 Å²	108.4	87%	0.869	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-91.5	126.4	175.7	-65.9	-174.6	-1.4	0	0	110.9	K132 V136	K132-Q134 PolarHBondContact O-N 3.17Å; Q134-V136 PolarHBondContact O-N 3.08Å
135	L	37.6	Very low	51.8	Low	145 Å²	145	114.7 Å²	114.7	76%	0.759	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-71.5	118.1	172.1	-97.4	145.4	0	0	0	110.6	L94 N137	L94-L135 HydrophobicContact CD1-CD1 4.47Å; L135-N137 PolarHBondContact O-N 3.06Å
136	V	31.4	Very low	49	Very low	122 Å²	122	119.4 Å²	119.4	74%	0.739	63%	0.634	S	S	*	*			trans	-80.6	109.2	170.7	-177.9	0	0	0	0	108.9	Q134 I138	Q134-V136 PolarHBondContact O-N 3.08Å; V136-I138 HydrophobicContact CG1-CG1 4.37Å; V136-I138 PolarHBondContact O-N 2.94Å
137	N	26.4	Very low	46.1	Very low	153 Å²	153	123.5 Å²	123.5	82%	0.818	67%	0.669	S	S	*	*			trans	-76	114.9	172.2	-83.1	-24	0	0	0	110.4	L135	L135-N137 PolarHBondContact O-N 3.06Å
138	I	29.5	Very low	43.5	Very low	164 Å²	164	127.3 Å²	127.3	84%	0.841	69%	0.689	S	S	*	*			trans	-108	101.3	162.4	-61.7	176.8	0	0	0	107.6	V136	V136-I138 HydrophobicContact CG1-CG1 4.37Å; V136-I138 PolarHBondContact O-N 2.94Å
139	S	25	Very low	41	Very low	100 Å²	100	133.9 Å²	133.9	70%	0.699	72%	0.715	S	S	*	*			trans	-83.5	155.1	172.5	54.7	0	0	0	0	112.1
140	S	27.5	Very low	38.4	Very low	111 Å²	111	132.3 Å²	132.3	78%	0.776	72%	0.718	S	S	*	*			trans	94.1	103.8	158.3	77.3	0	0	0	0	118.1
141	K	30.5	Very low	36.1	Very low	216 Å²	216	135.3 Å²	135.3	94%	0.939	74%	0.742	S	S	*	*				-158.5	133.6	116.3	-102.6	170.1	-174	179.3	0	110.1
142	S	26.3	Very low	33.9	Very low	93 Å²	93	132.5 Å²	132.5	65%	0.65	74%	0.737	S	S	*	*			trans	-104.9	179.5	-162.5	53.9	0	0	0	0	112.4
143	N	29.8	Very low	32.1	Very low	130 Å²	130	136.3 Å²	136.3	70%	0.695	76%	0.756	S	S	*	*			trans	88.4	135.8	160	-53.6	-6.4	0	0	0	113.4
144	N	29.3	Very low	30.6	Very low	131 Å²	131	140.1 Å²	140.1	70%	0.701	77%	0.773	S	S	*	*			cis	177	137	16.4	-110.6	-0.1	0	0	0	104.3
145	I	32.9	Very low	29.7	Very low	132 Å²	132	135.9 Å²	135.9	68%	0.677	76%	0.763	S	S	*	*				162.2	130.6	93	-96.3	144.4	0	0	0	109.4
146	E	29.8	Very low	29.3	Very low	170 Å²	170	134.5 Å²	134.5	79%	0.794	76%	0.761	S	S	*	*			trans	47.2	117.8	140.6	-57	161.2	179.4	0	0	120.1
147	A	28	Very low	29.2	Very low	89 Å²	89	139.8 Å²	139.8	74%	0.736	77%	0.768	S	S	*	*				62.3	115.8	55.4	0	0	0	0	0	115.3
148	L	30.9	Very low	29.2	Very low	156 Å²	156	142.2 Å²	142.2	82%	0.817	77%	0.771	S	S	*	*			trans	169.5	120.4	132.1	-85.8	153.3	0	0	0	112
149	H	31.6	Very low	29.2	Very low	175 Å²	175	140.2 Å²	140.2	81%	0.81	77%	0.769	S	S	*	*			trans	42.7	149.3	134.6	-71.9	-99.3	0	0	0	121.2
150	A	30.8	Very low	29.3	Very low	77 Å²	77	140.7 Å²	140.7	64%	0.636	77%	0.772	S	S	*	*			cis	169.9	-167.3	-1.7	0	0	0	0	0	104.4
151	P	31.8	Very low	29.4	Very low	127 Å²	127	140.1 Å²	140.1	83%	0.825	77%	0.774	S	S	*	*			cis	-130.2	-176.2	-48.2	28	-6	0	0	0	113.4
152	V	27.2	Very low	29.3	Very low	121 Å²	121	139.3 Å²	139.3	73%	0.733	77%	0.771	S	S	*	*			trans	-65.9	141	169.3	172.8	0	0	0	0	113
153	E	32.1	Very low	29.5	Very low	196 Å²	196	140.3 Å²	140.3	92%	0.916	78%	0.775	S	S	*	*			trans	-135.8	137.1	150.5	-86.4	-165.5	165.7	0	0	112.3
154	N	26.2	Very low	29.4	Very low	149 Å²	149	139.3 Å²	139.3	80%	0.797	78%	0.778	S	S	*	*			trans	-85.2	160.6	-176.7	-84.7	-41.4	0	0	0	112.6
155	S	29.8	Very low	29.4	Very low	96 Å²	96	142.5 Å²	142.5	67%	0.671	79%	0.786	S	S	*	*				118	120.5	127.9	-152.9	0	0	0	0	117.9
156	T	28.2	Very low	29.3	Very low	117 Å²	117	140.5 Å²	140.5	72%	0.718	78%	0.784	S	S	*	*			trans	90.4	122	138	47.7	0	0	0	0	122.9
157	R	29.6	Very low	29.2	Very low	232 Å²	232	138.5 Å²	138.5	88%	0.875	79%	0.785	S	S	*	*			trans	98.1	105.7	141.1	-72.1	164.9	-175.2	-161.4	2.5	118.7
158	K	26.1	Very low	29.2	Very low	204 Å²	204	144 Å²	144	89%	0.887	79%	0.793	S	S	*	*			trans	-52.2	155.5	152.6	-74.2	176.9	173.7	174.7	0	110.7
159	P	29.8	Very low	28.9	Very low	122 Å²	122	142.4 Å²	142.4	79%	0.792	79%	0.79	S	S	*	*				-135	148.1	106.6	32.2	-18.4	0	0	0	114.3
160	S	26.6	Very low	28.5	Very low	111 Å²	111	141.6 Å²	141.6	78%	0.776	79%	0.792	S	S	*	*			trans	-53.9	139.5	162.7	48.8	0	0	0	0	113.8
161	A	30.8	Very low	28.5	Very low	98 Å²	98	143.4 Å²	143.4	81%	0.81	80%	0.8	S	S	*	*			trans	-170.2	119.6	138.2	0	0	0	0	0	111.3
162	K	27.3	Very low	28.1	Very low	200 Å²	200	147.6 Å²	147.6	87%	0.87	81%	0.805	S	S	*	*			trans	-75.9	148.8	162.5	-61.1	172.2	177.8	177.2	0	108.6
163	P	31.6	Very low	28.1	Very low	114 Å²	114	147 Å²	147	74%	0.74	81%	0.806	S	S	*	*			trans	-99.8	101	150.4	31.1	-20	0	0	0	108.5	F165	P163-F165 PolarHBondContact O-N 2.86Å
164	S	26.1	Very low	27.8	Very low	108 Å²	108	147.3 Å²	147.3	76%	0.755	80%	0.804	S	S	*	*			trans	-70.3	111	157.9	50.6	0	0	0	0	108.4
165	F	30.5	Very low	27.9	Very low	198 Å²	198	148.4 Å²	148.4	87%	0.868	81%	0.809	S	S	*	*			trans	-96.6	100	166.3	-107.7	-90.3	0	0	0	109.1	P163	P163-F165 PolarHBondContact O-N 2.86Å
166	S	29.9	Very low	27.7	Very low	91 Å²	91	150.9 Å²	150.9	64%	0.636	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-75	141.4	164.4	52.2	0	0	0	0	110.3
167	P	27.7	Very low	27.6	Very low	127 Å²	127	155 Å²	155	83%	0.825	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-78.7	129.1	179.3	31.6	-30.2	0	0	0	110.4
168	K	29	Very low	27.5	Very low	205 Å²	205	148.7 Å²	148.7	89%	0.891	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-90.1	128	167.5	-77.5	-174.5	178.2	179.1	0	110.1
169	T	24.1	Very low	27.6	Very low	123 Å²	123	151.8 Å²	151.8	76%	0.755	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-72.8	158.6	174.1	46.6	0	0	0	0	113.3
170	N	24.2	Very low	27.5	Very low	158 Å²	158	148.5 Å²	148.5	85%	0.845	81%	0.812	S	S	*	*			trans	84.3	104.4	160.7	-68.1	-13.2	0	0	0	119
171	S	29.1	Very low	27.8	Very low	115 Å²	115	154.5 Å²	154.5	80%	0.804	82%	0.819	S	S	*	*				-163.7	124.2	111.8	55	0	0	0	0	110.6
172	K	24.9	Very low	28.3	Very low	215 Å²	215	154.1 Å²	154.1	94%	0.935	81%	0.81	S	S	*	*			trans	-58.3	130.4	169.7	-70.8	168.7	173.1	172.9	0	110.2
173	S	27.2	Very low	29.7	Very low	108 Å²	108	149.7 Å²	149.7	76%	0.755	80%	0.796	S	S	*	*			trans	-155	136.5	147.5	51	0	0	0	0	110.5
174	K	24.6	Very low	31.3	Very low	203 Å²	203	152.8 Å²	152.8	88%	0.883	79%	0.793	S	S	*	*			trans	-50.1	139.4	-180	-65.7	164.5	171.1	179	0	111.3
175	L	28	Very low	33.8	Very low	172 Å²	172	149 Å²	149	90%	0.901	76%	0.764	S	S	*	*			trans	-125.6	108.7	166.9	-97.2	157	0	0	0	109.1
176	D	26.8	Very low	36.3	Very low	147 Å²	147	143.9 Å²	143.9	79%	0.786	75%	0.745	S	S	*	*			trans	-58.7	145.2	169.3	-74.3	-44.1	0	0	0	111.7	S178	D176-S178 PolarHBondContact O-N 2.83Å
177	E	25.9	Very low	38.9	Very low	203 Å²	203	139.8 Å²	139.8	95%	0.949	72%	0.716	S	S	*	*			trans	-63.6	104	168.8	-69.5	172	139.9	0	0	110.5
178	S	27.8	Very low	41.5	Very low	100 Å²	100	135.7 Å²	135.7	70%	0.699	69%	0.69	S	S	*	*			trans	-152	128.9	154.8	65.4	0	0	0	0	110.2	D176 G180	D176-S178 PolarHBondContact O-N 2.83Å; S178-G180 VanDerWaalsContact C-N 3.32Å; S178-G180 PolarHBondContact O-N 2.89Å
179	W	27.6	Very low	44	Very low	269 Å²	269	132.4 Å²	132.4	100%	1.019	68%	0.675	S	S	*	*			trans	-71.7	86.1	178.5	-73.9	29	0	0	0	109.3
180	G	27	Very low	46.5	Very low	53 Å²	53	127.1 Å²	127.1	55%	0.546	64%	0.643	S	S	.	*			trans	-132.6	113.8	-179.4	0	0	0	0	0	112.3	S178 S182	S178-G180 VanDerWaalsContact C-N 3.32Å; S178-G180 PolarHBondContact O-N 2.89Å; G180-S182 PolarHBondContact O-N 2.81Å; G180-S182 VanDerWaalsContact O-N 3.1Å
181	Y	33.8	Very low	48.9	Very low	238 Å²	238	121.9 Å²	121.9	93%	0.933	62%	0.618	S	S	*	*			trans	4.1	86.1	162.5	-68	-93.1	0	0	0	117.4
182	S	40.8	Very low	50.8	Low	89 Å²	89	119.5 Å²	119.5	62%	0.622	61%	0.605	S	S	*	*			trans	-116.4	128.4	152.5	74.8	0	0	0	0	107.8	G180 R184	G180-S182 PolarHBondContact O-N 2.81Å; G180-S182 VanDerWaalsContact O-N 3.1Å; S182-R184 PolarHBondContact O-N 2.83Å
183	N	56.9	Low	52.8	Low	108 Å²	108	116.3 Å²	116.3	58%	0.578	60%	0.598	S	S	*	*	S	Bend	trans	-68.4	33.9	-173.6	-76.3	-23.8	0	0	0	114.1	S212	N183-S212 WeakPolarHBondContact CB-OG 3.43Å; N183-S212 WeakPolarHBondContact O-CA 3.2Å; N183-S212 VanDerWaalsContact O-CB 3.3Å; N183-S212 WeakPolarHBondContact O-CB 3.33Å; N183-S212 PolarHBondContact O-OG 3.1Å
184	R	65.5	Low	54.6	Low	178 Å²	178	111.6 Å²	111.6	67%	0.672	57%	0.565	S	S	*	*			trans	-128.3	115.4	-178.4	-65.5	-176.8	-177.6	-174.9	1	108.8	S182 I186 V209	S182-R184 PolarHBondContact O-N 2.83Å; R184-I186 PolarHBondContact O-N 2.9Å; R184-V209 HydrophobicContact CB-CG1 4.24Å
185	L	79.3	Confident	56.5	Low	28 Å²	28	104.1 Å²	104.1	15%	0.147	53%	0.534	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	106.2	171.8	-175.1	70.2	0	0	0	108.2	M187 L210 A215 C223 I227	L185-M187 HydrophobicContact CD2-CE 3.53Å; L185-M187 HydrophobicContact CG-CE 3.71Å; L185-L210 HydrophobicContact CB-CB 4.15Å; L185-L210 HydrophobicContact CB-CD2 4.42Å; L185-L210 HydrophobicContact CD2-CD2 3.74Å; L185-L210 PolarHBondContact O-N 3.11Å; L185-A215 HydrophobicContact CB-CB 4.15Å; L185-C223 HydrophobicContact CD1-CB 3.96Å; L185-C223 HydrophobicContact CD2-CB 4.11Å; L185-I227 HydrophobicContact CD1-CD1 3.96Å; L185-I227 HydrophobicContact CD1-CG1 4.41Å
186	I	81.9	Confident	58.1	Low	92 Å²	92	105.7 Å²	105.7	47%	0.472	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	128.5	178.1	-55.6	176.1	0	0	0	108.2	R184 V209	R184-I186 PolarHBondContact O-N 2.9Å; I186-V209 HydrophobicContact CG1-CG2 4.28Å
187	M	85.4	Confident	60	Low	5 Å²	5	102.4 Å²	102.4	3%	0.025	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-77.8	151.9	177.3	-67.3	-56	138.8	0	0	112.1	L185 V208 L210 I226 I227 Y230 L273	L185-M187 HydrophobicContact CD2-CE 3.53Å; L185-M187 HydrophobicContact CG-CE 3.71Å; M187-V208 HydrophobicContact CB-CB 4.05Å; M187-V208 HydrophobicContact CB-CG1 4.2Å; M187-V208 HydrophobicContact CG-CB 4.29Å; M187-V208 HydrophobicContact CG-CG1 3.89Å; M187-V208 PolarHBondContact N-O 2.86Å; M187-L210 HydrophobicContact CE-CB 4.47Å; M187-I226 HydrophobicContact CE-CG2 3.73Å; M187-I226 HydrophobicContact SD-CG2 4.44Å; M187-I227 HydrophobicContact SD-CG1 4.08Å; M187-Y230 HydrophobicContact CB-CD1 3.82Å; M187-Y230 HydrophobicContact CB-CE1 3.63Å; M187-Y230 HydrophobicContact CB-CE2 4.48Å; M187-Y230 HydrophobicContact CB-CG 4.31Å; M187-Y230 HydrophobicContact CG-CD1 4.07Å; M187-Y230 HydrophobicContact CG-CD2 4.25Å; M187-Y230 HydrophobicContact CG-CE1 4.24Å; M187-Y230 HydrophobicContact CG-CE2 4.42Å; M187-Y230 HydrophobicContact CG-CG 4.07Å; M187-Y230 HydrophobicContact SD-CD1 4.21Å; M187-Y230 HydrophobicContact SD-CG 4.04Å; M187-L273 HydrophobicContact CE-CD2 3.99Å; M187-L273 HydrophobicContact CG-CD2 3.7Å; M187-L273 HydrophobicContact SD-CD2 4.12Å
188	P	82.1	Confident	62	Low	41 Å²	41	94.5 Å²	94.5	27%	0.266	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-60.7	139.9	176.4	26.4	-35.8	0	0	0	111.5	I227 Y230 K231	P188-I227 HydrophobicContact CG-CG2 4.22Å; P188-Y230 HydrophobicContact CG-CD1 4.03Å; P188-Y230 HydrophobicContact CG-CE1 4.25Å; P188-Y230 WeakPolarHBondContact O-CE1 3.41Å; P188-K231 HydrophobicContact CG-CD 4.36Å; P188-K231 HydrophobicContact CG-CG 3.77Å
189	K	80.3	Confident	64.1	Low	135 Å²	135	90.1 Å²	90.1	59%	0.587	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-66.8	152.6	173.8	-71.6	-179.4	174.8	-179.5	0	111	D207	K189-D207 WeakPolarHBondContact CE-OD1 3.21Å; K189-D207 IonicContact NZ-OD1 3.22Å; K189-D207 PolarHBondContact NZ-OD1 3.36Å
190	P	77.7	Confident	66.1	Low	12 Å²	12	82.4 Å²	82.4	8%	0.078	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-59.5	135.2	176.6	23.5	-33.1	0	0	0	111	I195 I205 F236 P279 Y280	P190-I195 HydrophobicContact CB-CG1 4.17Å; P190-I195 HydrophobicContact CG-CG1 4.2Å; P190-I205 HydrophobicContact CG-CD1 4.13Å; P190-I205 HydrophobicContact CG-CG1 4.48Å; P190-I205 HydrophobicContact CG-CG2 4.04Å; P190-F236 HydrophobicContact CB-CE1 3.73Å; P190-F236 HydrophobicContact CB-CE2 4.23Å; P190-F236 HydrophobicContact CB-CZ 3.56Å; P190-P279 HydrophobicContact CG-CB 4.46Å; P190-Y280 HydrophobicContact CG-CE1 4.32Å
191	P	75	Confident	68.1	Low	49 Å²	49	85 Å²	85	32%	0.318	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-67.4	151.5	173.1	28.3	-32.8	0	0	0	110.5	N193 C194 I195 F236	P191-N193 PolarHBondContact O-N 2.75Å; P191-C194 HydrophobicContact CG-CB 4.12Å; P191-C194 PolarHBondContact O-N 3.31Å; P191-I195 PolarHBondContact O-N 3.17Å; P191-F236 HydrophobicContact CG-CB 4.13Å; P191-F236 HydrophobicContact CG-CD1 4.32Å; P191-F236 HydrophobicContact CG-CG 4.37Å
192	A	68.6	Low	70	Confident	65 Å²	65	79.3 Å²	79.3	54%	0.537	42%	0.421	S	S	.	.	H	α-helix	trans	-51.3	-37.2	-173.8	0	0	0	0	0	113.7	C194 I195	A192-C194 VanDerWaalsContact C-N 3.27Å; A192-C194 PolarHBondContact O-N 2.93Å; A192-I195 PolarHBondContact O-N 2.76Å
193	N	67.1	Low	71.7	Confident	147 Å²	147	76.8 Å²	76.8	79%	0.786	40%	0.4	S	S	*	.	H	α-helix	trans	-65.8	-26.8	-179.3	-58.1	1.7	0	0	0	113.2	P191	P191-N193 PolarHBondContact O-N 2.75Å
194	C	65	Low	72.8	Confident	10 Å²	10	76 Å²	76	7%	0.068	40%	0.4	C	S	.	.	H	α-helix	trans	-89.6	-20.9	-179.1	-69.4	0	0	0	0	113	P191 A192 W196 S197 Q198 F236 Y280	P191-C194 HydrophobicContact CG-CB 4.12Å; P191-C194 PolarHBondContact O-N 3.31Å; A192-C194 VanDerWaalsContact C-N 3.27Å; A192-C194 PolarHBondContact O-N 2.93Å; C194-W196 PolarHBondContact O-N 3.06Å; C194-S197 PolarHBondContact O-N 2.91Å; C194-S197 PolarHBondContact O-OG 2.94Å; C194-Q198 WeakPolarHBondContact O-CB 2.75Å; C194-Q198 PolarHBondContact O-N 3.32Å; C194-F236 HydrophobicContact CB-CD1 4.22Å; C194-F236 HydrophobicContact CB-CE1 4.32Å; C194-Y280 PolarHBondContact O-OH 3.35Å
195	I	64.8	Low	73.4	Confident	45 Å²	45	71 Å²	71	23%	0.231	39%	0.386	C	S	.	.	H	α-helix	trans	-61.8	-47.7	-175.5	-61.5	174.6	0	0	0	109.8	P190 P191 A192 N199 I205	P190-I195 HydrophobicContact CB-CG1 4.17Å; P190-I195 HydrophobicContact CG-CG1 4.2Å; P191-I195 PolarHBondContact O-N 3.17Å; A192-I195 PolarHBondContact O-N 2.76Å; I195-N199 WeakPolarHBondContact O-CB 3.2Å; I195-N199 PolarHBondContact O-N 2.86Å; I195-N199 VanDerWaalsContact O-N 3.1Å; I195-I205 HydrophobicContact CD1-CD1 3.85Å; I195-I205 HydrophobicContact CG1-CD1 4.23Å; I195-I205 HydrophobicContact CG2-CD1 4.35Å
196	W	60.6	Low	73.6	Confident	206 Å²	206	72.7 Å²	72.7	78%	0.78	40%	0.398	S	S	*	.	H	α-helix	trans	-69.7	-35.2	-178.2	-58.9	102.3	0	0	0	113.6	C194	C194-W196 PolarHBondContact O-N 3.06Å
197	S	66.6	Low	73.6	Confident	78 Å²	78	71.8 Å²	71.8	55%	0.545	39%	0.394	S	S	.	.	H	α-helix	trans	-82.6	-29.6	-176.5	56.9	0	0	0	0	113.5	C194	C194-S197 PolarHBondContact O-N 2.91Å; C194-S197 PolarHBondContact O-OG 2.94Å
198	Q	67.7	Low	73.6	Confident	36 Å²	36	71.7 Å²	71.7	17%	0.168	39%	0.394	C	S	.	.	H	α-helix	trans	-108.4	-8.3	-173.1	-55.9	-173.3	3	0	0	114.1	C194 P200 M234 Y251 Y280	C194-Q198 WeakPolarHBondContact O-CB 2.75Å; C194-Q198 PolarHBondContact O-N 3.32Å; Q198-P200 VanDerWaalsContact C-CD 3.46Å; Q198-P200 WeakPolarHBondContact O-CD 2.87Å; Q198-M234 PolarHBondContact NE2-O 3.4Å; Q198-M234 PolarHBondContact OE1-O 3.48Å; Q198-Y251 PolarHBondContact NE2-OH 3.48Å; Q198-Y251 VanDerWaalsContact NE2-OH 3.08Å; Q198-Y280 HydrophobicContact CB-CE2 3.76Å
199	N	72.3	Confident	73.7	Confident	8 Å²	8	71.7 Å²	71.7	4%	0.043	39%	0.393	C	S	.	.			trans	-123.1	66.7	178.2	-167.2	16.4	0	0	0	112.4	I195 D201 N202 L203 Y280	I195-N199 WeakPolarHBondContact O-CB 3.2Å; I195-N199 PolarHBondContact O-N 2.86Å; I195-N199 VanDerWaalsContact O-N 3.1Å; N199-D201 PolarHBondContact O-N 3.04Å; N199-N202 PolarHBondContact O-N 2.99Å; N199-N202 PolarHBondContact OD1-N 2.67Å; N199-L203 PolarHBondContact ND2-N 3.5Å; N199-L203 VanDerWaalsContact ND2-N 3.17Å; N199-L203 PolarHBondContact ND2-O 3.42Å; N199-L203 PolarHBondContact OD1-N 3.48Å; N199-Y280 HydrophobicContact CB-CD1 3.53Å; N199-Y280 HydrophobicContact CB-CE1 3.62Å; N199-Y280 HydrophobicContact CB-CG 4.14Å
200	P	69	Low	73.9	Confident	108 Å²	108	65.2 Å²	65.2	70%	0.701	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-26.9	178.7	26.8	-34.9	0	0	0	112.6	Q198 N202	Q198-P200 VanDerWaalsContact C-CD 3.46Å; Q198-P200 WeakPolarHBondContact O-CD 2.87Å; P200-N202 VanDerWaalsContact C-N 3.31Å; P200-N202 PolarHBondContact O-N 3.24Å
201	D	70	Confident	73.9	Confident	106 Å²	106	68.8 Å²	68.8	57%	0.567	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	1.2	-177.3	-68.4	-13.5	0	0	0	113.6	N199 L203 R283	N199-D201 PolarHBondContact O-N 3.04Å; D201-L203 HydrophobicContact CB-CD1 4.16Å; D201-L203 HydrophobicContact CB-CD2 4.27Å; D201-L203 HydrophobicContact CB-CG 3.77Å; D201-L203 PolarHBondContact O-N 3.01Å; D201-L203 VanDerWaalsContact O-N 3.12Å; D201-R283 IonicContact OD2-NH1 3.49Å
202	N	72.8	Confident	73.7	Confident	120 Å²	120	68.8 Å²	68.8	64%	0.642	38%	0.381	S	S	*	.			trans	47.8	39.3	-176	-81.8	-26.4	0	0	0	113.8	N199 P200	N199-N202 PolarHBondContact O-N 2.99Å; N199-N202 PolarHBondContact OD1-N 2.67Å; P200-N202 VanDerWaalsContact C-N 3.31Å; P200-N202 PolarHBondContact O-N 3.24Å
203	L	76.8	Confident	74	Confident	36 Å²	36	73.9 Å²	73.9	19%	0.188	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-66.4	150.3	178.7	-64.4	172	0	0	0	111.2	N199 D201 I205	N199-L203 PolarHBondContact ND2-N 3.5Å; N199-L203 VanDerWaalsContact ND2-N 3.17Å; N199-L203 PolarHBondContact ND2-O 3.42Å; N199-L203 PolarHBondContact OD1-N 3.48Å; D201-L203 HydrophobicContact CB-CD1 4.16Å; D201-L203 HydrophobicContact CB-CD2 4.27Å; D201-L203 HydrophobicContact CB-CG 3.77Å; D201-L203 PolarHBondContact O-N 3.01Å; D201-L203 VanDerWaalsContact O-N 3.12Å; L203-I205 PolarHBondContact O-N 2.94Å
204	P	80.3	Confident	74.6	Confident	90 Å²	90	67.3 Å²	67.3	58%	0.584	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-61.7	135.9	177.9	25.7	-33.7	0	0	0	110.4	V206 G281	P204-V206 PolarHBondContact O-N 3.23Å; P204-G281 WeakPolarHBondContact O-CA 3.45Å; P204-G281 PolarHBondContact O-N 3.47Å
205	I	78.8	Confident	75.3	Confident	74 Å²	74	67.4 Å²	67.4	38%	0.379	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-75.9	117	175.5	-61.6	170.5	0	0	0	108	P190 I195 L203 P279	P190-I205 HydrophobicContact CG-CD1 4.13Å; P190-I205 HydrophobicContact CG-CG1 4.48Å; P190-I205 HydrophobicContact CG-CG2 4.04Å; I195-I205 HydrophobicContact CD1-CD1 3.85Å; I195-I205 HydrophobicContact CG1-CD1 4.23Å; I195-I205 HydrophobicContact CG2-CD1 4.35Å; L203-I205 PolarHBondContact O-N 2.94Å; I205-P279 CarbonylContact C-O 3.56Å; I205-P279 VanDerWaalsContact CA-O 3.28Å; I205-P279 WeakPolarHBondContact CA-O 3.49Å
206	V	82.6	Confident	76	Confident	63 Å²	63	68.4 Å²	68.4	38%	0.382	37%	0.368	S	S	.	.			trans	-105.9	140.3	-179.4	-177.3	0	0	0	0	109.2	P204 V208 P279	P204-V206 PolarHBondContact O-N 3.23Å; V206-V208 PolarHBondContact O-N 2.91Å; V206-P279 PolarHBondContact N-O 3.4Å
207	D	82.6	Confident	77.1	Confident	73 Å²	73	66.4 Å²	66.4	39%	0.39	36%	0.361	S	S	.	.			trans	-67	122.6	173.9	-68	-19	0	0	0	109.7	K189 V209	K189-D207 WeakPolarHBondContact CE-OD1 3.21Å; K189-D207 IonicContact NZ-OD1 3.22Å; K189-D207 PolarHBondContact NZ-OD1 3.36Å; D207-V209 HydrophobicContact CB-CG2 4.36Å
208	V	84.2	Confident	78	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.024	34%	0.338	C	S	.	.			trans	-86.7	118	176.6	174	0	0	0	0	108.2	M187 V206 Y230 L273 Q277 G278 P279	M187-V208 HydrophobicContact CB-CB 4.05Å; M187-V208 HydrophobicContact CB-CG1 4.2Å; M187-V208 HydrophobicContact CG-CB 4.29Å; M187-V208 HydrophobicContact CG-CG1 3.89Å; M187-V208 PolarHBondContact N-O 2.86Å; V206-V208 PolarHBondContact O-N 2.91Å; V208-Y230 HydrophobicContact CG1-CE2 4.19Å; V208-L273 HydrophobicContact CG1-CD1 3.57Å; V208-L273 HydrophobicContact CG1-CD2 3.83Å; V208-L273 HydrophobicContact CG1-CG 3.69Å; V208-Q277 HydrophobicContact CG1-CB 4.28Å; V208-G278 VanDerWaalsContact CG2-C 3.48Å; V208-P279 HydrophobicContact CG2-CB 4.4Å
209	V	86	Confident	78.9	Confident	40 Å²	40	64.8 Å²	64.8	24%	0.242	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	125.8	-172.2	-175.9	0	0	0	0	110.3	R184 I186 D207 Q277	R184-V209 HydrophobicContact CB-CG1 4.24Å; I186-V209 HydrophobicContact CG1-CG2 4.28Å; D207-V209 HydrophobicContact CB-CG2 4.36Å; V209-Q277 PolarHBondContact O-NE2 3.47Å; V209-Q277 VanDerWaalsContact O-NE2 3.16Å; V209-Q277 PolarHBondContact O-OE1 3.05Å
210	L	82.9	Confident	79.6	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	132	170.5	-176	60.1	0	0	0	109.8	L185 M187 S212 F214 A215 L218 I226 W272 L273	L185-L210 HydrophobicContact CB-CB 4.15Å; L185-L210 HydrophobicContact CB-CD2 4.42Å; L185-L210 HydrophobicContact CD2-CD2 3.74Å; L185-L210 PolarHBondContact O-N 3.11Å; M187-L210 HydrophobicContact CE-CB 4.47Å; L210-S212 PolarHBondContact O-N 3.42Å; L210-F214 HydrophobicContact CD1-CB 4.42Å; L210-F214 HydrophobicContact CD1-CD1 3.83Å; L210-F214 HydrophobicContact CD1-CE1 4.42Å; L210-F214 HydrophobicContact CD1-CG 4.26Å; L210-F214 HydrophobicContact CD2-CD1 3.85Å; L210-F214 HydrophobicContact CD2-CE1 4.35Å; L210-F214 HydrophobicContact CG-CD1 4.06Å; L210-A215 HydrophobicContact CD2-CB 4.21Å; L210-A215 HydrophobicContact CG-CB 4.26Å; L210-L218 HydrophobicContact CD2-CD1 3.8Å; L210-I226 HydrophobicContact CD2-CD1 4.34Å; L210-W272 HydrophobicContact CD1-CE3 3.45Å; L210-W272 VanDerWaalsContact CD1-CE3 3.45Å; L210-W272 HydrophobicContact CD1-CH2 4.33Å; L210-W272 HydrophobicContact CD1-CZ3 3.28Å; L210-W272 HydrophobicContact CG-CZ3 4.42Å; L210-L273 HydrophobicContact CB-CD1 4.48Å
211	E	79.3	Confident	80.6	Confident	86 Å²	86	63.8 Å²	63.8	40%	0.402	34%	0.338	S	S	.	.			trans	-53.6	136.6	-178.2	-96.5	-179.8	-149.8	0	0	112.4	K213 F214 A215 W272	E211-K213 VanDerWaalsContact C-N 3.26Å; E211-K213 PolarHBondContact O-N 3.08Å; E211-F214 WeakPolarHBondContact O-CB 2.96Å; E211-F214 PolarHBondContact O-N 2.97Å; E211-A215 PolarHBondContact O-N 2.77Å; E211-W272 HydrophobicContact CB-CH2 3.61Å; E211-W272 HydrophobicContact CB-CZ2 4.03Å; E211-W272 HydrophobicContact CB-CZ3 4.47Å; E211-W272 VanDerWaalsContact CD-CZ2 3.49Å; E211-W272 HydrophobicContact CG-CH2 3.56Å; E211-W272 HydrophobicContact CG-CZ2 3.79Å; E211-W272 WeakPolarHBondContact OE1-CZ2 3.37Å
212	S	69.5	Low	81.6	Confident	50 Å²	50	59.8 Å²	59.8	35%	0.35	32%	0.316	S	S	.	.	H	α-helix	trans	-60.5	-33	-174.6	-169.6	0	0	0	0	113.6	N183 L210 F214 S216	N183-S212 WeakPolarHBondContact CB-OG 3.43Å; N183-S212 WeakPolarHBondContact O-CA 3.2Å; N183-S212 VanDerWaalsContact O-CB 3.3Å; N183-S212 WeakPolarHBondContact O-CB 3.33Å; N183-S212 PolarHBondContact O-OG 3.1Å; L210-S212 PolarHBondContact O-N 3.42Å; S212-F214 VanDerWaalsContact C-N 3.27Å; S212-F214 PolarHBondContact O-N 3.28Å; S212-S216 VanDerWaalsContact O-CB 3.25Å; S212-S216 WeakPolarHBondContact O-CB 3.28Å; S212-S216 PolarHBondContact O-N 3.3Å; S212-S216 PolarHBondContact O-OG 2.96Å
213	K	76.1	Confident	82.4	Confident	171 Å²	171	55.1 Å²	55.1	74%	0.743	29%	0.293	S	S	*	.	H	α-helix	trans	-63.4	-34.6	175.8	-67	-177.5	-179.6	177.9	0	112.5	E211 S216	E211-K213 VanDerWaalsContact C-N 3.26Å; E211-K213 PolarHBondContact O-N 3.08Å; K213-S216 PolarHBondContact O-OG 3.4Å
214	F	78.7	Confident	83	Confident	9 Å²	9	59.3 Å²	59.3	4%	0.039	31%	0.311	C	S	.	.	H	α-helix	trans	-82.8	-49	179.2	-167.9	-78.6	0	0	0	110.2	L210 E211 S212 S216 R217 L218 V265 A269 W308 L309	L210-F214 HydrophobicContact CD1-CB 4.42Å; L210-F214 HydrophobicContact CD1-CD1 3.83Å; L210-F214 HydrophobicContact CD1-CE1 4.42Å; L210-F214 HydrophobicContact CD1-CG 4.26Å; L210-F214 HydrophobicContact CD2-CD1 3.85Å; L210-F214 HydrophobicContact CD2-CE1 4.35Å; L210-F214 HydrophobicContact CG-CD1 4.06Å; E211-F214 WeakPolarHBondContact O-CB 2.96Å; E211-F214 PolarHBondContact O-N 2.97Å; S212-F214 VanDerWaalsContact C-N 3.27Å; S212-F214 PolarHBondContact O-N 3.28Å; F214-S216 VanDerWaalsContact C-N 3.32Å; F214-S216 PolarHBondContact O-N 2.61Å; F214-R217 PolarHBondContact O-N 3.1Å; F214-L218 HydrophobicContact CD1-CD1 3.92Å; F214-L218 HydrophobicContact CD1-CD2 4.48Å; F214-L218 HydrophobicContact CD1-CG 4.23Å; F214-L218 HydrophobicContact CE1-CD1 3.85Å; F214-L218 HydrophobicContact CE1-CD2 3.92Å; F214-L218 HydrophobicContact CE1-CG 4.13Å; F214-V265 HydrophobicContact CZ-CG1 4.29Å; F214-A269 HydrophobicContact CD1-CB 4.32Å; F214-A269 HydrophobicContact CE1-CB 3.27Å; F214-A269 HydrophobicContact CZ-CB 3.5Å; F214-A269 VanDerWaalsContact CZ-CB 3.5Å; F214-W308 HydrophobicContact CD2-CB 4.5Å; F214-W308 HydrophobicContact CD2-CE3 4.43Å; F214-W308 HydrophobicContact CE2-CB 3.81Å; F214-W308 HydrophobicContact CE2-CE3 4.14Å; F214-W308 HydrophobicContact CE2-CG 4.41Å; F214-W308 HydrophobicContact CZ-CE3 4.38Å; F214-L309 HydrophobicContact CD2-CD2 4Å; F214-L309 HydrophobicContact CE2-CD2 3.95Å
215	A	79.4	Confident	83.5	Confident	12 Å²	12	55 Å²	55	10%	0.099	28%	0.283	C	S	.	.	H	α-helix	trans	-61.9	-35.1	-177.2	0	0	0	0	0	113.4	L185 L210 E211 R217 L218	L185-A215 HydrophobicContact CB-CB 4.15Å; L210-A215 HydrophobicContact CD2-CB 4.21Å; L210-A215 HydrophobicContact CG-CB 4.26Å; E211-A215 PolarHBondContact O-N 2.77Å; A215-R217 PolarHBondContact O-N 3.03Å; A215-L218 PolarHBondContact O-N 3.37Å
216	S	80.5	Confident	84.2	Confident	66 Å²	66	51.5 Å²	51.5	46%	0.462	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.4	-179.4	52	0	0	0	0	115.1	S212 K213 F214	S212-S216 VanDerWaalsContact O-CB 3.25Å; S212-S216 WeakPolarHBondContact O-CB 3.28Å; S212-S216 PolarHBondContact O-N 3.3Å; S212-S216 PolarHBondContact O-OG 2.96Å; K213-S216 PolarHBondContact O-OG 3.4Å; F214-S216 VanDerWaalsContact C-N 3.32Å; F214-S216 PolarHBondContact O-N 2.61Å
217	R	83.8	Confident	84.6	Confident	164 Å²	164	50.6 Å²	50.6	62%	0.619	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-9.3	-178.9	-68.7	-179.9	179.9	-179.8	-0.1	113.4	F214 A215 W308	F214-R217 PolarHBondContact O-N 3.1Å; A215-R217 PolarHBondContact O-N 3.03Å; R217-W308 HydrophobicContact CB-CH2 4.2Å; R217-W308 HydrophobicContact CB-CZ3 3.74Å
218	L	86.1	Confident	85	Confident	15 Å²	15	48.5 Å²	48.5	8%	0.079	25%	0.245	C	C	.	.	S	Bend	trans	-80	146.4	-178.9	-65.4	176.5	0	0	0	111.2	L210 F214 A215 Q222 I226 V265	L210-L218 HydrophobicContact CD2-CD1 3.8Å; F214-L218 HydrophobicContact CD1-CD1 3.92Å; F214-L218 HydrophobicContact CD1-CD2 4.48Å; F214-L218 HydrophobicContact CD1-CG 4.23Å; F214-L218 HydrophobicContact CE1-CD1 3.85Å; F214-L218 HydrophobicContact CE1-CD2 3.92Å; F214-L218 HydrophobicContact CE1-CG 4.13Å; A215-L218 PolarHBondContact O-N 3.37Å; L218-Q222 HydrophobicContact CB-CB 4.32Å; L218-Q222 HydrophobicContact CD2-CB 4.3Å; L218-I226 HydrophobicContact CD1-CD1 3.43Å; L218-I226 VanDerWaalsContact CD1-CD1 3.43Å; L218-V265 HydrophobicContact CD2-CG1 3.6Å
219	Q	85.9	Confident	85.4	Confident	66 Å²	66	48.3 Å²	48.3	31%	0.308	24%	0.244	S	C	.	.			trans	-79.5	156.7	171.9	-61.1	-57.7	-54.6	0	0	111.1	H221 Q222 C223	Q219-H221 VanDerWaalsContact C-N 3.31Å; Q219-H221 VanDerWaalsContact CB-CE1 3.41Å; Q219-H221 WeakPolarHBondContact CB-CE1 3.11Å; Q219-H221 VanDerWaalsContact CB-ND1 3.35Å; Q219-H221 WeakPolarHBondContact CB-ND1 3.39Å; Q219-H221 PolarHBondContact O-N 3.03Å; Q219-Q222 HydrophobicContact CB-CG 4.13Å; Q219-Q222 WeakPolarHBondContact O-CA 3.48Å; Q219-Q222 WeakPolarHBondContact O-CB 3.47Å; Q219-Q222 PolarHBondContact O-N 2.77Å; Q219-C223 PolarHBondContact O-N 2.87Å
220	P	87.4	Confident	85.6	Confident	86 Å²	86	46.6 Å²	46.6	56%	0.558	23%	0.233	S	C	*	.	H	α-helix	trans	-53	-45.7	-178.8	-28.2	35.7	0	0	0	113.5	Q222 C223 E224	P220-Q222 VanDerWaalsContact C-N 3.29Å; P220-Q222 PolarHBondContact O-N 2.85Å; P220-C223 WeakPolarHBondContact O-CB 3.48Å; P220-C223 PolarHBondContact O-N 2.82Å; P220-C223 VanDerWaalsContact O-N 3.15Å; P220-E224 PolarHBondContact O-N 2.86Å
221	H	89	Confident	85.9	Confident	8 Å²	8	50.3 Å²	50.3	4%	0.037	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-37.1	176.4	72.9	-76.8	0	0	0	111.4	Q219 C223 E224 G225 L261 R492 V496 I497	Q219-H221 VanDerWaalsContact C-N 3.31Å; Q219-H221 VanDerWaalsContact CB-CE1 3.41Å; Q219-H221 WeakPolarHBondContact CB-CE1 3.11Å; Q219-H221 VanDerWaalsContact CB-ND1 3.35Å; Q219-H221 WeakPolarHBondContact CB-ND1 3.39Å; Q219-H221 PolarHBondContact O-N 3.03Å; H221-C223 VanDerWaalsContact C-N 3.32Å; H221-C223 PolarHBondContact O-N 2.95Å; H221-E224 PolarHBondContact O-N 3.27Å; H221-G225 PolarHBondContact O-N 2.96Å; H221-L261 PolarHBondContact NE2-O 3.18Å; H221-R492 PolarHBondContact O-NH1 3.21Å; H221-V496 HydrophobicContact CB-CG1 3.73Å; H221-I497 VanDerWaalsContact CE1-CD1 3.45Å; H221-I497 WeakPolarHBondContact CE1-CD1 3.5Å
222	Q	91.5	Very high	86.3	Confident	22 Å²	22	46.3 Å²	46.3	10%	0.103	23%	0.231	C	C	.	.	H	α-helix	trans	-64.5	-39.5	176.9	-63.2	171.5	-22	0	0	111.3	L218 Q219 P220 G225 I226 L261 Q266	L218-Q222 HydrophobicContact CB-CB 4.32Å; L218-Q222 HydrophobicContact CD2-CB 4.3Å; Q219-Q222 HydrophobicContact CB-CG 4.13Å; Q219-Q222 WeakPolarHBondContact O-CA 3.48Å; Q219-Q222 WeakPolarHBondContact O-CB 3.47Å; Q219-Q222 PolarHBondContact O-N 2.77Å; P220-Q222 VanDerWaalsContact C-N 3.29Å; P220-Q222 PolarHBondContact O-N 2.85Å; Q222-G225 PolarHBondContact O-N 3.37Å; Q222-I226 WeakPolarHBondContact O-CD1 3.33Å; Q222-I226 VanDerWaalsContact O-CG1 3.27Å; Q222-I226 WeakPolarHBondContact O-CG1 3.38Å; Q222-I226 PolarHBondContact O-N 2.8Å; Q222-L261 PolarHBondContact NE2-O 3.23Å; Q222-L261 VanDerWaalsContact NE2-O 3.16Å; Q222-Q266 HydrophobicContact CB-CG 4.1Å; Q222-Q266 HydrophobicContact CG-CG 4.27Å
223	C	90.1	Very high	87.2	Confident	23 Å²	23	44 Å²	44	16%	0.155	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-48	174.8	-65.6	0	0	0	0	111.9	L185 Q219 P220 H221 G225 I226 I227	L185-C223 HydrophobicContact CD1-CB 3.96Å; L185-C223 HydrophobicContact CD2-CB 4.11Å; Q219-C223 PolarHBondContact O-N 2.87Å; P220-C223 WeakPolarHBondContact O-CB 3.48Å; P220-C223 PolarHBondContact O-N 2.82Å; P220-C223 VanDerWaalsContact O-N 3.15Å; H221-C223 VanDerWaalsContact C-N 3.32Å; H221-C223 PolarHBondContact O-N 2.95Å; C223-G225 VanDerWaalsContact C-N 3.27Å; C223-G225 PolarHBondContact O-N 3.49Å; C223-I226 PolarHBondContact O-N 2.75Å; C223-I227 WeakPolarHBondContact O-CG1 3.22Å; C223-I227 PolarHBondContact O-N 3.26Å
224	E	89	Confident	87.7	Confident	123 Å²	123	35.9 Å²	35.9	58%	0.575	18%	0.18	S	C	*	.	H	α-helix	trans	-59.5	-39.6	174.6	-69.8	172.9	179	0	0	111.9	P220 H221 I227 F228	P220-E224 PolarHBondContact O-N 2.86Å; H221-E224 PolarHBondContact O-N 3.27Å; E224-I227 PolarHBondContact O-N 2.8Å; E224-F228 WeakPolarHBondContact O-CB 3.38Å; E224-F228 PolarHBondContact O-N 3.42Å
225	G	91.3	Very high	87.9	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.3	-46.9	176.3	0	0	0	0	0	111.7	H221 Q222 C223 I227 F228 L229	H221-G225 PolarHBondContact O-N 2.96Å; Q222-G225 PolarHBondContact O-N 3.37Å; C223-G225 VanDerWaalsContact C-N 3.27Å; C223-G225 PolarHBondContact O-N 3.49Å; G225-I227 VanDerWaalsContact C-N 3.34Å; G225-I227 PolarHBondContact O-N 3.47Å; G225-F228 WeakPolarHBondContact O-CB 3.4Å; G225-F228 PolarHBondContact O-N 3.14Å; G225-L229 WeakPolarHBondContact O-CB 3.5Å; G225-L229 VanDerWaalsContact O-CG 3.26Å; G225-L229 WeakPolarHBondContact O-CG 3.22Å; G225-L229 PolarHBondContact O-N 2.96Å
226	I	92.4	Very high	87.8	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.3	-40.6	177.4	-66.6	159.8	0	0	0	111.2	M187 L210 L218 Q222 C223 F228 L229 Y230 Q266 A269	M187-I226 HydrophobicContact CE-CG2 3.73Å; M187-I226 HydrophobicContact SD-CG2 4.44Å; L210-I226 HydrophobicContact CD2-CD1 4.34Å; L218-I226 HydrophobicContact CD1-CD1 3.43Å; L218-I226 VanDerWaalsContact CD1-CD1 3.43Å; Q222-I226 WeakPolarHBondContact O-CD1 3.33Å; Q222-I226 VanDerWaalsContact O-CG1 3.27Å; Q222-I226 WeakPolarHBondContact O-CG1 3.38Å; Q222-I226 PolarHBondContact O-N 2.8Å; C223-I226 PolarHBondContact O-N 2.75Å; I226-F228 VanDerWaalsContact C-N 3.33Å; I226-F228 PolarHBondContact O-N 2.94Å; I226-L229 PolarHBondContact O-N 2.87Å; I226-Y230 VanDerWaalsContact O-CB 3.31Å; I226-Y230 WeakPolarHBondContact O-CB 3.24Å; I226-Y230 PolarHBondContact O-N 3.11Å; I226-Q266 HydrophobicContact CG1-CB 4.22Å; I226-Q266 HydrophobicContact CG1-CG 4.39Å; I226-A269 HydrophobicContact CD1-CB 3.49Å; I226-A269 VanDerWaalsContact CD1-CB 3.49Å; I226-A269 HydrophobicContact CG1-CB 3.95Å
227	I	90.9	Very high	87.4	Confident	44 Å²	44	35.7 Å²	35.7	23%	0.226	17%	0.17	C	C	.	.	H	α-helix	trans	-60.9	-45.2	175.2	-69.2	165.2	0	0	0	110.3	L185 M187 P188 C223 E224 G225 Y230 K231	L185-I227 HydrophobicContact CD1-CD1 3.96Å; L185-I227 HydrophobicContact CD1-CG1 4.41Å; M187-I227 HydrophobicContact SD-CG1 4.08Å; P188-I227 HydrophobicContact CG-CG2 4.22Å; C223-I227 WeakPolarHBondContact O-CG1 3.22Å; C223-I227 PolarHBondContact O-N 3.26Å; E224-I227 PolarHBondContact O-N 2.8Å; G225-I227 VanDerWaalsContact C-N 3.34Å; G225-I227 PolarHBondContact O-N 3.47Å; I227-Y230 PolarHBondContact O-N 3.21Å; I227-K231 HydrophobicContact CG2-CD 4.33Å; I227-K231 WeakPolarHBondContact O-CG 3.43Å; I227-K231 PolarHBondContact O-N 3.44Å
228	F	90.8	Very high	86.3	Confident	30 Å²	30	32 Å²	32	13%	0.132	17%	0.168	C	C	.	.	H	α-helix	trans	-62.2	-47.8	177	179.1	-94.5	0	0	0	111.9	E224 G225 I226 Y230 K231 C232 C253 L490	E224-F228 WeakPolarHBondContact O-CB 3.38Å; E224-F228 PolarHBondContact O-N 3.42Å; G225-F228 WeakPolarHBondContact O-CB 3.4Å; G225-F228 PolarHBondContact O-N 3.14Å; I226-F228 VanDerWaalsContact C-N 3.33Å; I226-F228 PolarHBondContact O-N 2.94Å; F228-Y230 VanDerWaalsContact C-N 3.3Å; F228-Y230 PolarHBondContact O-N 3.46Å; F228-K231 PolarHBondContact O-N 3.01Å; F228-C232 VanDerWaalsContact CE1-SG 3.6Å; F228-C232 VanDerWaalsContact CZ-SG 3.58Å; F228-C232 PolarHBondContact O-N 3.35Å; F228-C232 PolarHBondContact O-SG 2.79Å; F228-C253 WeakPolarHBondContact CE1-SG 3.27Å; F228-L490 HydrophobicContact CB-CD2 4.04Å; F228-L490 HydrophobicContact CD1-CB 3.65Å; F228-L490 HydrophobicContact CD1-CD2 3.79Å; F228-L490 HydrophobicContact CD1-CG 4.29Å; F228-L490 HydrophobicContact CE1-CB 3.46Å; F228-L490 VanDerWaalsContact CE1-CB 3.46Å; F228-L490 HydrophobicContact CE1-CD2 4.47Å; F228-L490 HydrophobicContact CG-CB 4.32Å; F228-L490 HydrophobicContact CG-CD2 3.97Å; F228-L490 HydrophobicContact CZ-CB 3.99Å
229	L	92.4	Very high	84.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-56.7	-45.3	175.7	-70.5	-179.7	0	0	0	111.1	G225 I226 C232 L233 C253 L255 Q266 T270 L390	G225-L229 WeakPolarHBondContact O-CB 3.5Å; G225-L229 VanDerWaalsContact O-CG 3.26Å; G225-L229 WeakPolarHBondContact O-CG 3.22Å; G225-L229 PolarHBondContact O-N 2.96Å; I226-L229 PolarHBondContact O-N 2.87Å; L229-C232 PolarHBondContact O-N 3.01Å; L229-L233 VanDerWaalsContact O-CB 3.31Å; L229-L233 WeakPolarHBondContact O-CB 3.46Å; L229-L233 WeakPolarHBondContact O-CG 3.31Å; L229-L233 PolarHBondContact O-N 2.65Å; L229-C253 HydrophobicContact CD2-CB 4.29Å; L229-C253 WeakPolarHBondContact CD2-SG 3.39Å; L229-L255 HydrophobicContact CD1-CD2 4.46Å; L229-L255 HydrophobicContact CD2-CB 4.41Å; L229-Q266 HydrophobicContact CD1-CB 4.11Å; L229-T270 HydrophobicContact CB-CG2 4.15Å; L229-T270 WeakPolarHBondContact CD1-OG1 3.5Å; L229-L390 HydrophobicContact CD2-CD1 3.52Å
230	Y	91	Very high	83.5	Confident	4 Å²	4	34 Å²	34	2%	0.016	18%	0.176	C	C	.	.	H	α-helix	trans	-61.9	-47.1	177.7	177.1	-98.2	0	0	0	111.8	M187 P188 V208 I226 I227 F228 C232 L233 M234 F236 L273 L274	M187-Y230 HydrophobicContact CB-CD1 3.82Å; M187-Y230 HydrophobicContact CB-CE1 3.63Å; M187-Y230 HydrophobicContact CB-CE2 4.48Å; M187-Y230 HydrophobicContact CB-CG 4.31Å; M187-Y230 HydrophobicContact CG-CD1 4.07Å; M187-Y230 HydrophobicContact CG-CD2 4.25Å; M187-Y230 HydrophobicContact CG-CE1 4.24Å; M187-Y230 HydrophobicContact CG-CE2 4.42Å; M187-Y230 HydrophobicContact CG-CG 4.07Å; M187-Y230 HydrophobicContact SD-CD1 4.21Å; M187-Y230 HydrophobicContact SD-CG 4.04Å; P188-Y230 HydrophobicContact CG-CD1 4.03Å; P188-Y230 HydrophobicContact CG-CE1 4.25Å; P188-Y230 WeakPolarHBondContact O-CE1 3.41Å; V208-Y230 HydrophobicContact CG1-CE2 4.19Å; I226-Y230 VanDerWaalsContact O-CB 3.31Å; I226-Y230 WeakPolarHBondContact O-CB 3.24Å; I226-Y230 PolarHBondContact O-N 3.11Å; I227-Y230 PolarHBondContact O-N 3.21Å; F228-Y230 VanDerWaalsContact C-N 3.3Å; F228-Y230 PolarHBondContact O-N 3.46Å; Y230-C232 VanDerWaalsContact C-N 3.34Å; Y230-C232 PolarHBondContact O-N 3.36Å; Y230-L233 PolarHBondContact O-N 3.42Å; Y230-M234 HydrophobicContact CD1-CG 4.41Å; Y230-M234 HydrophobicContact CD2-CG 3.95Å; Y230-M234 HydrophobicContact CE1-CG 4.13Å; Y230-M234 HydrophobicContact CE2-CG 3.63Å; Y230-M234 HydrophobicContact CE2-SD 4.08Å; Y230-M234 HydrophobicContact CG-CG 4.34Å; Y230-M234 WeakPolarHBondContact O-CB 3.34Å; Y230-M234 VanDerWaalsContact O-CG 3.26Å; Y230-M234 WeakPolarHBondContact O-CG 3.37Å; Y230-M234 PolarHBondContact O-N 3.09Å; Y230-F236 HydrophobicContact CE1-CD2 4.12Å; Y230-F236 AromaticContact CE1-CE2 3.65Å; Y230-F236 HydrophobicContact CE1-CE2 3.65Å; Y230-L273 HydrophobicContact CD2-CD2 4Å; Y230-L273 HydrophobicContact CE2-CD2 4.47Å; Y230-L274 HydrophobicContact CD2-CD2 4.11Å; Y230-L274 HydrophobicContact CE2-CD2 4.23Å
231	K	88.3	Confident	82	Confident	77 Å²	77	31.1 Å²	31.1	34%	0.335	16%	0.16	S	C	.	.	H	α-helix	trans	-57.4	-45.5	176.4	-73.5	176.5	-179.8	-177.8	0	112	P188 I227 F228 G235 F236	P188-K231 HydrophobicContact CG-CD 4.36Å; P188-K231 HydrophobicContact CG-CG 3.77Å; I227-K231 HydrophobicContact CG2-CD 4.33Å; I227-K231 WeakPolarHBondContact O-CG 3.43Å; I227-K231 PolarHBondContact O-N 3.44Å; F228-K231 PolarHBondContact O-N 3.01Å; K231-G235 PolarHBondContact O-N 3.44Å; K231-G235 VanDerWaalsContact O-N 3.15Å; K231-F236 HydrophobicContact CB-CB 4.49Å; K231-F236 PolarHBondContact O-N 2.84Å
232	C	88.3	Confident	80.4	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.02	17%	0.173	C	C	.	.	H	α-helix	trans	-68.1	-45.9	-179.7	-62.8	0	0	0	0	112	F228 L229 Y230 M234 G235 C253	F228-C232 VanDerWaalsContact CE1-SG 3.6Å; F228-C232 VanDerWaalsContact CZ-SG 3.58Å; F228-C232 PolarHBondContact O-N 3.35Å; F228-C232 PolarHBondContact O-SG 2.79Å; L229-C232 PolarHBondContact O-N 3.01Å; Y230-C232 VanDerWaalsContact C-N 3.34Å; Y230-C232 PolarHBondContact O-N 3.36Å; C232-M234 VanDerWaalsContact C-N 3.32Å; C232-M234 PolarHBondContact O-N 3.39Å; C232-G235 PolarHBondContact O-N 3.18Å; C232-G235 VanDerWaalsContact O-N 3.08Å; C232-C253 HydrophobicContact CB-CB 3.74Å
233	L	89.4	Confident	78.5	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-73.4	-22.3	-176.9	-66.6	171.4	0	0	0	113.5	L229 Y230 Y251 T270 L274 M361 R388	L229-L233 VanDerWaalsContact O-CB 3.31Å; L229-L233 WeakPolarHBondContact O-CB 3.46Å; L229-L233 WeakPolarHBondContact O-CG 3.31Å; L229-L233 PolarHBondContact O-N 2.65Å; Y230-L233 PolarHBondContact O-N 3.42Å; L233-Y251 WeakPolarHBondContact O-CD1 3.48Å; L233-T270 HydrophobicContact CD1-CG2 3.46Å; L233-T270 VanDerWaalsContact CD1-CG2 3.46Å; L233-L274 HydrophobicContact CB-CD1 4.32Å; L233-L274 HydrophobicContact CD1-CD1 3.92Å; L233-M361 HydrophobicContact CD1-CE 3.82Å; L233-R388 HydrophobicContact CD2-CB 4.09Å; L233-R388 HydrophobicContact CD2-CG 4.45Å; L233-R388 WeakPolarHBondContact O-CD 3.43Å; L233-R388 PolarHBondContact O-NE 3.01Å
234	M	85.5	Confident	76.6	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-86.4	-12	169.6	-62.4	-58.9	85.8	0	0	112.8	Q198 Y230 C232 F236 Y251 L274 V285	Q198-M234 PolarHBondContact NE2-O 3.4Å; Q198-M234 PolarHBondContact OE1-O 3.48Å; Y230-M234 HydrophobicContact CD1-CG 4.41Å; Y230-M234 HydrophobicContact CD2-CG 3.95Å; Y230-M234 HydrophobicContact CE1-CG 4.13Å; Y230-M234 HydrophobicContact CE2-CG 3.63Å; Y230-M234 HydrophobicContact CE2-SD 4.08Å; Y230-M234 HydrophobicContact CG-CG 4.34Å; Y230-M234 WeakPolarHBondContact O-CB 3.34Å; Y230-M234 VanDerWaalsContact O-CG 3.26Å; Y230-M234 WeakPolarHBondContact O-CG 3.37Å; Y230-M234 PolarHBondContact O-N 3.09Å; C232-M234 VanDerWaalsContact C-N 3.32Å; C232-M234 PolarHBondContact O-N 3.39Å; M234-F236 HydrophobicContact CB-CD1 3.73Å; M234-F236 HydrophobicContact CB-CD2 3.88Å; M234-F236 HydrophobicContact CB-CE1 3.59Å; M234-F236 HydrophobicContact CB-CE2 3.75Å; M234-F236 HydrophobicContact CB-CG 3.87Å; M234-F236 HydrophobicContact CB-CZ 3.59Å; M234-F236 HydrophobicContact CG-CD2 4.46Å; M234-F236 HydrophobicContact CG-CE1 4.46Å; M234-F236 HydrophobicContact CG-CE2 4Å; M234-F236 HydrophobicContact CG-CZ 3.99Å; M234-Y251 WeakPolarHBondContact O-CE1 3.46Å; M234-L274 HydrophobicContact CE-CD1 4.26Å; M234-L274 HydrophobicContact CE-CD2 3.44Å; M234-L274 VanDerWaalsContact CE-CD2 3.44Å; M234-L274 HydrophobicContact CE-CG 4.5Å; M234-L274 HydrophobicContact SD-CD2 4.06Å; M234-V285 HydrophobicContact CE-CB 4.34Å; M234-V285 HydrophobicContact CE-CG1 3.52Å; M234-V285 HydrophobicContact CE-CG2 4.47Å; M234-V285 HydrophobicContact SD-CG1 3.97Å; M234-V285 HydrophobicContact SD-CG2 4.09Å
235	G	82.4	Confident	74.7	Confident	5 Å²	5	44.4 Å²	44.4	5%	0.052	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	29.4	-175.5	0	0	0	0	0	113.3	K231 C232 Q237 T250	K231-G235 PolarHBondContact O-N 3.44Å; K231-G235 VanDerWaalsContact O-N 3.15Å; C232-G235 PolarHBondContact O-N 3.18Å; C232-G235 VanDerWaalsContact O-N 3.08Å; G235-Q237 VanDerWaalsContact C-N 3.31Å; G235-T250 WeakPolarHBondContact CA-O 3.4Å
236	F	77.9	Confident	72.8	Confident	20 Å²	20	49.2 Å²	49.2	9%	0.088	26%	0.262	C	S	.	.			trans	-82.4	-8.9	178.3	-64.7	-13	0	0	0	113.5	P190 P191 C194 Y230 K231 M234 P279	P190-F236 HydrophobicContact CB-CE1 3.73Å; P190-F236 HydrophobicContact CB-CE2 4.23Å; P190-F236 HydrophobicContact CB-CZ 3.56Å; P191-F236 HydrophobicContact CG-CB 4.13Å; P191-F236 HydrophobicContact CG-CD1 4.32Å; P191-F236 HydrophobicContact CG-CG 4.37Å; C194-F236 HydrophobicContact CB-CD1 4.22Å; C194-F236 HydrophobicContact CB-CE1 4.32Å; Y230-F236 HydrophobicContact CE1-CD2 4.12Å; Y230-F236 AromaticContact CE1-CE2 3.65Å; Y230-F236 HydrophobicContact CE1-CE2 3.65Å; K231-F236 HydrophobicContact CB-CB 4.49Å; K231-F236 PolarHBondContact O-N 2.84Å; M234-F236 HydrophobicContact CB-CD1 3.73Å; M234-F236 HydrophobicContact CB-CD2 3.88Å; M234-F236 HydrophobicContact CB-CE1 3.59Å; M234-F236 HydrophobicContact CB-CE2 3.75Å; M234-F236 HydrophobicContact CB-CG 3.87Å; M234-F236 HydrophobicContact CB-CZ 3.59Å; M234-F236 HydrophobicContact CG-CD2 4.46Å; M234-F236 HydrophobicContact CG-CE1 4.46Å; M234-F236 HydrophobicContact CG-CE2 4Å; M234-F236 HydrophobicContact CG-CZ 3.99Å; F236-P279 HydrophobicContact CZ-CG 4.17Å
237	Q	72.3	Confident	71	Confident	57 Å²	57	52.9 Å²	52.9	27%	0.266	29%	0.292	S	S	.	.	S	Bend	trans	-69.4	136.4	-179.7	-163.2	70.1	-1.9	0	0	110.2	G235 Y239 S487	G235-Q237 VanDerWaalsContact C-N 3.31Å; Q237-Y239 PolarHBondContact O-N 3.34Å; Q237-S487 WeakPolarHBondContact CG-O 3.41Å
238	P	60.3	Low	69.5	Low	88 Å²	88	57.9 Å²	57.9	57%	0.571	31%	0.314	S	S	*	.			trans	-56.1	134.2	177.1	21	-33	0	0	0	110.9	V240	P238-V240 PolarHBondContact O-N 3.48Å
239	Y	57.3	Low	68.3	Low	84 Å²	84	58.8 Å²	58.8	33%	0.329	32%	0.324	S	S	.	.			trans	-69.5	110.8	175.9	-178.6	-99.7	0	0	0	109	Q237 A241 N243 D246 A247	Q237-Y239 PolarHBondContact O-N 3.34Å; Y239-A241 HydrophobicContact CD1-CB 4.06Å; Y239-A241 HydrophobicContact CE1-CB 3.21Å; Y239-A241 HydrophobicContact CE2-CB 3.86Å; Y239-A241 WeakPolarHBondContact OH-CB 3.39Å; Y239-N243 PolarHBondContact OH-O 2.89Å; Y239-D246 WeakPolarHBondContact CE2-O 3.46Å; Y239-D246 VanDerWaalsContact CZ-C 3.43Å; Y239-D246 WeakPolarHBondContact OH-CA 3.24Å; Y239-D246 PolarHBondContact OH-O 3.47Å; Y239-A247 HydrophobicContact CD1-CB 4.35Å; Y239-A247 HydrophobicContact CE1-CB 4.21Å; Y239-A247 PolarHBondContact OH-N 3.36Å
240	V	56.9	Low	67.5	Low	37 Å²	37	60.3 Å²	60.3	22%	0.224	33%	0.334	C	S	.	.			trans	-117.1	78.2	176.7	-178.8	0	0	0	0	108	P238 R415 R483 L484	P238-V240 PolarHBondContact O-N 3.48Å; V240-R415 PolarHBondContact O-NH1 2.93Å; V240-R415 PolarHBondContact O-NH2 2.77Å; V240-R483 HydrophobicContact CG1-CG 4.37Å; V240-R483 VanDerWaalsContact CG1-CZ 3.46Å; V240-L484 WeakPolarHBondContact O-CD2 3.27Å
241	A	55.3	Low	67.2	Low	27 Å²	27	61.6 Å²	61.6	22%	0.223	34%	0.339	C	S	.	.			trans	-96.6	165.6	-180	0	0	0	0	0	113	Y239 N243	Y239-A241 HydrophobicContact CD1-CB 4.06Å; Y239-A241 HydrophobicContact CE1-CB 3.21Å; Y239-A241 HydrophobicContact CE2-CB 3.86Å; Y239-A241 WeakPolarHBondContact OH-CB 3.39Å; A241-N243 VanDerWaalsContact C-N 3.32Å; A241-N243 VanDerWaalsContact CB-O 3.31Å; A241-N243 WeakPolarHBondContact CB-O 3.38Å
242	L	54.4	Low	67.2	Low	59 Å²	59	58 Å²	58	31%	0.309	32%	0.323	S	S	.	.	S	Bend	trans	-68.7	-34.5	167.7	-64.6	175.6	0	0	0	111.1	L416 L484	L242-L416 VanDerWaalsContact CD1-O 3.32Å; L242-L416 WeakPolarHBondContact CD1-O 3.29Å; L242-L484 HydrophobicContact CD1-CD1 4.44Å; L242-L484 HydrophobicContact CD2-CD1 4.15Å; L242-L484 HydrophobicContact CG-CD1 4.3Å
243	N	53.1	Low	67.4	Low	105 Å²	105	57.9 Å²	57.9	56%	0.561	32%	0.322	S	S	*	.	S	Bend	trans	-125.7	132	-179.4	-59.3	-17.9	0	0	0	109.7	Y239 A241 S245	Y239-N243 PolarHBondContact OH-O 2.89Å; A241-N243 VanDerWaalsContact C-N 3.32Å; A241-N243 VanDerWaalsContact CB-O 3.31Å; A241-N243 WeakPolarHBondContact CB-O 3.38Å; N243-S245 PolarHBondContact O-N 3.29Å
244	E	50.5	Low	67.5	Low	192 Å²	192	58 Å²	58	90%	0.897	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-13.8	-178.1	-64.7	-174.7	155.3	0	0	113.7
245	S	48.3	Very low	67.9	Low	99 Å²	99	57.9 Å²	57.9	69%	0.692	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-19	-171	49.5	0	0	0	0	115.6	N243	N243-S245 PolarHBondContact O-N 3.29Å
246	D	51.9	Low	68.2	Low	101 Å²	101	57.6 Å²	57.6	54%	0.54	32%	0.32	S	S	.	.			trans	-110.5	47.7	-173.4	-74.6	-35.9	0	0	0	112.9	Y239 Q248	Y239-D246 WeakPolarHBondContact CE2-O 3.46Å; Y239-D246 VanDerWaalsContact CZ-C 3.43Å; Y239-D246 WeakPolarHBondContact OH-CA 3.24Å; Y239-D246 PolarHBondContact OH-O 3.47Å; D246-Q248 PolarHBondContact O-N 3.08Å
247	A	53.2	Low	68.8	Low	77 Å²	77	56.7 Å²	56.7	64%	0.636	32%	0.316	S	S	*	.			trans	-67.1	62.4	-178.7	0	0	0	0	0	113.2	Y239	Y239-A247 HydrophobicContact CD1-CB 4.35Å; Y239-A247 HydrophobicContact CE1-CB 4.21Å; Y239-A247 PolarHBondContact OH-N 3.36Å
248	Q	60.5	Low	69.3	Low	148 Å²	148	57.3 Å²	57.3	69%	0.692	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-91.3	127.3	172.5	-66.2	-174.8	7.8	0	0	109.4	D246 T250	D246-Q248 PolarHBondContact O-N 3.08Å; Q248-T250 PolarHBondContact O-N 2.97Å
249	S	65.2	Low	70.3	Confident	49 Å²	49	54 Å²	54	34%	0.343	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-60.7	121.4	171.1	-60.7	0	0	0	0	109.7	Y251	S249-Y251 WeakPolarHBondContact CB-OH 3.31Å; S249-Y251 VanDerWaalsContact O-CD2 3.3Å; S249-Y251 WeakPolarHBondContact O-CD2 3.36Å; S249-Y251 WeakPolarHBondContact O-CE2 3.33Å
250	T	75.3	Confident	71.3	Confident	33 Å²	33	51.4 Å²	51.4	20%	0.202	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-87.5	134.5	179.3	56.2	0	0	0	0	110	G235 Q248 V412	G235-T250 WeakPolarHBondContact CA-O 3.4Å; Q248-T250 PolarHBondContact O-N 2.97Å; T250-V412 HydrophobicContact CG2-CG1 3.25Å
251	Y	84.6	Confident	72.6	Confident	31 Å²	31	49.7 Å²	49.7	12%	0.122	28%	0.284	C	S	.	.			trans	-117.1	31.4	-177.2	-62.6	-71	0	0	0	112.3	Q198 L233 M234 S249 R387 R388 R389	Q198-Y251 PolarHBondContact NE2-OH 3.48Å; Q198-Y251 VanDerWaalsContact NE2-OH 3.08Å; L233-Y251 WeakPolarHBondContact O-CD1 3.48Å; M234-Y251 WeakPolarHBondContact O-CE1 3.46Å; S249-Y251 WeakPolarHBondContact CB-OH 3.31Å; S249-Y251 VanDerWaalsContact O-CD2 3.3Å; S249-Y251 WeakPolarHBondContact O-CD2 3.36Å; S249-Y251 WeakPolarHBondContact O-CE2 3.33Å; Y251-R387 VanDerWaalsContact CB-O 3.27Å; Y251-R387 WeakPolarHBondContact CB-O 3.42Å; Y251-R387 HydrophobicContact CD2-CG 3.85Å; Y251-R387 HydrophobicContact CE2-CG 4.46Å; Y251-R387 VanDerWaalsContact CE2-NH2 3.31Å; Y251-R387 HydrophobicContact CG-CG 4.11Å; Y251-R387 PolarHBondContact OH-NH2 3.48Å; Y251-R388 VanDerWaalsContact O-CA 3.3Å; Y251-R388 WeakPolarHBondContact O-CA 3.36Å; Y251-R389 PolarHBondContact O-N 3.48Å; Y251-R389 VanDerWaalsContact O-N 3.09Å
252	G	88.9	Confident	74.2	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	150	-177.3	0	0	0	0	0	112.7	R389 C411	G252-R389 CarbonylContact C-O 3.48Å; G252-R389 VanDerWaalsContact CA-O 3.28Å; G252-R389 WeakPolarHBondContact CA-O 3.42Å; G252-C411 WeakPolarHBondContact CA-O 3.38Å
253	C	92.2	Very high	75.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	142.1	177.8	-171.2	0	0	0	0	111.7	F228 L229 C232 R389 L390 L391 F488	F228-C253 WeakPolarHBondContact CE1-SG 3.27Å; L229-C253 HydrophobicContact CD2-CB 4.29Å; L229-C253 WeakPolarHBondContact CD2-SG 3.39Å; C232-C253 HydrophobicContact CB-CB 3.74Å; C253-R389 PolarHBondContact N-O 3.27Å; C253-L390 HydrophobicContact CB-CD1 4.14Å; C253-L390 WeakPolarHBondContact O-CA 3.23Å; C253-L391 PolarHBondContact O-N 2.95Å; C253-F488 CarbonylContact C-O 3.55Å; C253-F488 WeakPolarHBondContact CA-O 2.81Å
254	I	92.6	Very high	77.7	Confident	2 Å²	2	44 Å²	44	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	114.4	172.5	-59.9	174.7	0	0	0	108.3	A256 L391 T393 L407 C411 F488 F489 L490	I254-A256 HydrophobicContact CG2-CB 4.25Å; I254-L391 WeakPolarHBondContact CA-O 3.41Å; I254-L391 HydrophobicContact CG1-CB 4.31Å; I254-L391 HydrophobicContact CG2-CD2 4Å; I254-T393 HydrophobicContact CG2-CG2 4.22Å; I254-L407 HydrophobicContact CD1-CB 4.45Å; I254-C411 HydrophobicContact CD1-CB 4.48Å; I254-C411 HydrophobicContact CG1-CB 4.15Å; I254-C411 VanDerWaalsContact CG1-SG 3.6Å; I254-F488 HydrophobicContact CD1-CD2 4.17Å; I254-F488 HydrophobicContact CD1-CE2 4.01Å; I254-F488 HydrophobicContact CG1-CD2 4.39Å; I254-F488 PolarHBondContact N-O 3.11Å; I254-F489 HydrophobicContact CB-CD2 3.79Å; I254-F489 HydrophobicContact CB-CE2 4.45Å; I254-F489 HydrophobicContact CD1-CD2 4.19Å; I254-F489 HydrophobicContact CG2-CD2 3.57Å; I254-F489 HydrophobicContact CG2-CE2 3.73Å; I254-F489 WeakPolarHBondContact O-CA 3.28Å; I254-L490 PolarHBondContact O-N 2.91Å
255	L	93	Very high	79.7	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	98.3	170.7	-170.6	67.2	0	0	0	109	L229 D257 K263 Q266 L391 L392 T393 L490	L229-L255 HydrophobicContact CD1-CD2 4.46Å; L229-L255 HydrophobicContact CD2-CB 4.41Å; L255-D257 HydrophobicContact CG-CB 4.47Å; L255-K263 HydrophobicContact CD2-CB 3.99Å; L255-K263 HydrophobicContact CD2-CD 4.49Å; L255-K263 HydrophobicContact CD2-CG 3.85Å; L255-K263 HydrophobicContact CG-CD 4.45Å; L255-K263 HydrophobicContact CG-CG 4.19Å; L255-Q266 HydrophobicContact CD2-CB 4.24Å; L255-L391 PolarHBondContact N-O 3.36Å; L255-L392 HydrophobicContact CB-CD2 3.84Å; L255-L392 HydrophobicContact CD2-CD2 3.96Å; L255-L392 HydrophobicContact CG-CD2 4.49Å; L255-T393 PolarHBondContact O-N 3.23Å; L255-L490 HydrophobicContact CD1-CB 4.28Å; L255-L490 HydrophobicContact CD1-CD2 3.86Å; L255-L490 HydrophobicContact CD1-CG 4.28Å
256	A	89.6	Confident	81.8	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.182	C	C	.	.			trans	-102.8	29.3	-177.4	0	0	0	0	0	112.9	I254 T393 P396 F489 L490 R491	I254-A256 HydrophobicContact CG2-CB 4.25Å; A256-T393 CarbonylContact C-O 3.58Å; A256-T393 VanDerWaalsContact CA-O 3.3Å; A256-T393 WeakPolarHBondContact CA-O 3.42Å; A256-T393 HydrophobicContact CB-CG2 3.89Å; A256-P396 HydrophobicContact CB-CB 3.98Å; A256-P396 HydrophobicContact CB-CG 4.08Å; A256-F489 HydrophobicContact CB-CD2 4.39Å; A256-F489 HydrophobicContact CB-CE1 3.88Å; A256-F489 HydrophobicContact CB-CE2 3.6Å; A256-F489 HydrophobicContact CB-CZ 3.31Å; A256-L490 CarbonylContact C-O 3.59Å; A256-L490 WeakPolarHBondContact CA-O 3.43Å; A256-L490 PolarHBondContact N-O 3.1Å; A256-R491 HydrophobicContact CB-CB 4.24Å; A256-R491 WeakPolarHBondContact O-CG 3.42Å
257	D	89	Confident	83.8	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-53.7	143.4	172	-83.4	-3.7	0	0	0	112	L255 L261 K263 Q266 R492	L255-D257 HydrophobicContact CG-CB 4.47Å; D257-L261 HydrophobicContact CB-CB 4.12Å; D257-L261 HydrophobicContact CB-CD1 3.84Å; D257-L261 HydrophobicContact CB-CG 4.48Å; D257-K263 HydrophobicContact CB-CD 3.97Å; D257-K263 HydrophobicContact CB-CG 3.68Å; D257-K263 PolarHBondContact O-NZ 3.18Å; D257-Q266 PolarHBondContact OD2-NE2 3.08Å; D257-R492 IonicContact OD1-CZ 2.61Å; D257-R492 VanDerWaalsContact OD1-CZ 3.3Å; D257-R492 IonicContact OD1-NE 3.88Å; D257-R492 PolarHBondContact OD1-NE 3.19Å; D257-R492 IonicContact OD1-NH2 2.78Å; D257-R492 PolarHBondContact OD1-NH2 3.34Å; D257-R492 VanDerWaalsContact OD1-NH2 3.07Å; D257-R492 IonicContact OD2-CZ 3.07Å; D257-R492 IonicContact OD2-NE 3.86Å; D257-R492 IonicContact OD2-NH2 2.74Å; D257-R492 PolarHBondContact OD2-NH2 3.34Å
258	E	82.3	Confident	85.8	Confident	71 Å²	71	22.1 Å²	22.1	33%	0.332	13%	0.126	S	C	.	.	P	Polyproline II helix	trans	-56.6	157.8	171.1	-161.7	172	163.9	0	0	112.1	G260 L261 K263 R492 T493 C494	E258-G260 PolarHBondContact O-N 3.1Å; E258-L261 HydrophobicContact CB-CD1 4.22Å; E258-L261 HydrophobicContact CB-CG 4.48Å; E258-L261 PolarHBondContact O-N 3.45Å; E258-K263 PolarHBondContact O-NZ 3.03Å; E258-R492 WeakPolarHBondContact CB-O 3.4Å; E258-R492 PolarHBondContact N-O 3.39Å; E258-T493 WeakPolarHBondContact OE2-CA 3.31Å; E258-C494 VanDerWaalsContact CG-SG 3.59Å; E258-C494 PolarHBondContact OE2-N 2.76Å
259	M	81.5	Confident	87.3	Confident	19 Å²	19	15.1 Å²	15.1	9%	0.094	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	123.9	-176.8	-56.9	-163.8	66.6	0	0	110.6	Q779 A782	M259-Q779 HydrophobicContact CE-CB 4.44Å; M259-Q779 HydrophobicContact CE-CG 3.7Å; M259-Q779 HydrophobicContact SD-CB 3.77Å; M259-Q779 HydrophobicContact SD-CG 3.69Å; M259-A782 HydrophobicContact CB-CB 3.79Å
260	G	78.9	Confident	88.5	Confident	28 Å²	28	12.8 Å²	12.8	29%	0.289	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	109.9	-14.7	-179	0	0	0	0	0	114.8	E258 G262	E258-G260 PolarHBondContact O-N 3.1Å; G260-G262 PolarHBondContact O-N 3.05Å; G260-G262 VanDerWaalsContact O-N 3.15Å
261	L	85.1	Confident	89.4	Confident	1 Å²	1	11.2 Å²	11.2	1%	0.005	7%	0.067	C	C	.	.	S	Bend	trans	-70.9	-7.2	179.7	-63.7	-175.6	0	0	0	115	H221 Q222 D257 E258 R492 I497	H221-L261 PolarHBondContact NE2-O 3.18Å; Q222-L261 PolarHBondContact NE2-O 3.23Å; Q222-L261 VanDerWaalsContact NE2-O 3.16Å; D257-L261 HydrophobicContact CB-CB 4.12Å; D257-L261 HydrophobicContact CB-CD1 3.84Å; D257-L261 HydrophobicContact CB-CG 4.48Å; E258-L261 HydrophobicContact CB-CD1 4.22Å; E258-L261 HydrophobicContact CB-CG 4.48Å; E258-L261 PolarHBondContact O-N 3.45Å; L261-R492 HydrophobicContact CD1-CB 3.71Å; L261-R492 VanDerWaalsContact CD1-O 3.29Å; L261-R492 WeakPolarHBondContact CD1-O 3.37Å; L261-I497 HydrophobicContact CD2-CD1 3.3Å; L261-I497 HydrophobicContact CD2-CG1 3.56Å
262	G	87.2	Confident	89.7	Confident	20 Å²	20	9.9 Å²	9.9	21%	0.206	6%	0.062	C	C	.	.			trans	89.4	38	176.6	0	0	0	0	0	115.2	G260 T264 V265 Q266	G260-G262 PolarHBondContact O-N 3.05Å; G260-G262 VanDerWaalsContact O-N 3.15Å; G262-T264 VanDerWaalsContact C-N 3.28Å; G262-T264 PolarHBondContact O-N 2.66Å; G262-V265 PolarHBondContact O-N 3.23Å; G262-Q266 PolarHBondContact O-N 3.49Å; G262-Q266 VanDerWaalsContact O-N 3.12Å
263	K	90.9	Very high	89.7	Confident	22 Å²	22	9.9 Å²	9.9	10%	0.096	6%	0.061	C	C	.	.	H	α-helix	trans	-48.9	-44.5	176	-69.5	-171	-75.7	-79.2	0	113.8	L255 D257 E258 V265 Q266 A267 T393	L255-K263 HydrophobicContact CD2-CB 3.99Å; L255-K263 HydrophobicContact CD2-CD 4.49Å; L255-K263 HydrophobicContact CD2-CG 3.85Å; L255-K263 HydrophobicContact CG-CD 4.45Å; L255-K263 HydrophobicContact CG-CG 4.19Å; D257-K263 HydrophobicContact CB-CD 3.97Å; D257-K263 HydrophobicContact CB-CG 3.68Å; D257-K263 PolarHBondContact O-NZ 3.18Å; E258-K263 PolarHBondContact O-NZ 3.03Å; K263-V265 VanDerWaalsContact C-N 3.34Å; K263-V265 PolarHBondContact O-N 2.94Å; K263-Q266 PolarHBondContact O-N 3.4Å; K263-A267 WeakPolarHBondContact O-CB 3.44Å; K263-A267 PolarHBondContact O-N 3.41Å; K263-T393 WeakPolarHBondContact CD-O 3.35Å; K263-T393 WeakPolarHBondContact CE-O 3.47Å
264	T	91.3	Very high	89.7	Confident	29 Å²	29	9.9 Å²	9.9	18%	0.178	6%	0.061	C	C	.	.	H	α-helix	trans	-59.7	-43.3	178.3	-50.5	0	0	0	0	111.8	G262 A267 I268 W301 E304	G262-T264 VanDerWaalsContact C-N 3.28Å; G262-T264 PolarHBondContact O-N 2.66Å; T264-A267 PolarHBondContact O-N 3.22Å; T264-I268 HydrophobicContact CG2-CD1 3.94Å; T264-I268 VanDerWaalsContact O-CG1 3.27Å; T264-I268 WeakPolarHBondContact O-CG1 3.27Å; T264-I268 PolarHBondContact O-N 2.97Å; T264-W301 HydrophobicContact CG2-CD2 3.87Å; T264-W301 HydrophobicContact CG2-CE3 3.7Å; T264-W301 HydrophobicContact CG2-CH2 3.83Å; T264-W301 HydrophobicContact CG2-CZ2 3.95Å; T264-W301 HydrophobicContact CG2-CZ3 3.7Å; T264-E304 HydrophobicContact CG2-CB 4.27Å; T264-E304 HydrophobicContact CG2-CG 4.37Å
265	V	91.5	Very high	89.5	Confident	11 Å²	11	10.1 Å²	10.1	7%	0.067	6%	0.063	C	C	.	.	H	α-helix	trans	-66.6	-42.6	179.5	-176.3	0	0	0	0	110.6	F214 L218 G262 K263 A267 I268 A269 W308	F214-V265 HydrophobicContact CZ-CG1 4.29Å; L218-V265 HydrophobicContact CD2-CG1 3.6Å; G262-V265 PolarHBondContact O-N 3.23Å; K263-V265 VanDerWaalsContact C-N 3.34Å; K263-V265 PolarHBondContact O-N 2.94Å; V265-A267 VanDerWaalsContact C-N 3.34Å; V265-A267 PolarHBondContact O-N 3.4Å; V265-I268 PolarHBondContact O-N 3.31Å; V265-A269 WeakPolarHBondContact O-CB 3.48Å; V265-A269 PolarHBondContact O-N 3.01Å; V265-W308 HydrophobicContact CB-CZ2 4.46Å; V265-W308 HydrophobicContact CG1-CD2 4.05Å; V265-W308 HydrophobicContact CG1-CE3 4.31Å; V265-W308 HydrophobicContact CG1-CH2 4.08Å; V265-W308 HydrophobicContact CG1-CZ2 3.8Å; V265-W308 HydrophobicContact CG1-CZ3 4.31Å; V265-W308 HydrophobicContact CG2-CZ2 3.76Å
266	Q	93.6	Very high	89.2	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-60.2	-44.7	175	-64.1	176.7	43.5	0	0	111.1	Q222 I226 L229 L255 D257 G262 K263 A269 T270 R492	Q222-Q266 HydrophobicContact CB-CG 4.1Å; Q222-Q266 HydrophobicContact CG-CG 4.27Å; I226-Q266 HydrophobicContact CG1-CB 4.22Å; I226-Q266 HydrophobicContact CG1-CG 4.39Å; L229-Q266 HydrophobicContact CD1-CB 4.11Å; L255-Q266 HydrophobicContact CD2-CB 4.24Å; D257-Q266 PolarHBondContact OD2-NE2 3.08Å; G262-Q266 PolarHBondContact O-N 3.49Å; G262-Q266 VanDerWaalsContact O-N 3.12Å; K263-Q266 PolarHBondContact O-N 3.4Å; Q266-A269 WeakPolarHBondContact O-CB 3.49Å; Q266-A269 PolarHBondContact O-N 3.23Å; Q266-T270 PolarHBondContact O-N 3.23Å; Q266-T270 PolarHBondContact O-OG1 3.45Å; Q266-T270 VanDerWaalsContact O-OG1 3.04Å; Q266-R492 VanDerWaalsContact NE2-NH2 3.16Å
267	A	94.5	Very high	89	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-63.2	-46.8	176.6	0	0	0	0	0	112.5	K263 T264 V265 A269 T270 I271 W301 L390 L392	K263-A267 WeakPolarHBondContact O-CB 3.44Å; K263-A267 PolarHBondContact O-N 3.41Å; T264-A267 PolarHBondContact O-N 3.22Å; V265-A267 VanDerWaalsContact C-N 3.34Å; V265-A267 PolarHBondContact O-N 3.4Å; A267-A269 VanDerWaalsContact C-N 3.32Å; A267-A269 PolarHBondContact O-N 3.4Å; A267-T270 PolarHBondContact O-N 3.21Å; A267-I271 WeakPolarHBondContact O-CB 3.32Å; A267-I271 WeakPolarHBondContact O-CD1 3.31Å; A267-I271 WeakPolarHBondContact O-CG1 3.47Å; A267-I271 PolarHBondContact O-N 3.15Å; A267-W301 HydrophobicContact CB-CH2 4.03Å; A267-L390 HydrophobicContact CB-CD2 4.1Å; A267-L392 HydrophobicContact CB-CD1 3.94Å; A267-L392 HydrophobicContact CB-CD2 4.35Å
268	I	93.3	Very high	88.8	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-59.4	-44.8	176.9	-69.2	169.3	0	0	0	110.5	T264 V265 T270 I271 W272 W301 E304 F305 L309	T264-I268 HydrophobicContact CG2-CD1 3.94Å; T264-I268 VanDerWaalsContact O-CG1 3.27Å; T264-I268 WeakPolarHBondContact O-CG1 3.27Å; T264-I268 PolarHBondContact O-N 2.97Å; V265-I268 PolarHBondContact O-N 3.31Å; I268-T270 VanDerWaalsContact C-N 3.35Å; I268-T270 PolarHBondContact O-N 3.06Å; I268-I271 PolarHBondContact O-N 3.28Å; I268-W272 VanDerWaalsContact O-CB 3.3Å; I268-W272 WeakPolarHBondContact O-CB 3.48Å; I268-W272 PolarHBondContact O-N 3.03Å; I268-W301 HydrophobicContact CD1-CE3 4.45Å; I268-W301 HydrophobicContact CD1-CZ3 4.45Å; I268-W301 HydrophobicContact CG1-CE3 4.37Å; I268-W301 HydrophobicContact CG1-CZ3 3.98Å; I268-E304 HydrophobicContact CD1-CB 3.83Å; I268-F305 HydrophobicContact CB-CE1 4.42Å; I268-F305 HydrophobicContact CD1-CD1 4.42Å; I268-F305 HydrophobicContact CD1-CD2 4.34Å; I268-F305 HydrophobicContact CD1-CE2 4.48Å; I268-F305 HydrophobicContact CD1-CG 4.3Å; I268-F305 HydrophobicContact CG1-CD1 4.24Å; I268-F305 HydrophobicContact CG1-CD2 4.49Å; I268-F305 HydrophobicContact CG1-CE1 3.91Å; I268-F305 HydrophobicContact CG1-CE2 4.18Å; I268-F305 HydrophobicContact CG1-CZ 3.87Å; I268-F305 HydrophobicContact CG2-CD1 4.08Å; I268-F305 HydrophobicContact CG2-CE1 3.99Å; I268-L309 HydrophobicContact CG2-CD1 3.87Å; I268-L309 HydrophobicContact CG2-CG 4.14Å
269	A	91.9	Very high	88.8	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-58.6	-46.9	178.1	0	0	0	0	0	111.8	F214 I226 V265 Q266 A267 L273	F214-A269 HydrophobicContact CD1-CB 4.32Å; F214-A269 HydrophobicContact CE1-CB 3.27Å; F214-A269 HydrophobicContact CZ-CB 3.5Å; F214-A269 VanDerWaalsContact CZ-CB 3.5Å; I226-A269 HydrophobicContact CD1-CB 3.49Å; I226-A269 VanDerWaalsContact CD1-CB 3.49Å; I226-A269 HydrophobicContact CG1-CB 3.95Å; V265-A269 WeakPolarHBondContact O-CB 3.48Å; V265-A269 PolarHBondContact O-N 3.01Å; Q266-A269 WeakPolarHBondContact O-CB 3.49Å; Q266-A269 PolarHBondContact O-N 3.23Å; A267-A269 VanDerWaalsContact C-N 3.32Å; A267-A269 PolarHBondContact O-N 3.4Å; A269-L273 VanDerWaalsContact O-CB 3.3Å; A269-L273 WeakPolarHBondContact O-CB 3.47Å; A269-L273 PolarHBondContact O-N 2.93Å
270	T	92.3	Very high	88.8	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-66.2	-43.7	178.8	-60.4	0	0	0	0	111.8	L229 L233 Q266 A267 I268 L273 L274	L229-T270 HydrophobicContact CB-CG2 4.15Å; L229-T270 WeakPolarHBondContact CD1-OG1 3.5Å; L233-T270 HydrophobicContact CD1-CG2 3.46Å; L233-T270 VanDerWaalsContact CD1-CG2 3.46Å; Q266-T270 PolarHBondContact O-N 3.23Å; Q266-T270 PolarHBondContact O-OG1 3.45Å; Q266-T270 VanDerWaalsContact O-OG1 3.04Å; A267-T270 PolarHBondContact O-N 3.21Å; I268-T270 VanDerWaalsContact C-N 3.35Å; I268-T270 PolarHBondContact O-N 3.06Å; T270-L273 PolarHBondContact O-N 2.73Å; T270-L274 HydrophobicContact CG2-CD1 4.03Å; T270-L274 HydrophobicContact CG2-CG 4.38Å; T270-L274 WeakPolarHBondContact O-CB 3.07Å; T270-L274 VanDerWaalsContact O-CG 3.27Å; T270-L274 WeakPolarHBondContact O-CG 3.2Å; T270-L274 PolarHBondContact O-N 3.06Å
271	I	92.7	Very high	88.6	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-60.3	-48.7	176.6	-67.8	164.1	0	0	0	110.3	A267 I268 L273 L274 I275 C289 I291 V338 M361 V363	A267-I271 WeakPolarHBondContact O-CB 3.32Å; A267-I271 WeakPolarHBondContact O-CD1 3.31Å; A267-I271 WeakPolarHBondContact O-CG1 3.47Å; A267-I271 PolarHBondContact O-N 3.15Å; I268-I271 PolarHBondContact O-N 3.28Å; I271-L273 VanDerWaalsContact C-N 3.33Å; I271-L273 PolarHBondContact O-N 3Å; I271-L274 PolarHBondContact O-N 3.42Å; I271-I275 HydrophobicContact CG2-CD1 3.58Å; I271-I275 HydrophobicContact CG2-CG1 4.43Å; I271-I275 WeakPolarHBondContact O-CB 3.2Å; I271-I275 VanDerWaalsContact O-CG1 3.32Å; I271-I275 WeakPolarHBondContact O-CG1 3.48Å; I271-I275 PolarHBondContact O-N 3.26Å; I271-C289 HydrophobicContact CG2-CB 4.33Å; I271-I291 HydrophobicContact CD1-CD1 3.88Å; I271-I291 HydrophobicContact CD1-CG1 4.35Å; I271-V338 HydrophobicContact CG2-CG2 3.92Å; I271-M361 HydrophobicContact CG1-CE 4.09Å; I271-M361 HydrophobicContact CG1-SD 4.45Å; I271-V363 HydrophobicContact CD1-CG2 4.01Å; I271-V363 HydrophobicContact CG1-CG2 4.41Å
272	W	90.9	Very high	88.3	Confident	4 Å²	4	17.5 Å²	17.5	2%	0.015	10%	0.1	C	C	.	.	H	α-helix	trans	-59.4	-44.3	178.7	174.5	85.8	0	0	0	111.8	L210 E211 I268 I275 R276 L309	L210-W272 HydrophobicContact CD1-CE3 3.45Å; L210-W272 VanDerWaalsContact CD1-CE3 3.45Å; L210-W272 HydrophobicContact CD1-CH2 4.33Å; L210-W272 HydrophobicContact CD1-CZ3 3.28Å; L210-W272 HydrophobicContact CG-CZ3 4.42Å; E211-W272 HydrophobicContact CB-CH2 3.61Å; E211-W272 HydrophobicContact CB-CZ2 4.03Å; E211-W272 HydrophobicContact CB-CZ3 4.47Å; E211-W272 VanDerWaalsContact CD-CZ2 3.49Å; E211-W272 HydrophobicContact CG-CH2 3.56Å; E211-W272 HydrophobicContact CG-CZ2 3.79Å; E211-W272 WeakPolarHBondContact OE1-CZ2 3.37Å; I268-W272 VanDerWaalsContact O-CB 3.3Å; I268-W272 WeakPolarHBondContact O-CB 3.48Å; I268-W272 PolarHBondContact O-N 3.03Å; W272-I275 PolarHBondContact O-N 3.46Å; W272-R276 HydrophobicContact CZ2-CG 4.49Å; W272-R276 WeakPolarHBondContact O-CB 3.37Å; W272-R276 WeakPolarHBondContact O-CG 3.32Å; W272-R276 PolarHBondContact O-N 3.44Å; W272-R276 VanDerWaalsContact O-N 3.08Å; W272-L309 HydrophobicContact CB-CD1 4.07Å; W272-L309 HydrophobicContact CB-CD2 4.15Å; W272-L309 HydrophobicContact CD2-CD2 4.27Å; W272-L309 HydrophobicContact CG-CD1 4.19Å; W272-L309 HydrophobicContact CG-CD2 3.66Å
273	L	89.9	Confident	88.1	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.2	-48.5	179	-171.5	71.6	0	0	0	111.5	M187 V208 L210 Y230 A269 T270 I271 I275 R276 Q277	M187-L273 HydrophobicContact CE-CD2 3.99Å; M187-L273 HydrophobicContact CG-CD2 3.7Å; M187-L273 HydrophobicContact SD-CD2 4.12Å; V208-L273 HydrophobicContact CG1-CD1 3.57Å; V208-L273 HydrophobicContact CG1-CD2 3.83Å; V208-L273 HydrophobicContact CG1-CG 3.69Å; L210-L273 HydrophobicContact CB-CD1 4.48Å; Y230-L273 HydrophobicContact CD2-CD2 4Å; Y230-L273 HydrophobicContact CE2-CD2 4.47Å; A269-L273 VanDerWaalsContact O-CB 3.3Å; A269-L273 WeakPolarHBondContact O-CB 3.47Å; A269-L273 PolarHBondContact O-N 2.93Å; T270-L273 PolarHBondContact O-N 2.73Å; I271-L273 VanDerWaalsContact C-N 3.33Å; I271-L273 PolarHBondContact O-N 3Å; L273-I275 VanDerWaalsContact C-N 3.34Å; L273-I275 PolarHBondContact O-N 3.06Å; L273-R276 PolarHBondContact O-N 3.33Å; L273-Q277 PolarHBondContact O-N 3.48Å
274	L	90.9	Very high	87.9	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-70.5	-27.9	-177.7	-66.6	-177.9	0	0	0	113.3	Y230 L233 M234 T270 I271 V285 I286 M361	Y230-L274 HydrophobicContact CD2-CD2 4.11Å; Y230-L274 HydrophobicContact CE2-CD2 4.23Å; L233-L274 HydrophobicContact CB-CD1 4.32Å; L233-L274 HydrophobicContact CD1-CD1 3.92Å; M234-L274 HydrophobicContact CE-CD1 4.26Å; M234-L274 HydrophobicContact CE-CD2 3.44Å; M234-L274 VanDerWaalsContact CE-CD2 3.44Å; M234-L274 HydrophobicContact CE-CG 4.5Å; M234-L274 HydrophobicContact SD-CD2 4.06Å; T270-L274 HydrophobicContact CG2-CD1 4.03Å; T270-L274 HydrophobicContact CG2-CG 4.38Å; T270-L274 WeakPolarHBondContact O-CB 3.07Å; T270-L274 VanDerWaalsContact O-CG 3.27Å; T270-L274 WeakPolarHBondContact O-CG 3.2Å; T270-L274 PolarHBondContact O-N 3.06Å; I271-L274 PolarHBondContact O-N 3.42Å; L274-V285 HydrophobicContact CB-CB 4.48Å; L274-V285 HydrophobicContact CD2-CB 4.19Å; L274-V285 HydrophobicContact CD2-CG2 4.27Å; L274-V285 PolarHBondContact O-N 3.27Å; L274-I286 HydrophobicContact CB-CD1 3.72Å; L274-I286 HydrophobicContact CB-CG1 3.82Å; L274-I286 HydrophobicContact CB-CG2 4.26Å; L274-I286 HydrophobicContact CD1-CG2 4.45Å; L274-I286 PolarHBondContact O-N 3.33Å; L274-M361 HydrophobicContact CD1-SD 4.1Å
275	I	90.1	Very high	87.6	Confident	7 Å²	7	25.9 Å²	25.9	4%	0.036	13%	0.134	C	C	.	.	H	α-helix	trans	-75.2	-31.7	174.3	-75.5	171.3	0	0	0	111.5	I271 W272 L273 P284 I286 L314 Q337 V338	I271-I275 HydrophobicContact CG2-CD1 3.58Å; I271-I275 HydrophobicContact CG2-CG1 4.43Å; I271-I275 WeakPolarHBondContact O-CB 3.2Å; I271-I275 VanDerWaalsContact O-CG1 3.32Å; I271-I275 WeakPolarHBondContact O-CG1 3.48Å; I271-I275 PolarHBondContact O-N 3.26Å; W272-I275 PolarHBondContact O-N 3.46Å; L273-I275 VanDerWaalsContact C-N 3.34Å; L273-I275 PolarHBondContact O-N 3.06Å; I275-P284 WeakPolarHBondContact O-CB 3.43Å; I275-I286 HydrophobicContact CB-CG1 4.42Å; I275-I286 HydrophobicContact CD1-CD1 4.33Å; I275-I286 HydrophobicContact CD1-CG1 4.47Å; I275-I286 HydrophobicContact CG1-CD1 3.73Å; I275-I286 HydrophobicContact CG1-CG1 3.46Å; I275-I286 VanDerWaalsContact CG1-CG1 3.46Å; I275-L314 HydrophobicContact CD1-CD1 3.74Å; I275-L314 HydrophobicContact CG2-CD1 4.42Å; I275-Q337 HydrophobicContact CD1-CB 4.28Å; I275-V338 HydrophobicContact CD1-CG2 3.76Å
276	R	86.1	Confident	87.5	Confident	128 Å²	128	25.3 Å²	25.3	48%	0.483	13%	0.131	S	C	.	.	H	α-helix	trans	-94.4	-37.9	-173.9	-72.4	-72.7	-177.5	176.2	-2.6	113.3	W272 L273 Q313	W272-R276 HydrophobicContact CZ2-CG 4.49Å; W272-R276 WeakPolarHBondContact O-CB 3.37Å; W272-R276 WeakPolarHBondContact O-CG 3.32Å; W272-R276 PolarHBondContact O-N 3.44Å; W272-R276 VanDerWaalsContact O-N 3.08Å; L273-R276 PolarHBondContact O-N 3.33Å; R276-Q313 PolarHBondContact NH2-O 3.39Å
277	Q	86.2	Confident	87.2	Confident	53 Å²	53	32.4 Å²	32.4	25%	0.248	16%	0.158	C	C	.	.			trans	-139.5	157.5	-169.1	-63	177.9	22.5	0	0	111	V208 V209 L273 R283	V208-Q277 HydrophobicContact CG1-CB 4.28Å; V209-Q277 PolarHBondContact O-NE2 3.47Å; V209-Q277 VanDerWaalsContact O-NE2 3.16Å; V209-Q277 PolarHBondContact O-OE1 3.05Å; L273-Q277 PolarHBondContact O-N 3.48Å; Q277-R283 CarbonylContact C-O 3.57Å
278	G	84.4	Confident	87	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.01	17%	0.166	C	C	.	.			trans	-152.4	158.4	172.6	0	0	0	0	0	110.5	V208 Y280 G282 R283 V285	V208-G278 VanDerWaalsContact CG2-C 3.48Å; G278-Y280 PolarHBondContact O-N 3.44Å; G278-G282 WeakPolarHBondContact O-CA 3.36Å; G278-G282 PolarHBondContact O-N 3.48Å; G278-R283 WeakPolarHBondContact CA-O 3.49Å; G278-R283 PolarHBondContact N-O 3.48Å; G278-V285 VanDerWaalsContact CA-CG2 3.49Å
279	P	80.9	Confident	87	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.013	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-26.9	-175.8	25.3	-33.1	0	0	0	112.4	P190 I205 V206 V208 F236	P190-P279 HydrophobicContact CG-CB 4.46Å; I205-P279 CarbonylContact C-O 3.56Å; I205-P279 VanDerWaalsContact CA-O 3.28Å; I205-P279 WeakPolarHBondContact CA-O 3.49Å; V206-P279 PolarHBondContact N-O 3.4Å; V208-P279 HydrophobicContact CG2-CB 4.4Å; F236-P279 HydrophobicContact CZ-CG 4.17Å
280	Y	81.5	Confident	87.1	Confident	31 Å²	31	34.6 Å²	34.6	12%	0.122	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-98.3	104.9	-176.4	-52	-62.7	0	0	0	110.8	P190 C194 Q198 N199 G278 G282 R283	P190-Y280 HydrophobicContact CG-CE1 4.32Å; C194-Y280 PolarHBondContact O-OH 3.35Å; Q198-Y280 HydrophobicContact CB-CE2 3.76Å; N199-Y280 HydrophobicContact CB-CD1 3.53Å; N199-Y280 HydrophobicContact CB-CE1 3.62Å; N199-Y280 HydrophobicContact CB-CG 4.14Å; G278-Y280 PolarHBondContact O-N 3.44Å; Y280-G282 PolarHBondContact O-N 3.5Å; Y280-G282 VanDerWaalsContact O-N 3.14Å; Y280-R283 PolarHBondContact O-N 3.26Å
281	G	75.9	Confident	87.3	Confident	29 Å²	29	34.6 Å²	34.6	30%	0.299	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	13.3	177.5	0	0	0	0	0	115.3	P204 R283	P204-G281 WeakPolarHBondContact O-CA 3.45Å; P204-G281 PolarHBondContact O-N 3.47Å; G281-R283 PolarHBondContact O-N 3.39Å
282	G	78.7	Confident	87.3	Confident	31 Å²	31	34.6 Å²	34.6	32%	0.32	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	14.1	-175.2	0	0	0	0	0	114.1	G278 Y280	G278-G282 WeakPolarHBondContact O-CA 3.36Å; G278-G282 PolarHBondContact O-N 3.48Å; Y280-G282 PolarHBondContact O-N 3.5Å; Y280-G282 VanDerWaalsContact O-N 3.14Å
283	R	83.6	Confident	87.4	Confident	139 Å²	139	34.4 Å²	34.4	53%	0.525	17%	0.165	S	C	.	.			trans	-75.1	148.2	-178.6	-67.8	-176.7	179.4	172.5	2.3	111.1	D201 Q277 G278 Y280 G281 V285	D201-R283 IonicContact OD2-NH1 3.49Å; Q277-R283 CarbonylContact C-O 3.57Å; G278-R283 WeakPolarHBondContact CA-O 3.49Å; G278-R283 PolarHBondContact N-O 3.48Å; Y280-R283 PolarHBondContact O-N 3.26Å; G281-R283 PolarHBondContact O-N 3.39Å; R283-V285 PolarHBondContact O-N 3.21Å
284	P	85.2	Confident	87.3	Confident	76 Å²	76	34.6 Å²	34.6	49%	0.494	17%	0.167	S	C	.	.			trans	-62.4	135	174.8	30.1	-37.7	0	0	0	110.5	I275	I275-P284 WeakPolarHBondContact O-CB 3.43Å
285	V	86.3	Confident	87	Confident	31 Å²	31	36.2 Å²	36.2	19%	0.188	18%	0.183	C	C	.	.	S	Bend	trans	-85.2	-28.5	-177.7	-176.1	0	0	0	0	112.1	M234 L274 G278 R283 R388	M234-V285 HydrophobicContact CE-CB 4.34Å; M234-V285 HydrophobicContact CE-CG1 3.52Å; M234-V285 HydrophobicContact CE-CG2 4.47Å; M234-V285 HydrophobicContact SD-CG1 3.97Å; M234-V285 HydrophobicContact SD-CG2 4.09Å; L274-V285 HydrophobicContact CB-CB 4.48Å; L274-V285 HydrophobicContact CD2-CB 4.19Å; L274-V285 HydrophobicContact CD2-CG2 4.27Å; L274-V285 PolarHBondContact O-N 3.27Å; G278-V285 VanDerWaalsContact CA-CG2 3.49Å; R283-V285 PolarHBondContact O-N 3.21Å; V285-R388 PolarHBondContact O-NH1 2.8Å
286	I	89.6	Confident	86.5	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.199	C	C	.	.			trans	-124.7	135.2	177	68.1	-178.3	0	0	0	109.5	L274 I275 C289 D360 M361	L274-I286 HydrophobicContact CB-CD1 3.72Å; L274-I286 HydrophobicContact CB-CG1 3.82Å; L274-I286 HydrophobicContact CB-CG2 4.26Å; L274-I286 HydrophobicContact CD1-CG2 4.45Å; L274-I286 PolarHBondContact O-N 3.33Å; I275-I286 HydrophobicContact CB-CG1 4.42Å; I275-I286 HydrophobicContact CD1-CD1 4.33Å; I275-I286 HydrophobicContact CD1-CG1 4.47Å; I275-I286 HydrophobicContact CG1-CD1 3.73Å; I275-I286 HydrophobicContact CG1-CG1 3.46Å; I275-I286 VanDerWaalsContact CG1-CG1 3.46Å; I286-C289 HydrophobicContact CD1-CB 4.32Å; I286-D360 HydrophobicContact CB-CB 4.05Å; I286-D360 HydrophobicContact CG2-CB 4.04Å; I286-M361 HydrophobicContact CD1-CB 4.24Å; I286-M361 HydrophobicContact CD1-SD 3.71Å; I286-M361 HydrophobicContact CG2-CB 4.13Å
287	R	87.3	Confident	86.4	Confident	149 Å²	149	33.2 Å²	33.2	56%	0.562	18%	0.179	S	C	*	.	S	Bend	trans	-90.4	-45.7	174.9	-67	-179.1	178.1	179.3	4.3	111.7	D358 D360	R287-D358 HydrophobicContact CB-CB 4.07Å; R287-D358 WeakPolarHBondContact CD-OD2 2.92Å; R287-D358 IonicContact CZ-OD2 3.67Å; R287-D358 IonicContact NH1-OD1 3.36Å; R287-D358 IonicContact NH1-OD2 3.85Å; R287-D358 PolarHBondContact NH1-OD2 3.43Å; R287-D360 PolarHBondContact N-OD2 3.02Å
288	R	90.1	Very high	86.5	Confident	45 Å²	45	31.1 Å²	31.1	17%	0.17	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	142.7	178.2	-61.1	178	175.3	163.1	-6.1	111.7	Q337 S357 D358 L359 D360 M361	R288-Q337 CarbonylContact C-O 3.45Å; R288-Q337 VanDerWaalsContact CA-O 3.26Å; R288-Q337 WeakPolarHBondContact CA-O 3.32Å; R288-S357 PolarHBondContact NH1-O 3.3Å; R288-D358 WeakPolarHBondContact CB-O 3.34Å; R288-D358 PolarHBondContact N-O 2.85Å; R288-L359 HydrophobicContact CB-CD1 4.46Å; R288-D360 PolarHBondContact O-N 3.29Å; R288-M361 PolarHBondContact O-N 2.73Å
289	C	93	Very high	86.5	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	128.9	177.7	-176.8	0	0	0	0	110.2	I271 I286 Q337 V338 I339 M361	I271-C289 HydrophobicContact CG2-CB 4.33Å; I286-C289 HydrophobicContact CD1-CB 4.32Å; C289-Q337 PolarHBondContact N-O 2.94Å; C289-V338 HydrophobicContact CB-CG2 4.29Å; C289-V338 WeakPolarHBondContact O-CA 3.31Å; C289-I339 PolarHBondContact O-N 3.12Å; C289-M361 WeakPolarHBondContact CA-O 3.29Å; C289-M361 HydrophobicContact CB-CB 4.42Å
290	L	94.2	Very high	86.8	Confident	1 Å²	1	39 Å²	39	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	120.5	174.1	176.4	65	0	0	0	109.9	V292 I339 M341 F346 I353 L359 M361 V362 V363 L384	L290-V292 HydrophobicContact CD2-CG2 4.09Å; L290-V292 HydrophobicContact CG-CG2 3.93Å; L290-I339 HydrophobicContact CD1-CB 4Å; L290-I339 HydrophobicContact CD1-CG2 3.85Å; L290-M341 HydrophobicContact CD1-CG 3.98Å; L290-M341 HydrophobicContact CD1-SD 3.73Å; L290-F346 HydrophobicContact CD2-CD2 4.26Å; L290-F346 HydrophobicContact CD2-CE2 4.12Å; L290-I353 HydrophobicContact CD2-CG2 4.16Å; L290-L359 HydrophobicContact CB-CD1 3.57Å; L290-L359 HydrophobicContact CB-CD2 4.23Å; L290-L359 HydrophobicContact CB-CG 4.49Å; L290-L359 HydrophobicContact CD2-CD2 4.21Å; L290-M361 PolarHBondContact N-O 3.32Å; L290-V362 HydrophobicContact CD2-CG2 4.46Å; L290-V362 CarbonylContact O-C 3.52Å; L290-V362 VanDerWaalsContact O-CA 3.32Å; L290-V362 WeakPolarHBondContact O-CA 3.46Å; L290-V363 PolarHBondContact O-N 3.45Å; L290-L384 HydrophobicContact CD2-CD1 4.11Å
291	I	95.3	Very high	87.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	117.7	174.9	-54.6	176.3	0	0	0	108.4	I271 W301 F305 V338 I339 L340 M341 V363	I271-I291 HydrophobicContact CD1-CD1 3.88Å; I271-I291 HydrophobicContact CD1-CG1 4.35Å; I291-W301 HydrophobicContact CD1-CE3 4.31Å; I291-W301 HydrophobicContact CD1-CZ3 4.2Å; I291-W301 HydrophobicContact CG2-CD2 4.38Å; I291-W301 HydrophobicContact CG2-CE3 4.39Å; I291-W301 HydrophobicContact CG2-CH2 4.45Å; I291-W301 HydrophobicContact CG2-CZ2 4.47Å; I291-W301 HydrophobicContact CG2-CZ3 4.42Å; I291-F305 HydrophobicContact CD1-CE2 3.59Å; I291-F305 HydrophobicContact CD1-CZ 3.53Å; I291-V338 HydrophobicContact CD1-CG1 3.54Å; I291-V338 HydrophobicContact CG1-CG1 4.09Å; I291-I339 PolarHBondContact N-O 2.84Å; I291-L340 HydrophobicContact CB-CD1 3.79Å; I291-L340 HydrophobicContact CG2-CD1 3.6Å; I291-M341 PolarHBondContact O-N 3.22Å; I291-V363 WeakPolarHBondContact CA-O 3.02Å; I291-V363 HydrophobicContact CG1-CB 4.2Å; I291-V363 HydrophobicContact CG1-CG2 4.47Å; I291-V363 HydrophobicContact CG2-CB 4.47Å
292	V	94.2	Very high	87.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	119	176.5	-169.4	0	0	0	0	108.4	L290 M341 Y343 V362 V363 D365 L381	L290-V292 HydrophobicContact CD2-CG2 4.09Å; L290-V292 HydrophobicContact CG-CG2 3.93Å; V292-M341 WeakPolarHBondContact CA-O 3.3Å; V292-Y343 HydrophobicContact CB-CE1 4.29Å; V292-Y343 HydrophobicContact CG1-CD1 3.33Å; V292-Y343 HydrophobicContact CG1-CD2 4.13Å; V292-Y343 HydrophobicContact CG1-CE1 3.53Å; V292-Y343 HydrophobicContact CG1-CE2 4.29Å; V292-Y343 HydrophobicContact CG1-CG 3.66Å; V292-V362 HydrophobicContact CG2-CG2 4.48Å; V292-V363 PolarHBondContact N-O 3.24Å; V292-D365 PolarHBondContact O-N 3.49Å; V292-L381 HydrophobicContact CG2-CD2 4.11Å
293	T	92.2	Very high	88.2	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	158.9	-174.7	-173.4	0	0	0	0	110.3	L297 I298 W301 L340 M341 S342 Y343 D365	T293-L297 VanDerWaalsContact OG1-CB 3.31Å; T293-L297 WeakPolarHBondContact OG1-CB 3.37Å; T293-I298 HydrophobicContact CG2-CG1 3.62Å; T293-W301 PolarHBondContact OG1-NE1 2.87Å; T293-L340 HydrophobicContact CG2-CD1 3.74Å; T293-M341 PolarHBondContact N-O 2.93Å; T293-M341 VanDerWaalsContact N-O 3.09Å; T293-S342 VanDerWaalsContact O-CA 3.22Å; T293-S342 WeakPolarHBondContact O-CA 3.45Å; T293-Y343 PolarHBondContact O-N 3.39Å; T293-D365 PolarHBondContact OG1-OD2 2.79Å
294	P	87.5	Confident	88.5	Confident	4 Å²	4	37.8 Å²	37.8	3%	0.026	19%	0.192	C	C	.	.			trans	-54.1	141.8	166.9	-27.1	36	0	0	0	111.8	T296 L297 Y343 E366	P294-T296 PolarHBondContact O-N 3.01Å; P294-L297 HydrophobicContact CB-CG 4.46Å; P294-L297 HydrophobicContact CG-CD1 4.18Å; P294-L297 PolarHBondContact O-N 3.04Å; P294-Y343 HydrophobicContact CG-CE2 4.43Å; P294-E366 HydrophobicContact CG-CB 3.99Å; P294-E366 HydrophobicContact CG-CG 3.99Å
295	G	84.7	Confident	88.7	Confident	34 Å²	34	34.6 Å²	34.6	35%	0.351	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-25.6	-179.4	0	0	0	0	0	114.7	L297	G295-L297 VanDerWaalsContact C-N 3.34Å; G295-L297 PolarHBondContact O-N 3.29Å
296	T	79.1	Confident	88.8	Confident	58 Å²	58	35.4 Å²	35.4	36%	0.356	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-19	177.1	54.9	0	0	0	0	114.4	P294 V755	P294-T296 PolarHBondContact O-N 3.01Å; T296-V755 HydrophobicContact CG2-CG1 3.82Å
297	L	85.1	Confident	88.7	Confident	13 Å²	13	41.6 Å²	41.6	7%	0.068	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-10.1	-175.1	-68.2	-175.1	0	0	0	113.5	T293 P294 G295 Q299 N300 W301 E366	T293-L297 VanDerWaalsContact OG1-CB 3.31Å; T293-L297 WeakPolarHBondContact OG1-CB 3.37Å; P294-L297 HydrophobicContact CB-CG 4.46Å; P294-L297 HydrophobicContact CG-CD1 4.18Å; P294-L297 PolarHBondContact O-N 3.04Å; G295-L297 VanDerWaalsContact C-N 3.34Å; G295-L297 PolarHBondContact O-N 3.29Å; L297-Q299 PolarHBondContact O-N 3.28Å; L297-N300 WeakPolarHBondContact O-CA 3.28Å; L297-N300 WeakPolarHBondContact O-CB 3.42Å; L297-N300 PolarHBondContact O-N 3.37Å; L297-W301 PolarHBondContact O-N 3.05Å; L297-E366 HydrophobicContact CD1-CG 4.23Å
298	I	88.4	Confident	88.6	Confident	9 Å²	9	36.9 Å²	36.9	5%	0.046	19%	0.187	C	C	.	.	H	α-helix	trans	-52.9	-51.3	-179	-67.7	176.9	0	0	0	111.7	T293 N300 W301 L302 C318 L340	T293-I298 HydrophobicContact CG2-CG1 3.62Å; I298-N300 PolarHBondContact O-N 3.39Å; I298-W301 PolarHBondContact O-N 3.5Å; I298-L302 HydrophobicContact CG2-CD1 4.38Å; I298-L302 WeakPolarHBondContact O-CG 3.42Å; I298-L302 PolarHBondContact O-N 3.02Å; I298-C318 WeakPolarHBondContact CG2-SG 3.46Å; I298-L340 HydrophobicContact CG2-CD2 3.85Å; I298-L340 HydrophobicContact CG2-CG 4.29Å
299	Q	84.2	Confident	88.3	Confident	107 Å²	107	35.2 Å²	35.2	50%	0.5	18%	0.181	S	C	.	.	H	α-helix	trans	-64.4	-30.5	179.4	-66.3	-61.8	-31.2	0	0	112.6	L297 K303	L297-Q299 PolarHBondContact O-N 3.28Å; Q299-K303 VanDerWaalsContact O-CG 3.29Å; Q299-K303 WeakPolarHBondContact O-CG 3.2Å; Q299-K303 PolarHBondContact O-N 3.36Å; Q299-K303 VanDerWaalsContact O-N 3.11Å
300	N	86.2	Confident	87.6	Confident	61 Å²	61	36.7 Å²	36.7	33%	0.326	20%	0.196	S	C	.	.	H	α-helix	trans	-70.6	-44.3	175.6	-172.9	67.2	0	0	0	111.3	L297 I298 L302 K303 E304	L297-N300 WeakPolarHBondContact O-CA 3.28Å; L297-N300 WeakPolarHBondContact O-CB 3.42Å; L297-N300 PolarHBondContact O-N 3.37Å; I298-N300 PolarHBondContact O-N 3.39Å; N300-L302 PolarHBondContact O-N 3.16Å; N300-K303 PolarHBondContact O-N 3.35Å; N300-E304 WeakPolarHBondContact O-CG 3.39Å; N300-E304 PolarHBondContact O-N 3.09Å
301	W	90.6	Very high	86.3	Confident	1 Å²	1	47 Å²	47	0%	0.004	24%	0.235	C	C	.	.	H	α-helix	trans	-58	-46.5	174	-85.9	93.9	0	0	0	111.7	T264 A267 I268 I291 T293 L297 I298 K303 E304 F305 L340 D365 L392	T264-W301 HydrophobicContact CG2-CD2 3.87Å; T264-W301 HydrophobicContact CG2-CE3 3.7Å; T264-W301 HydrophobicContact CG2-CH2 3.83Å; T264-W301 HydrophobicContact CG2-CZ2 3.95Å; T264-W301 HydrophobicContact CG2-CZ3 3.7Å; A267-W301 HydrophobicContact CB-CH2 4.03Å; I268-W301 HydrophobicContact CD1-CE3 4.45Å; I268-W301 HydrophobicContact CD1-CZ3 4.45Å; I268-W301 HydrophobicContact CG1-CE3 4.37Å; I268-W301 HydrophobicContact CG1-CZ3 3.98Å; I291-W301 HydrophobicContact CD1-CE3 4.31Å; I291-W301 HydrophobicContact CD1-CZ3 4.2Å; I291-W301 HydrophobicContact CG2-CD2 4.38Å; I291-W301 HydrophobicContact CG2-CE3 4.39Å; I291-W301 HydrophobicContact CG2-CH2 4.45Å; I291-W301 HydrophobicContact CG2-CZ2 4.47Å; I291-W301 HydrophobicContact CG2-CZ3 4.42Å; T293-W301 PolarHBondContact OG1-NE1 2.87Å; L297-W301 PolarHBondContact O-N 3.05Å; I298-W301 PolarHBondContact O-N 3.5Å; W301-K303 VanDerWaalsContact C-N 3.35Å; W301-K303 PolarHBondContact O-N 3.39Å; W301-E304 PolarHBondContact O-N 2.9Å; W301-F305 HydrophobicContact CE3-CD2 4.32Å; W301-F305 AromaticContact CE3-CE2 3.71Å; W301-F305 HydrophobicContact CE3-CE2 3.71Å; W301-F305 HydrophobicContact CE3-CZ 4.48Å; W301-F305 HydrophobicContact CZ3-CE2 4.23Å; W301-F305 VanDerWaalsContact O-CD2 3.26Å; W301-F305 WeakPolarHBondContact O-CD2 3.37Å; W301-F305 PolarHBondContact O-N 3.33Å; W301-L340 HydrophobicContact CB-CD1 4.12Å; W301-L340 HydrophobicContact CB-CD2 3.86Å; W301-L340 HydrophobicContact CG-CD1 4.33Å; W301-D365 HydrophobicContact CZ2-CB 4.08Å; W301-D365 PolarHBondContact NE1-OD2 2.97Å; W301-L392 HydrophobicContact CH2-CD1 3.87Å; W301-L392 HydrophobicContact CZ2-CD1 3.86Å
302	L	89.4	Confident	84.8	Confident	43 Å²	43	56.1 Å²	56.1	23%	0.225	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-43	176.4	-69	174.4	0	0	0	112.6	I298 N300 F305 S306 V316 C318 L340	I298-L302 HydrophobicContact CG2-CD1 4.38Å; I298-L302 WeakPolarHBondContact O-CG 3.42Å; I298-L302 PolarHBondContact O-N 3.02Å; N300-L302 PolarHBondContact O-N 3.16Å; L302-F305 PolarHBondContact O-N 3.4Å; L302-S306 WeakPolarHBondContact O-CB 3.32Å; L302-S306 PolarHBondContact O-N 3.27Å; L302-S306 PolarHBondContact O-OG 3.13Å; L302-V316 HydrophobicContact CD2-CB 4.08Å; L302-V316 HydrophobicContact CD2-CG1 3.76Å; L302-C318 HydrophobicContact CD1-CB 4.17Å; L302-L340 HydrophobicContact CD2-CD2 3.8Å; L302-L340 HydrophobicContact CG-CD2 3.74Å
303	K	86.5	Confident	83.8	Confident	126 Å²	126	59.8 Å²	59.8	55%	0.548	30%	0.295	S	S	.	.	H	α-helix	trans	-61.7	-45.8	175.3	-75.6	174.8	-177.5	-178.5	0	111.5	Q299 N300 W301 S306 K307	Q299-K303 VanDerWaalsContact O-CG 3.29Å; Q299-K303 WeakPolarHBondContact O-CG 3.2Å; Q299-K303 PolarHBondContact O-N 3.36Å; Q299-K303 VanDerWaalsContact O-N 3.11Å; N300-K303 PolarHBondContact O-N 3.35Å; W301-K303 VanDerWaalsContact C-N 3.35Å; W301-K303 PolarHBondContact O-N 3.39Å; K303-S306 PolarHBondContact O-N 3.41Å; K303-S306 PolarHBondContact O-OG 3.45Å; K303-K307 VanDerWaalsContact O-CB 3.27Å; K303-K307 WeakPolarHBondContact O-CB 3.37Å; K303-K307 PolarHBondContact O-N 3.39Å
304	E	89.2	Confident	83.1	Confident	35 Å²	35	60.1 Å²	60.1	16%	0.164	30%	0.297	C	S	.	.	H	α-helix	trans	-64.9	-42.6	178.6	-70.7	-63.5	138.8	0	0	111.9	T264 I268 N300 W301 S306 K307 W308	T264-E304 HydrophobicContact CG2-CB 4.27Å; T264-E304 HydrophobicContact CG2-CG 4.37Å; I268-E304 HydrophobicContact CD1-CB 3.83Å; N300-E304 WeakPolarHBondContact O-CG 3.39Å; N300-E304 PolarHBondContact O-N 3.09Å; W301-E304 PolarHBondContact O-N 2.9Å; E304-S306 VanDerWaalsContact C-N 3.33Å; E304-S306 PolarHBondContact O-N 3.18Å; E304-K307 PolarHBondContact O-N 2.92Å; E304-K307 IonicContact OE1-NZ 3.87Å; E304-K307 IonicContact OE2-NZ 3.3Å; E304-W308 PolarHBondContact O-N 3.46Å; E304-W308 VanDerWaalsContact OE2-CD1 3.23Å; E304-W308 PolarHBondContact OE2-NE1 3.36Å
305	F	90.1	Very high	82.8	Confident	9 Å²	9	63.1 Å²	63.1	4%	0.039	32%	0.316	C	S	.	.	H	α-helix	trans	-55.5	-48.7	171.8	-88.9	-72.5	0	0	0	111.6	I268 I291 W301 L302 K307 W308 L309 L314 V316 V338	I268-F305 HydrophobicContact CB-CE1 4.42Å; I268-F305 HydrophobicContact CD1-CD1 4.42Å; I268-F305 HydrophobicContact CD1-CD2 4.34Å; I268-F305 HydrophobicContact CD1-CE2 4.48Å; I268-F305 HydrophobicContact CD1-CG 4.3Å; I268-F305 HydrophobicContact CG1-CD1 4.24Å; I268-F305 HydrophobicContact CG1-CD2 4.49Å; I268-F305 HydrophobicContact CG1-CE1 3.91Å; I268-F305 HydrophobicContact CG1-CE2 4.18Å; I268-F305 HydrophobicContact CG1-CZ 3.87Å; I268-F305 HydrophobicContact CG2-CD1 4.08Å; I268-F305 HydrophobicContact CG2-CE1 3.99Å; I291-F305 HydrophobicContact CD1-CE2 3.59Å; I291-F305 HydrophobicContact CD1-CZ 3.53Å; W301-F305 HydrophobicContact CE3-CD2 4.32Å; W301-F305 AromaticContact CE3-CE2 3.71Å; W301-F305 HydrophobicContact CE3-CE2 3.71Å; W301-F305 HydrophobicContact CE3-CZ 4.48Å; W301-F305 HydrophobicContact CZ3-CE2 4.23Å; W301-F305 VanDerWaalsContact O-CD2 3.26Å; W301-F305 WeakPolarHBondContact O-CD2 3.37Å; W301-F305 PolarHBondContact O-N 3.33Å; L302-F305 PolarHBondContact O-N 3.4Å; F305-K307 VanDerWaalsContact C-N 3.31Å; F305-K307 PolarHBondContact O-N 3.07Å; F305-W308 PolarHBondContact O-N 3.03Å; F305-L309 HydrophobicContact CD1-CD1 4.12Å; F305-L309 HydrophobicContact CE1-CD1 4.46Å; F305-L309 PolarHBondContact O-N 3.29Å; F305-L314 HydrophobicContact CD1-CD2 4.25Å; F305-L314 HydrophobicContact CE1-CD2 4.09Å; F305-V316 HydrophobicContact CB-CG2 4.13Å; F305-V316 HydrophobicContact CD1-CG2 3.9Å; F305-V316 HydrophobicContact CD2-CG2 3.95Å; F305-V316 HydrophobicContact CE1-CG2 4.29Å; F305-V316 HydrophobicContact CE2-CG2 4.32Å; F305-V316 HydrophobicContact CG-CG2 3.73Å; F305-V316 HydrophobicContact CZ-CG2 4.5Å; F305-V338 HydrophobicContact CE2-CG1 4.5Å; F305-V338 HydrophobicContact CZ-CG1 4.08Å
306	S	88	Confident	82.8	Confident	49 Å²	49	63 Å²	63	34%	0.343	31%	0.309	S	S	.	.	H	α-helix	trans	-65.9	-32.6	179.8	73.4	0	0	0	0	113.5	L302 K303 E304 G310	L302-S306 WeakPolarHBondContact O-CB 3.32Å; L302-S306 PolarHBondContact O-N 3.27Å; L302-S306 PolarHBondContact O-OG 3.13Å; K303-S306 PolarHBondContact O-N 3.41Å; K303-S306 PolarHBondContact O-OG 3.45Å; E304-S306 VanDerWaalsContact C-N 3.33Å; E304-S306 PolarHBondContact O-N 3.18Å; S306-G310 VanDerWaalsContact O-CA 3.27Å; S306-G310 WeakPolarHBondContact O-CA 3.22Å; S306-G310 PolarHBondContact O-N 3.12Å
307	K	86.9	Confident	83.2	Confident	130 Å²	130	61.4 Å²	61.4	57%	0.565	30%	0.296	S	S	*	.	H	α-helix	trans	-73.4	-40.6	-179.7	175.5	-176	170.7	-170.6	0	112.4	K303 E304 F305	K303-K307 VanDerWaalsContact O-CB 3.27Å; K303-K307 WeakPolarHBondContact O-CB 3.37Å; K303-K307 PolarHBondContact O-N 3.39Å; E304-K307 PolarHBondContact O-N 2.92Å; E304-K307 IonicContact OE1-NZ 3.87Å; E304-K307 IonicContact OE2-NZ 3.3Å; F305-K307 VanDerWaalsContact C-N 3.31Å; F305-K307 PolarHBondContact O-N 3.07Å
308	W	85.9	Confident	83.4	Confident	49 Å²	49	61.7 Å²	61.7	19%	0.186	30%	0.299	C	S	.	.	H	α-helix	trans	-92.2	-37.2	-172.6	-72.6	103.4	0	0	0	114.1	F214 R217 V265 E304 F305	F214-W308 HydrophobicContact CD2-CB 4.5Å; F214-W308 HydrophobicContact CD2-CE3 4.43Å; F214-W308 HydrophobicContact CE2-CB 3.81Å; F214-W308 HydrophobicContact CE2-CE3 4.14Å; F214-W308 HydrophobicContact CE2-CG 4.41Å; F214-W308 HydrophobicContact CZ-CE3 4.38Å; R217-W308 HydrophobicContact CB-CH2 4.2Å; R217-W308 HydrophobicContact CB-CZ3 3.74Å; V265-W308 HydrophobicContact CB-CZ2 4.46Å; V265-W308 HydrophobicContact CG1-CD2 4.05Å; V265-W308 HydrophobicContact CG1-CE3 4.31Å; V265-W308 HydrophobicContact CG1-CH2 4.08Å; V265-W308 HydrophobicContact CG1-CZ2 3.8Å; V265-W308 HydrophobicContact CG1-CZ3 4.31Å; V265-W308 HydrophobicContact CG2-CZ2 3.76Å; E304-W308 PolarHBondContact O-N 3.46Å; E304-W308 VanDerWaalsContact OE2-CD1 3.23Å; E304-W308 PolarHBondContact OE2-NE1 3.36Å; F305-W308 PolarHBondContact O-N 3.03Å
309	L	83.3	Confident	83.2	Confident	10 Å²	10	61.3 Å²	61.3	5%	0.052	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-19.6	-177.6	-60.8	177.6	0	0	0	113.1	F214 I268 W272 F305 Q313 L314	F214-L309 HydrophobicContact CD2-CD2 4Å; F214-L309 HydrophobicContact CE2-CD2 3.95Å; I268-L309 HydrophobicContact CG2-CD1 3.87Å; I268-L309 HydrophobicContact CG2-CG 4.14Å; W272-L309 HydrophobicContact CB-CD1 4.07Å; W272-L309 HydrophobicContact CB-CD2 4.15Å; W272-L309 HydrophobicContact CD2-CD2 4.27Å; W272-L309 HydrophobicContact CG-CD1 4.19Å; W272-L309 HydrophobicContact CG-CD2 3.66Å; F305-L309 HydrophobicContact CD1-CD1 4.12Å; F305-L309 HydrophobicContact CE1-CD1 4.46Å; F305-L309 PolarHBondContact O-N 3.29Å; L309-Q313 HydrophobicContact CB-CB 4.48Å; L309-Q313 WeakPolarHBondContact O-CB 3.43Å; L309-Q313 WeakPolarHBondContact O-CG 3.46Å; L309-Q313 PolarHBondContact O-OE1 3.2Å; L309-L314 HydrophobicContact CD1-CB 4.12Å; L309-L314 HydrophobicContact CD1-CD1 4.42Å
310	G	77.6	Confident	83.1	Confident	31 Å²	31	59 Å²	59	32%	0.32	29%	0.289	S	S	.	.			trans	76.2	162.1	-166.5	0	0	0	0	0	112.1	S306 E312	S306-G310 VanDerWaalsContact O-CA 3.27Å; S306-G310 WeakPolarHBondContact O-CA 3.22Å; S306-G310 PolarHBondContact O-N 3.12Å; G310-E312 VanDerWaalsContact C-N 3.32Å; G310-E312 PolarHBondContact O-N 3.32Å
311	R	68.3	Low	82.6	Confident	218 Å²	218	64.3 Å²	64.3	82%	0.823	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-24.8	-175.6	-67.9	-175.5	179.8	-176.7	-0	114
312	E	64.1	Low	81.9	Confident	191 Å²	191	70.8 Å²	70.8	89%	0.893	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-24.3	-172	-62.5	-179.6	174.7	0	0	113.2	G310	G310-E312 VanDerWaalsContact C-N 3.32Å; G310-E312 PolarHBondContact O-N 3.32Å
313	Q	71.9	Confident	81.3	Confident	77 Å²	77	73.5 Å²	73.5	36%	0.36	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-31.5	-171.9	-65.5	-169	0	0	0	113.4	R276 L309	R276-Q313 PolarHBondContact NH2-O 3.39Å; L309-Q313 HydrophobicContact CB-CB 4.48Å; L309-Q313 WeakPolarHBondContact O-CB 3.43Å; L309-Q313 WeakPolarHBondContact O-CG 3.46Å; L309-Q313 PolarHBondContact O-OE1 3.2Å
314	L	78	Confident	81	Confident	7 Å²	7	68.7 Å²	68.7	4%	0.037	34%	0.34	C	S	.	.	S	Bend	trans	-151.9	100.5	-177.2	-167	142	0	0	0	109.2	I275 F305 L309 V316 V338	I275-L314 HydrophobicContact CD1-CD1 3.74Å; I275-L314 HydrophobicContact CG2-CD1 4.42Å; F305-L314 HydrophobicContact CD1-CD2 4.25Å; F305-L314 HydrophobicContact CE1-CD2 4.09Å; L309-L314 HydrophobicContact CD1-CB 4.12Å; L309-L314 HydrophobicContact CD1-CD1 4.42Å; L314-V316 HydrophobicContact CD2-CG2 3.81Å; L314-V338 HydrophobicContact CD1-CG2 4.26Å; L314-V338 HydrophobicContact CD2-CB 3.87Å; L314-V338 HydrophobicContact CD2-CG2 3.44Å; L314-V338 VanDerWaalsContact CD2-CG2 3.44Å; L314-V338 HydrophobicContact CG-CG2 4.29Å
315	P	80.7	Confident	80.4	Confident	67 Å²	67	67.1 Å²	67.1	44%	0.435	33%	0.332	S	S	.	.			trans	-68.5	137.8	174.1	28	-32.6	0	0	0	109.5	P336	P315-P336 HydrophobicContact CB-CB 4.08Å; P315-P336 HydrophobicContact CB-CG 4.2Å; P315-P336 HydrophobicContact CG-CB 4.16Å; P315-P336 WeakPolarHBondContact O-CB 3.42Å
316	V	86	Confident	79.7	Confident	33 Å²	33	72.6 Å²	72.6	20%	0.2	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	124.8	176.6	-179.7	0	0	0	0	108.1	L302 F305 L314 V338 L340	L302-V316 HydrophobicContact CD2-CB 4.08Å; L302-V316 HydrophobicContact CD2-CG1 3.76Å; F305-V316 HydrophobicContact CB-CG2 4.13Å; F305-V316 HydrophobicContact CD1-CG2 3.9Å; F305-V316 HydrophobicContact CD2-CG2 3.95Å; F305-V316 HydrophobicContact CE1-CG2 4.29Å; F305-V316 HydrophobicContact CE2-CG2 4.32Å; F305-V316 HydrophobicContact CG-CG2 3.73Å; F305-V316 HydrophobicContact CZ-CG2 4.5Å; L314-V316 HydrophobicContact CD2-CG2 3.81Å; V316-V338 WeakPolarHBondContact CA-O 3.41Å; V316-V338 HydrophobicContact CG1-CG1 4.19Å; V316-V338 HydrophobicContact CG2-CB 4.33Å; V316-V338 HydrophobicContact CG2-CG1 4.36Å; V316-L340 HydrophobicContact CG1-CB 3.81Å; V316-L340 HydrophobicContact CG1-CD2 4.45Å
317	Y	87.6	Confident	79.2	Confident	23 Å²	23	74 Å²	74	9%	0.09	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	117.5	174.9	-169.2	-99.5	0	0	0	110.1	V319 S324 Y328 P336 V338 L340	Y317-V319 HydrophobicContact CD1-CG2 3.89Å; Y317-V319 HydrophobicContact CE1-CG2 3.93Å; Y317-S324 PolarHBondContact OH-O 2.95Å; Y317-S324 VanDerWaalsContact OH-O 3.11Å; Y317-Y328 AromaticContact CD1-CD2 3.75Å; Y317-Y328 HydrophobicContact CD1-CD2 3.75Å; Y317-Y328 HydrophobicContact CD1-CG 4.23Å; Y317-Y328 AromaticContact CD2-CD2 4Å; Y317-Y328 HydrophobicContact CD2-CD2 4Å; Y317-Y328 HydrophobicContact CE1-CD2 4.22Å; Y317-Y328 HydrophobicContact CE1-CG 4.35Å; Y317-Y328 HydrophobicContact CE2-CD2 4.42Å; Y317-Y328 AromaticContact CG-CD2 3.63Å; Y317-Y328 HydrophobicContact CG-CD2 3.63Å; Y317-Y328 HydrophobicContact CG-CE2 4.29Å; Y317-P336 HydrophobicContact CD2-CG 4.35Å; Y317-V338 PolarHBondContact N-O 3.16Å; Y317-L340 PolarHBondContact O-N 2.92Å
318	C	88.2	Confident	78.9	Confident	19 Å²	19	68 Å²	68	13%	0.128	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	119.6	175.6	-168.4	0	0	0	0	109.8	I298 L302 D320	I298-C318 WeakPolarHBondContact CG2-SG 3.46Å; L302-C318 HydrophobicContact CD1-CB 4.17Å; C318-D320 PolarHBondContact O-N 3.38Å
319	V	85.2	Confident	78.4	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.006	34%	0.338	C	S	.	.			trans	-86.4	108.2	175	-174.8	0	0	0	0	108.8	Y317 V325 I339 L340 M341	Y317-V319 HydrophobicContact CD1-CG2 3.89Å; Y317-V319 HydrophobicContact CE1-CG2 3.93Å; V319-V325 HydrophobicContact CG1-CG2 3.76Å; V319-V325 HydrophobicContact CG2-CG2 4.06Å; V319-I339 HydrophobicContact CG2-CG2 3.85Å; V319-L340 PolarHBondContact N-O 3.45Å; V319-M341 HydrophobicContact CB-CB 3.82Å; V319-M341 HydrophobicContact CB-CE 4.4Å; V319-M341 HydrophobicContact CG1-CE 4.21Å; V319-M341 HydrophobicContact CG2-CB 4.06Å
320	D	80.6	Confident	78.1	Confident	60 Å²	60	73.1 Å²	73.1	32%	0.321	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-123.2	173.5	174.6	-69.1	-28	0	0	0	109.3	C318 N322 H323	C318-D320 PolarHBondContact O-N 3.38Å; D320-N322 PolarHBondContact O-N 3.33Å; D320-N322 VanDerWaalsContact O-N 3.08Å; D320-H323 PolarHBondContact N-O 3.45Å; D320-H323 CarbonylContact O-C 3.59Å; D320-H323 PolarHBondContact O-N 3.27Å; D320-H323 VanDerWaalsContact O-O 3.06Å
321	Q	77.1	Confident	77.8	Confident	171 Å²	171	76.3 Å²	76.3	80%	0.799	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-30.5	178.2	-65.7	178.3	0.2	0	0	113.6
322	N	75.1	Confident	77.6	Confident	138 Å²	138	70 Å²	70	74%	0.738	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-25.3	178.2	-61.6	-9.4	0	0	0	112.7	D320	D320-N322 PolarHBondContact O-N 3.33Å; D320-N322 VanDerWaalsContact O-N 3.08Å
323	H	78.2	Confident	77.7	Confident	99 Å²	99	67.3 Å²	67.3	46%	0.458	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-118	80.3	-175	-61.6	104.7	0	0	0	108.9	D320	D320-H323 PolarHBondContact N-O 3.45Å; D320-H323 CarbonylContact O-C 3.59Å; D320-H323 PolarHBondContact O-N 3.27Å; D320-H323 VanDerWaalsContact O-O 3.06Å
324	S	78.7	Confident	77.6	Confident	25 Å²	25	70.6 Å²	70.6	18%	0.175	39%	0.388	C	S	.	.			trans	-70	153.3	-179.6	175.2	0	0	0	0	111.9	Y317 K326 N327 Y328	Y317-S324 PolarHBondContact OH-O 2.95Å; Y317-S324 VanDerWaalsContact OH-O 3.11Å; S324-K326 PolarHBondContact O-N 3.09Å; S324-K326 VanDerWaalsContact O-N 3.14Å; S324-K326 PolarHBondContact OG-N 3.16Å; S324-N327 WeakPolarHBondContact O-CB 3.31Å; S324-N327 PolarHBondContact O-N 2.77Å; S324-Y328 PolarHBondContact O-N 3.46Å
325	V	77.3	Confident	77.4	Confident	2 Å²	2	71.2 Å²	71.2	1%	0.012	39%	0.394	C	S	.	.	H	α-helix	trans	-56	-27.4	171.3	-173.8	0	0	0	0	111.7	V319 N327 Y328 L329 H349 E352 I353 I356	V319-V325 HydrophobicContact CG1-CG2 3.76Å; V319-V325 HydrophobicContact CG2-CG2 4.06Å; V325-N327 VanDerWaalsContact C-N 3.29Å; V325-N327 PolarHBondContact O-N 2.93Å; V325-Y328 WeakPolarHBondContact O-CA 3.43Å; V325-Y328 VanDerWaalsContact O-CB 3.29Å; V325-Y328 WeakPolarHBondContact O-CB 3.45Å; V325-Y328 PolarHBondContact O-N 2.96Å; V325-Y328 VanDerWaalsContact O-N 3.09Å; V325-L329 WeakPolarHBondContact O-CG 3.34Å; V325-L329 PolarHBondContact O-N 2.96Å; V325-H349 HydrophobicContact CG2-CB 3.84Å; V325-E352 HydrophobicContact CB-CB 4.21Å; V325-E352 WeakPolarHBondContact CB-OE2 3.27Å; V325-E352 HydrophobicContact CG1-CB 4.03Å; V325-I353 HydrophobicContact CG1-CG1 4.38Å; V325-I353 HydrophobicContact CG2-CG1 4.48Å; V325-I356 HydrophobicContact CG1-CD1 4.04Å
326	K	75.7	Confident	77.5	Confident	124 Å²	124	68.7 Å²	68.7	54%	0.539	38%	0.378	S	S	.	.	H	α-helix	trans	-58.3	-39.2	171.9	-62	-171.8	-174.9	-175.9	0	113.2	S324 Y328 L329 T330 E352	S324-K326 PolarHBondContact O-N 3.09Å; S324-K326 VanDerWaalsContact O-N 3.14Å; S324-K326 PolarHBondContact OG-N 3.16Å; K326-Y328 VanDerWaalsContact C-N 3.31Å; K326-L329 PolarHBondContact O-N 3.08Å; K326-T330 PolarHBondContact O-N 2.9Å; K326-T330 VanDerWaalsContact O-N 3.12Å; K326-T330 PolarHBondContact O-OG1 2.74Å; K326-E352 WeakPolarHBondContact CE-OE1 3.35Å; K326-E352 IonicContact NZ-OE1 2.61Å
327	N	77.6	Confident	77.5	Confident	79 Å²	79	70.6 Å²	70.6	42%	0.422	38%	0.384	S	S	.	.	H	α-helix	trans	-66.8	-39.8	176.7	-65.7	-9.4	0	0	0	109.9	S324 V325 T330 M331	S324-N327 WeakPolarHBondContact O-CB 3.31Å; S324-N327 PolarHBondContact O-N 2.77Å; V325-N327 VanDerWaalsContact C-N 3.29Å; V325-N327 PolarHBondContact O-N 2.93Å; N327-T330 PolarHBondContact O-N 2.89Å; N327-M331 WeakPolarHBondContact O-CG 3.3Å; N327-M331 PolarHBondContact O-N 3.3Å
328	Y	79.6	Confident	77.7	Confident	4 Å²	4	69.5 Å²	69.5	2%	0.016	38%	0.38	C	S	.	.	H	α-helix	trans	-60.7	-45.1	174.2	-178.8	-95.4	0	0	0	112.5	Y317 S324 V325 K326 T330 M331 A335 P336 I339 I356	Y317-Y328 AromaticContact CD1-CD2 3.75Å; Y317-Y328 HydrophobicContact CD1-CD2 3.75Å; Y317-Y328 HydrophobicContact CD1-CG 4.23Å; Y317-Y328 AromaticContact CD2-CD2 4Å; Y317-Y328 HydrophobicContact CD2-CD2 4Å; Y317-Y328 HydrophobicContact CE1-CD2 4.22Å; Y317-Y328 HydrophobicContact CE1-CG 4.35Å; Y317-Y328 HydrophobicContact CE2-CD2 4.42Å; Y317-Y328 AromaticContact CG-CD2 3.63Å; Y317-Y328 HydrophobicContact CG-CD2 3.63Å; Y317-Y328 HydrophobicContact CG-CE2 4.29Å; S324-Y328 PolarHBondContact O-N 3.46Å; V325-Y328 WeakPolarHBondContact O-CA 3.43Å; V325-Y328 VanDerWaalsContact O-CB 3.29Å; V325-Y328 WeakPolarHBondContact O-CB 3.45Å; V325-Y328 PolarHBondContact O-N 2.96Å; V325-Y328 VanDerWaalsContact O-N 3.09Å; K326-Y328 VanDerWaalsContact C-N 3.31Å; Y328-T330 PolarHBondContact O-N 3.34Å; Y328-M331 PolarHBondContact O-N 3.47Å; Y328-M331 VanDerWaalsContact O-N 3.11Å; Y328-A335 HydrophobicContact CD2-CB 4.47Å; Y328-A335 HydrophobicContact CE2-CB 3.87Å; Y328-P336 WeakPolarHBondContact CE2-O 3.37Å; Y328-P336 PolarHBondContact OH-O 2.94Å; Y328-I339 HydrophobicContact CD1-CD1 4.16Å; Y328-I339 HydrophobicContact CE1-CD1 3.52Å; Y328-I339 HydrophobicContact CE1-CG1 4.16Å; Y328-I339 HydrophobicContact CE2-CD1 4.22Å; Y328-I339 HydrophobicContact CE2-CG1 3.91Å; Y328-I356 HydrophobicContact CD1-CD1 4.37Å; Y328-I356 HydrophobicContact CE1-CD1 4.35Å
329	L	76.4	Confident	77.9	Confident	53 Å²	53	68.9 Å²	68.9	28%	0.277	38%	0.375	S	S	.	.	H	α-helix	trans	-60.8	-34.6	177.4	-70.4	170.3	0	0	0	112.2	V325 K326 M331 S332 E352 I356	V325-L329 WeakPolarHBondContact O-CG 3.34Å; V325-L329 PolarHBondContact O-N 2.96Å; K326-L329 PolarHBondContact O-N 3.08Å; L329-M331 VanDerWaalsContact C-N 3.29Å; L329-M331 PolarHBondContact O-N 3.25Å; L329-S332 PolarHBondContact O-OG 3.04Å; L329-E352 HydrophobicContact CD1-CB 4.42Å; L329-I356 HydrophobicContact CD2-CG1 3.82Å
330	T	75.6	Confident	78.3	Confident	114 Å²	114	68.8 Å²	68.8	70%	0.699	38%	0.375	S	S	*	.	H	α-helix	trans	-70.4	-23.4	178.2	-50.8	0	0	0	0	112.7	K326 N327 Y328 S332	K326-T330 PolarHBondContact O-N 2.9Å; K326-T330 VanDerWaalsContact O-N 3.12Å; K326-T330 PolarHBondContact O-OG1 2.74Å; N327-T330 PolarHBondContact O-N 2.89Å; Y328-T330 PolarHBondContact O-N 3.34Å; T330-S332 PolarHBondContact O-N 3.2Å; T330-S332 VanDerWaalsContact O-N 3.12Å
331	M	72.4	Confident	78.8	Confident	98 Å²	98	66 Å²	66	48%	0.483	36%	0.36	S	S	.	.			trans	-84.9	33.6	-176.7	-68.2	177.5	73.8	0	0	113.9	N327 Y328 L329 S333 D334 A335	N327-M331 WeakPolarHBondContact O-CG 3.3Å; N327-M331 PolarHBondContact O-N 3.3Å; Y328-M331 PolarHBondContact O-N 3.47Å; Y328-M331 VanDerWaalsContact O-N 3.11Å; L329-M331 VanDerWaalsContact C-N 3.29Å; L329-M331 PolarHBondContact O-N 3.25Å; M331-S333 VanDerWaalsContact C-N 3.27Å; M331-S333 PolarHBondContact O-N 3.35Å; M331-D334 PolarHBondContact O-N 3.44Å; M331-A335 WeakPolarHBondContact O-CB 3.32Å; M331-A335 PolarHBondContact O-N 3.01Å; M331-A335 VanDerWaalsContact O-N 3.15Å
332	S	63.9	Low	79.6	Confident	86 Å²	86	58.2 Å²	58.2	60%	0.601	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-24.2	-155.8	-38.7	0	0	0	0	117	L329 T330	L329-S332 PolarHBondContact O-OG 3.04Å; T330-S332 PolarHBondContact O-N 3.2Å; T330-S332 VanDerWaalsContact O-N 3.12Å
333	S	65.9	Low	80.3	Confident	133 Å²	133	52 Å²	52	93%	0.93	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-22.1	-175.9	-60.9	0	0	0	0	115.5	M331	M331-S333 VanDerWaalsContact C-N 3.27Å; M331-S333 PolarHBondContact O-N 3.35Å
334	D	70.3	Confident	80.9	Confident	147 Å²	147	51.5 Å²	51.5	79%	0.786	29%	0.289	S	S	*	.	S	Bend	trans	-134.1	27.4	-177.5	-158.8	19.4	0	0	0	111.5	M331	M331-D334 PolarHBondContact O-N 3.44Å
335	A	74.5	Confident	81.4	Confident	19 Å²	19	51.4 Å²	51.4	16%	0.157	29%	0.286	C	S	.	.			trans	-65.5	134.5	-176.9	0	0	0	0	0	110.6	Y328 M331 Q337	Y328-A335 HydrophobicContact CD2-CB 4.47Å; Y328-A335 HydrophobicContact CE2-CB 3.87Å; M331-A335 WeakPolarHBondContact O-CB 3.32Å; M331-A335 PolarHBondContact O-N 3.01Å; M331-A335 VanDerWaalsContact O-N 3.15Å; A335-Q337 PolarHBondContact O-N 3.44Å
336	P	81.3	Confident	82.1	Confident	15 Å²	15	51.3 Å²	51.3	10%	0.097	29%	0.285	C	S	.	.			trans	-54.4	136.9	175.1	-27.7	35.3	0	0	0	112.4	P315 Y317 Y328 V338	P315-P336 HydrophobicContact CB-CB 4.08Å; P315-P336 HydrophobicContact CB-CG 4.2Å; P315-P336 HydrophobicContact CG-CB 4.16Å; P315-P336 WeakPolarHBondContact O-CB 3.42Å; Y317-P336 HydrophobicContact CD2-CG 4.35Å; Y328-P336 WeakPolarHBondContact CE2-O 3.37Å; Y328-P336 PolarHBondContact OH-O 2.94Å; P336-V338 VanDerWaalsContact C-N 3.3Å; P336-V338 PolarHBondContact O-N 2.9Å
337	Q	87.3	Confident	82.8	Confident	72 Å²	72	48.7 Å²	48.7	34%	0.336	28%	0.277	S	S	.	.	S	Bend	trans	-72.8	-23.8	-177	-66.4	173.2	-46.2	0	0	112.7	I275 R288 C289 A335	I275-Q337 HydrophobicContact CD1-CB 4.28Å; R288-Q337 CarbonylContact C-O 3.45Å; R288-Q337 VanDerWaalsContact CA-O 3.26Å; R288-Q337 WeakPolarHBondContact CA-O 3.32Å; C289-Q337 PolarHBondContact N-O 2.94Å; A335-Q337 PolarHBondContact O-N 3.44Å
338	V	90.9	Very high	83.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	123.6	179.6	178.3	0	0	0	0	109.7	I271 I275 C289 I291 F305 L314 V316 Y317 P336	I271-V338 HydrophobicContact CG2-CG2 3.92Å; I275-V338 HydrophobicContact CD1-CG2 3.76Å; C289-V338 HydrophobicContact CB-CG2 4.29Å; C289-V338 WeakPolarHBondContact O-CA 3.31Å; I291-V338 HydrophobicContact CD1-CG1 3.54Å; I291-V338 HydrophobicContact CG1-CG1 4.09Å; F305-V338 HydrophobicContact CE2-CG1 4.5Å; F305-V338 HydrophobicContact CZ-CG1 4.08Å; L314-V338 HydrophobicContact CD1-CG2 4.26Å; L314-V338 HydrophobicContact CD2-CB 3.87Å; L314-V338 HydrophobicContact CD2-CG2 3.44Å; L314-V338 VanDerWaalsContact CD2-CG2 3.44Å; L314-V338 HydrophobicContact CG-CG2 4.29Å; V316-V338 WeakPolarHBondContact CA-O 3.41Å; V316-V338 HydrophobicContact CG1-CG1 4.19Å; V316-V338 HydrophobicContact CG2-CB 4.33Å; V316-V338 HydrophobicContact CG2-CG1 4.36Å; Y317-V338 PolarHBondContact N-O 3.16Å; P336-V338 VanDerWaalsContact C-N 3.3Å; P336-V338 PolarHBondContact O-N 2.9Å
339	I	92.1	Very high	83.5	Confident	6 Å²	6	52.7 Å²	52.7	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	124.8	176.3	-54.1	170.2	0	0	0	107.4	C289 L290 I291 V319 Y328 I356	C289-I339 PolarHBondContact O-N 3.12Å; L290-I339 HydrophobicContact CD1-CB 4Å; L290-I339 HydrophobicContact CD1-CG2 3.85Å; I291-I339 PolarHBondContact N-O 2.84Å; V319-I339 HydrophobicContact CG2-CG2 3.85Å; Y328-I339 HydrophobicContact CD1-CD1 4.16Å; Y328-I339 HydrophobicContact CE1-CD1 3.52Å; Y328-I339 HydrophobicContact CE1-CG1 4.16Å; Y328-I339 HydrophobicContact CE2-CD1 4.22Å; Y328-I339 HydrophobicContact CE2-CG1 3.91Å; I339-I356 HydrophobicContact CD1-CD1 3.86Å
340	L	93.8	Very high	84.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.1	177.2	179.6	66.8	0	0	0	109.2	I291 T293 I298 W301 L302 V316 Y317 V319	I291-L340 HydrophobicContact CB-CD1 3.79Å; I291-L340 HydrophobicContact CG2-CD1 3.6Å; T293-L340 HydrophobicContact CG2-CD1 3.74Å; I298-L340 HydrophobicContact CG2-CD2 3.85Å; I298-L340 HydrophobicContact CG2-CG 4.29Å; W301-L340 HydrophobicContact CB-CD1 4.12Å; W301-L340 HydrophobicContact CB-CD2 3.86Å; W301-L340 HydrophobicContact CG-CD1 4.33Å; L302-L340 HydrophobicContact CD2-CD2 3.8Å; L302-L340 HydrophobicContact CG-CD2 3.74Å; V316-L340 HydrophobicContact CG1-CB 3.81Å; V316-L340 HydrophobicContact CG1-CD2 4.45Å; Y317-L340 PolarHBondContact O-N 2.92Å; V319-L340 PolarHBondContact N-O 3.45Å
341	M	92.2	Very high	84.5	Confident	1 Å²	1	50 Å²	50	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	163.5	178.5	72.8	-176.6	-43.8	0	0	113.6	L290 I291 V292 T293 V319 M345 F346 I353	L290-M341 HydrophobicContact CD1-CG 3.98Å; L290-M341 HydrophobicContact CD1-SD 3.73Å; I291-M341 PolarHBondContact O-N 3.22Å; V292-M341 WeakPolarHBondContact CA-O 3.3Å; T293-M341 PolarHBondContact N-O 2.93Å; T293-M341 VanDerWaalsContact N-O 3.09Å; V319-M341 HydrophobicContact CB-CB 3.82Å; V319-M341 HydrophobicContact CB-CE 4.4Å; V319-M341 HydrophobicContact CG1-CE 4.21Å; V319-M341 HydrophobicContact CG2-CB 4.06Å; M341-M345 VanDerWaalsContact CE-C 3.45Å; M341-M345 HydrophobicContact CE-CB 3.89Å; M341-F346 HydrophobicContact CE-CB 3.99Å; M341-F346 VanDerWaalsContact CE-N 3.31Å; M341-F346 HydrophobicContact CG-CB 4.38Å; M341-F346 HydrophobicContact SD-CB 3.89Å; M341-F346 HydrophobicContact SD-CD2 3.86Å; M341-F346 HydrophobicContact SD-CG 4.4Å; M341-I353 HydrophobicContact CE-CD1 3.71Å; M341-I353 HydrophobicContact SD-CD1 3.44Å; M341-I353 WeakPolarHBondContact SD-CD1 3.48Å
342	S	92.4	Very high	85.1	Confident	7 Å²	7	46.8 Å²	46.8	5%	0.049	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	155.1	174.9	103.4	0	0	0	0	112.2	T293 E344 M345 F346	T293-S342 VanDerWaalsContact O-CA 3.22Å; T293-S342 WeakPolarHBondContact O-CA 3.45Å; S342-E344 VanDerWaalsContact CB-OE2 3.28Å; S342-E344 WeakPolarHBondContact CB-OE2 3.14Å; S342-E344 PolarHBondContact O-N 3.39Å; S342-E344 PolarHBondContact OG-N 3.34Å; S342-E344 VanDerWaalsContact OG-N 3.14Å; S342-E344 PolarHBondContact OG-OE2 3.38Å; S342-M345 PolarHBondContact O-N 3.37Å; S342-M345 PolarHBondContact OG-N 2.9Å; S342-F346 WeakPolarHBondContact O-CB 3.14Å; S342-F346 PolarHBondContact O-N 3.38Å
343	Y	91.3	Very high	86.2	Confident	8 Å²	8	42.9 Å²	42.9	3%	0.031	24%	0.239	C	C	.	.	H	α-helix	trans	-55.7	-37.1	170.7	-77.4	-76.2	0	0	0	112.5	V292 T293 P294 L347 D365 L370 T377 L381	V292-Y343 HydrophobicContact CB-CE1 4.29Å; V292-Y343 HydrophobicContact CG1-CD1 3.33Å; V292-Y343 HydrophobicContact CG1-CD2 4.13Å; V292-Y343 HydrophobicContact CG1-CE1 3.53Å; V292-Y343 HydrophobicContact CG1-CE2 4.29Å; V292-Y343 HydrophobicContact CG1-CG 3.66Å; T293-Y343 PolarHBondContact O-N 3.39Å; P294-Y343 HydrophobicContact CG-CE2 4.43Å; Y343-L347 PolarHBondContact O-N 3.31Å; Y343-D365 VanDerWaalsContact CE2-O 3.31Å; Y343-D365 WeakPolarHBondContact CE2-O 3.43Å; Y343-D365 PolarHBondContact OH-O 3.35Å; Y343-L370 HydrophobicContact CE1-CD2 4.17Å; Y343-T377 HydrophobicContact CD1-CG2 3.58Å; Y343-T377 HydrophobicContact CE1-CG2 4.33Å; Y343-T377 HydrophobicContact CG-CG2 4.44Å; Y343-L381 HydrophobicContact CD1-CD1 4.45Å; Y343-L381 HydrophobicContact CE1-CD1 4.07Å
344	E	89.6	Confident	87.2	Confident	88 Å²	88	40 Å²	40	41%	0.411	21%	0.208	S	C	.	.	H	α-helix	trans	-71.4	-42.6	179.5	-54.6	78.7	-170.6	0	0	111.7	S342 F346 L347 Q348 R369	S342-E344 VanDerWaalsContact CB-OE2 3.28Å; S342-E344 WeakPolarHBondContact CB-OE2 3.14Å; S342-E344 PolarHBondContact O-N 3.39Å; S342-E344 PolarHBondContact OG-N 3.34Å; S342-E344 VanDerWaalsContact OG-N 3.14Å; S342-E344 PolarHBondContact OG-OE2 3.38Å; E344-F346 VanDerWaalsContact C-N 3.3Å; E344-F346 PolarHBondContact O-N 2.95Å; E344-L347 PolarHBondContact O-N 2.76Å; E344-Q348 WeakPolarHBondContact O-CG 3.48Å; E344-Q348 PolarHBondContact O-N 3.29Å; E344-R369 IonicContact OE1-NH1 3.34Å; E344-R369 PolarHBondContact OE1-NH1 3.28Å
345	M	89.9	Confident	87.9	Confident	23 Å²	23	39.6 Å²	39.6	11%	0.113	20%	0.201	C	C	.	.	H	α-helix	trans	-66	-34	174.2	-64.9	-61.7	94.2	0	0	111.8	M341 S342 L347 Q348 H349	M341-M345 VanDerWaalsContact CE-C 3.45Å; M341-M345 HydrophobicContact CE-CB 3.89Å; S342-M345 PolarHBondContact O-N 3.37Å; S342-M345 PolarHBondContact OG-N 2.9Å; M345-L347 VanDerWaalsContact C-N 3.34Å; M345-L347 PolarHBondContact O-N 3.14Å; M345-Q348 PolarHBondContact O-N 3.12Å; M345-H349 PolarHBondContact O-CD2 3.35Å; M345-H349 PolarHBondContact O-N 3.12Å
346	F	91.6	Very high	88.3	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.6	-43.9	177.2	174.3	-98.3	0	0	0	111.6	L290 M341 S342 E344 Q348 H349 T350 I353 A380 L381 L384	L290-F346 HydrophobicContact CD2-CD2 4.26Å; L290-F346 HydrophobicContact CD2-CE2 4.12Å; M341-F346 HydrophobicContact CE-CB 3.99Å; M341-F346 VanDerWaalsContact CE-N 3.31Å; M341-F346 HydrophobicContact CG-CB 4.38Å; M341-F346 HydrophobicContact SD-CB 3.89Å; M341-F346 HydrophobicContact SD-CD2 3.86Å; M341-F346 HydrophobicContact SD-CG 4.4Å; S342-F346 WeakPolarHBondContact O-CB 3.14Å; S342-F346 PolarHBondContact O-N 3.38Å; E344-F346 VanDerWaalsContact C-N 3.3Å; E344-F346 PolarHBondContact O-N 2.95Å; F346-Q348 VanDerWaalsContact C-N 3.34Å; F346-Q348 PolarHBondContact O-N 3.3Å; F346-H349 CarbonylContact O-C 3.53Å; F346-H349 PolarHBondContact O-N 3.32Å; F346-T350 WeakPolarHBondContact O-CA 3.17Å; F346-T350 PolarHBondContact O-N 3.05Å; F346-T350 PolarHBondContact O-OG1 3.16Å; F346-I353 HydrophobicContact CD2-CD1 3.45Å; F346-I353 VanDerWaalsContact CD2-CD1 3.45Å; F346-I353 HydrophobicContact CE2-CD1 3.81Å; F346-I353 HydrophobicContact CE2-CG2 4.21Å; F346-I353 HydrophobicContact CG-CD1 4.42Å; F346-A380 HydrophobicContact CE1-CB 3.65Å; F346-A380 HydrophobicContact CZ-CB 4.31Å; F346-L381 HydrophobicContact CD1-CD2 4Å; F346-L381 HydrophobicContact CD1-CG 4.19Å; F346-L381 HydrophobicContact CD2-CD2 4.37Å; F346-L381 HydrophobicContact CE1-CB 4.46Å; F346-L381 HydrophobicContact CE1-CD2 3.54Å; F346-L381 HydrophobicContact CE1-CG 3.62Å; F346-L381 HydrophobicContact CE2-CD2 3.98Å; F346-L381 HydrophobicContact CG-CD2 4.41Å; F346-L381 HydrophobicContact CZ-CD2 3.55Å; F346-L381 HydrophobicContact CZ-CG 4.03Å; F346-L384 HydrophobicContact CE2-CD1 3.83Å; F346-L384 HydrophobicContact CE2-CD2 4.09Å; F346-L384 HydrophobicContact CE2-CG 4.31Å; F346-L384 HydrophobicContact CZ-CD1 3.79Å; F346-L384 HydrophobicContact CZ-CD2 4.19Å; F346-L384 HydrophobicContact CZ-CG 4.06Å
347	L	89.7	Confident	88	Confident	69 Å²	69	42.2 Å²	42.2	36%	0.361	22%	0.217	S	C	.	.	H	α-helix	trans	-63.8	-38.1	175.9	-78	176.5	0	0	0	112.9	Y343 E344 M345 T350 N376 T377 A380	Y343-L347 PolarHBondContact O-N 3.31Å; E344-L347 PolarHBondContact O-N 2.76Å; M345-L347 VanDerWaalsContact C-N 3.34Å; M345-L347 PolarHBondContact O-N 3.14Å; L347-T350 WeakPolarHBondContact CA-OG1 3.2Å; L347-T350 PolarHBondContact O-OG1 3.48Å; L347-N376 HydrophobicContact CD2-CB 4.25Å; L347-T377 WeakPolarHBondContact CD1-OG1 3.17Å; L347-A380 HydrophobicContact CD2-CB 4.24Å
348	Q	87.9	Confident	87.7	Confident	132 Å²	132	42.1 Å²	42.1	62%	0.617	22%	0.219	S	C	*	.	H	α-helix	trans	-70	-36.6	180	-68.4	177.6	2.2	0	0	112.3	E344 M345 F346	E344-Q348 WeakPolarHBondContact O-CG 3.48Å; E344-Q348 PolarHBondContact O-N 3.29Å; M345-Q348 PolarHBondContact O-N 3.12Å; F346-Q348 VanDerWaalsContact C-N 3.34Å; F346-Q348 PolarHBondContact O-N 3.3Å
349	H	85.6	Confident	87.5	Confident	36 Å²	36	43 Å²	43	17%	0.167	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	22.7	-176	-65.6	-78.3	0	0	0	113.6	V325 M345 F346 S351 E352 I353	V325-H349 HydrophobicContact CG2-CB 3.84Å; M345-H349 PolarHBondContact O-CD2 3.35Å; M345-H349 PolarHBondContact O-N 3.12Å; F346-H349 CarbonylContact O-C 3.53Å; F346-H349 PolarHBondContact O-N 3.32Å; H349-S351 VanDerWaalsContact C-N 3.29Å; H349-S351 PolarHBondContact O-N 3.11Å; H349-E352 IonicContact CE1-OE2 2.77Å; H349-E352 IonicContact CG-OE2 3.57Å; H349-E352 IonicContact ND1-OE1 2.82Å; H349-E352 IonicContact ND1-OE2 2.65Å; H349-E352 PolarHBondContact ND1-OE2 3.4Å; H349-E352 PolarHBondContact O-N 3.43Å; H349-I353 HydrophobicContact CB-CD1 4.48Å; H349-I353 WeakPolarHBondContact O-CG1 3.21Å; H349-I353 PolarHBondContact O-N 2.95Å; H349-I353 VanDerWaalsContact O-N 3.13Å
350	T	87.7	Confident	87.4	Confident	21 Å²	21	44.7 Å²	44.7	13%	0.129	23%	0.233	C	C	.	.	H	α-helix	trans	-56.4	-41.6	-174.6	-65.8	0	0	0	0	112.5	F346 L347 I353 Y354 A380	F346-T350 WeakPolarHBondContact O-CA 3.17Å; F346-T350 PolarHBondContact O-N 3.05Å; F346-T350 PolarHBondContact O-OG1 3.16Å; L347-T350 WeakPolarHBondContact CA-OG1 3.2Å; L347-T350 PolarHBondContact O-OG1 3.48Å; T350-I353 PolarHBondContact O-N 2.94Å; T350-Y354 HydrophobicContact CG2-CD2 4.13Å; T350-Y354 HydrophobicContact CG2-CE1 4.07Å; T350-Y354 HydrophobicContact CG2-CE2 3.34Å; T350-Y354 VanDerWaalsContact CG2-OH 3.24Å; T350-Y354 WeakPolarHBondContact CG2-OH 3.31Å; T350-Y354 WeakPolarHBondContact O-CD2 3.41Å; T350-Y354 PolarHBondContact O-N 2.86Å; T350-A380 HydrophobicContact CG2-CB 4.13Å
351	S	85.2	Confident	87.3	Confident	89 Å²	89	44.7 Å²	44.7	62%	0.622	23%	0.233	S	C	*	.	H	α-helix	trans	-62.8	-44.5	179.7	-50	0	0	0	0	112.5	H349 I353 Y354 E355	H349-S351 VanDerWaalsContact C-N 3.29Å; H349-S351 PolarHBondContact O-N 3.11Å; S351-I353 VanDerWaalsContact C-N 3.29Å; S351-I353 PolarHBondContact O-N 3Å; S351-Y354 PolarHBondContact O-N 2.82Å; S351-E355 PolarHBondContact O-N 2.85Å
352	E	85.2	Confident	87.4	Confident	30 Å²	30	44.7 Å²	44.7	14%	0.14	23%	0.233	C	C	.	.	H	α-helix	trans	-67	-32.8	-179.3	-64.6	168.1	-172.3	0	0	111.3	V325 K326 L329 H349 E355	V325-E352 HydrophobicContact CB-CB 4.21Å; V325-E352 WeakPolarHBondContact CB-OE2 3.27Å; V325-E352 HydrophobicContact CG1-CB 4.03Å; K326-E352 WeakPolarHBondContact CE-OE1 3.35Å; K326-E352 IonicContact NZ-OE1 2.61Å; L329-E352 HydrophobicContact CD1-CB 4.42Å; H349-E352 IonicContact CE1-OE2 2.77Å; H349-E352 IonicContact CG-OE2 3.57Å; H349-E352 IonicContact ND1-OE1 2.82Å; H349-E352 IonicContact ND1-OE2 2.65Å; H349-E352 PolarHBondContact ND1-OE2 3.4Å; H349-E352 PolarHBondContact O-N 3.43Å; E352-E355 WeakPolarHBondContact O-CB 3.48Å; E352-E355 PolarHBondContact O-N 3.35Å
353	I	86.4	Confident	87.6	Confident	5 Å²	5	44.4 Å²	44.4	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-72	-32.2	178.2	-64.3	166.8	0	0	0	111.4	L290 V325 M341 F346 H349 T350 S351 E355 I356 L384	L290-I353 HydrophobicContact CD2-CG2 4.16Å; V325-I353 HydrophobicContact CG1-CG1 4.38Å; V325-I353 HydrophobicContact CG2-CG1 4.48Å; M341-I353 HydrophobicContact CE-CD1 3.71Å; M341-I353 HydrophobicContact SD-CD1 3.44Å; M341-I353 WeakPolarHBondContact SD-CD1 3.48Å; F346-I353 HydrophobicContact CD2-CD1 3.45Å; F346-I353 VanDerWaalsContact CD2-CD1 3.45Å; F346-I353 HydrophobicContact CE2-CD1 3.81Å; F346-I353 HydrophobicContact CE2-CG2 4.21Å; F346-I353 HydrophobicContact CG-CD1 4.42Å; H349-I353 HydrophobicContact CB-CD1 4.48Å; H349-I353 WeakPolarHBondContact O-CG1 3.21Å; H349-I353 PolarHBondContact O-N 2.95Å; H349-I353 VanDerWaalsContact O-N 3.13Å; T350-I353 PolarHBondContact O-N 2.94Å; S351-I353 VanDerWaalsContact C-N 3.29Å; S351-I353 PolarHBondContact O-N 3Å; I353-E355 PolarHBondContact O-N 2.93Å; I353-I356 HydrophobicContact CB-CD1 4.48Å; I353-I356 HydrophobicContact CG1-CD1 4.44Å; I353-I356 HydrophobicContact CG2-CD1 4.43Å; I353-I356 WeakPolarHBondContact O-CB 3.48Å; I353-I356 PolarHBondContact O-N 3.34Å; I353-L384 HydrophobicContact CG2-CD2 3.76Å
354	Y	86.9	Confident	87.7	Confident	72 Å²	72	44 Å²	44	28%	0.282	23%	0.229	S	C	.	.	H	α-helix	trans	-68.4	-21.4	175.1	-64.1	-27.4	0	0	0	113.4	T350 S351 A380 R383 L384	T350-Y354 HydrophobicContact CG2-CD2 4.13Å; T350-Y354 HydrophobicContact CG2-CE1 4.07Å; T350-Y354 HydrophobicContact CG2-CE2 3.34Å; T350-Y354 VanDerWaalsContact CG2-OH 3.24Å; T350-Y354 WeakPolarHBondContact CG2-OH 3.31Å; T350-Y354 WeakPolarHBondContact O-CD2 3.41Å; T350-Y354 PolarHBondContact O-N 2.86Å; S351-Y354 PolarHBondContact O-N 2.82Å; Y354-A380 PolarHBondContact OH-O 3.26Å; Y354-R383 HydrophobicContact CE1-CB 4.27Å; Y354-R383 WeakPolarHBondContact OH-CB 3.26Å; Y354-L384 HydrophobicContact CD1-CD2 3.77Å; Y354-L384 HydrophobicContact CE1-CD2 3.6Å; Y354-L384 HydrophobicContact CE1-CG 4.15Å
355	E	85.1	Confident	87.9	Confident	139 Å²	139	40.2 Å²	40.2	65%	0.65	21%	0.212	S	C	*	.	H	α-helix	trans	-78.6	-19.1	174.1	-64.9	175.3	-175.5	0	0	112.7	S351 E352 I353 S357	S351-E355 PolarHBondContact O-N 2.85Å; E352-E355 WeakPolarHBondContact O-CB 3.48Å; E352-E355 PolarHBondContact O-N 3.35Å; I353-E355 PolarHBondContact O-N 2.93Å; E355-S357 PolarHBondContact O-N 2.82Å
356	I	82	Confident	87.8	Confident	14 Å²	14	40 Å²	40	7%	0.072	21%	0.211	C	C	.	.			trans	-65.6	106.5	178.5	-59.6	175	0	0	0	109.2	V325 Y328 L329 I339 I353	V325-I356 HydrophobicContact CG1-CD1 4.04Å; Y328-I356 HydrophobicContact CD1-CD1 4.37Å; Y328-I356 HydrophobicContact CE1-CD1 4.35Å; L329-I356 HydrophobicContact CD2-CG1 3.82Å; I339-I356 HydrophobicContact CD1-CD1 3.86Å; I353-I356 HydrophobicContact CB-CD1 4.48Å; I353-I356 HydrophobicContact CG1-CD1 4.44Å; I353-I356 HydrophobicContact CG2-CD1 4.43Å; I353-I356 WeakPolarHBondContact O-CB 3.48Å; I353-I356 PolarHBondContact O-N 3.34Å
357	S	74.7	Confident	87.4	Confident	75 Å²	75	40 Å²	40	52%	0.524	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	151.7	168	60.6	0	0	0	0	110.7	R288 E355 L359	R288-S357 PolarHBondContact NH1-O 3.3Å; E355-S357 PolarHBondContact O-N 2.82Å; S357-L359 PolarHBondContact O-N 2.96Å
358	D	81.6	Confident	87.1	Confident	69 Å²	69	38.1 Å²	38.1	37%	0.369	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	24.7	174.1	-55.8	-9.3	0	0	0	116.5	R287 R288 D360	R287-D358 HydrophobicContact CB-CB 4.07Å; R287-D358 WeakPolarHBondContact CD-OD2 2.92Å; R287-D358 IonicContact CZ-OD2 3.67Å; R287-D358 IonicContact NH1-OD1 3.36Å; R287-D358 IonicContact NH1-OD2 3.85Å; R287-D358 PolarHBondContact NH1-OD2 3.43Å; R288-D358 WeakPolarHBondContact CB-O 3.34Å; R288-D358 PolarHBondContact N-O 2.85Å; D358-D360 PolarHBondContact O-N 3.25Å; D358-D360 VanDerWaalsContact O-N 3.1Å
359	L	86	Confident	86.8	Confident	18 Å²	18	36.6 Å²	36.6	9%	0.094	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	94.3	170.7	-174.2	69.1	0	0	0	111.2	R288 L290 S357 L384 A386	R288-L359 HydrophobicContact CB-CD1 4.46Å; L290-L359 HydrophobicContact CB-CD1 3.57Å; L290-L359 HydrophobicContact CB-CD2 4.23Å; L290-L359 HydrophobicContact CB-CG 4.49Å; L290-L359 HydrophobicContact CD2-CD2 4.21Å; S357-L359 PolarHBondContact O-N 2.96Å; L359-L384 HydrophobicContact CD2-CD2 4.21Å; L359-A386 WeakPolarHBondContact O-CA 3.29Å
360	D	89.9	Confident	86.7	Confident	43 Å²	43	34.9 Å²	34.9	23%	0.23	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-28.5	-174.1	-65.4	-44.1	0	0	0	113.8	I286 R287 R288 D358 R387 R388	I286-D360 HydrophobicContact CB-CB 4.05Å; I286-D360 HydrophobicContact CG2-CB 4.04Å; R287-D360 PolarHBondContact N-OD2 3.02Å; R288-D360 PolarHBondContact O-N 3.29Å; D358-D360 PolarHBondContact O-N 3.25Å; D358-D360 VanDerWaalsContact O-N 3.1Å; D360-R387 PolarHBondContact O-N 2.92Å; D360-R388 WeakPolarHBondContact O-CB 3.45Å; D360-R388 PolarHBondContact O-N 3.08Å
361	M	93.3	Very high	86.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	137.4	-172.7	-175.1	169	175.2	0	0	112.5	L233 I271 L274 I286 R288 C289 L290 V363 R388 L390	L233-M361 HydrophobicContact CD1-CE 3.82Å; I271-M361 HydrophobicContact CG1-CE 4.09Å; I271-M361 HydrophobicContact CG1-SD 4.45Å; L274-M361 HydrophobicContact CD1-SD 4.1Å; I286-M361 HydrophobicContact CD1-CB 4.24Å; I286-M361 HydrophobicContact CD1-SD 3.71Å; I286-M361 HydrophobicContact CG2-CB 4.13Å; R288-M361 PolarHBondContact O-N 2.73Å; C289-M361 WeakPolarHBondContact CA-O 3.29Å; C289-M361 HydrophobicContact CB-CB 4.42Å; L290-M361 PolarHBondContact N-O 3.32Å; M361-V363 HydrophobicContact CE-CG2 3.72Å; M361-V363 HydrophobicContact CG-CG2 4.43Å; M361-R388 WeakPolarHBondContact CA-O 2.89Å; M361-R388 HydrophobicContact CB-CB 4.15Å; M361-R388 HydrophobicContact CG-CB 4.11Å; M361-L390 HydrophobicContact CE-CB 4.02Å; M361-L390 HydrophobicContact CE-CD2 3.95Å
362	V	94.5	Very high	86.2	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.006	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	134.9	170	65.1	0	0	0	0	110.5	L290 V292 L384 A386 R388 R389 L390	L290-V362 HydrophobicContact CD2-CG2 4.46Å; L290-V362 CarbonylContact O-C 3.52Å; L290-V362 VanDerWaalsContact O-CA 3.32Å; L290-V362 WeakPolarHBondContact O-CA 3.46Å; V292-V362 HydrophobicContact CG2-CG2 4.48Å; V362-L384 HydrophobicContact CG2-CD1 4.35Å; V362-A386 HydrophobicContact CB-CB 4.11Å; V362-A386 HydrophobicContact CG1-CB 3.96Å; V362-R388 PolarHBondContact N-O 3.22Å; V362-R389 HydrophobicContact CG1-CB 4.17Å; V362-R389 HydrophobicContact CG1-CG 3.79Å; V362-L390 PolarHBondContact O-N 3.28Å
363	V	95.6	Very high	85.8	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	117.7	175.7	-175.4	0	0	0	0	108.6	I271 L290 I291 V292 M361 L390 L392	I271-V363 HydrophobicContact CD1-CG2 4.01Å; I271-V363 HydrophobicContact CG1-CG2 4.41Å; L290-V363 PolarHBondContact O-N 3.45Å; I291-V363 WeakPolarHBondContact CA-O 3.02Å; I291-V363 HydrophobicContact CG1-CB 4.2Å; I291-V363 HydrophobicContact CG1-CG2 4.47Å; I291-V363 HydrophobicContact CG2-CB 4.47Å; V292-V363 PolarHBondContact N-O 3.24Å; M361-V363 HydrophobicContact CE-CG2 3.72Å; M361-V363 HydrophobicContact CG-CG2 4.43Å; V363-L390 CarbonylContact C-O 3.22Å; V363-L390 VanDerWaalsContact CA-O 3.3Å; V363-L390 WeakPolarHBondContact CA-O 3.36Å; V363-L390 HydrophobicContact CG1-CD2 4.18Å; V363-L390 HydrophobicContact CG1-CG 4.31Å; V363-L390 HydrophobicContact CG2-CB 4.21Å; V363-L390 HydrophobicContact CG2-CD2 4.22Å; V363-L392 HydrophobicContact CG1-CD1 3.96Å; V363-L392 HydrophobicContact CG1-CG 4.23Å
364	C	94.2	Very high	85.6	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	112.7	177	-64.4	0	0	0	0	109.3	L370 L390 L392 F410	C364-L370 HydrophobicContact CB-CD1 4.13Å; C364-L390 PolarHBondContact N-O 3.4Å; C364-L392 PolarHBondContact O-N 3.1Å; C364-F410 HydrophobicContact CB-CE1 4.5Å
365	D	92.5	Very high	85.5	Confident	9 Å²	9	42.1 Å²	42.1	5%	0.048	22%	0.217	C	C	.	.	S	Bend	trans	-88.4	148.7	175	-167.7	21.2	0	0	0	111.2	V292 T293 W301 Y343 G367	V292-D365 PolarHBondContact O-N 3.49Å; T293-D365 PolarHBondContact OG1-OD2 2.79Å; W301-D365 HydrophobicContact CZ2-CB 4.08Å; W301-D365 PolarHBondContact NE1-OD2 2.97Å; Y343-D365 VanDerWaalsContact CE2-O 3.31Å; Y343-D365 WeakPolarHBondContact CE2-O 3.43Å; Y343-D365 PolarHBondContact OH-O 3.35Å; D365-G367 VanDerWaalsContact C-N 3.33Å; D365-G367 PolarHBondContact O-N 3.46Å
366	E	87.4	Confident	85.6	Confident	19 Å²	19	40.9 Å²	40.9	9%	0.089	22%	0.215	C	C	.	.	S	Bend	trans	50.3	50.6	-170.8	-63.6	-66.1	179	0	0	112.8	P294 L297 H368 R369 L392	P294-E366 HydrophobicContact CG-CB 3.99Å; P294-E366 HydrophobicContact CG-CG 3.99Å; L297-E366 HydrophobicContact CD1-CG 4.23Å; E366-H368 PolarHBondContact O-N 3.47Å; E366-H368 IonicContact OE2-CE1 3Å; E366-H368 PolarHBondContact OE2-CE1 2.68Å; E366-H368 IonicContact OE2-ND1 2.86Å; E366-H368 PolarHBondContact OE2-ND1 3.29Å; E366-H368 VanDerWaalsContact OE2-ND1 3.1Å; E366-R369 PolarHBondContact O-N 3.29Å; E366-L392 PolarHBondContact N-O 3.47Å; E366-L392 VanDerWaalsContact N-O 3.12Å
367	G	84.6	Confident	85.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-59.6	-12.8	-173.2	0	0	0	0	0	115.4	D365 R369 L370 L392 L407	D365-G367 VanDerWaalsContact C-N 3.33Å; D365-G367 PolarHBondContact O-N 3.46Å; G367-R369 PolarHBondContact O-N 2.94Å; G367-L370 WeakPolarHBondContact O-CB 2.85Å; G367-L370 PolarHBondContact O-N 2.97Å; G367-L392 PolarHBondContact N-O 3.42Å; G367-L407 WeakPolarHBondContact O-CD2 3.49Å
368	H	82.3	Confident	86.4	Confident	29 Å²	29	37.8 Å²	37.8	13%	0.134	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-58	-18	169.7	69.9	-100.6	0	0	0	113.1	E366 L370 K371 Q398	E366-H368 PolarHBondContact O-N 3.47Å; E366-H368 IonicContact OE2-CE1 3Å; E366-H368 PolarHBondContact OE2-CE1 2.68Å; E366-H368 IonicContact OE2-ND1 2.86Å; E366-H368 PolarHBondContact OE2-ND1 3.29Å; E366-H368 VanDerWaalsContact OE2-ND1 3.1Å; H368-L370 PolarHBondContact O-N 3.48Å; H368-K371 WeakPolarHBondContact O-CB 3.2Å; H368-K371 WeakPolarHBondContact O-CG 3.44Å; H368-K371 PolarHBondContact O-N 3.18Å; H368-Q398 PolarHBondContact CD2-NE2 3.3Å
369	R	81.9	Confident	86.7	Confident	99 Å²	99	38 Å²	38	37%	0.374	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-64.2	-23.1	169.5	-70	-175.6	171.4	-152.2	-3.9	113.6	E344 E366 G367 K371	E344-R369 IonicContact OE1-NH1 3.34Å; E344-R369 PolarHBondContact OE1-NH1 3.28Å; E366-R369 PolarHBondContact O-N 3.29Å; G367-R369 PolarHBondContact O-N 2.94Å; R369-K371 VanDerWaalsContact C-N 3.33Å
370	L	84	Confident	86.9	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-92.2	13.7	-179	-54.5	177.6	0	0	0	113.2	Y343 C364 G367 H368 N372 T377 L381 L391 L407 F410	Y343-L370 HydrophobicContact CE1-CD2 4.17Å; C364-L370 HydrophobicContact CB-CD1 4.13Å; G367-L370 WeakPolarHBondContact O-CB 2.85Å; G367-L370 PolarHBondContact O-N 2.97Å; H368-L370 PolarHBondContact O-N 3.48Å; L370-N372 PolarHBondContact O-N 3.38Å; L370-N372 VanDerWaalsContact O-N 3.17Å; L370-T377 HydrophobicContact CD2-CG2 4.35Å; L370-L381 HydrophobicContact CD1-CD1 4.05Å; L370-L381 HydrophobicContact CD2-CD1 3.62Å; L370-L381 HydrophobicContact CG-CD1 4.5Å; L370-L391 HydrophobicContact CD1-CD1 4.22Å; L370-L407 HydrophobicContact CB-CD2 4.06Å; L370-F410 HydrophobicContact CD1-CD1 4.09Å; L370-F410 HydrophobicContact CD1-CE1 3.94Å; L370-F410 HydrophobicContact CD1-CG 4.47Å; L370-F410 HydrophobicContact CD1-CZ 4.22Å
371	K	81.8	Confident	86.9	Confident	70 Å²	70	35.5 Å²	35.5	30%	0.304	18%	0.181	S	C	.	.			trans	-59.5	-26.7	-174.8	66.1	-176.2	-170.3	169.6	0	115.4	H368 R369 N399 E403 S406	H368-K371 WeakPolarHBondContact O-CB 3.2Å; H368-K371 WeakPolarHBondContact O-CG 3.44Å; H368-K371 PolarHBondContact O-N 3.18Å; R369-K371 VanDerWaalsContact C-N 3.33Å; K371-N399 PolarHBondContact NZ-ND2 2.74Å; K371-E403 HydrophobicContact CB-CB 4.05Å; K371-E403 HydrophobicContact CB-CG 3.97Å; K371-E403 WeakPolarHBondContact CD-OE1 3.46Å; K371-E403 IonicContact NZ-OE1 3.64Å; K371-S406 WeakPolarHBondContact O-CB 3.43Å; K371-S406 PolarHBondContact O-OG 3.34Å
372	N	80.8	Confident	86.6	Confident	71 Å²	71	38.1 Å²	38.1	38%	0.38	20%	0.198	S	C	.	.			trans	-110.3	122.3	179.1	-177.4	-3.2	0	0	0	109	L370 N374 I375 T378	L370-N372 PolarHBondContact O-N 3.38Å; L370-N372 VanDerWaalsContact O-N 3.17Å; N372-N374 PolarHBondContact O-N 3.25Å; N372-N374 WeakPolarHBondContact OD1-CB 3.23Å; N372-N374 PolarHBondContact OD1-N 2.64Å; N372-I375 HydrophobicContact CB-CD1 3.77Å; N372-I375 HydrophobicContact CB-CG1 3.9Å; N372-I375 PolarHBondContact O-N 3.36Å; N372-T378 PolarHBondContact O-OG1 3.04Å; N372-T378 VanDerWaalsContact O-OG1 3.12Å
373	S	76.8	Confident	86.4	Confident	45 Å²	45	46.8 Å²	46.8	32%	0.315	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.7	178.8	51.9	0	0	0	0	113.1	I375	S373-I375 VanDerWaalsContact C-N 3.28Å; S373-I375 PolarHBondContact O-N 3.29Å
374	N	80.9	Confident	86	Confident	121 Å²	121	47.1 Å²	47.1	65%	0.647	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-5	-173	-59.4	-6.8	0	0	0	112.9	N372 N376 M379	N372-N374 PolarHBondContact O-N 3.25Å; N372-N374 WeakPolarHBondContact OD1-CB 3.23Å; N372-N374 PolarHBondContact OD1-N 2.64Å; N374-N376 PolarHBondContact O-N 3.36Å; N374-M379 WeakPolarHBondContact O-CE 3.04Å
375	I	84.9	Confident	85.5	Confident	62 Å²	62	57.9 Å²	57.9	32%	0.318	27%	0.273	S	S	.	.	S	Bend	trans	-71.6	131.9	177.6	-62.7	172.9	0	0	0	108.8	N372 S373 T377 T378 M379	N372-I375 HydrophobicContact CB-CD1 3.77Å; N372-I375 HydrophobicContact CB-CG1 3.9Å; N372-I375 PolarHBondContact O-N 3.36Å; S373-I375 VanDerWaalsContact C-N 3.28Å; S373-I375 PolarHBondContact O-N 3.29Å; I375-T377 PolarHBondContact O-N 3.4Å; I375-T377 VanDerWaalsContact O-N 3.08Å; I375-T378 WeakPolarHBondContact O-CB 3.48Å; I375-T378 PolarHBondContact O-N 2.98Å; I375-M379 PolarHBondContact O-N 3.17Å
376	N	87.4	Confident	85.3	Confident	112 Å²	112	57.6 Å²	57.6	60%	0.599	27%	0.273	S	S	*	.	H	α-helix	trans	-49.5	-38.4	178.3	-69.6	-14.6	0	0	0	113	L347 N374 M379 A380	L347-N376 HydrophobicContact CD2-CB 4.25Å; N374-N376 PolarHBondContact O-N 3.36Å; N376-M379 PolarHBondContact O-N 2.73Å; N376-M379 WeakPolarHBondContact OD1-CE 3.43Å; N376-A380 VanDerWaalsContact O-CB 3.26Å; N376-A380 WeakPolarHBondContact O-CB 3.34Å; N376-A380 PolarHBondContact O-N 2.87Å
377	T	87.2	Confident	85.2	Confident	21 Å²	21	63.3 Å²	63.3	13%	0.129	29%	0.293	C	S	.	.	H	α-helix	trans	-59.2	-48.7	175.4	-44.3	0	0	0	0	112.4	Y343 L347 L370 I375 A380 L381	Y343-T377 HydrophobicContact CD1-CG2 3.58Å; Y343-T377 HydrophobicContact CE1-CG2 4.33Å; Y343-T377 HydrophobicContact CG-CG2 4.44Å; L347-T377 WeakPolarHBondContact CD1-OG1 3.17Å; L370-T377 HydrophobicContact CD2-CG2 4.35Å; I375-T377 PolarHBondContact O-N 3.4Å; I375-T377 VanDerWaalsContact O-N 3.08Å; T377-A380 PolarHBondContact O-N 3.23Å; T377-L381 HydrophobicContact CG2-CD1 4.08Å; T377-L381 WeakPolarHBondContact O-CB 3.29Å; T377-L381 VanDerWaalsContact O-CG 3.28Å; T377-L381 WeakPolarHBondContact O-CG 3.14Å; T377-L381 PolarHBondContact O-N 2.86Å
378	T	86.8	Confident	85.6	Confident	4 Å²	4	64.2 Å²	64.2	3%	0.025	30%	0.297	C	S	.	.	H	α-helix	trans	-63.6	-44.9	178.8	-49.2	0	0	0	0	110.3	N372 I375 A380 L381 C382	N372-T378 PolarHBondContact O-OG1 3.04Å; N372-T378 VanDerWaalsContact O-OG1 3.12Å; I375-T378 WeakPolarHBondContact O-CB 3.48Å; I375-T378 PolarHBondContact O-N 2.98Å; T378-A380 PolarHBondContact O-N 3.41Å; T378-L381 PolarHBondContact O-N 2.85Å; T378-C382 WeakPolarHBondContact O-CB 3.41Å; T378-C382 PolarHBondContact O-N 2.96Å; T378-C382 PolarHBondContact O-SG 3.4Å
379	M	88	Confident	86.2	Confident	74 Å²	74	64.3 Å²	64.3	37%	0.365	30%	0.296	S	S	.	.	H	α-helix	trans	-61.2	-43.5	177.1	-67.1	-168.9	-74.7	0	0	112.4	N374 I375 N376 C382 R383	N374-M379 WeakPolarHBondContact O-CE 3.04Å; I375-M379 PolarHBondContact O-N 3.17Å; N376-M379 PolarHBondContact O-N 2.73Å; N376-M379 WeakPolarHBondContact OD1-CE 3.43Å; M379-C382 PolarHBondContact O-N 2.99Å; M379-R383 WeakPolarHBondContact O-CG 3.46Å; M379-R383 PolarHBondContact O-N 2.61Å
380	A	90.2	Very high	86.8	Confident	8 Å²	8	59.6 Å²	59.6	7%	0.066	28%	0.278	C	S	.	.	H	α-helix	trans	-67.2	-39.2	179	0	0	0	0	0	112.4	F346 L347 T350 Y354 N376 T377 T378 R383	F346-A380 HydrophobicContact CE1-CB 3.65Å; F346-A380 HydrophobicContact CZ-CB 4.31Å; L347-A380 HydrophobicContact CD2-CB 4.24Å; T350-A380 HydrophobicContact CG2-CB 4.13Å; Y354-A380 PolarHBondContact OH-O 3.26Å; N376-A380 VanDerWaalsContact O-CB 3.26Å; N376-A380 WeakPolarHBondContact O-CB 3.34Å; N376-A380 PolarHBondContact O-N 2.87Å; T377-A380 PolarHBondContact O-N 3.23Å; T378-A380 PolarHBondContact O-N 3.41Å; A380-R383 PolarHBondContact O-N 2.78Å
381	L	90.7	Very high	87.3	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-69.2	-38.3	175	-70.9	168.1	0	0	0	112	V292 Y343 F346 L370 T377 T378 R383 L384 F410	V292-L381 HydrophobicContact CG2-CD2 4.11Å; Y343-L381 HydrophobicContact CD1-CD1 4.45Å; Y343-L381 HydrophobicContact CE1-CD1 4.07Å; F346-L381 HydrophobicContact CD1-CD2 4Å; F346-L381 HydrophobicContact CD1-CG 4.19Å; F346-L381 HydrophobicContact CD2-CD2 4.37Å; F346-L381 HydrophobicContact CE1-CB 4.46Å; F346-L381 HydrophobicContact CE1-CD2 3.54Å; F346-L381 HydrophobicContact CE1-CG 3.62Å; F346-L381 HydrophobicContact CE2-CD2 3.98Å; F346-L381 HydrophobicContact CG-CD2 4.41Å; F346-L381 HydrophobicContact CZ-CD2 3.55Å; F346-L381 HydrophobicContact CZ-CG 4.03Å; L370-L381 HydrophobicContact CD1-CD1 4.05Å; L370-L381 HydrophobicContact CD2-CD1 3.62Å; L370-L381 HydrophobicContact CG-CD1 4.5Å; T377-L381 HydrophobicContact CG2-CD1 4.08Å; T377-L381 WeakPolarHBondContact O-CB 3.29Å; T377-L381 VanDerWaalsContact O-CG 3.28Å; T377-L381 WeakPolarHBondContact O-CG 3.14Å; T377-L381 PolarHBondContact O-N 2.86Å; T378-L381 PolarHBondContact O-N 2.85Å; L381-R383 VanDerWaalsContact C-N 3.25Å; L381-R383 PolarHBondContact O-N 3.3Å; L381-L384 HydrophobicContact CD2-CD1 3.77Å; L381-L384 WeakPolarHBondContact O-CB 3.3Å; L381-L384 PolarHBondContact O-N 3.04Å; L381-L384 VanDerWaalsContact O-N 3.14Å; L381-F410 HydrophobicContact CB-CE2 3.61Å; L381-F410 HydrophobicContact CB-CZ 4.09Å
382	C	87.2	Confident	87.8	Confident	54 Å²	54	56.2 Å²	56.2	37%	0.365	26%	0.264	S	S	.	.	H	α-helix	trans	-59.7	-36.7	176.5	-78.3	0	0	0	0	112.4	T378 M379 L384 R389	T378-C382 WeakPolarHBondContact O-CB 3.41Å; T378-C382 PolarHBondContact O-N 2.96Å; T378-C382 PolarHBondContact O-SG 3.4Å; M379-C382 PolarHBondContact O-N 2.99Å; C382-L384 PolarHBondContact O-N 2.89Å; C382-R389 PolarHBondContact O-NH2 2.81Å
383	R	88.3	Confident	88.2	Confident	183 Å²	183	52.9 Å²	52.9	69%	0.691	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-12	178.3	-72.7	174.1	-177.1	175.3	1.4	114.2	Y354 M379 A380 L381	Y354-R383 HydrophobicContact CE1-CB 4.27Å; Y354-R383 WeakPolarHBondContact OH-CB 3.26Å; M379-R383 WeakPolarHBondContact O-CG 3.46Å; M379-R383 PolarHBondContact O-N 2.61Å; A380-R383 PolarHBondContact O-N 2.78Å; L381-R383 VanDerWaalsContact C-N 3.25Å; L381-R383 PolarHBondContact O-N 3.3Å
384	L	87.9	Confident	88.4	Confident	7 Å²	7	51.1 Å²	51.1	4%	0.037	24%	0.235	C	C	.	.	S	Bend	trans	-64.8	136.2	175.9	-68.8	170.4	0	0	0	111	L290 F346 I353 Y354 L359 V362 L381 C382 A386 R389	L290-L384 HydrophobicContact CD2-CD1 4.11Å; F346-L384 HydrophobicContact CE2-CD1 3.83Å; F346-L384 HydrophobicContact CE2-CD2 4.09Å; F346-L384 HydrophobicContact CE2-CG 4.31Å; F346-L384 HydrophobicContact CZ-CD1 3.79Å; F346-L384 HydrophobicContact CZ-CD2 4.19Å; F346-L384 HydrophobicContact CZ-CG 4.06Å; I353-L384 HydrophobicContact CG2-CD2 3.76Å; Y354-L384 HydrophobicContact CD1-CD2 3.77Å; Y354-L384 HydrophobicContact CE1-CD2 3.6Å; Y354-L384 HydrophobicContact CE1-CG 4.15Å; L359-L384 HydrophobicContact CD2-CD2 4.21Å; V362-L384 HydrophobicContact CG2-CD1 4.35Å; L381-L384 HydrophobicContact CD2-CD1 3.77Å; L381-L384 WeakPolarHBondContact O-CB 3.3Å; L381-L384 PolarHBondContact O-N 3.04Å; L381-L384 VanDerWaalsContact O-N 3.14Å; C382-L384 PolarHBondContact O-N 2.89Å; L384-A386 PolarHBondContact O-N 2.95Å; L384-R389 PolarHBondContact O-NH2 3.08Å; L384-R389 VanDerWaalsContact O-NH2 3.16Å
385	R	85	Confident	88.3	Confident	226 Å²	226	46.6 Å²	46.6	85%	0.853	21%	0.212	S	C	*	.			trans	-73.9	11.7	177.7	-63.7	-177.1	176.4	127.5	-3.2	114.2	R387	R385-R387 PolarHBondContact O-N 2.53Å
386	A	86.7	Confident	87.7	Confident	4 Å²	4	43.9 Å²	43.9	3%	0.033	20%	0.198	C	C	.	.			trans	-66.5	119.2	-179.4	0	0	0	0	0	110.9	L359 V362 L384	L359-A386 WeakPolarHBondContact O-CA 3.29Å; V362-A386 HydrophobicContact CB-CB 4.11Å; V362-A386 HydrophobicContact CG1-CB 3.96Å; L384-A386 PolarHBondContact O-N 2.95Å
387	R	86.8	Confident	87	Confident	138 Å²	138	39.2 Å²	39.2	52%	0.521	17%	0.173	S	C	.	.	S	Bend	trans	-68.4	-39	177.8	-176.8	177.4	179.1	169.5	3.4	111.6	Y251 D360 R385	Y251-R387 VanDerWaalsContact CB-O 3.27Å; Y251-R387 WeakPolarHBondContact CB-O 3.42Å; Y251-R387 HydrophobicContact CD2-CG 3.85Å; Y251-R387 HydrophobicContact CE2-CG 4.46Å; Y251-R387 VanDerWaalsContact CE2-NH2 3.31Å; Y251-R387 HydrophobicContact CG-CG 4.11Å; Y251-R387 PolarHBondContact OH-NH2 3.48Å; D360-R387 PolarHBondContact O-N 2.92Å; R385-R387 PolarHBondContact O-N 2.53Å
388	R	92.7	Very high	86	Confident	19 Å²	19	39 Å²	39	7%	0.072	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	127.5	-175.8	-71.9	175.2	-174.6	93.6	0.9	111.6	L233 Y251 V285 D360 M361 V362	L233-R388 HydrophobicContact CD2-CB 4.09Å; L233-R388 HydrophobicContact CD2-CG 4.45Å; L233-R388 WeakPolarHBondContact O-CD 3.43Å; L233-R388 PolarHBondContact O-NE 3.01Å; Y251-R388 VanDerWaalsContact O-CA 3.3Å; Y251-R388 WeakPolarHBondContact O-CA 3.36Å; V285-R388 PolarHBondContact O-NH1 2.8Å; D360-R388 WeakPolarHBondContact O-CB 3.45Å; D360-R388 PolarHBondContact O-N 3.08Å; M361-R388 WeakPolarHBondContact CA-O 2.89Å; M361-R388 HydrophobicContact CB-CB 4.15Å; M361-R388 HydrophobicContact CG-CB 4.11Å; V362-R388 PolarHBondContact N-O 3.22Å
389	R	93.5	Very high	84.9	Confident	32 Å²	32	41.3 Å²	41.3	12%	0.121	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	117	-176	-57.6	-173.4	174.6	-158.6	-3.8	110.5	Y251 G252 C253 V362 C382 L384 F410	Y251-R389 PolarHBondContact O-N 3.48Å; Y251-R389 VanDerWaalsContact O-N 3.09Å; G252-R389 CarbonylContact C-O 3.48Å; G252-R389 VanDerWaalsContact CA-O 3.28Å; G252-R389 WeakPolarHBondContact CA-O 3.42Å; C253-R389 PolarHBondContact N-O 3.27Å; V362-R389 HydrophobicContact CG1-CB 4.17Å; V362-R389 HydrophobicContact CG1-CG 3.79Å; C382-R389 PolarHBondContact O-NH2 2.81Å; L384-R389 PolarHBondContact O-NH2 3.08Å; L384-R389 VanDerWaalsContact O-NH2 3.16Å; R389-F410 WeakPolarHBondContact CD-O 3.48Å; R389-F410 PolarHBondContact NH1-O 2.86Å
390	L	94.9	Very high	84.2	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	121.2	175.9	175.9	59.6	0	0	0	109.5	L229 C253 A267 M361 V362 V363 C364 L392	L229-L390 HydrophobicContact CD2-CD1 3.52Å; C253-L390 HydrophobicContact CB-CD1 4.14Å; C253-L390 WeakPolarHBondContact O-CA 3.23Å; A267-L390 HydrophobicContact CB-CD2 4.1Å; M361-L390 HydrophobicContact CE-CB 4.02Å; M361-L390 HydrophobicContact CE-CD2 3.95Å; V362-L390 PolarHBondContact O-N 3.28Å; V363-L390 CarbonylContact C-O 3.22Å; V363-L390 VanDerWaalsContact CA-O 3.3Å; V363-L390 WeakPolarHBondContact CA-O 3.36Å; V363-L390 HydrophobicContact CG1-CD2 4.18Å; V363-L390 HydrophobicContact CG1-CG 4.31Å; V363-L390 HydrophobicContact CG2-CB 4.21Å; V363-L390 HydrophobicContact CG2-CD2 4.22Å; C364-L390 PolarHBondContact N-O 3.4Å; L390-L392 HydrophobicContact CD1-CD2 4.03Å; L390-L392 HydrophobicContact CD2-CD2 4.1Å; L390-L392 HydrophobicContact CG-CD2 3.89Å
391	L	94.3	Very high	83.6	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	125.8	175.9	-171.5	147.6	0	0	0	109.9	C253 I254 L255 L370 T393 L407 F410 C411	C253-L391 PolarHBondContact O-N 2.95Å; I254-L391 WeakPolarHBondContact CA-O 3.41Å; I254-L391 HydrophobicContact CG1-CB 4.31Å; I254-L391 HydrophobicContact CG2-CD2 4Å; L255-L391 PolarHBondContact N-O 3.36Å; L370-L391 HydrophobicContact CD1-CD1 4.22Å; L391-T393 HydrophobicContact CD2-CG2 3.97Å; L391-L407 HydrophobicContact CD1-CD2 3.81Å; L391-F410 HydrophobicContact CD1-CD1 3.93Å; L391-F410 HydrophobicContact CD1-CE1 4.37Å; L391-C411 WeakPolarHBondContact CB-SG 3.42Å
392	L	93.5	Very high	83.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	124	177.1	-48.2	177.4	0	0	0	108.4	L255 A267 W301 V363 C364 E366 G367 L390	L255-L392 HydrophobicContact CB-CD2 3.84Å; L255-L392 HydrophobicContact CD2-CD2 3.96Å; L255-L392 HydrophobicContact CG-CD2 4.49Å; A267-L392 HydrophobicContact CB-CD1 3.94Å; A267-L392 HydrophobicContact CB-CD2 4.35Å; W301-L392 HydrophobicContact CH2-CD1 3.87Å; W301-L392 HydrophobicContact CZ2-CD1 3.86Å; V363-L392 HydrophobicContact CG1-CD1 3.96Å; V363-L392 HydrophobicContact CG1-CG 4.23Å; C364-L392 PolarHBondContact O-N 3.1Å; E366-L392 PolarHBondContact N-O 3.47Å; E366-L392 VanDerWaalsContact N-O 3.12Å; G367-L392 PolarHBondContact N-O 3.42Å; L390-L392 HydrophobicContact CD1-CD2 4.03Å; L390-L392 HydrophobicContact CD2-CD2 4.1Å; L390-L392 HydrophobicContact CG-CD2 3.89Å
393	T	89.1	Confident	82.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	19%	0.187	C	C	.	.			trans	-141.1	146.2	175.3	-174.9	0	0	0	0	110.7	I254 L255 A256 K263 L391 T395 P396	I254-T393 HydrophobicContact CG2-CG2 4.22Å; L255-T393 PolarHBondContact O-N 3.23Å; A256-T393 CarbonylContact C-O 3.58Å; A256-T393 VanDerWaalsContact CA-O 3.3Å; A256-T393 WeakPolarHBondContact CA-O 3.42Å; A256-T393 HydrophobicContact CB-CG2 3.89Å; K263-T393 WeakPolarHBondContact CD-O 3.35Å; K263-T393 WeakPolarHBondContact CE-O 3.47Å; L391-T393 HydrophobicContact CD2-CG2 3.97Å; T393-T395 PolarHBondContact OG1-N 3.17Å; T393-T395 PolarHBondContact OG1-O 2.9Å; T393-P396 HydrophobicContact CG2-CB 4.14Å
394	G	80.2	Confident	82.5	Confident	9 Å²	9	35 Å²	35	9%	0.093	16%	0.155	C	C	.	.	S	Bend	trans	-90.5	-22.8	168.1	0	0	0	0	0	113.1
395	T	78.9	Confident	82.4	Confident	26 Å²	26	35.7 Å²	35.7	16%	0.16	16%	0.157	C	C	.	.			trans	-136.7	87.1	-171.6	48.5	0	0	0	0	108.6	T393 L397 A775	T393-T395 PolarHBondContact OG1-N 3.17Å; T393-T395 PolarHBondContact OG1-O 2.9Å; T395-L397 VanDerWaalsContact C-N 3.28Å; T395-L397 PolarHBondContact O-N 2.76Å; T395-A775 HydrophobicContact CG2-CB 3.64Å
396	P	72.3	Confident	82.5	Confident	4 Å²	4	25.5 Å²	25.5	3%	0.026	12%	0.12	C	C	.	.	S	Bend	trans	-68.7	-25.1	-172	27.1	-36.2	0	0	0	113.8	A256 T393 F489 L823	A256-P396 HydrophobicContact CB-CB 3.98Å; A256-P396 HydrophobicContact CB-CG 4.08Å; T393-P396 HydrophobicContact CG2-CB 4.14Å; P396-F489 HydrophobicContact CB-CE2 3.69Å; P396-F489 HydrophobicContact CB-CZ 3.52Å; P396-F489 HydrophobicContact CG-CE2 4.45Å; P396-F489 HydrophobicContact CG-CZ 3.78Å; P396-L823 HydrophobicContact CB-CD1 4.15Å; P396-L823 HydrophobicContact CG-CD1 3.49Å; P396-L823 VanDerWaalsContact CG-CD1 3.49Å
397	L	72.3	Confident	82.5	Confident	15 Å²	15	25.5 Å²	25.5	8%	0.079	12%	0.12	C	C	.	.			trans	-125.3	129.1	176	-75.5	169.9	0	0	0	108.1	T395 L401 L404 T819 L823	T395-L397 VanDerWaalsContact C-N 3.28Å; T395-L397 PolarHBondContact O-N 2.76Å; L397-L401 HydrophobicContact CD1-CD2 4.14Å; L397-L401 HydrophobicContact CD2-CD2 4.1Å; L397-L404 HydrophobicContact CD2-CB 3.75Å; L397-L404 HydrophobicContact CD2-CD2 4.46Å; L397-T819 HydrophobicContact CB-CG2 3.95Å; L397-T819 HydrophobicContact CD1-CG2 4.17Å; L397-L823 HydrophobicContact CD1-CD1 3.59Å; L397-L823 HydrophobicContact CD1-CD2 4.49Å; L397-L823 HydrophobicContact CD1-CG 3.92Å; L397-L823 HydrophobicContact CG-CD1 4.04Å
398	Q	67	Low	82.5	Confident	16 Å²	16	19 Å²	19	8%	0.075	10%	0.095	C	C	.	.	S	Bend	trans	-113.1	-53.8	173.4	-63.9	-171.4	-23.7	0	0	111	H368 E403 A775	H368-Q398 PolarHBondContact CD2-NE2 3.3Å; Q398-E403 PolarHBondContact N-OE2 3.36Å; Q398-A775 HydrophobicContact CG-CB 4.16Å
399	N	64.2	Low	82.3	Confident	53 Å²	53	20.6 Å²	20.6	28%	0.283	11%	0.106	S	C	.	.	S	Bend	trans	-121.9	-47.4	-171	-51.7	-63.5	0	0	0	112.8	K371 E403	K371-N399 PolarHBondContact NZ-ND2 2.74Å; N399-E403 WeakPolarHBondContact CB-OE1 3.47Å; N399-E403 PolarHBondContact N-OE2 3.17Å; N399-E403 PolarHBondContact ND2-OE1 2.89Å
400	H	72.2	Confident	82	Confident	107 Å²	107	19.2 Å²	19.2	50%	0.495	10%	0.1	S	C	.	.			trans	-143.8	150.4	-169.5	-57.4	-65.8	0	0	0	112.2	N402 E403	H400-N402 HydrophobicContact CB-CB 4.44Å; H400-N402 PolarHBondContact O-N 2.93Å; H400-N402 VanDerWaalsContact O-N 3.16Å; H400-E403 VanDerWaalsContact O-CB 3.3Å; H400-E403 WeakPolarHBondContact O-CB 3.33Å; H400-E403 WeakPolarHBondContact O-CG 3.17Å; H400-E403 PolarHBondContact O-N 3.34Å
401	L	77.2	Confident	81.6	Confident	24 Å²	24	19.4 Å²	19.4	13%	0.126	10%	0.102	C	C	.	.	H	α-helix	trans	-60	-23.6	173	-64.7	177.4	0	0	0	112.9	L397 E403 L404 W405 F423 V428 L431 T822	L397-L401 HydrophobicContact CD1-CD2 4.14Å; L397-L401 HydrophobicContact CD2-CD2 4.1Å; L401-E403 PolarHBondContact O-N 2.89Å; L401-L404 WeakPolarHBondContact O-CB 3.39Å; L401-L404 PolarHBondContact O-N 3.44Å; L401-L404 VanDerWaalsContact O-N 3.1Å; L401-W405 PolarHBondContact O-N 3.31Å; L401-F423 HydrophobicContact CB-CE1 4.42Å; L401-V428 HydrophobicContact CB-CG2 4.11Å; L401-L431 HydrophobicContact CD1-CD1 3.78Å; L401-T822 HydrophobicContact CD2-CG2 3.87Å
402	N	80.1	Confident	81.1	Confident	34 Å²	34	19.7 Å²	19.7	18%	0.182	10%	0.104	C	C	.	.	H	α-helix	trans	-61.1	-29.6	173.3	-61.3	-24.5	0	0	0	112.7	H400 L404 W405 S406 L420 R424	H400-N402 HydrophobicContact CB-CB 4.44Å; H400-N402 PolarHBondContact O-N 2.93Å; H400-N402 VanDerWaalsContact O-N 3.16Å; N402-L404 VanDerWaalsContact C-N 3.32Å; N402-W405 PolarHBondContact O-N 3.43Å; N402-S406 PolarHBondContact O-N 3.47Å; N402-S406 VanDerWaalsContact O-N 3.15Å; N402-S406 PolarHBondContact O-OG 3.01Å; N402-S406 VanDerWaalsContact O-OG 3.08Å; N402-L420 HydrophobicContact CB-CD1 4.19Å; N402-R424 PolarHBondContact ND2-NH1 2.98Å
403	E	81.4	Confident	80.6	Confident	19 Å²	19	24.1 Å²	24.1	9%	0.089	13%	0.132	C	C	.	.	H	α-helix	trans	-66.6	-38.3	176.1	-58.9	178.3	158.1	0	0	110.2	K371 Q398 N399 H400 L401 W405 S406 L407	K371-E403 HydrophobicContact CB-CB 4.05Å; K371-E403 HydrophobicContact CB-CG 3.97Å; K371-E403 WeakPolarHBondContact CD-OE1 3.46Å; K371-E403 IonicContact NZ-OE1 3.64Å; Q398-E403 PolarHBondContact N-OE2 3.36Å; N399-E403 WeakPolarHBondContact CB-OE1 3.47Å; N399-E403 PolarHBondContact N-OE2 3.17Å; N399-E403 PolarHBondContact ND2-OE1 2.89Å; H400-E403 VanDerWaalsContact O-CB 3.3Å; H400-E403 WeakPolarHBondContact O-CB 3.33Å; H400-E403 WeakPolarHBondContact O-CG 3.17Å; H400-E403 PolarHBondContact O-N 3.34Å; L401-E403 PolarHBondContact O-N 2.89Å; E403-W405 PolarHBondContact O-N 3.38Å; E403-S406 PolarHBondContact O-N 2.92Å; E403-L407 WeakPolarHBondContact O-CG 3.47Å; E403-L407 PolarHBondContact O-N 3.01Å
404	L	83.2	Confident	79.9	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-63.8	-41.3	176.8	-175.2	65.1	0	0	0	111.9	L397 L401 N402 S406 L407 A408 L485 F489 L823	L397-L404 HydrophobicContact CD2-CB 3.75Å; L397-L404 HydrophobicContact CD2-CD2 4.46Å; L401-L404 WeakPolarHBondContact O-CB 3.39Å; L401-L404 PolarHBondContact O-N 3.44Å; L401-L404 VanDerWaalsContact O-N 3.1Å; N402-L404 VanDerWaalsContact C-N 3.32Å; L404-S406 VanDerWaalsContact C-N 3.34Å; L404-S406 PolarHBondContact O-N 2.94Å; L404-L407 PolarHBondContact O-N 3.44Å; L404-A408 VanDerWaalsContact O-CB 3.26Å; L404-A408 WeakPolarHBondContact O-CB 3.42Å; L404-A408 PolarHBondContact O-N 3.5Å; L404-L485 HydrophobicContact CD1-CD2 4.36Å; L404-L485 HydrophobicContact CD2-CD1 3.84Å; L404-L485 HydrophobicContact CD2-CD2 4.28Å; L404-L485 HydrophobicContact CG-CD2 4.38Å; L404-F489 HydrophobicContact CD1-CE2 4.33Å; L404-L823 HydrophobicContact CD2-CD2 4.39Å
405	W	85.9	Confident	79.6	Confident	22 Å²	22	26.8 Å²	26.8	8%	0.083	15%	0.154	C	C	.	.	H	α-helix	trans	-60.7	-44.2	173.7	179.3	88	0	0	0	111.4	L401 N402 E403 L407 A408 N409 T417 L420 F423	L401-W405 PolarHBondContact O-N 3.31Å; N402-W405 PolarHBondContact O-N 3.43Å; E403-W405 PolarHBondContact O-N 3.38Å; W405-L407 PolarHBondContact O-N 3.37Å; W405-A408 PolarHBondContact O-N 3.49Å; W405-N409 HydrophobicContact CD2-CB 4.46Å; W405-N409 HydrophobicContact CH2-CB 4.48Å; W405-N409 HydrophobicContact CZ2-CB 4.35Å; W405-N409 VanDerWaalsContact O-CB 3.23Å; W405-N409 WeakPolarHBondContact O-CB 3.39Å; W405-N409 PolarHBondContact O-N 3.1Å; W405-T417 PolarHBondContact NE1-OG1 3.01Å; W405-L420 HydrophobicContact CB-CD1 4.22Å; W405-L420 HydrophobicContact CD2-CB 4.23Å; W405-L420 HydrophobicContact CD2-CD1 3.81Å; W405-L420 HydrophobicContact CE3-CB 4.01Å; W405-L420 HydrophobicContact CE3-CD1 3.64Å; W405-L420 HydrophobicContact CE3-CG 4.31Å; W405-L420 HydrophobicContact CG-CD1 4.07Å; W405-L420 HydrophobicContact CH2-CB 3.94Å; W405-L420 HydrophobicContact CZ2-CB 4.16Å; W405-L420 HydrophobicContact CZ3-CB 3.86Å; W405-L420 HydrophobicContact CZ3-CD1 4.29Å; W405-L420 HydrophobicContact CZ3-CG 4.49Å; W405-F423 HydrophobicContact CB-CD1 3.72Å; W405-F423 HydrophobicContact CB-CD2 4.45Å; W405-F423 HydrophobicContact CB-CE1 3.88Å; W405-F423 HydrophobicContact CB-CG 4.03Å; W405-F423 HydrophobicContact CB-CZ 4.32Å; W405-F423 AromaticContact CD1-CD2 3.77Å; W405-F423 AromaticContact CD1-CG 3.53Å; W405-F423 HydrophobicContact CG-CB 4.18Å; W405-F423 HydrophobicContact CG-CD1 4.12Å; W405-F423 HydrophobicContact CG-CD2 4.46Å; W405-F423 AromaticContact CG-CG 4Å; W405-F423 HydrophobicContact CG-CG 4Å
406	S	85.8	Confident	79.4	Confident	12 Å²	12	25.9 Å²	25.9	8%	0.084	15%	0.148	C	C	.	.	H	α-helix	trans	-62.1	-42.6	179.8	-58.5	0	0	0	0	111.8	K371 N402 E403 L404 F410	K371-S406 WeakPolarHBondContact O-CB 3.43Å; K371-S406 PolarHBondContact O-OG 3.34Å; N402-S406 PolarHBondContact O-N 3.47Å; N402-S406 VanDerWaalsContact O-N 3.15Å; N402-S406 PolarHBondContact O-OG 3.01Å; N402-S406 VanDerWaalsContact O-OG 3.08Å; E403-S406 PolarHBondContact O-N 2.92Å; L404-S406 VanDerWaalsContact C-N 3.34Å; L404-S406 PolarHBondContact O-N 2.94Å; S406-F410 WeakPolarHBondContact O-CB 3.48Å; S406-F410 PolarHBondContact O-N 2.81Å; S406-F410 VanDerWaalsContact O-N 3.1Å
407	L	87.1	Confident	79.6	Confident	4 Å²	4	26 Å²	26	2%	0.021	15%	0.149	C	C	.	.	H	α-helix	trans	-67.2	-42.9	175.7	-64.5	175.6	0	0	0	112.3	I254 G367 L370 L391 E403 L404 W405 F410 C411	I254-L407 HydrophobicContact CD1-CB 4.45Å; G367-L407 WeakPolarHBondContact O-CD2 3.49Å; L370-L407 HydrophobicContact CB-CD2 4.06Å; L391-L407 HydrophobicContact CD1-CD2 3.81Å; E403-L407 WeakPolarHBondContact O-CG 3.47Å; E403-L407 PolarHBondContact O-N 3.01Å; L404-L407 PolarHBondContact O-N 3.44Å; W405-L407 PolarHBondContact O-N 3.37Å; L407-F410 PolarHBondContact O-N 3.31Å; L407-C411 PolarHBondContact O-N 2.79Å
408	A	87	Confident	79.8	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-65	-44.8	177.9	0	0	0	0	0	111.6	L404 W405 F410 C411 V412 L416 F488	L404-A408 VanDerWaalsContact O-CB 3.26Å; L404-A408 WeakPolarHBondContact O-CB 3.42Å; L404-A408 PolarHBondContact O-N 3.5Å; W405-A408 PolarHBondContact O-N 3.49Å; A408-F410 VanDerWaalsContact C-N 3.3Å; A408-F410 PolarHBondContact O-N 2.99Å; A408-C411 PolarHBondContact O-N 3.34Å; A408-V412 CarbonylContact O-C 3.54Å; A408-V412 PolarHBondContact O-N 3.43Å; A408-L416 HydrophobicContact CB-CD1 3.38Å; A408-L416 HydrophobicContact CB-CG 4.14Å; A408-F488 HydrophobicContact CB-CE2 3.95Å; A408-F488 HydrophobicContact CB-CZ 4.02Å
409	N	87.9	Confident	80.5	Confident	54 Å²	54	31.6 Å²	31.6	29%	0.289	19%	0.191	S	C	.	.	H	α-helix	trans	-64	-34.5	177.9	-172.4	48.1	0	0	0	112.2	W405 P413	W405-N409 HydrophobicContact CD2-CB 4.46Å; W405-N409 HydrophobicContact CH2-CB 4.48Å; W405-N409 HydrophobicContact CZ2-CB 4.35Å; W405-N409 VanDerWaalsContact O-CB 3.23Å; W405-N409 WeakPolarHBondContact O-CB 3.39Å; W405-N409 PolarHBondContact O-N 3.1Å; N409-P413 WeakPolarHBondContact O-CA 3.48Å; N409-P413 WeakPolarHBondContact OD1-CA 3.46Å
410	F	86.9	Confident	81.3	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.009	19%	0.19	C	C	.	.	H	α-helix	trans	-63.3	-44.5	173.3	172.8	-102.9	0	0	0	112.5	C364 L370 L381 R389 L391 S406 L407 A408	C364-F410 HydrophobicContact CB-CE1 4.5Å; L370-F410 HydrophobicContact CD1-CD1 4.09Å; L370-F410 HydrophobicContact CD1-CE1 3.94Å; L370-F410 HydrophobicContact CD1-CG 4.47Å; L370-F410 HydrophobicContact CD1-CZ 4.22Å; L381-F410 HydrophobicContact CB-CE2 3.61Å; L381-F410 HydrophobicContact CB-CZ 4.09Å; R389-F410 WeakPolarHBondContact CD-O 3.48Å; R389-F410 PolarHBondContact NH1-O 2.86Å; L391-F410 HydrophobicContact CD1-CD1 3.93Å; L391-F410 HydrophobicContact CD1-CE1 4.37Å; S406-F410 WeakPolarHBondContact O-CB 3.48Å; S406-F410 PolarHBondContact O-N 2.81Å; S406-F410 VanDerWaalsContact O-N 3.1Å; L407-F410 PolarHBondContact O-N 3.31Å; A408-F410 VanDerWaalsContact C-N 3.3Å; A408-F410 PolarHBondContact O-N 2.99Å
411	C	86.2	Confident	81.6	Confident	5 Å²	5	32.7 Å²	32.7	3%	0.034	20%	0.196	C	C	.	.	H	α-helix	trans	-78.1	-47.4	-177.9	-71.3	0	0	0	0	112.9	G252 I254 L391 L407 A408	G252-C411 WeakPolarHBondContact CA-O 3.38Å; I254-C411 HydrophobicContact CD1-CB 4.48Å; I254-C411 HydrophobicContact CG1-CB 4.15Å; I254-C411 VanDerWaalsContact CG1-SG 3.6Å; L391-C411 WeakPolarHBondContact CB-SG 3.42Å; L407-C411 PolarHBondContact O-N 2.79Å; A408-C411 PolarHBondContact O-N 3.34Å
412	V	85.6	Confident	81.8	Confident	6 Å²	6	34.9 Å²	34.9	4%	0.036	21%	0.205	C	C	.	.	S	Bend	trans	-135.7	86.8	-175.8	-165.7	0	0	0	0	108.8	T250 A408 G414 R415 F488	T250-V412 HydrophobicContact CG2-CG1 3.25Å; A408-V412 CarbonylContact O-C 3.54Å; A408-V412 PolarHBondContact O-N 3.43Å; V412-G414 PolarHBondContact O-N 3.12Å; V412-R415 HydrophobicContact CB-CB 3.96Å; V412-R415 HydrophobicContact CG1-CB 3.56Å; V412-R415 HydrophobicContact CG1-CG 4.01Å; V412-R415 PolarHBondContact O-N 3.11Å; V412-F488 HydrophobicContact CG2-CB 4.19Å; V412-F488 HydrophobicContact CG2-CD1 4.49Å; V412-F488 HydrophobicContact CG2-CD2 4.33Å; V412-F488 HydrophobicContact CG2-CG 4.09Å
413	P	82.1	Confident	82	Confident	93 Å²	93	33.3 Å²	33.3	60%	0.604	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	136	-178.6	25.5	-33.6	0	0	0	110.9	N409 R415	N409-P413 WeakPolarHBondContact O-CA 3.48Å; N409-P413 WeakPolarHBondContact OD1-CA 3.46Å; P413-R415 VanDerWaalsContact C-N 3.32Å; P413-R415 PolarHBondContact O-N 3.34Å
414	G	74.7	Confident	82	Confident	46 Å²	46	37.1 Å²	37.1	47%	0.474	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	2	176.5	0	0	0	0	0	116.6	V412	V412-G414 PolarHBondContact O-N 3.12Å
415	R	74.1	Confident	81.9	Confident	18 Å²	18	45.5 Å²	45.5	7%	0.068	24%	0.242	C	C	.	.	S	Bend	trans	-75.3	-37.8	-175.6	-171	60.9	172.3	137.6	15.3	115	V240 V412 P413 S487 F488	V240-R415 PolarHBondContact O-NH1 2.93Å; V240-R415 PolarHBondContact O-NH2 2.77Å; V412-R415 HydrophobicContact CB-CB 3.96Å; V412-R415 HydrophobicContact CG1-CB 3.56Å; V412-R415 HydrophobicContact CG1-CG 4.01Å; V412-R415 PolarHBondContact O-N 3.11Å; P413-R415 VanDerWaalsContact C-N 3.32Å; P413-R415 PolarHBondContact O-N 3.34Å; R415-S487 PolarHBondContact NH2-OG 3.41Å; R415-F488 HydrophobicContact CB-CE1 4.43Å; R415-F488 HydrophobicContact CG-CD1 4.06Å; R415-F488 HydrophobicContact CG-CE1 3.7Å
416	L	73.5	Confident	81.5	Confident	7 Å²	7	47.9 Å²	47.9	4%	0.037	25%	0.254	C	S	.	.	S	Bend	trans	-85.8	-60.8	176.8	-69	177.2	0	0	0	109.6	L242 A408 F423 L481 L484 L485 F488	L242-L416 VanDerWaalsContact CD1-O 3.32Å; L242-L416 WeakPolarHBondContact CD1-O 3.29Å; A408-L416 HydrophobicContact CB-CD1 3.38Å; A408-L416 HydrophobicContact CB-CG 4.14Å; L416-F423 HydrophobicContact CB-CD2 4.42Å; L416-F423 HydrophobicContact CD1-CE2 4.12Å; L416-L481 HydrophobicContact CD2-CD1 4.06Å; L416-L484 HydrophobicContact CD2-CB 3.95Å; L416-L484 HydrophobicContact CD2-CD1 4.22Å; L416-L485 HydrophobicContact CD2-CD2 4.38Å; L416-F488 HydrophobicContact CD2-CZ 4.39Å; L416-F488 HydrophobicContact CG-CZ 4.39Å
417	T	77.1	Confident	81	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.043	25%	0.251	C	S	.	.			trans	-154.3	161.9	175.9	59.3	0	0	0	0	109	W405 S419 E422 F423 F427	W405-T417 PolarHBondContact NE1-OG1 3.01Å; T417-S419 PolarHBondContact OG1-O 3.11Å; T417-E422 HydrophobicContact CG2-CB 4.34Å; T417-E422 HydrophobicContact CG2-CG 3.98Å; T417-F423 HydrophobicContact CG2-CB 4.13Å; T417-F423 HydrophobicContact CG2-CD2 4.43Å; T417-F423 WeakPolarHBondContact OG1-CB 3.34Å; T417-F427 HydrophobicContact CG2-CE2 4.4Å
418	S	75.7	Confident	80.5	Confident	102 Å²	102	48 Å²	48	71%	0.713	25%	0.254	S	S	*	.	S	Bend	trans	-76.9	-28.6	177.1	-62.2	0	0	0	0	112.5
419	S	81.9	Confident	79.8	Confident	47 Å²	47	51.9 Å²	51.9	33%	0.329	27%	0.274	S	S	.	.	S	Bend	trans	-128.2	154.7	179.5	73.1	0	0	0	0	112.9	T417 E421 E422 F423	T417-S419 PolarHBondContact OG1-O 3.11Å; S419-E421 VanDerWaalsContact C-N 3.27Å; S419-E421 PolarHBondContact O-N 3.35Å; S419-E422 PolarHBondContact O-N 3.05Å; S419-E422 WeakPolarHBondContact OG-CB 3.43Å; S419-E422 PolarHBondContact OG-N 3.26Å; S419-E422 VanDerWaalsContact OG-N 3.13Å; S419-F423 PolarHBondContact O-N 2.96Å; S419-F423 VanDerWaalsContact O-N 3.17Å
420	L	81.2	Confident	79	Confident	50 Å²	50	50.9 Å²	50.9	26%	0.262	27%	0.271	S	S	.	.	H	α-helix	trans	-64.7	-33.5	173.9	178.9	63.3	0	0	0	111.5	N402 W405 F423 R424	N402-L420 HydrophobicContact CB-CD1 4.19Å; W405-L420 HydrophobicContact CB-CD1 4.22Å; W405-L420 HydrophobicContact CD2-CB 4.23Å; W405-L420 HydrophobicContact CD2-CD1 3.81Å; W405-L420 HydrophobicContact CE3-CB 4.01Å; W405-L420 HydrophobicContact CE3-CD1 3.64Å; W405-L420 HydrophobicContact CE3-CG 4.31Å; W405-L420 HydrophobicContact CG-CD1 4.07Å; W405-L420 HydrophobicContact CH2-CB 3.94Å; W405-L420 HydrophobicContact CZ2-CB 4.16Å; W405-L420 HydrophobicContact CZ3-CB 3.86Å; W405-L420 HydrophobicContact CZ3-CD1 4.29Å; W405-L420 HydrophobicContact CZ3-CG 4.49Å; L420-F423 WeakPolarHBondContact O-CB 3.42Å; L420-F423 PolarHBondContact O-N 2.86Å; L420-R424 VanDerWaalsContact O-CG 3.28Å; L420-R424 WeakPolarHBondContact O-CG 3.43Å; L420-R424 PolarHBondContact O-N 3.3Å
421	E	79.7	Confident	78.1	Confident	132 Å²	132	51.6 Å²	51.6	62%	0.617	28%	0.275	S	S	*	.	H	α-helix	trans	-68.4	-41.1	179.8	-65.2	177.8	-176.8	0	0	111.9	S419 R424 R425	S419-E421 VanDerWaalsContact C-N 3.27Å; S419-E421 PolarHBondContact O-N 3.35Å; E421-R424 WeakPolarHBondContact O-CB 3.01Å; E421-R424 PolarHBondContact O-N 3.06Å; E421-R425 WeakPolarHBondContact O-CG 3.44Å; E421-R425 PolarHBondContact O-N 2.96Å
422	E	81.6	Confident	77.2	Confident	70 Å²	70	54.4 Å²	54.4	33%	0.327	29%	0.289	S	S	.	.	H	α-helix	trans	-64.4	-41.8	174.3	-174	179.9	-166.8	0	0	111.4	T417 S419 R424 R425 Q426	T417-E422 HydrophobicContact CG2-CB 4.34Å; T417-E422 HydrophobicContact CG2-CG 3.98Å; S419-E422 PolarHBondContact O-N 3.05Å; S419-E422 WeakPolarHBondContact OG-CB 3.43Å; S419-E422 PolarHBondContact OG-N 3.26Å; S419-E422 VanDerWaalsContact OG-N 3.13Å; E422-R424 PolarHBondContact O-N 3.5Å; E422-R425 PolarHBondContact O-N 2.93Å; E422-Q426 HydrophobicContact CG-CG 4.39Å; E422-Q426 WeakPolarHBondContact O-CB 3.32Å; E422-Q426 PolarHBondContact O-N 3.01Å; E422-Q426 PolarHBondContact OE1-NE2 2.85Å
423	F	83.6	Confident	75.9	Confident	1 Å²	1	58 Å²	58	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-58.4	-40.9	173.5	-177.2	-106.1	0	0	0	111.5	L401 W405 L416 T417 S419 L420 F427 V428 L481	L401-F423 HydrophobicContact CB-CE1 4.42Å; W405-F423 HydrophobicContact CB-CD1 3.72Å; W405-F423 HydrophobicContact CB-CD2 4.45Å; W405-F423 HydrophobicContact CB-CE1 3.88Å; W405-F423 HydrophobicContact CB-CG 4.03Å; W405-F423 HydrophobicContact CB-CZ 4.32Å; W405-F423 AromaticContact CD1-CD2 3.77Å; W405-F423 AromaticContact CD1-CG 3.53Å; W405-F423 HydrophobicContact CG-CB 4.18Å; W405-F423 HydrophobicContact CG-CD1 4.12Å; W405-F423 HydrophobicContact CG-CD2 4.46Å; W405-F423 AromaticContact CG-CG 4Å; W405-F423 HydrophobicContact CG-CG 4Å; L416-F423 HydrophobicContact CB-CD2 4.42Å; L416-F423 HydrophobicContact CD1-CE2 4.12Å; T417-F423 HydrophobicContact CG2-CB 4.13Å; T417-F423 HydrophobicContact CG2-CD2 4.43Å; T417-F423 WeakPolarHBondContact OG1-CB 3.34Å; S419-F423 PolarHBondContact O-N 2.96Å; S419-F423 VanDerWaalsContact O-N 3.17Å; L420-F423 WeakPolarHBondContact O-CB 3.42Å; L420-F423 PolarHBondContact O-N 2.86Å; F423-F427 HydrophobicContact CD2-CB 4.38Å; F423-F427 AromaticContact CD2-CD2 3.51Å; F423-F427 HydrophobicContact CD2-CD2 3.51Å; F423-F427 HydrophobicContact CD2-CE2 4.22Å; F423-F427 HydrophobicContact CD2-CG 4.29Å; F423-F427 HydrophobicContact CE2-CB 4.04Å; F423-F427 AromaticContact CE2-CD2 3.62Å; F423-F427 HydrophobicContact CE2-CD2 3.62Å; F423-F427 HydrophobicContact CE2-CE2 4.37Å; F423-F427 HydrophobicContact CE2-CG 4.01Å; F423-F427 HydrophobicContact CG-CD2 4.44Å; F423-F427 HydrophobicContact CZ-CB 4.26Å; F423-F427 PolarHBondContact O-N 3.12Å; F423-V428 HydrophobicContact CD1-CG2 3.85Å; F423-V428 HydrophobicContact CE1-CG2 3.7Å; F423-V428 PolarHBondContact O-N 3.04Å; F423-L481 HydrophobicContact CE2-CD1 4.05Å; F423-L481 HydrophobicContact CZ-CD1 4.47Å
424	R	80.7	Confident	74.4	Confident	99 Å²	99	56.8 Å²	56.8	37%	0.374	30%	0.296	S	S	.	.	I	π-helix	trans	-65.4	-42.9	177.7	-71.3	173.3	94.2	141.5	5.6	111.6	N402 L420 E421 E422 V428 I429	N402-R424 PolarHBondContact ND2-NH1 2.98Å; L420-R424 VanDerWaalsContact O-CG 3.28Å; L420-R424 WeakPolarHBondContact O-CG 3.43Å; L420-R424 PolarHBondContact O-N 3.3Å; E421-R424 WeakPolarHBondContact O-CB 3.01Å; E421-R424 PolarHBondContact O-N 3.06Å; E422-R424 PolarHBondContact O-N 3.5Å; R424-V428 HydrophobicContact CB-CB 4.35Å; R424-V428 HydrophobicContact CB-CG2 4.49Å; R424-V428 HydrophobicContact CG-CB 4.36Å; R424-V428 HydrophobicContact CG-CG2 4.13Å; R424-V428 PolarHBondContact O-N 3.17Å; R424-I429 WeakPolarHBondContact O-CG1 3.06Å; R424-I429 PolarHBondContact O-N 3.47Å
425	R	80.5	Confident	73.3	Confident	178 Å²	178	58.5 Å²	58.5	67%	0.672	29%	0.289	S	S	*	.	I	π-helix	trans	-67	-41.1	178	-72.1	179.4	179.9	149.8	2.2	113.4	E421 E422 P430	E421-R425 WeakPolarHBondContact O-CG 3.44Å; E421-R425 PolarHBondContact O-N 2.96Å; E422-R425 PolarHBondContact O-N 2.93Å; R425-P430 WeakPolarHBondContact O-CD 3.48Å; R425-P430 WeakPolarHBondContact O-CG 3.15Å
426	Q	78.2	Confident	71.6	Confident	72 Å²	72	61.7 Å²	61.7	34%	0.336	31%	0.307	S	S	.	.	I	π-helix	trans	-83.9	-35	-175.2	-70.2	-178.6	3.9	0	0	114	E422 P430	E422-Q426 HydrophobicContact CG-CG 4.39Å; E422-Q426 WeakPolarHBondContact O-CB 3.32Å; E422-Q426 PolarHBondContact O-N 3.01Å; E422-Q426 PolarHBondContact OE1-NE2 2.85Å; Q426-P430 WeakPolarHBondContact O-CG 3.37Å
427	F	76.6	Confident	69.7	Low	1 Å²	1	65 Å²	65	0%	0.004	32%	0.324	C	S	.	.	I	π-helix	trans	-117.7	-53.5	-174	-63	-75.8	0	0	0	112.3	T417 F423 L431 K480 L481 L484	T417-F427 HydrophobicContact CG2-CE2 4.4Å; F423-F427 HydrophobicContact CD2-CB 4.38Å; F423-F427 AromaticContact CD2-CD2 3.51Å; F423-F427 HydrophobicContact CD2-CD2 3.51Å; F423-F427 HydrophobicContact CD2-CE2 4.22Å; F423-F427 HydrophobicContact CD2-CG 4.29Å; F423-F427 HydrophobicContact CE2-CB 4.04Å; F423-F427 AromaticContact CE2-CD2 3.62Å; F423-F427 HydrophobicContact CE2-CD2 3.62Å; F423-F427 HydrophobicContact CE2-CE2 4.37Å; F423-F427 HydrophobicContact CE2-CG 4.01Å; F423-F427 HydrophobicContact CG-CD2 4.44Å; F423-F427 HydrophobicContact CZ-CB 4.26Å; F423-F427 PolarHBondContact O-N 3.12Å; F427-L431 HydrophobicContact CB-CD1 4.37Å; F427-L431 WeakPolarHBondContact O-CB 3.07Å; F427-L431 WeakPolarHBondContact O-CD1 3.47Å; F427-L431 WeakPolarHBondContact O-CG 3.33Å; F427-L431 PolarHBondContact O-N 3.18Å; F427-K480 HydrophobicContact CE1-CB 4.31Å; F427-K480 HydrophobicContact CE1-CD 4.47Å; F427-K480 HydrophobicContact CE1-CG 4.14Å; F427-K480 HydrophobicContact CZ-CG 4.46Å; F427-L481 HydrophobicContact CD1-CB 3.73Å; F427-L481 HydrophobicContact CD1-CD1 4.2Å; F427-L481 HydrophobicContact CD1-CG 4.37Å; F427-L481 HydrophobicContact CE1-CB 3.8Å; F427-L481 HydrophobicContact CE1-CD1 4.3Å; F427-L481 HydrophobicContact CG-CD1 4.4Å; F427-L484 HydrophobicContact CZ-CD1 3.8Å
428	V	75.4	Confident	68	Low	17 Å²	17	68.8 Å²	68.8	10%	0.103	35%	0.347	C	S	.	.	I	π-helix	trans	-66.5	-50.4	-170.8	-176.7	0	0	0	0	112	L401 F423 R424 L431 L432	L401-V428 HydrophobicContact CB-CG2 4.11Å; F423-V428 HydrophobicContact CD1-CG2 3.85Å; F423-V428 HydrophobicContact CE1-CG2 3.7Å; F423-V428 PolarHBondContact O-N 3.04Å; R424-V428 HydrophobicContact CB-CB 4.35Å; R424-V428 HydrophobicContact CB-CG2 4.49Å; R424-V428 HydrophobicContact CG-CB 4.36Å; R424-V428 HydrophobicContact CG-CG2 4.13Å; R424-V428 PolarHBondContact O-N 3.17Å; V428-L431 PolarHBondContact O-N 3.14Å; V428-L432 HydrophobicContact CG1-CD1 3.85Å; V428-L432 HydrophobicContact CG1-CG 4.44Å; V428-L432 WeakPolarHBondContact O-CB 3.31Å; V428-L432 WeakPolarHBondContact O-CG 3.42Å; V428-L432 PolarHBondContact O-N 3.37Å
429	I	73.3	Confident	66.1	Low	82 Å²	82	67 Å²	67	42%	0.421	33%	0.327	S	S	.	.	H	α-helix	trans	-64.3	-47.9	-179.6	-64.7	170.9	0	0	0	110.4	R424 L431 L432 N433	R424-I429 WeakPolarHBondContact O-CG1 3.06Å; R424-I429 PolarHBondContact O-N 3.47Å; I429-L431 VanDerWaalsContact C-N 3.35Å; I429-L431 PolarHBondContact O-N 3.18Å; I429-L432 CarbonylContact O-C 3.52Å; I429-L432 PolarHBondContact O-N 2.92Å; I429-L432 VanDerWaalsContact O-N 3.12Å; I429-N433 WeakPolarHBondContact CG2-ND2 3.48Å; I429-N433 WeakPolarHBondContact O-CB 3.49Å; I429-N433 VanDerWaalsContact O-CG 3.26Å; I429-N433 PolarHBondContact O-N 3.35Å; I429-N433 PolarHBondContact O-OD1 3.33Å
430	P	70.7	Confident	63.7	Low	33 Å²	33	69 Å²	69	21%	0.214	34%	0.335	C	S	.	.	H	α-helix	trans	-64.4	-34.6	175.6	-28.1	39.7	0	0	0	113.6	R425 Q426 L432 N433 N434 P477	R425-P430 WeakPolarHBondContact O-CD 3.48Å; R425-P430 WeakPolarHBondContact O-CG 3.15Å; Q426-P430 WeakPolarHBondContact O-CG 3.37Å; P430-L432 VanDerWaalsContact C-N 3.27Å; P430-L432 PolarHBondContact O-N 2.82Å; P430-N433 PolarHBondContact O-N 2.85Å; P430-N434 WeakPolarHBondContact O-CB 3.39Å; P430-N434 PolarHBondContact O-N 3.41Å; P430-P477 HydrophobicContact CB-CB 4.06Å; P430-P477 HydrophobicContact CB-CG 3.59Å
431	L	68.8	Low	61.7	Low	18 Å²	18	70.8 Å²	70.8	9%	0.094	35%	0.347	C	S	.	.	H	α-helix	trans	-70.4	-24.8	174.6	-73.8	170.3	0	0	0	112.7	L401 F427 V428 I429 R435 P477 L481	L401-L431 HydrophobicContact CD1-CD1 3.78Å; F427-L431 HydrophobicContact CB-CD1 4.37Å; F427-L431 WeakPolarHBondContact O-CB 3.07Å; F427-L431 WeakPolarHBondContact O-CD1 3.47Å; F427-L431 WeakPolarHBondContact O-CG 3.33Å; F427-L431 PolarHBondContact O-N 3.18Å; V428-L431 PolarHBondContact O-N 3.14Å; I429-L431 VanDerWaalsContact C-N 3.35Å; I429-L431 PolarHBondContact O-N 3.18Å; L431-R435 VanDerWaalsContact O-CD 3.28Å; L431-R435 WeakPolarHBondContact O-CD 3.21Å; L431-R435 VanDerWaalsContact O-CG 3.25Å; L431-R435 WeakPolarHBondContact O-CG 3.36Å; L431-R435 PolarHBondContact O-NE 3.32Å; L431-P477 HydrophobicContact CD2-CB 4.2Å; L431-P477 HydrophobicContact CG-CB 4.24Å; L431-L481 HydrophobicContact CD1-CD2 4.14Å
432	L	65.7	Low	59.7	Low	64 Å²	64	69.6 Å²	69.6	34%	0.335	34%	0.34	S	S	.	.	H	α-helix	trans	-81.4	-38.4	171.3	-68.4	169.4	0	0	0	110.9	V428 I429 P430 R435 P843	V428-L432 HydrophobicContact CG1-CD1 3.85Å; V428-L432 HydrophobicContact CG1-CG 4.44Å; V428-L432 WeakPolarHBondContact O-CB 3.31Å; V428-L432 WeakPolarHBondContact O-CG 3.42Å; V428-L432 PolarHBondContact O-N 3.37Å; I429-L432 CarbonylContact O-C 3.52Å; I429-L432 PolarHBondContact O-N 2.92Å; I429-L432 VanDerWaalsContact O-N 3.12Å; P430-L432 VanDerWaalsContact C-N 3.27Å; P430-L432 PolarHBondContact O-N 2.82Å; L432-R435 WeakPolarHBondContact O-CB 3.31Å; L432-P843 HydrophobicContact CD1-CG 4.37Å
433	N	59.5	Low	57.8	Low	82 Å²	82	70.2 Å²	70.2	44%	0.439	34%	0.344	S	S	.	.	H	α-helix	trans	-82.9	-33.7	-176.1	-69.6	-0.6	0	0	0	113.8	I429 P430 R435 N436 L437	I429-N433 WeakPolarHBondContact CG2-ND2 3.48Å; I429-N433 WeakPolarHBondContact O-CB 3.49Å; I429-N433 VanDerWaalsContact O-CG 3.26Å; I429-N433 PolarHBondContact O-N 3.35Å; I429-N433 PolarHBondContact O-OD1 3.33Å; P430-N433 PolarHBondContact O-N 2.85Å; N433-R435 PolarHBondContact O-N 2.99Å; N433-R435 VanDerWaalsContact O-N 3.14Å; N433-N436 WeakPolarHBondContact O-CA 3.26Å; N433-N436 VanDerWaalsContact O-CB 3.28Å; N433-N436 WeakPolarHBondContact O-CB 3.2Å; N433-N436 PolarHBondContact O-N 3.42Å; N433-L437 PolarHBondContact O-N 3.48Å
434	N	50.9	Low	55.7	Low	67 Å²	67	75.4 Å²	75.4	36%	0.358	37%	0.373	S	S	.	.	H	α-helix	trans	-64.5	-14.4	172.3	-89.1	-4.5	0	0	0	112.3	P430 N436 L437 P477	P430-N434 WeakPolarHBondContact O-CB 3.39Å; P430-N434 PolarHBondContact O-N 3.41Å; N434-N436 VanDerWaalsContact C-N 3.26Å; N434-L437 WeakPolarHBondContact OD1-CD1 3.41Å; N434-P477 WeakPolarHBondContact ND2-CD 3.32Å
435	R	50.1	Low	53.9	Low	82 Å²	82	75.6 Å²	75.6	31%	0.309	38%	0.38	S	S	.	.	H	α-helix	trans	-71.7	-23.6	168.4	-58.8	172	-170.6	-175	1	111.8	L431 L432 N433 L818	L431-R435 VanDerWaalsContact O-CD 3.28Å; L431-R435 WeakPolarHBondContact O-CD 3.21Å; L431-R435 VanDerWaalsContact O-CG 3.25Å; L431-R435 WeakPolarHBondContact O-CG 3.36Å; L431-R435 PolarHBondContact O-NE 3.32Å; L432-R435 WeakPolarHBondContact O-CB 3.31Å; N433-R435 PolarHBondContact O-N 2.99Å; N433-R435 VanDerWaalsContact O-N 3.14Å; R435-L818 VanDerWaalsContact CZ-CD2 3.47Å
436	N	38.2	Very low	52	Low	84 Å²	84	73.1 Å²	73.1	45%	0.449	38%	0.376	S	S	.	.	H	α-helix	trans	-89	-29.7	178.1	-56	-19	0	0	0	112.2	N433 N434 V438 Q439 N440	N433-N436 WeakPolarHBondContact O-CA 3.26Å; N433-N436 VanDerWaalsContact O-CB 3.28Å; N433-N436 WeakPolarHBondContact O-CB 3.2Å; N433-N436 PolarHBondContact O-N 3.42Å; N434-N436 VanDerWaalsContact C-N 3.26Å; N436-V438 VanDerWaalsContact C-N 3.28Å; N436-V438 PolarHBondContact O-N 2.71Å; N436-Q439 WeakPolarHBondContact O-CB 3.42Å; N436-Q439 PolarHBondContact O-N 3.37Å; N436-Q439 VanDerWaalsContact O-N 3.08Å; N436-N440 PolarHBondContact O-N 2.54Å
437	L	35.3	Very low	50.2	Low	78 Å²	78	73.4 Å²	73.4	41%	0.408	38%	0.38	S	S	.	.	H	α-helix	trans	-67.3	-24.3	-177.1	-84.4	156.5	0	0	0	113.9	N433 N434 Q439 N440 V441	N433-L437 PolarHBondContact O-N 3.48Å; N434-L437 WeakPolarHBondContact OD1-CD1 3.41Å; L437-Q439 PolarHBondContact O-N 3.43Å; L437-N440 PolarHBondContact O-N 3.35Å; L437-V441 WeakPolarHBondContact O-CG2 3.29Å; L437-V441 PolarHBondContact O-N 3.12Å
438	V	41	Very low	48.7	Very low	85 Å²	85	77.4 Å²	77.4	52%	0.515	41%	0.413	S	S	.	.	H	α-helix	trans	-64.4	-25.5	173.2	-176.1	0	0	0	0	111.6	N436	N436-V438 VanDerWaalsContact C-N 3.28Å; N436-V438 PolarHBondContact O-N 2.71Å
439	Q	34.6	Very low	47.4	Very low	64 Å²	64	82.5 Å²	82.5	30%	0.299	44%	0.438	S	S	.	.	H	α-helix	trans	-83.9	-41.4	176.9	-70.4	-177.3	-16.5	0	0	112.7	N436 L437 V441 K442 I443 E838	N436-Q439 WeakPolarHBondContact O-CB 3.42Å; N436-Q439 PolarHBondContact O-N 3.37Å; N436-Q439 VanDerWaalsContact O-N 3.08Å; L437-Q439 PolarHBondContact O-N 3.43Å; Q439-V441 VanDerWaalsContact C-N 3.3Å; Q439-V441 PolarHBondContact O-N 2.82Å; Q439-K442 PolarHBondContact O-N 2.91Å; Q439-I443 HydrophobicContact CB-CD1 4.24Å; Q439-I443 WeakPolarHBondContact O-CB 3.24Å; Q439-I443 VanDerWaalsContact O-CG1 3.24Å; Q439-I443 WeakPolarHBondContact O-CG1 3.17Å; Q439-I443 PolarHBondContact O-N 2.77Å; Q439-E838 VanDerWaalsContact NE2-CB 3.3Å; Q439-E838 PolarHBondContact NE2-OE2 2.89Å
440	N	32.9	Very low	46	Very low	91 Å²	91	83.3 Å²	83.3	49%	0.487	44%	0.444	S	S	.	.	H	α-helix	trans	-66	-32.9	-179.5	-71.9	-7.4	0	0	0	112.6	N436 L437 N444	N436-N440 PolarHBondContact O-N 2.54Å; L437-N440 PolarHBondContact O-N 3.35Å; N440-N444 WeakPolarHBondContact O-CB 3.33Å; N440-N444 PolarHBondContact O-N 2.92Å; N440-N444 PolarHBondContact O-ND2 3.16Å
441	V	39.2	Very low	44.6	Very low	86 Å²	86	88.1 Å²	88.1	52%	0.521	47%	0.468	S	S	.	.	H	α-helix	trans	-70.1	-40.1	174.4	178.5	0	0	0	0	111	L437 Q439 L445	L437-V441 WeakPolarHBondContact O-CG2 3.29Å; L437-V441 PolarHBondContact O-N 3.12Å; Q439-V441 VanDerWaalsContact C-N 3.3Å; Q439-V441 PolarHBondContact O-N 2.82Å; V441-L445 HydrophobicContact CG1-CD1 3.87Å; V441-L445 WeakPolarHBondContact O-CB 3.13Å; V441-L445 VanDerWaalsContact O-CD1 3.31Å; V441-L445 WeakPolarHBondContact O-CD1 3.47Å; V441-L445 PolarHBondContact O-N 2.95Å; V441-L445 VanDerWaalsContact O-N 3.14Å
442	K	36.5	Very low	43.4	Very low	107 Å²	107	94.4 Å²	94.4	47%	0.465	50%	0.501	S	S	.	.	H	α-helix	trans	-76.4	-33.1	179.1	-88.1	178.1	177.5	169.9	0	114.1	Q439 L445 H446	Q439-K442 PolarHBondContact O-N 2.91Å; K442-L445 PolarHBondContact O-N 3.44Å; K442-H446 WeakPolarHBondContact O-CB 3.48Å; K442-H446 PolarHBondContact O-N 2.81Å
443	I	42	Very low	42.6	Very low	83 Å²	83	98.3 Å²	98.3	43%	0.426	52%	0.523	S	S	.	.	H	α-helix	trans	-70.1	-40	177	-67.6	164.7	0	0	0	109.9	Q439 L445 H446 N447	Q439-I443 HydrophobicContact CB-CD1 4.24Å; Q439-I443 WeakPolarHBondContact O-CB 3.24Å; Q439-I443 VanDerWaalsContact O-CG1 3.24Å; Q439-I443 WeakPolarHBondContact O-CG1 3.17Å; Q439-I443 PolarHBondContact O-N 2.77Å; I443-L445 VanDerWaalsContact C-N 3.34Å; I443-L445 PolarHBondContact O-N 2.99Å; I443-H446 PolarHBondContact O-N 3.16Å; I443-N447 WeakPolarHBondContact O-CB 3.48Å; I443-N447 PolarHBondContact O-N 3.28Å; I443-N447 PolarHBondContact O-OD1 3.08Å
444	N	39.3	Very low	41.9	Very low	111 Å²	111	101.1 Å²	101.1	59%	0.594	54%	0.538	S	S	*	.	H	α-helix	trans	-69.6	-30.8	174.8	-67.6	-9.3	0	0	0	112.5	N440 A448	N440-N444 WeakPolarHBondContact O-CB 3.33Å; N440-N444 PolarHBondContact O-N 2.92Å; N440-N444 PolarHBondContact O-ND2 3.16Å; N444-A448 WeakPolarHBondContact O-CB 3.48Å; N444-A448 PolarHBondContact O-N 2.79Å; N444-A448 VanDerWaalsContact O-N 3.12Å
445	L	43.3	Very low	41.6	Very low	103 Å²	103	104.7 Å²	104.7	54%	0.539	56%	0.556	S	S	.	*	H	α-helix	trans	-77	-24	172.2	-93.1	142.2	0	0	0	113.7	V441 K442 I443 I449	V441-L445 HydrophobicContact CG1-CD1 3.87Å; V441-L445 WeakPolarHBondContact O-CB 3.13Å; V441-L445 VanDerWaalsContact O-CD1 3.31Å; V441-L445 WeakPolarHBondContact O-CD1 3.47Å; V441-L445 PolarHBondContact O-N 2.95Å; V441-L445 VanDerWaalsContact O-N 3.14Å; K442-L445 PolarHBondContact O-N 3.44Å; I443-L445 VanDerWaalsContact C-N 3.34Å; I443-L445 PolarHBondContact O-N 2.99Å; L445-I449 WeakPolarHBondContact O-CD1 3.19Å; L445-I449 WeakPolarHBondContact O-CG1 3.39Å
446	H	40.9	Very low	41.1	Very low	125 Å²	125	107.3 Å²	107.3	58%	0.579	58%	0.577	S	S	*	*	H	α-helix	trans	-89.3	-28.4	178	-157.6	56.5	0	0	0	112.7	K442 I443 N450	K442-H446 WeakPolarHBondContact O-CB 3.48Å; K442-H446 PolarHBondContact O-N 2.81Å; I443-H446 PolarHBondContact O-N 3.16Å; H446-N450 PolarHBondContact O-ND2 2.88Å
447	N	41.1	Very low	41.3	Very low	79 Å²	79	110.6 Å²	110.6	42%	0.422	59%	0.594	S	S	.	*	H	α-helix	trans	-77.4	-39	171.7	-63.4	-4.2	0	0	0	110.6	I443 I449 N450 D451	I443-N447 WeakPolarHBondContact O-CB 3.48Å; I443-N447 PolarHBondContact O-N 3.28Å; I443-N447 PolarHBondContact O-OD1 3.08Å; N447-I449 PolarHBondContact O-N 2.96Å; N447-N450 PolarHBondContact O-N 3.32Å; N447-N450 VanDerWaalsContact O-N 3.13Å; N447-D451 PolarHBondContact O-N 2.92Å
448	A	43.3	Very low	41.3	Very low	84 Å²	84	114.5 Å²	114.5	69%	0.694	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-3.3	175	0	0	0	0	0	115.4	N444	N444-A448 WeakPolarHBondContact O-CB 3.48Å; N444-A448 PolarHBondContact O-N 2.79Å; N444-A448 VanDerWaalsContact O-N 3.12Å
449	I	47.8	Very low	40.9	Very low	124 Å²	124	115.9 Å²	115.9	64%	0.636	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	-7.7	176.8	-67.4	173.8	0	0	0	111.4	L445 N447	L445-I449 WeakPolarHBondContact O-CD1 3.19Å; L445-I449 WeakPolarHBondContact O-CG1 3.39Å; N447-I449 PolarHBondContact O-N 2.96Å
450	N	44.9	Very low	40.7	Very low	100 Å²	100	119 Å²	119	54%	0.535	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-126.4	6.2	-174.4	-67.8	-51.1	0	0	0	115	H446 N447	H446-N450 PolarHBondContact O-ND2 2.88Å; N447-N450 PolarHBondContact O-N 3.32Å; N447-N450 VanDerWaalsContact O-N 3.13Å
451	D	42.2	Very low	40.4	Very low	134 Å²	134	119.7 Å²	119.7	72%	0.717	66%	0.659	S	S	*	*			trans	-105.7	66.7	178.8	-65.8	-27.1	0	0	0	110.6	N447	N447-D451 PolarHBondContact O-N 2.92Å
452	D	43.7	Very low	40	Very low	149 Å²	149	126.8 Å²	126.8	80%	0.797	68%	0.676	S	S	*	*			trans	-100.1	129.4	148.8	-76.2	-40.6	0	0	0	105.2
453	D	47.2	Very low	39.5	Very low	147 Å²	147	128 Å²	128	79%	0.786	69%	0.688	S	S	*	*	S	Bend	trans	108.3	113.6	173.2	-51.5	-31.2	0	0	0	116.8
454	D	45.2	Very low	39	Very low	141 Å²	141	133.3 Å²	133.3	75%	0.754	70%	0.704	S	S	*	*			trans	86	97.6	146.9	-53.2	-24.1	0	0	0	121.9
455	D	45.1	Very low	38.5	Very low	141 Å²	141	132.8 Å²	132.8	75%	0.754	71%	0.705	S	S	*	*				50.5	122.7	125.7	-59	-23.4	0	0	0	123.1
456	D	40.4	Very low	37.9	Very low	137 Å²	137	135 Å²	135	73%	0.733	72%	0.717	S	S	*	*			trans	61.1	108.1	138.6	-59.5	-26.3	0	0	0	121.2
457	D	40.8	Very low	37.5	Very low	154 Å²	154	139.2 Å²	139.2	82%	0.824	73%	0.729	S	S	*	*				153.1	119.4	115.5	-82	-29.3	0	0	0	113.8
458	D	36.3	Very low	37.1	Very low	159 Å²	159	144.3 Å²	144.3	85%	0.85	75%	0.75	S	S	*	*			trans	17.3	116.1	151.6	-70.4	-28.7	0	0	0	120.8
459	C	31.9	Very low	36.5	Very low	114 Å²	114	149.3 Å²	149.3	77%	0.77	76%	0.757	S	S	*	*			trans	-176.5	116.2	130.4	-159.3	0	0	0	0	113.6
460	D	30.2	Very low	35.6	Very low	131 Å²	131	149.6 Å²	149.6	70%	0.701	76%	0.76	S	S	*	*			trans	64.7	92.1	149	-60.9	-15.2	0	0	0	122.4	W462	D460-W462 PolarHBondContact O-N 2.87Å
461	S	27.3	Very low	35.2	Very low	105 Å²	105	149.9 Å²	149.9	73%	0.734	77%	0.769	S	S	*	*			trans	-53.7	105.7	157.2	178.1	0	0	0	0	113.1
462	W	30.7	Very low	35	Very low	235 Å²	235	151.1 Å²	151.1	89%	0.89	78%	0.776	S	S	*	*			trans	-108.2	105.8	153.4	-77.6	84.3	0	0	0	108.7	D460 Y464	D460-W462 PolarHBondContact O-N 2.87Å; W462-Y464 PolarHBondContact O-N 2.85Å
463	N	24.9	Very low	35.1	Very low	132 Å²	132	150.1 Å²	150.1	71%	0.706	77%	0.771	S	S	*	*			trans	-54.3	103.2	178.3	-82.6	-31.9	0	0	0	112.1	T465	N463-T465 VanDerWaalsContact C-N 3.32Å; N463-T465 PolarHBondContact O-N 3.5Å
464	Y	31.6	Very low	35.2	Very low	195 Å²	195	150.9 Å²	150.9	77%	0.765	77%	0.774	S	S	*	*			trans	-89.2	66.9	164.8	-165.5	-91.1	0	0	0	108.7	W462	W462-Y464 PolarHBondContact O-N 2.85Å
465	T	28.8	Very low	36	Very low	100 Å²	100	148.2 Å²	148.2	61%	0.613	76%	0.757	S	S	*	*			trans	-132.7	9.5	-176.5	46	0	0	0	0	115.3	N463	N463-T465 VanDerWaalsContact C-N 3.32Å; N463-T465 PolarHBondContact O-N 3.5Å
466	D	30.5	Very low	37	Very low	149 Å²	149	144.1 Å²	144.1	80%	0.797	74%	0.739	S	S	*	*	S	Bend	trans	-105.5	6.1	-178.5	-82.5	-24.7	0	0	0	115.9
467	Y	33.9	Very low	38.4	Very low	213 Å²	213	138.6 Å²	138.6	84%	0.835	71%	0.711	S	S	*	*	S	Bend	trans	-98.5	2.7	-178.8	-93.7	-81.5	0	0	0	116.1
468	E	32.4	Very low	39.7	Very low	186 Å²	186	133.1 Å²	133.1	87%	0.869	69%	0.685	S	S	*	*	S	Bend	trans	-103.9	12.8	-173.1	-73.2	-168.4	151.4	0	0	115.9
469	K	30.6	Very low	41.4	Very low	190 Å²	190	126.9 Å²	126.9	83%	0.826	66%	0.655	S	S	*	*	S	Bend	trans	-102.8	6.9	-173.3	-88.3	-179.5	-178.9	166.8	0	118.4
470	N	29.1	Very low	43.5	Very low	130 Å²	130	124.9 Å²	124.9	70%	0.695	63%	0.633	S	S	*	*			trans	-127.8	78.3	174.8	-70.9	-29.4	0	0	0	111.5	D472	N470-D472 PolarHBondContact O-N 3.13Å
471	S	35.4	Very low	45.9	Very low	106 Å²	106	118.6 Å²	118.6	74%	0.741	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	3.5	-175.3	55.1	0	0	0	0	115.8
472	D	39.2	Very low	48.3	Very low	159 Å²	159	115.6 Å²	115.6	85%	0.85	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	-3.2	-178.3	-74	-24	0	0	0	114.3	N470	N470-D472 PolarHBondContact O-N 3.13Å
473	D	45.3	Very low	50.6	Low	129 Å²	129	109.7 Å²	109.7	69%	0.69	55%	0.551	S	S	*	*			trans	-108.1	22.2	-173.4	-85.3	-38.1	0	0	0	114.6	E475	D473-E475 PolarHBondContact O-N 2.72Å
474	L	49.7	Very low	53.3	Low	162 Å²	162	103.4 Å²	103.4	85%	0.848	52%	0.517	S	S	*	.			trans	-79.8	30.2	-173.4	-136.8	86.9	0	0	0	115
475	E	61.2	Low	55.8	Low	85 Å²	85	94.1 Å²	94.1	40%	0.397	48%	0.481	S	S	.	.			trans	-83.7	120.5	171.5	-170.3	177.1	-160.7	0	0	109.6	D473 A479 K480 R483	D473-E475 PolarHBondContact O-N 2.72Å; E475-A479 HydrophobicContact CG-CB 3.71Å; E475-A479 VanDerWaalsContact OE1-C 3.32Å; E475-K480 HydrophobicContact CG-CB 4.18Å; E475-K480 PolarHBondContact OE1-N 2.75Å; E475-R483 IonicContact OE2-NE 3.77Å
476	S	67.8	Low	58.4	Low	55 Å²	55	92.5 Å²	92.5	39%	0.385	47%	0.468	S	S	.	.			trans	-53.2	139.5	174.9	66.1	0	0	0	0	110.8	S478 A479 K480	S476-S478 PolarHBondContact O-N 3.07Å; S476-S478 PolarHBondContact OG-OG 3.34Å; S476-S478 VanDerWaalsContact OG-OG 3.14Å; S476-A479 PolarHBondContact O-N 3.29Å; S476-A479 VanDerWaalsContact OG-CB 3.31Å; S476-A479 WeakPolarHBondContact OG-CB 3.26Å; S476-A479 PolarHBondContact OG-N 2.94Å; S476-K480 PolarHBondContact O-N 3.28Å
477	P	69.7	Low	60.8	Low	22 Å²	22	85.8 Å²	85.8	14%	0.143	43%	0.434	C	S	.	.	H	α-helix	trans	-53.8	-29.9	-179.2	-27.3	33.6	0	0	0	113.6	P430 L431 N434 L481	P430-P477 HydrophobicContact CB-CB 4.06Å; P430-P477 HydrophobicContact CB-CG 3.59Å; L431-P477 HydrophobicContact CD2-CB 4.2Å; L431-P477 HydrophobicContact CG-CB 4.24Å; N434-P477 WeakPolarHBondContact ND2-CD 3.32Å; P477-L481 VanDerWaalsContact O-CB 3.3Å; P477-L481 WeakPolarHBondContact O-CB 3.43Å; P477-L481 PolarHBondContact O-N 3.15Å
478	S	67.5	Low	63.4	Low	39 Å²	39	75.7 Å²	75.7	27%	0.273	39%	0.394	S	S	.	.	H	α-helix	trans	-67.8	-46.9	173.6	45.1	0	0	0	0	112.2	S476 L481 F482	S476-S478 PolarHBondContact O-N 3.07Å; S476-S478 PolarHBondContact OG-OG 3.34Å; S476-S478 VanDerWaalsContact OG-OG 3.14Å; S478-L481 PolarHBondContact O-N 3.12Å; S478-F482 VanDerWaalsContact O-CB 3.3Å; S478-F482 WeakPolarHBondContact O-CB 3.31Å; S478-F482 PolarHBondContact O-N 3.08Å
479	A	70.9	Confident	66	Low	27 Å²	27	67.3 Å²	67.3	22%	0.223	35%	0.354	C	S	.	.	H	α-helix	trans	-62.1	-43.6	176.7	0	0	0	0	0	111.4	E475 S476 L481 F482 R483	E475-A479 HydrophobicContact CG-CB 3.71Å; E475-A479 VanDerWaalsContact OE1-C 3.32Å; S476-A479 PolarHBondContact O-N 3.29Å; S476-A479 VanDerWaalsContact OG-CB 3.31Å; S476-A479 WeakPolarHBondContact OG-CB 3.26Å; S476-A479 PolarHBondContact OG-N 2.94Å; A479-L481 PolarHBondContact O-N 3.22Å; A479-F482 PolarHBondContact O-N 3.5Å; A479-R483 WeakPolarHBondContact O-CB 3.4Å; A479-R483 PolarHBondContact O-N 3.45Å
480	K	77.7	Confident	68.8	Low	72 Å²	72	59.9 Å²	59.9	31%	0.313	32%	0.324	S	S	.	.	H	α-helix	trans	-60.3	-45.1	175.6	-173.1	171.3	-178.5	169.5	0	111.9	F427 E475 S476 R483 L484	F427-K480 HydrophobicContact CE1-CB 4.31Å; F427-K480 HydrophobicContact CE1-CD 4.47Å; F427-K480 HydrophobicContact CE1-CG 4.14Å; F427-K480 HydrophobicContact CZ-CG 4.46Å; E475-K480 HydrophobicContact CG-CB 4.18Å; E475-K480 PolarHBondContact OE1-N 2.75Å; S476-K480 PolarHBondContact O-N 3.28Å; K480-R483 PolarHBondContact O-N 3.01Å; K480-L484 WeakPolarHBondContact O-CG 3.43Å; K480-L484 PolarHBondContact O-N 3.27Å
481	L	79.9	Confident	71.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.3	-45.3	176.2	-178.9	59.2	0	0	0	111.5	L416 F423 F427 L431 P477 S478 A479 R483 L484 L485 T822	L416-L481 HydrophobicContact CD2-CD1 4.06Å; F423-L481 HydrophobicContact CE2-CD1 4.05Å; F423-L481 HydrophobicContact CZ-CD1 4.47Å; F427-L481 HydrophobicContact CD1-CB 3.73Å; F427-L481 HydrophobicContact CD1-CD1 4.2Å; F427-L481 HydrophobicContact CD1-CG 4.37Å; F427-L481 HydrophobicContact CE1-CB 3.8Å; F427-L481 HydrophobicContact CE1-CD1 4.3Å; F427-L481 HydrophobicContact CG-CD1 4.4Å; L431-L481 HydrophobicContact CD1-CD2 4.14Å; P477-L481 VanDerWaalsContact O-CB 3.3Å; P477-L481 WeakPolarHBondContact O-CB 3.43Å; P477-L481 PolarHBondContact O-N 3.15Å; S478-L481 PolarHBondContact O-N 3.12Å; A479-L481 PolarHBondContact O-N 3.22Å; L481-R483 PolarHBondContact O-N 2.95Å; L481-L484 PolarHBondContact O-N 3.46Å; L481-L485 HydrophobicContact CD1-CD1 4.04Å; L481-L485 HydrophobicContact CD1-CG 4.14Å; L481-L485 HydrophobicContact CD2-CD1 4.45Å; L481-L485 HydrophobicContact CG-CD1 3.79Å; L481-L485 HydrophobicContact CG-CG 4.33Å; L481-L485 WeakPolarHBondContact O-CB 3.22Å; L481-L485 VanDerWaalsContact O-CG 3.28Å; L481-L485 WeakPolarHBondContact O-CG 3.47Å; L481-L485 PolarHBondContact O-N 2.94Å; L481-T822 HydrophobicContact CD2-CG2 3.84Å
482	F	78.1	Confident	74	Confident	42 Å²	42	53.5 Å²	53.5	18%	0.184	27%	0.274	C	S	.	.	H	α-helix	trans	-60.9	-43.3	179	-177.2	-106.6	0	0	0	111.7	S478 A479 L484 L485 N486 L823 N825	S478-F482 VanDerWaalsContact O-CB 3.3Å; S478-F482 WeakPolarHBondContact O-CB 3.31Å; S478-F482 PolarHBondContact O-N 3.08Å; A479-F482 PolarHBondContact O-N 3.5Å; F482-L484 VanDerWaalsContact C-N 3.34Å; F482-L484 PolarHBondContact O-N 3.31Å; F482-L485 PolarHBondContact O-N 2.97Å; F482-N486 WeakPolarHBondContact CD1-ND2 3.41Å; F482-N486 WeakPolarHBondContact CE1-ND2 3.4Å; F482-N486 WeakPolarHBondContact CZ-ND2 3.33Å; F482-N486 WeakPolarHBondContact O-CB 3.46Å; F482-N486 VanDerWaalsContact O-CG 3.24Å; F482-N486 PolarHBondContact O-N 3.47Å; F482-N486 PolarHBondContact O-ND2 3.19Å; F482-L823 WeakPolarHBondContact CE2-O 3.39Å; F482-N825 VanDerWaalsContact CD1-ND2 3.34Å; F482-N825 WeakPolarHBondContact CD1-ND2 3.41Å; F482-N825 VanDerWaalsContact CE1-ND2 3.3Å; F482-N825 WeakPolarHBondContact CE1-ND2 3.31Å
483	R	78.9	Confident	76.2	Confident	110 Å²	110	48.2 Å²	48.2	42%	0.415	25%	0.247	S	C	.	.	H	α-helix	trans	-58.6	-43.6	175.5	-170.7	178.1	73.1	106.2	6.4	112.2	V240 E475 A479 K480 L481	V240-R483 HydrophobicContact CG1-CG 4.37Å; V240-R483 VanDerWaalsContact CG1-CZ 3.46Å; E475-R483 IonicContact OE2-NE 3.77Å; A479-R483 WeakPolarHBondContact O-CB 3.4Å; A479-R483 PolarHBondContact O-N 3.45Å; K480-R483 PolarHBondContact O-N 3.01Å; L481-R483 PolarHBondContact O-N 2.95Å
484	L	82.1	Confident	77.8	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.6	-46.1	176.6	-68.7	172.8	0	0	0	111.6	V240 L242 L416 F427 K480 L481 F482 S487 F488	V240-L484 WeakPolarHBondContact O-CD2 3.27Å; L242-L484 HydrophobicContact CD1-CD1 4.44Å; L242-L484 HydrophobicContact CD2-CD1 4.15Å; L242-L484 HydrophobicContact CG-CD1 4.3Å; L416-L484 HydrophobicContact CD2-CB 3.95Å; L416-L484 HydrophobicContact CD2-CD1 4.22Å; F427-L484 HydrophobicContact CZ-CD1 3.8Å; K480-L484 WeakPolarHBondContact O-CG 3.43Å; K480-L484 PolarHBondContact O-N 3.27Å; L481-L484 PolarHBondContact O-N 3.46Å; F482-L484 VanDerWaalsContact C-N 3.34Å; F482-L484 PolarHBondContact O-N 3.31Å; L484-S487 PolarHBondContact O-N 3.07Å; L484-S487 PolarHBondContact O-OG 2.86Å; L484-F488 WeakPolarHBondContact O-CE1 3.48Å
485	L	83.9	Confident	79.1	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-62.8	-44.6	-178.7	-71.6	170.8	0	0	0	112	L404 L416 L481 F482 S487 F488 F489 L823	L404-L485 HydrophobicContact CD1-CD2 4.36Å; L404-L485 HydrophobicContact CD2-CD1 3.84Å; L404-L485 HydrophobicContact CD2-CD2 4.28Å; L404-L485 HydrophobicContact CG-CD2 4.38Å; L416-L485 HydrophobicContact CD2-CD2 4.38Å; L481-L485 HydrophobicContact CD1-CD1 4.04Å; L481-L485 HydrophobicContact CD1-CG 4.14Å; L481-L485 HydrophobicContact CD2-CD1 4.45Å; L481-L485 HydrophobicContact CG-CD1 3.79Å; L481-L485 HydrophobicContact CG-CG 4.33Å; L481-L485 WeakPolarHBondContact O-CB 3.22Å; L481-L485 VanDerWaalsContact O-CG 3.28Å; L481-L485 WeakPolarHBondContact O-CG 3.47Å; L481-L485 PolarHBondContact O-N 2.94Å; F482-L485 PolarHBondContact O-N 2.97Å; L485-S487 PolarHBondContact O-N 3.25Å; L485-F488 HydrophobicContact CD2-CE2 4.19Å; L485-F488 HydrophobicContact CD2-CZ 3.88Å; L485-F488 PolarHBondContact O-N 2.91Å; L485-F489 HydrophobicContact CB-CB 4.16Å; L485-F489 WeakPolarHBondContact O-CA 3.22Å; L485-F489 WeakPolarHBondContact O-CB 3.34Å; L485-F489 PolarHBondContact O-N 3.28Å; L485-L823 HydrophobicContact CD1-CD2 3.94Å
486	N	82.8	Confident	80	Confident	65 Å²	65	38.7 Å²	38.7	35%	0.348	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-16.4	-178.8	-76.4	-21.7	0	0	0	114.6	F482	F482-N486 WeakPolarHBondContact CD1-ND2 3.41Å; F482-N486 WeakPolarHBondContact CE1-ND2 3.4Å; F482-N486 WeakPolarHBondContact CZ-ND2 3.33Å; F482-N486 WeakPolarHBondContact O-CB 3.46Å; F482-N486 VanDerWaalsContact O-CG 3.24Å; F482-N486 PolarHBondContact O-N 3.47Å; F482-N486 PolarHBondContact O-ND2 3.19Å
487	S	81.9	Confident	80.5	Confident	9 Å²	9	37 Å²	37	6%	0.063	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-26.4	174.6	68.5	0	0	0	0	113.8	Q237 R415 L484 L485	Q237-S487 WeakPolarHBondContact CG-O 3.41Å; R415-S487 PolarHBondContact NH2-OG 3.41Å; L484-S487 PolarHBondContact O-N 3.07Å; L484-S487 PolarHBondContact O-OG 2.86Å; L485-S487 PolarHBondContact O-N 3.25Å
488	F	86.4	Confident	80.6	Confident	1 Å²	1	37.6 Å²	37.6	0%	0.004	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-137.8	-2.2	-178.6	60.4	-92	0	0	0	114.1	C253 I254 A408 V412 R415 L416 L484 L485	C253-F488 CarbonylContact C-O 3.55Å; C253-F488 WeakPolarHBondContact CA-O 2.81Å; I254-F488 HydrophobicContact CD1-CD2 4.17Å; I254-F488 HydrophobicContact CD1-CE2 4.01Å; I254-F488 HydrophobicContact CG1-CD2 4.39Å; I254-F488 PolarHBondContact N-O 3.11Å; A408-F488 HydrophobicContact CB-CE2 3.95Å; A408-F488 HydrophobicContact CB-CZ 4.02Å; V412-F488 HydrophobicContact CG2-CB 4.19Å; V412-F488 HydrophobicContact CG2-CD1 4.49Å; V412-F488 HydrophobicContact CG2-CD2 4.33Å; V412-F488 HydrophobicContact CG2-CG 4.09Å; R415-F488 HydrophobicContact CB-CE1 4.43Å; R415-F488 HydrophobicContact CG-CD1 4.06Å; R415-F488 HydrophobicContact CG-CE1 3.7Å; L416-F488 HydrophobicContact CD2-CZ 4.39Å; L416-F488 HydrophobicContact CG-CZ 4.39Å; L484-F488 WeakPolarHBondContact O-CE1 3.48Å; L485-F488 HydrophobicContact CD2-CE2 4.19Å; L485-F488 HydrophobicContact CD2-CZ 3.88Å; L485-F488 PolarHBondContact O-N 2.91Å
489	F	88.6	Confident	81.1	Confident	9 Å²	9	41.4 Å²	41.4	4%	0.039	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.5	-175.7	-172.8	-87.2	0	0	0	110.2	I254 A256 P396 L404 L485 R491 L823	I254-F489 HydrophobicContact CB-CD2 3.79Å; I254-F489 HydrophobicContact CB-CE2 4.45Å; I254-F489 HydrophobicContact CD1-CD2 4.19Å; I254-F489 HydrophobicContact CG2-CD2 3.57Å; I254-F489 HydrophobicContact CG2-CE2 3.73Å; I254-F489 WeakPolarHBondContact O-CA 3.28Å; A256-F489 HydrophobicContact CB-CD2 4.39Å; A256-F489 HydrophobicContact CB-CE1 3.88Å; A256-F489 HydrophobicContact CB-CE2 3.6Å; A256-F489 HydrophobicContact CB-CZ 3.31Å; P396-F489 HydrophobicContact CB-CE2 3.69Å; P396-F489 HydrophobicContact CB-CZ 3.52Å; P396-F489 HydrophobicContact CG-CE2 4.45Å; P396-F489 HydrophobicContact CG-CZ 3.78Å; L404-F489 HydrophobicContact CD1-CE2 4.33Å; L485-F489 HydrophobicContact CB-CB 4.16Å; L485-F489 WeakPolarHBondContact O-CA 3.22Å; L485-F489 WeakPolarHBondContact O-CB 3.34Å; L485-F489 PolarHBondContact O-N 3.28Å; F489-R491 HydrophobicContact CD1-CB 4.35Å; F489-R491 HydrophobicContact CE1-CB 3.65Å; F489-R491 HydrophobicContact CZ-CB 4.43Å; F489-L823 HydrophobicContact CE1-CD2 3.98Å; F489-L823 HydrophobicContact CZ-CD1 4.14Å; F489-L823 HydrophobicContact CZ-CD2 4Å
490	L	89.3	Confident	81.3	Confident	35 Å²	35	46.9 Å²	46.9	18%	0.183	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.7	174.6	178.7	64.4	0	0	0	109.8	F228 I254 L255 A256	F228-L490 HydrophobicContact CB-CD2 4.04Å; F228-L490 HydrophobicContact CD1-CB 3.65Å; F228-L490 HydrophobicContact CD1-CD2 3.79Å; F228-L490 HydrophobicContact CD1-CG 4.29Å; F228-L490 HydrophobicContact CE1-CB 3.46Å; F228-L490 VanDerWaalsContact CE1-CB 3.46Å; F228-L490 HydrophobicContact CE1-CD2 4.47Å; F228-L490 HydrophobicContact CG-CB 4.32Å; F228-L490 HydrophobicContact CG-CD2 3.97Å; F228-L490 HydrophobicContact CZ-CB 3.99Å; I254-L490 PolarHBondContact O-N 2.91Å; L255-L490 HydrophobicContact CD1-CB 4.28Å; L255-L490 HydrophobicContact CD1-CD2 3.86Å; L255-L490 HydrophobicContact CD1-CG 4.28Å; A256-L490 CarbonylContact C-O 3.59Å; A256-L490 WeakPolarHBondContact CA-O 3.43Å; A256-L490 PolarHBondContact N-O 3.1Å
491	R	88	Confident	81.3	Confident	75 Å²	75	44.8 Å²	44.8	28%	0.283	23%	0.232	S	C	.	.			trans	-129.1	130.6	174.2	176.5	169.3	-172.4	-178.5	-0.9	110.2	A256 F489	A256-R491 HydrophobicContact CB-CB 4.24Å; A256-R491 WeakPolarHBondContact O-CG 3.42Å; F489-R491 HydrophobicContact CD1-CB 4.35Å; F489-R491 HydrophobicContact CE1-CB 3.65Å; F489-R491 HydrophobicContact CZ-CB 4.43Å
492	R	86.3	Confident	81.5	Confident	26 Å²	26	46.4 Å²	46.4	10%	0.098	24%	0.241	C	C	.	.			trans	-131.2	145.7	173.3	-68	168.8	-70	-157.6	3.8	109.3	H221 D257 E258 L261 Q266	H221-R492 PolarHBondContact O-NH1 3.21Å; D257-R492 IonicContact OD1-CZ 2.61Å; D257-R492 VanDerWaalsContact OD1-CZ 3.3Å; D257-R492 IonicContact OD1-NE 3.88Å; D257-R492 PolarHBondContact OD1-NE 3.19Å; D257-R492 IonicContact OD1-NH2 2.78Å; D257-R492 PolarHBondContact OD1-NH2 3.34Å; D257-R492 VanDerWaalsContact OD1-NH2 3.07Å; D257-R492 IonicContact OD2-CZ 3.07Å; D257-R492 IonicContact OD2-NE 3.86Å; D257-R492 IonicContact OD2-NH2 2.74Å; D257-R492 PolarHBondContact OD2-NH2 3.34Å; E258-R492 WeakPolarHBondContact CB-O 3.4Å; E258-R492 PolarHBondContact N-O 3.39Å; L261-R492 HydrophobicContact CD1-CB 3.71Å; L261-R492 VanDerWaalsContact CD1-O 3.29Å; L261-R492 WeakPolarHBondContact CD1-O 3.37Å; Q266-R492 VanDerWaalsContact NE2-NH2 3.16Å
493	T	83.9	Confident	81.8	Confident	48 Å²	48	50.6 Å²	50.6	29%	0.294	27%	0.266	S	S	.	.			trans	-92.3	164.7	176.3	57	0	0	0	0	111.1	E258 D495 V496	E258-T493 WeakPolarHBondContact OE2-CA 3.31Å; T493-D495 VanDerWaalsContact CB-OD2 3.29Å; T493-D495 WeakPolarHBondContact CB-OD2 3.44Å; T493-D495 PolarHBondContact O-N 3.08Å; T493-D495 PolarHBondContact OG1-OD2 3.07Å; T493-V496 WeakPolarHBondContact O-CG2 3.44Å; T493-V496 PolarHBondContact O-N 2.72Å
494	C	79.1	Confident	82.1	Confident	12 Å²	12	48.6 Å²	48.6	8%	0.081	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-65.4	-13.6	176.5	-77	0	0	0	0	113.8	E258 V496 I497 A498 W785	E258-C494 VanDerWaalsContact CG-SG 3.59Å; E258-C494 PolarHBondContact OE2-N 2.76Å; C494-V496 PolarHBondContact O-N 3.44Å; C494-V496 VanDerWaalsContact O-N 3.1Å; C494-I497 PolarHBondContact O-N 2.73Å; C494-A498 PolarHBondContact O-N 3.02Å; C494-W785 HydrophobicContact CB-CH2 4.18Å; C494-W785 HydrophobicContact CB-CZ3 3.6Å
495	D	77.7	Confident	82.4	Confident	88 Å²	88	50.2 Å²	50.2	47%	0.471	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-56.1	-28.3	176.3	-48.4	-42.8	0	0	0	112.2	T493 I497 A498 P499	T493-D495 VanDerWaalsContact CB-OD2 3.29Å; T493-D495 WeakPolarHBondContact CB-OD2 3.44Å; T493-D495 PolarHBondContact O-N 3.08Å; T493-D495 PolarHBondContact OG1-OD2 3.07Å; D495-I497 PolarHBondContact O-N 2.93Å; D495-A498 PolarHBondContact O-N 3.5Å; D495-P499 WeakPolarHBondContact O-CD 3.49Å
496	V	79.6	Confident	82.6	Confident	77 Å²	77	52.5 Å²	52.5	47%	0.467	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-63.4	-28.8	176.2	-176.4	0	0	0	0	112.5	H221 T493 C494	H221-V496 HydrophobicContact CB-CG1 3.73Å; T493-V496 WeakPolarHBondContact O-CG2 3.44Å; T493-V496 PolarHBondContact O-N 2.72Å; C494-V496 PolarHBondContact O-N 3.44Å; C494-V496 VanDerWaalsContact O-N 3.1Å
497	I	78.4	Confident	82.9	Confident	18 Å²	18	50.6 Å²	50.6	9%	0.092	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-14.3	177.9	-47.8	-173.8	0	0	0	111.3	H221 L261 C494 D495 P499 K500 L501	H221-I497 VanDerWaalsContact CE1-CD1 3.45Å; H221-I497 WeakPolarHBondContact CE1-CD1 3.5Å; L261-I497 HydrophobicContact CD2-CD1 3.3Å; L261-I497 HydrophobicContact CD2-CG1 3.56Å; C494-I497 PolarHBondContact O-N 2.73Å; D495-I497 PolarHBondContact O-N 2.93Å; I497-P499 VanDerWaalsContact C-N 3.28Å; I497-P499 VanDerWaalsContact O-N 3.09Å; I497-K500 HydrophobicContact CG2-CB 4.37Å; I497-K500 WeakPolarHBondContact O-CA 3.45Å; I497-K500 WeakPolarHBondContact O-CB 3.31Å; I497-K500 PolarHBondContact O-N 3.08Å; I497-L501 HydrophobicContact CB-CD1 4.16Å; I497-L501 HydrophobicContact CG2-CD1 3.98Å; I497-L501 HydrophobicContact CG2-CD2 4.49Å; I497-L501 HydrophobicContact CG2-CG 3.96Å; I497-L501 PolarHBondContact O-N 3.4Å
498	A	72.8	Confident	83.2	Confident	36 Å²	36	50.3 Å²	50.3	30%	0.298	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-47.5	-41.1	-177.4	0	0	0	0	0	114.2	C494 D495 K500 L501 W785	C494-A498 PolarHBondContact O-N 3.02Å; D495-A498 PolarHBondContact O-N 3.5Å; A498-K500 PolarHBondContact O-N 3.4Å; A498-L501 PolarHBondContact O-N 2.84Å; A498-W785 HydrophobicContact CB-CH2 4.31Å
499	P	77	Confident	83.4	Confident	119 Å²	119	50.6 Å²	50.6	77%	0.773	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-61.6	-13.6	176.6	-23.9	34.1	0	0	0	115.6	D495 I497	D495-P499 WeakPolarHBondContact O-CD 3.49Å; I497-P499 VanDerWaalsContact C-N 3.28Å; I497-P499 VanDerWaalsContact O-N 3.09Å
500	K	75.1	Confident	83.4	Confident	141 Å²	141	50.7 Å²	50.7	61%	0.613	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-109.8	-5.4	179.4	-60.3	-175.7	-176.2	-174.1	0	113	I497 A498	I497-K500 HydrophobicContact CG2-CB 4.37Å; I497-K500 WeakPolarHBondContact O-CA 3.45Å; I497-K500 WeakPolarHBondContact O-CB 3.31Å; I497-K500 PolarHBondContact O-N 3.08Å; A498-K500 PolarHBondContact O-N 3.4Å
501	L	78.4	Confident	83.3	Confident	29 Å²	29	49.1 Å²	49.1	15%	0.152	26%	0.261	C	S	.	.	S	Bend	trans	-100.2	163.8	178.4	-67.8	169.3	0	0	0	109.4	I497 A498 W785 P787	I497-L501 HydrophobicContact CB-CD1 4.16Å; I497-L501 HydrophobicContact CG2-CD1 3.98Å; I497-L501 HydrophobicContact CG2-CD2 4.49Å; I497-L501 HydrophobicContact CG2-CG 3.96Å; I497-L501 PolarHBondContact O-N 3.4Å; A498-L501 PolarHBondContact O-N 2.84Å; L501-W785 HydrophobicContact CB-CZ2 3.69Å; L501-W785 HydrophobicContact CD1-CD2 4.11Å; L501-W785 HydrophobicContact CD1-CE3 4.27Å; L501-W785 HydrophobicContact CD1-CH2 3.75Å; L501-W785 HydrophobicContact CD1-CZ2 3.53Å; L501-W785 HydrophobicContact CD1-CZ3 4.12Å; L501-W785 HydrophobicContact CG-CZ2 4.24Å; L501-P787 HydrophobicContact CD2-CG 4.44Å
502	T	82.9	Confident	83.2	Confident	33 Å²	33	49.1 Å²	49.1	20%	0.202	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-71.8	161.1	170.9	52.8	0	0	0	0	110.8	W785 Q789 R791	T502-W785 PolarHBondContact O-NE1 2.92Å; T502-Q789 WeakPolarHBondContact OG1-CG 3.45Å; T502-R791 VanDerWaalsContact CB-O 3.26Å; T502-R791 WeakPolarHBondContact CB-O 3.3Å; T502-R791 PolarHBondContact OG1-O 3.3Å
503	D	84.6	Confident	83.1	Confident	130 Å²	130	49.4 Å²	49.4	70%	0.695	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-59.3	140.2	176.6	-60.1	-41.8	0	0	0	111.2	S792 V793	D503-S792 WeakPolarHBondContact O-CA 3.37Å; D503-V793 PolarHBondContact O-N 2.87Å
504	K	85.8	Confident	83.2	Confident	69 Å²	69	48.1 Å²	48.1	30%	0.3	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	123.5	179.3	175.7	-166.9	168.8	-159.1	0	108	E506 W785 V793 L795	K504-E506 WeakPolarHBondContact CE-OE1 3.18Å; K504-E506 IonicContact NZ-OE1 3.81Å; K504-E506 PolarHBondContact NZ-OE1 3.3Å; K504-W785 HydrophobicContact CB-CD2 4.22Å; K504-W785 HydrophobicContact CB-CG 4.36Å; K504-W785 HydrophobicContact CB-CZ2 4.24Å; K504-W785 HydrophobicContact CD-CD2 3.82Å; K504-W785 HydrophobicContact CD-CE3 3.8Å; K504-W785 HydrophobicContact CD-CG 4.24Å; K504-W785 HydrophobicContact CD-CH2 4.46Å; K504-W785 HydrophobicContact CD-CZ2 4.5Å; K504-W785 HydrophobicContact CD-CZ3 4.11Å; K504-W785 HydrophobicContact CG-CD2 4.42Å; K504-W785 HydrophobicContact CG-CG 4.47Å; K504-V793 WeakPolarHBondContact CA-O 3.43Å; K504-L795 HydrophobicContact CD-CD1 4.37Å; K504-L795 HydrophobicContact CG-CD1 4.31Å
505	T	87.3	Confident	83.4	Confident	34 Å²	34	56.2 Å²	56.2	21%	0.209	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	137.3	174.6	55.6	0	0	0	0	109.4	V793 N794 L795	T505-V793 PolarHBondContact N-O 3.23Å; T505-V793 PolarHBondContact OG1-O 2.99Å; T505-N794 WeakPolarHBondContact OG1-CA 3.2Å; T505-N794 PolarHBondContact OG1-OD1 3.38Å; T505-L795 PolarHBondContact O-N 3.04Å
506	E	88.2	Confident	83.8	Confident	49 Å²	49	52.7 Å²	52.7	23%	0.229	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.4	174.5	-65.4	-163.5	-173.9	0	0	109.9	K504 L795 L956	K504-E506 WeakPolarHBondContact CE-OE1 3.18Å; K504-E506 IonicContact NZ-OE1 3.81Å; K504-E506 PolarHBondContact NZ-OE1 3.3Å; E506-L795 WeakPolarHBondContact CA-O 3.49Å; E506-L795 HydrophobicContact CG-CB 4.25Å; E506-L795 HydrophobicContact CG-CD1 4.04Å; E506-L956 PolarHBondContact O-N 3.39Å
507	H	89.4	Confident	84.1	Confident	24 Å²	24	49 Å²	49	11%	0.111	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	130.1	179.8	-60.2	-77.5	0	0	0	110	L509 L795 Y796 R797	H507-L509 HydrophobicContact CB-CD2 4.48Å; H507-L795 PolarHBondContact N-O 3.41Å; H507-Y796 HydrophobicContact CB-CD1 3.61Å; H507-Y796 HydrophobicContact CB-CE1 3.83Å; H507-Y796 HydrophobicContact CB-CG 4.48Å; H507-Y796 AromaticContact CD2-CE1 3.69Å; H507-Y796 AromaticContact CD2-CZ 3.98Å; H507-Y796 AromaticContact CG-CE1 3.86Å; H507-Y796 CarbonylContact O-C 3.53Å; H507-Y796 WeakPolarHBondContact O-CA 3.31Å; H507-R797 PolarHBondContact O-N 2.9Å
508	V	89.1	Confident	84.4	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.024	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	116	169.9	-173.9	0	0	0	0	107.5	F510 R797 V799 F809 F954 L956	V508-F510 HydrophobicContact CB-CE2 4.35Å; V508-F510 HydrophobicContact CG1-CD2 4.31Å; V508-F510 HydrophobicContact CG1-CE2 3.74Å; V508-F510 HydrophobicContact CG1-CZ 3.92Å; V508-R797 HydrophobicContact CG2-CB 4.47Å; V508-V799 HydrophobicContact CG1-CG2 4Å; V508-F809 HydrophobicContact CG1-CE1 4.5Å; V508-F809 HydrophobicContact CG1-CE2 4.4Å; V508-F809 HydrophobicContact CG1-CZ 4.21Å; V508-F809 HydrophobicContact CG2-CE2 4.19Å; V508-F809 HydrophobicContact CG2-CZ 4.01Å; V508-F954 PolarHBondContact N-O 3.1Å; V508-F954 PolarHBondContact O-N 3.23Å; V508-L956 HydrophobicContact CG2-CD1 3.73Å; V508-L956 HydrophobicContact CG2-CG 4.36Å
509	L	89.5	Confident	85	Confident	7 Å²	7	53.7 Å²	53.7	4%	0.037	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	114.9	-179.2	-55	-175.3	0	0	0	108.7	H507 V645 M649 Y796 R797 L798 V799 L953	H507-L509 HydrophobicContact CB-CD2 4.48Å; L509-V645 HydrophobicContact CD1-CG1 4.3Å; L509-M649 HydrophobicContact CD1-CE 4.2Å; L509-M649 HydrophobicContact CD1-SD 3.74Å; L509-Y796 HydrophobicContact CD1-CD1 3.78Å; L509-Y796 HydrophobicContact CD1-CE1 4.49Å; L509-Y796 HydrophobicContact CD2-CD1 4.44Å; L509-Y796 HydrophobicContact CG-CD1 4.17Å; L509-R797 PolarHBondContact N-O 3.18Å; L509-L798 HydrophobicContact CB-CD2 3.87Å; L509-L798 HydrophobicContact CD1-CD2 3.64Å; L509-L798 HydrophobicContact CG-CD2 4.2Å; L509-V799 PolarHBondContact O-N 3.42Å; L509-L953 HydrophobicContact CD2-CD2 3.2Å; L509-L953 HydrophobicContact CD2-CG 3.7Å
510	F	88.5	Confident	85.4	Confident	11 Å²	11	48 Å²	48	5%	0.048	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	109.6	172.1	-66	-91.4	0	0	0	108.6	V508 V799 A801 E806 F809 F954	V508-F510 HydrophobicContact CB-CE2 4.35Å; V508-F510 HydrophobicContact CG1-CD2 4.31Å; V508-F510 HydrophobicContact CG1-CE2 3.74Å; V508-F510 HydrophobicContact CG1-CZ 3.92Å; F510-V799 CarbonylContact C-O 3.58Å; F510-V799 WeakPolarHBondContact CA-O 3.2Å; F510-V799 HydrophobicContact CD1-CB 4.24Å; F510-V799 HydrophobicContact CD1-CG1 4.14Å; F510-V799 HydrophobicContact CE1-CB 4.4Å; F510-V799 HydrophobicContact CE1-CG1 4.12Å; F510-A801 HydrophobicContact CB-CB 4.23Å; F510-E806 HydrophobicContact CD1-CG 4.5Å; F510-E806 HydrophobicContact CE1-CG 3.96Å; F510-E806 VanDerWaalsContact CE1-OE1 3.22Å; F510-E806 WeakPolarHBondContact CE1-OE1 3.47Å; F510-F809 HydrophobicContact CZ-CE1 4.42Å; F510-F954 AromaticContact CD2-CD2 3.42Å; F510-F954 HydrophobicContact CD2-CD2 3.42Å; F510-F954 VanDerWaalsContact CD2-CD2 3.42Å; F510-F954 AromaticContact CD2-CE2 3.74Å; F510-F954 HydrophobicContact CD2-CE2 3.74Å; F510-F954 AromaticContact CE2-CD2 3.46Å; F510-F954 HydrophobicContact CE2-CD2 3.46Å; F510-F954 VanDerWaalsContact CE2-CD2 3.46Å; F510-F954 AromaticContact CE2-CE2 3.93Å; F510-F954 HydrophobicContact CE2-CE2 3.93Å; F510-F954 HydrophobicContact CE2-CG 4.28Å
511	C	87.2	Confident	85.8	Confident	1 Å²	1	42 Å²	42	1%	0.007	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.6	-179.7	-52.8	0	0	0	0	109.2	K642 V645 V799 T800 A801	C511-K642 HydrophobicContact CB-CG 4.17Å; C511-V645 HydrophobicContact CB-CG2 4.21Å; C511-V799 PolarHBondContact N-O 3.02Å; C511-T800 WeakPolarHBondContact O-CA 3.4Å; C511-A801 PolarHBondContact O-N 3.45Å
512	R	85.5	Confident	86	Confident	76 Å²	76	42.7 Å²	42.7	29%	0.287	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-67.2	134.6	174.1	-65.8	-170.1	-173.4	138.9	2.2	110.7	G641 S949 N950	R512-G641 VanDerWaalsContact O-CA 3.23Å; R512-G641 WeakPolarHBondContact O-CA 3.35Å; R512-S949 PolarHBondContact NH1-O 3.46Å; R512-S949 PolarHBondContact NH1-OG 2.94Å; R512-S949 PolarHBondContact NH2-O 3.41Å; R512-N950 PolarHBondContact NH1-OD1 3.17Å
513	P	84.9	Confident	86	Confident	32 Å²	32	42.9 Å²	42.9	21%	0.208	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-64.2	152	173.6	27.4	-33.1	0	0	0	110.8	Q517 T800	P513-Q517 HydrophobicContact CB-CB 3.86Å; P513-T800 HydrophobicContact CB-CG2 4.01Å; P513-T800 HydrophobicContact CG-CG2 4.41Å
514	S	85.6	Confident	85.9	Confident	20 Å²	20	36.7 Å²	36.7	14%	0.14	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-68	164.1	170.3	70.2	0	0	0	0	111.2	L516 Q517 T518 L639	S514-L516 VanDerWaalsContact C-N 3.3Å; S514-L516 PolarHBondContact O-N 2.87Å; S514-Q517 PolarHBondContact O-N 3.46Å; S514-Q517 VanDerWaalsContact O-N 3.1Å; S514-Q517 WeakPolarHBondContact OG-CB 3.41Å; S514-Q517 VanDerWaalsContact OG-CG 3.31Å; S514-Q517 WeakPolarHBondContact OG-CG 3.22Å; S514-Q517 PolarHBondContact OG-N 2.91Å; S514-Q517 VanDerWaalsContact OG-N 3.08Å; S514-T518 PolarHBondContact O-N 2.94Å; S514-T518 PolarHBondContact O-OG1 2.95Å; S514-L639 WeakPolarHBondContact CB-O 3.27Å; S514-L639 PolarHBondContact OG-O 2.98Å
515	K	84.7	Confident	85.6	Confident	183 Å²	183	33.7 Å²	33.7	80%	0.796	18%	0.175	S	C	*	.	H	α-helix	trans	-53.8	-49.5	174.7	-68.3	-177.4	179.8	177.4	0	110.6	Q517 T518 D519	K515-Q517 VanDerWaalsContact C-N 3.35Å; K515-Q517 PolarHBondContact O-N 3.18Å; K515-T518 WeakPolarHBondContact O-CB 3.35Å; K515-T518 PolarHBondContact O-N 2.76Å; K515-T518 VanDerWaalsContact O-N 3.1Å; K515-D519 VanDerWaalsContact O-CG 3.32Å; K515-D519 PolarHBondContact O-N 3.25Å
516	L	84.4	Confident	85.1	Confident	14 Å²	14	38 Å²	38	7%	0.073	19%	0.193	C	C	.	.	H	α-helix	trans	-57.7	-42.3	175.3	-177.4	68	0	0	0	113.1	S514 T518 D519 L520 P584 E620 L623 L639	S514-L516 VanDerWaalsContact C-N 3.3Å; S514-L516 PolarHBondContact O-N 2.87Å; L516-T518 VanDerWaalsContact C-N 3.33Å; L516-D519 PolarHBondContact O-N 2.69Å; L516-L520 HydrophobicContact CD1-CD1 4.17Å; L516-L520 HydrophobicContact CD1-CG 4.4Å; L516-L520 HydrophobicContact CG-CD1 3.96Å; L516-L520 WeakPolarHBondContact O-CB 3.39Å; L516-L520 VanDerWaalsContact O-CG 3.24Å; L516-L520 WeakPolarHBondContact O-CG 3.49Å; L516-L520 PolarHBondContact O-N 3.04Å; L516-L520 VanDerWaalsContact O-N 3.08Å; L516-P584 HydrophobicContact CD2-CB 4.02Å; L516-P584 HydrophobicContact CD2-CG 4.08Å; L516-E620 HydrophobicContact CD1-CG 4.1Å; L516-E620 HydrophobicContact CD2-CG 4.03Å; L516-L623 HydrophobicContact CD2-CD1 3.88Å; L516-L639 HydrophobicContact CD2-CD2 4.03Å
517	Q	87.1	Confident	84.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.8	-42.5	176.9	-78.6	178.4	-50.7	0	0	111.5	P513 S514 K515 L520 E521 L580 H581 P584 S640 G641	P513-Q517 HydrophobicContact CB-CB 3.86Å; S514-Q517 PolarHBondContact O-N 3.46Å; S514-Q517 VanDerWaalsContact O-N 3.1Å; S514-Q517 WeakPolarHBondContact OG-CB 3.41Å; S514-Q517 VanDerWaalsContact OG-CG 3.31Å; S514-Q517 WeakPolarHBondContact OG-CG 3.22Å; S514-Q517 PolarHBondContact OG-N 2.91Å; S514-Q517 VanDerWaalsContact OG-N 3.08Å; K515-Q517 VanDerWaalsContact C-N 3.35Å; K515-Q517 PolarHBondContact O-N 3.18Å; Q517-L520 PolarHBondContact O-N 2.91Å; Q517-E521 WeakPolarHBondContact O-CB 3.45Å; Q517-E521 PolarHBondContact O-N 3.27Å; Q517-L580 HydrophobicContact CG-CD1 4.22Å; Q517-L580 PolarHBondContact NE2-O 3.26Å; Q517-H581 PolarHBondContact NE2-O 3.41Å; Q517-P584 HydrophobicContact CG-CG 3.9Å; Q517-S640 PolarHBondContact NE2-OG 2.65Å; Q517-G641 VanDerWaalsContact OE1-N 3.1Å
518	T	85.3	Confident	83.7	Confident	66 Å²	66	36.6 Å²	36.6	41%	0.405	19%	0.185	S	C	.	.	H	α-helix	trans	-62.8	-44.7	179.2	-52.1	0	0	0	0	111.2	S514 K515 L516 E521 A522	S514-T518 PolarHBondContact O-N 2.94Å; S514-T518 PolarHBondContact O-OG1 2.95Å; K515-T518 WeakPolarHBondContact O-CB 3.35Å; K515-T518 PolarHBondContact O-N 2.76Å; K515-T518 VanDerWaalsContact O-N 3.1Å; L516-T518 VanDerWaalsContact C-N 3.33Å; T518-E521 PolarHBondContact O-N 3.45Å; T518-A522 WeakPolarHBondContact O-CB 3.39Å; T518-A522 PolarHBondContact O-N 2.71Å
519	D	84.4	Confident	82.8	Confident	86 Å²	86	39.1 Å²	39.1	46%	0.46	20%	0.198	S	C	.	.	H	α-helix	trans	-64.5	-44.7	179.5	-64.4	-24	0	0	0	111.8	K515 L516 E521 A522 I523	K515-D519 VanDerWaalsContact O-CG 3.32Å; K515-D519 PolarHBondContact O-N 3.25Å; L516-D519 PolarHBondContact O-N 2.69Å; D519-E521 VanDerWaalsContact C-N 3.32Å; D519-E521 PolarHBondContact O-N 3.44Å; D519-A522 PolarHBondContact O-N 2.76Å; D519-I523 WeakPolarHBondContact O-CG1 3.5Å; D519-I523 PolarHBondContact O-N 3.19Å
520	L	84.9	Confident	81.9	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-37.3	176.3	-68.3	170.2	0	0	0	111.8	L516 Q517 I523 L524 L580 P584 L587 L613 L616 L617	L516-L520 HydrophobicContact CD1-CD1 4.17Å; L516-L520 HydrophobicContact CD1-CG 4.4Å; L516-L520 HydrophobicContact CG-CD1 3.96Å; L516-L520 WeakPolarHBondContact O-CB 3.39Å; L516-L520 VanDerWaalsContact O-CG 3.24Å; L516-L520 WeakPolarHBondContact O-CG 3.49Å; L516-L520 PolarHBondContact O-N 3.04Å; L516-L520 VanDerWaalsContact O-N 3.08Å; Q517-L520 PolarHBondContact O-N 2.91Å; L520-I523 PolarHBondContact O-N 3.44Å; L520-L524 WeakPolarHBondContact O-CG 3.3Å; L520-L524 PolarHBondContact O-N 3.33Å; L520-L524 VanDerWaalsContact O-N 3.09Å; L520-L580 HydrophobicContact CB-CD1 3.83Å; L520-L580 HydrophobicContact CB-CD2 3.74Å; L520-L580 HydrophobicContact CB-CG 4.45Å; L520-L580 HydrophobicContact CD1-CD1 3.57Å; L520-L580 HydrophobicContact CG-CD1 4.37Å; L520-P584 HydrophobicContact CD1-CB 4.47Å; L520-L587 HydrophobicContact CD1-CD2 4.45Å; L520-L613 HydrophobicContact CD2-CD2 3.7Å; L520-L616 HydrophobicContact CD2-CB 4.03Å; L520-L617 HydrophobicContact CD1-CD2 3.62Å; L520-L617 HydrophobicContact CD1-CG 4.18Å; L520-L617 HydrophobicContact CD2-CG 4.21Å
521	E	84.1	Confident	80.9	Confident	14 Å²	14	46.2 Å²	46.2	7%	0.065	23%	0.234	C	C	.	.	H	α-helix	trans	-66.5	-40.1	177	-166.9	171.6	-179.3	0	0	111.6	Q517 T518 D519 I523 L524 T525 F577 L580 H581 G803	Q517-E521 WeakPolarHBondContact O-CB 3.45Å; Q517-E521 PolarHBondContact O-N 3.27Å; T518-E521 PolarHBondContact O-N 3.45Å; D519-E521 VanDerWaalsContact C-N 3.32Å; D519-E521 PolarHBondContact O-N 3.44Å; E521-I523 PolarHBondContact O-N 3.02Å; E521-L524 PolarHBondContact O-N 3.46Å; E521-T525 VanDerWaalsContact O-CB 3.28Å; E521-T525 WeakPolarHBondContact O-CB 3.39Å; E521-T525 PolarHBondContact O-N 3.14Å; E521-T525 PolarHBondContact O-OG1 3.3Å; E521-F577 HydrophobicContact CG-CD1 4.12Å; E521-F577 HydrophobicContact CG-CE1 3.71Å; E521-L580 HydrophobicContact CB-CD2 4.12Å; E521-H581 IonicContact OE1-CE1 3.62Å; E521-H581 PolarHBondContact OE1-CE1 3.24Å; E521-H581 IonicContact OE1-NE2 3.91Å; E521-H581 IonicContact OE2-CE1 3.81Å; E521-H581 PolarHBondContact OE2-CE1 3.23Å; E521-H581 IonicContact OE2-ND1 3.82Å; E521-G803 VanDerWaalsContact OE1-CA 3.29Å; E521-G803 WeakPolarHBondContact OE1-CA 3.35Å
522	A	82.9	Confident	79.7	Confident	43 Å²	43	47.1 Å²	47.1	36%	0.355	24%	0.238	S	C	.	.	H	α-helix	trans	-60.7	-43.4	175.4	0	0	0	0	0	111.7	T518 D519 T525 Q526	T518-A522 WeakPolarHBondContact O-CB 3.39Å; T518-A522 PolarHBondContact O-N 2.71Å; D519-A522 PolarHBondContact O-N 2.76Å; A522-T525 PolarHBondContact O-N 3.02Å; A522-Q526 WeakPolarHBondContact O-CB 3.48Å; A522-Q526 PolarHBondContact O-N 3.13Å
523	I	82.4	Confident	78.3	Confident	37 Å²	37	48.4 Å²	48.4	19%	0.19	25%	0.25	C	S	.	.	H	α-helix	trans	-65.1	-46.7	178.1	-67.6	166.7	0	0	0	111.5	D519 L520 E521 T525 Q526 W527 L613 L616	D519-I523 WeakPolarHBondContact O-CG1 3.5Å; D519-I523 PolarHBondContact O-N 3.19Å; L520-I523 PolarHBondContact O-N 3.44Å; E521-I523 PolarHBondContact O-N 3.02Å; I523-T525 VanDerWaalsContact C-N 3.27Å; I523-T525 PolarHBondContact O-N 3.48Å; I523-Q526 PolarHBondContact O-N 3.22Å; I523-W527 PolarHBondContact O-N 3.11Å; I523-L613 HydrophobicContact CB-CD2 4.37Å; I523-L613 HydrophobicContact CG2-CD2 4.02Å; I523-L616 HydrophobicContact CD1-CD1 3.03Å
524	L	82	Confident	76.5	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-60.1	-41.2	176.6	-73.7	172.2	0	0	0	111.3	L520 E521 M528 A576 F577 L580 L609 L613	L520-L524 WeakPolarHBondContact O-CG 3.3Å; L520-L524 PolarHBondContact O-N 3.33Å; L520-L524 VanDerWaalsContact O-N 3.09Å; E521-L524 PolarHBondContact O-N 3.46Å; L524-M528 WeakPolarHBondContact O-CG 3.48Å; L524-M528 PolarHBondContact O-N 2.8Å; L524-A576 HydrophobicContact CD2-CB 4.49Å; L524-F577 HydrophobicContact CB-CD1 4.47Å; L524-F577 HydrophobicContact CB-CD2 4.43Å; L524-F577 HydrophobicContact CB-CE1 3.75Å; L524-F577 HydrophobicContact CB-CE2 3.7Å; L524-F577 HydrophobicContact CB-CZ 3.32Å; L524-F577 HydrophobicContact CD1-CD1 4.05Å; L524-F577 HydrophobicContact CD1-CD2 4.29Å; L524-F577 HydrophobicContact CD1-CE1 4.15Å; L524-F577 HydrophobicContact CD1-CE2 4.36Å; L524-F577 HydrophobicContact CD1-CG 4.14Å; L524-F577 HydrophobicContact CD1-CZ 4.31Å; L524-F577 HydrophobicContact CG-CZ 4.42Å; L524-L580 HydrophobicContact CD1-CD2 3.87Å; L524-L609 HydrophobicContact CD2-CD1 4.27Å; L524-L609 HydrophobicContact CD2-CD2 4.11Å; L524-L613 HydrophobicContact CD2-CD1 3.77Å; L524-L613 HydrophobicContact CD2-CD2 4.43Å; L524-L613 HydrophobicContact CG-CD1 4.45Å; L524-L613 HydrophobicContact CG-CD2 4.27Å
525	T	79.4	Confident	74.6	Confident	6 Å²	6	53.7 Å²	53.7	4%	0.037	28%	0.278	C	S	.	.	H	α-helix	trans	-68.6	-43.9	179.7	-58.8	0	0	0	0	111.7	E521 A522 I523 W527 M528 N529 F859 L861	E521-T525 VanDerWaalsContact O-CB 3.28Å; E521-T525 WeakPolarHBondContact O-CB 3.39Å; E521-T525 PolarHBondContact O-N 3.14Å; E521-T525 PolarHBondContact O-OG1 3.3Å; A522-T525 PolarHBondContact O-N 3.02Å; I523-T525 VanDerWaalsContact C-N 3.27Å; I523-T525 PolarHBondContact O-N 3.48Å; T525-W527 VanDerWaalsContact C-N 3.32Å; T525-W527 PolarHBondContact O-N 3.41Å; T525-M528 PolarHBondContact O-N 3.45Å; T525-N529 WeakPolarHBondContact O-CB 3.44Å; T525-N529 PolarHBondContact O-N 2.91Å; T525-N529 PolarHBondContact O-ND2 3.01Å; T525-F859 WeakPolarHBondContact CG2-O 3.42Å; T525-L861 HydrophobicContact CG2-CD1 4.1Å; T525-L861 HydrophobicContact CG2-CG 4.17Å
526	Q	78.2	Confident	72.4	Confident	123 Å²	123	54 Å²	54	58%	0.575	27%	0.274	S	S	*	.	H	α-helix	trans	-59.7	-44.1	176.4	-174.2	-177.8	12.2	0	0	111.1	A522 I523 N529 N530	A522-Q526 WeakPolarHBondContact O-CB 3.48Å; A522-Q526 PolarHBondContact O-N 3.13Å; I523-Q526 PolarHBondContact O-N 3.22Å; Q526-N529 PolarHBondContact O-N 3.49Å; Q526-N530 PolarHBondContact O-N 3.44Å; Q526-N530 PolarHBondContact O-ND2 3.23Å
527	W	75.1	Confident	70.3	Confident	42 Å²	42	57.2 Å²	57.2	16%	0.159	30%	0.298	C	S	.	.	H	α-helix	trans	-63.3	-44.5	177.6	-173.9	83.5	0	0	0	112.3	I523 T525 N529 N530 E531 V573 P606 L609	I523-W527 PolarHBondContact O-N 3.11Å; T525-W527 VanDerWaalsContact C-N 3.32Å; T525-W527 PolarHBondContact O-N 3.41Å; W527-N529 VanDerWaalsContact C-N 3.35Å; W527-N529 PolarHBondContact O-N 3.07Å; W527-N530 WeakPolarHBondContact O-CB 3.24Å; W527-N530 PolarHBondContact O-N 2.77Å; W527-E531 HydrophobicContact CD2-CG 4.07Å; W527-E531 HydrophobicContact CE3-CG 4.12Å; W527-E531 HydrophobicContact CH2-CG 3.42Å; W527-E531 VanDerWaalsContact CH2-CG 3.42Å; W527-E531 VanDerWaalsContact CZ2-CD 3.46Å; W527-E531 HydrophobicContact CZ2-CG 3.26Å; W527-E531 VanDerWaalsContact CZ2-OE1 3.24Å; W527-E531 WeakPolarHBondContact CZ2-OE1 3.44Å; W527-E531 HydrophobicContact CZ3-CG 3.82Å; W527-E531 PolarHBondContact O-N 3Å; W527-V573 HydrophobicContact CE3-CG2 4.24Å; W527-V573 HydrophobicContact CZ3-CG2 3.7Å; W527-P606 HydrophobicContact CD2-CG 4.4Å; W527-P606 VanDerWaalsContact CE2-CG 3.44Å; W527-P606 HydrophobicContact CH2-CG 3.5Å; W527-P606 VanDerWaalsContact CH2-CG 3.5Å; W527-P606 HydrophobicContact CZ2-CB 4.15Å; W527-P606 HydrophobicContact CZ2-CG 2.95Å; W527-P606 HydrophobicContact CZ3-CG 4.43Å; W527-L609 HydrophobicContact CB-CD1 3.27Å; W527-L609 HydrophobicContact CD2-CD1 3.68Å; W527-L609 HydrophobicContact CE3-CD1 4.19Å; W527-L609 HydrophobicContact CG-CB 4.45Å; W527-L609 HydrophobicContact CG-CD1 3.21Å; W527-L609 HydrophobicContact CG-CG 4.41Å
528	M	72.5	Confident	67.9	Low	3 Å²	3	64.5 Å²	64.5	2%	0.015	33%	0.332	C	S	.	.	H	α-helix	trans	-61	-43.6	176	-76	-64.9	-82.8	0	0	112	L524 T525 N530 E531 F532 I570 V573 F577 F859	L524-M528 WeakPolarHBondContact O-CG 3.48Å; L524-M528 PolarHBondContact O-N 2.8Å; T525-M528 PolarHBondContact O-N 3.45Å; M528-N530 VanDerWaalsContact C-N 3.29Å; M528-N530 PolarHBondContact O-N 2.67Å; M528-E531 PolarHBondContact O-N 2.95Å; M528-F532 HydrophobicContact CB-CD2 4.39Å; M528-F532 HydrophobicContact CB-CE2 4.38Å; M528-F532 HydrophobicContact CE-CD2 4.39Å; M528-F532 HydrophobicContact CE-CE2 3.37Å; M528-F532 HydrophobicContact CE-CZ 3.83Å; M528-F532 WeakPolarHBondContact O-CB 3.28Å; M528-F532 WeakPolarHBondContact O-CD2 3.33Å; M528-F532 PolarHBondContact O-N 3.18Å; M528-F532 HydrophobicContact SD-CE2 4.36Å; M528-I570 HydrophobicContact CE-CG2 4.49Å; M528-V573 HydrophobicContact CE-CG1 4.22Å; M528-V573 HydrophobicContact CG-CG1 3.71Å; M528-V573 HydrophobicContact SD-CB 4.04Å; M528-V573 HydrophobicContact SD-CG1 3.65Å; M528-V573 HydrophobicContact SD-CG2 3.98Å; M528-F577 HydrophobicContact CG-CE2 4.44Å; M528-F859 HydrophobicContact CE-CD2 3.89Å; M528-F859 HydrophobicContact CE-CE1 3.97Å; M528-F859 HydrophobicContact CE-CE2 3.32Å; M528-F859 HydrophobicContact CE-CZ 3.36Å; M528-F859 HydrophobicContact CG-CD1 4.47Å; M528-F859 HydrophobicContact CG-CE1 4.41Å
529	N	70.8	Confident	65.6	Low	57 Å²	57	64.2 Å²	64.2	31%	0.305	33%	0.332	S	S	.	.	H	α-helix	trans	-61.8	-37.8	176.8	-74.8	-28.6	0	0	0	112.1	T525 Q526 W527 N533	T525-N529 WeakPolarHBondContact O-CB 3.44Å; T525-N529 PolarHBondContact O-N 2.91Å; T525-N529 PolarHBondContact O-ND2 3.01Å; Q526-N529 PolarHBondContact O-N 3.49Å; W527-N529 VanDerWaalsContact C-N 3.35Å; W527-N529 PolarHBondContact O-N 3.07Å; N529-N533 WeakPolarHBondContact O-CB 3.39Å; N529-N533 VanDerWaalsContact O-CG 3.27Å; N529-N533 PolarHBondContact O-N 3.34Å; N529-N533 PolarHBondContact O-ND2 3.29Å; N529-N533 VanDerWaalsContact O-ND2 3.16Å
530	N	70.3	Confident	63.2	Low	81 Å²	81	65.3 Å²	65.3	43%	0.433	34%	0.338	S	S	.	.	H	α-helix	trans	-64.8	-49.8	175.7	-69	-19.6	0	0	0	111.2	Q526 W527 M528 F532 N533 L534	Q526-N530 PolarHBondContact O-N 3.44Å; Q526-N530 PolarHBondContact O-ND2 3.23Å; W527-N530 WeakPolarHBondContact O-CB 3.24Å; W527-N530 PolarHBondContact O-N 2.77Å; M528-N530 VanDerWaalsContact C-N 3.29Å; M528-N530 PolarHBondContact O-N 2.67Å; N530-F532 VanDerWaalsContact C-N 3.35Å; N530-F532 PolarHBondContact O-N 3.06Å; N530-N533 PolarHBondContact O-N 2.98Å; N530-N533 VanDerWaalsContact O-N 3.09Å; N530-L534 HydrophobicContact CB-CD1 4.48Å; N530-L534 WeakPolarHBondContact O-CD1 3.12Å; N530-L534 PolarHBondContact O-N 3.31Å
531	E	67	Low	60.9	Low	85 Å²	85	73.4 Å²	73.4	40%	0.397	37%	0.373	S	S	.	.	H	α-helix	trans	-58.8	-43.1	176.3	-76.4	-73.8	149.7	0	0	112.7	W527 M528 N533	W527-E531 HydrophobicContact CD2-CG 4.07Å; W527-E531 HydrophobicContact CE3-CG 4.12Å; W527-E531 HydrophobicContact CH2-CG 3.42Å; W527-E531 VanDerWaalsContact CH2-CG 3.42Å; W527-E531 VanDerWaalsContact CZ2-CD 3.46Å; W527-E531 HydrophobicContact CZ2-CG 3.26Å; W527-E531 VanDerWaalsContact CZ2-OE1 3.24Å; W527-E531 WeakPolarHBondContact CZ2-OE1 3.44Å; W527-E531 HydrophobicContact CZ3-CG 3.82Å; W527-E531 PolarHBondContact O-N 3Å; M528-E531 PolarHBondContact O-N 2.95Å; E531-N533 VanDerWaalsContact C-N 3.27Å; E531-N533 PolarHBondContact O-N 3.43Å
532	F	61.6	Low	58.4	Low	20 Å²	20	80.2 Å²	80.2	9%	0.088	41%	0.409	C	S	.	.	H	α-helix	trans	-70.2	-19.8	177.5	-76.3	-61.7	0	0	0	113.5	M528 N530 S535 I570 R852 L855 F859	M528-F532 HydrophobicContact CB-CD2 4.39Å; M528-F532 HydrophobicContact CB-CE2 4.38Å; M528-F532 HydrophobicContact CE-CD2 4.39Å; M528-F532 HydrophobicContact CE-CE2 3.37Å; M528-F532 HydrophobicContact CE-CZ 3.83Å; M528-F532 WeakPolarHBondContact O-CB 3.28Å; M528-F532 WeakPolarHBondContact O-CD2 3.33Å; M528-F532 PolarHBondContact O-N 3.18Å; M528-F532 HydrophobicContact SD-CE2 4.36Å; N530-F532 VanDerWaalsContact C-N 3.35Å; N530-F532 PolarHBondContact O-N 3.06Å; F532-S535 PolarHBondContact O-OG 3.34Å; F532-I570 HydrophobicContact CE1-CD1 4.5Å; F532-I570 HydrophobicContact CZ-CD1 4.43Å; F532-R852 HydrophobicContact CD1-CG 4.28Å; F532-R852 PolarHBondContact O-NH2 3.15Å; F532-L855 HydrophobicContact CE1-CB 4.2Å; F532-L855 HydrophobicContact CE1-CD1 4.06Å; F532-L855 HydrophobicContact CE2-CB 4.42Å; F532-L855 HydrophobicContact CZ-CB 3.74Å; F532-L855 HydrophobicContact CZ-CD1 3.96Å; F532-L855 HydrophobicContact CZ-CG 4.34Å; F532-F859 HydrophobicContact CE2-CD2 4.05Å; F532-F859 HydrophobicContact CE2-CE2 4.18Å
533	N	56.4	Low	56	Low	103 Å²	103	86 Å²	86	55%	0.551	43%	0.426	S	S	*	.	H	α-helix	trans	-90.4	-31.2	176.8	-75.4	-27.4	0	0	0	112.8	N529 N530 E531 S535 R536	N529-N533 WeakPolarHBondContact O-CB 3.39Å; N529-N533 VanDerWaalsContact O-CG 3.27Å; N529-N533 PolarHBondContact O-N 3.34Å; N529-N533 PolarHBondContact O-ND2 3.29Å; N529-N533 VanDerWaalsContact O-ND2 3.16Å; N530-N533 PolarHBondContact O-N 2.98Å; N530-N533 VanDerWaalsContact O-N 3.09Å; E531-N533 VanDerWaalsContact C-N 3.27Å; E531-N533 PolarHBondContact O-N 3.43Å; N533-S535 VanDerWaalsContact C-N 3.3Å; N533-S535 PolarHBondContact O-N 2.85Å; N533-R536 PolarHBondContact O-N 3.12Å
534	L	47.2	Very low	53.7	Low	123 Å²	123	90.9 Å²	90.9	64%	0.644	45%	0.452	S	S	*	.	H	α-helix	trans	-68.2	-18.9	-178.8	-92.5	122.1	0	0	0	114.9	N530 R536 S537	N530-L534 HydrophobicContact CB-CD1 4.48Å; N530-L534 WeakPolarHBondContact O-CD1 3.12Å; N530-L534 PolarHBondContact O-N 3.31Å; L534-R536 VanDerWaalsContact C-N 3.29Å; L534-R536 PolarHBondContact O-N 3.36Å; L534-S537 PolarHBondContact O-OG 2.94Å
535	S	45.6	Very low	51.3	Low	40 Å²	40	96.6 Å²	96.6	28%	0.28	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-3.6	178.6	51.8	0	0	0	0	115.5	F532 N533 S539 R852	F532-S535 PolarHBondContact O-OG 3.34Å; N533-S535 VanDerWaalsContact C-N 3.3Å; N533-S535 PolarHBondContact O-N 2.85Å; S535-S539 PolarHBondContact O-OG 2.81Å; S535-R852 VanDerWaalsContact OG-CZ 3.23Å; S535-R852 PolarHBondContact OG-NH1 3.23Å; S535-R852 PolarHBondContact OG-NH2 2.82Å
536	R	39.5	Very low	48.9	Very low	191 Å²	191	102.9 Å²	102.9	72%	0.721	52%	0.524	S	S	*	.	H	α-helix	trans	-80.2	-20.7	-176.1	-151	174	140.1	128.7	-1.9	113.4	N533 L534	N533-R536 PolarHBondContact O-N 3.12Å; L534-R536 VanDerWaalsContact C-N 3.29Å; L534-R536 PolarHBondContact O-N 3.36Å
537	S	38.6	Very low	46.7	Very low	81 Å²	81	104 Å²	104	57%	0.566	53%	0.534	S	S	*	.	H	α-helix	trans	-87.2	-24.8	-179.4	43.7	0	0	0	0	114.4	L534	L534-S537 PolarHBondContact O-OG 2.94Å
538	E	38.6	Very low	44.6	Very low	153 Å²	153	109 Å²	109	72%	0.715	56%	0.564	S	S	*	*	H	α-helix	trans	-88.1	-27.9	176	-74	-178.2	157.3	0	0	112.9	L540 K541	E538-L540 VanDerWaalsContact C-N 3.35Å; E538-L540 PolarHBondContact O-N 3.35Å; E538-K541 PolarHBondContact O-N 3.27Å
539	S	36.9	Very low	42.7	Very low	59 Å²	59	114.5 Å²	114.5	41%	0.413	60%	0.601	S	S	.	*	H	α-helix	trans	-68.6	-33.7	178.3	-53.2	0	0	0	0	112.1	S535 K541 L542 F543	S535-S539 PolarHBondContact O-OG 2.81Å; S539-K541 VanDerWaalsContact C-N 3.34Å; S539-K541 PolarHBondContact O-N 3.14Å; S539-L542 PolarHBondContact O-N 3.47Å; S539-F543 VanDerWaalsContact O-CD2 3.27Å; S539-F543 WeakPolarHBondContact O-CD2 3.45Å
540	L	34.1	Very low	40.7	Very low	110 Å²	110	121.3 Å²	121.3	58%	0.576	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-17.9	179.2	-82.8	163	0	0	0	114	E538 L542	E538-L540 VanDerWaalsContact C-N 3.35Å; E538-L540 PolarHBondContact O-N 3.35Å; L540-L542 VanDerWaalsContact C-N 3.3Å
541	K	35.5	Very low	38.9	Very low	170 Å²	170	124.9 Å²	124.9	74%	0.739	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-14.9	172.8	-76.7	-176.2	176.7	-179.3	0	113.1	E538 S539	E538-K541 PolarHBondContact O-N 3.27Å; S539-K541 VanDerWaalsContact C-N 3.34Å; S539-K541 PolarHBondContact O-N 3.14Å
542	L	32.1	Very low	37	Very low	156 Å²	156	126.9 Å²	126.9	82%	0.817	66%	0.658	S	S	*	*	S	Bend	trans	-93	-7.1	178.4	-126.1	96.6	0	0	0	113.8	S539 L540	S539-L542 PolarHBondContact O-N 3.47Å; L540-L542 VanDerWaalsContact C-N 3.3Å
543	F	32.7	Very low	35.7	Very low	164 Å²	164	132.2 Å²	132.2	72%	0.719	69%	0.692	S	S	*	*	S	Bend	trans	-103.4	11.5	177.4	-78.8	-76.9	0	0	0	113	S539	S539-F543 VanDerWaalsContact O-CD2 3.27Å; S539-F543 WeakPolarHBondContact O-CD2 3.45Å
544	L	34.3	Very low	34.4	Very low	141 Å²	141	136.2 Å²	136.2	74%	0.738	71%	0.707	S	S	*	*	S	Bend	trans	-122.9	24.3	-175.7	-73.8	172.5	0	0	0	113.9
545	C	29.9	Very low	33.6	Very low	120 Å²	120	132.7 Å²	132.7	81%	0.811	69%	0.693	S	S	*	*			trans	-129.7	82.5	164.8	-70.4	0	0	0	0	107.9
546	D	29	Very low	32.9	Very low	138 Å²	138	134.4 Å²	134.4	74%	0.738	70%	0.702	S	S	*	*			trans	-67.7	157.9	155.8	-67.1	-45.7	0	0	0	109
547	D	33.7	Very low	32.3	Very low	146 Å²	146	133.3 Å²	133.3	78%	0.781	70%	0.704	S	S	*	*			trans	94.6	109	169.6	-51.4	-30.5	0	0	0	117.9
548	D	31.3	Very low	31.7	Very low	149 Å²	149	131.7 Å²	131.7	80%	0.797	70%	0.701	S	S	*	*			trans	70.9	102.6	146.3	-53	-32.7	0	0	0	120.6
549	C	31	Very low	31.3	Very low	118 Å²	118	128.4 Å²	128.4	80%	0.797	69%	0.687	S	S	*	*				155.3	128.7	125.5	-79.4	0	0	0	0	113.3	D551	C549-D551 VanDerWaalsContact C-N 3.33Å; C549-D551 PolarHBondContact O-N 3.11Å; C549-D551 VanDerWaalsContact O-N 3.12Å
550	E	29.4	Very low	31	Very low	200 Å²	200	129.4 Å²	129.4	94%	0.935	69%	0.694	S	S	*	*	S	Bend	trans	-77.6	28.4	-173.7	-70.3	-157.1	142.3	0	0	117.1
551	D	31.9	Very low	30.9	Very low	156 Å²	156	127.5 Å²	127.5	83%	0.834	69%	0.69	S	S	*	*			trans	-107.8	19.9	-174.3	-78.9	-29.1	0	0	0	115.7	C549	C549-D551 VanDerWaalsContact C-N 3.33Å; C549-D551 PolarHBondContact O-N 3.11Å; C549-D551 VanDerWaalsContact O-N 3.12Å
552	F	28.7	Very low	30.9	Very low	126 Å²	126	122.3 Å²	122.3	55%	0.553	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-93.6	7	-166	-151.1	-100.4	0	0	0	117.2	E554 S555 V556 I559	F552-E554 PolarHBondContact O-N 3.39Å; F552-S555 WeakPolarHBondContact CD1-OG 3.46Å; F552-S555 WeakPolarHBondContact CD2-OG 3.29Å; F552-S555 WeakPolarHBondContact CE1-OG 3.26Å; F552-S555 WeakPolarHBondContact CE2-OG 3.4Å; F552-S555 WeakPolarHBondContact CG-OG 3.38Å; F552-S555 WeakPolarHBondContact CZ-OG 3.07Å; F552-S555 PolarHBondContact O-OG 3.48Å; F552-S555 VanDerWaalsContact O-OG 3.04Å; F552-V556 HydrophobicContact CD1-CG2 3.86Å; F552-V556 HydrophobicContact CE1-CG2 4.09Å; F552-V556 WeakPolarHBondContact O-CG2 3.48Å; F552-I559 HydrophobicContact CE1-CD1 4.11Å; F552-I559 HydrophobicContact CZ-CD1 4.46Å
553	V	33.1	Very low	31.2	Very low	132 Å²	132	123.7 Å²	123.7	80%	0.8	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-74.5	-19.6	-173	-178.7	0	0	0	0	113.7
554	E	29.4	Very low	31.8	Very low	187 Å²	187	119 Å²	119	87%	0.874	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-91.2	-13.2	177.3	-78.6	-174.8	156.1	0	0	114.9	F552	F552-E554 PolarHBondContact O-N 3.39Å
555	S	29.8	Very low	32.5	Very low	50 Å²	50	119.3 Å²	119.3	35%	0.35	65%	0.653	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.7	-10.8	176.8	47.7	0	0	0	0	113.7	F552 E557 G558	F552-S555 WeakPolarHBondContact CD1-OG 3.46Å; F552-S555 WeakPolarHBondContact CD2-OG 3.29Å; F552-S555 WeakPolarHBondContact CE1-OG 3.26Å; F552-S555 WeakPolarHBondContact CE2-OG 3.4Å; F552-S555 WeakPolarHBondContact CG-OG 3.38Å; F552-S555 WeakPolarHBondContact CZ-OG 3.07Å; F552-S555 PolarHBondContact O-OG 3.48Å; F552-S555 VanDerWaalsContact O-OG 3.04Å; S555-E557 PolarHBondContact O-N 3.45Å; S555-G558 PolarHBondContact O-N 2.93Å
556	V	31.6	Very low	33.7	Very low	76 Å²	76	119.2 Å²	119.2	46%	0.461	64%	0.64	S	S	.	*	H	α-helix	trans	-74	-22.6	179.9	175.7	0	0	0	0	112.8	F552 G558 I559	F552-V556 HydrophobicContact CD1-CG2 3.86Å; F552-V556 HydrophobicContact CE1-CG2 4.09Å; F552-V556 WeakPolarHBondContact O-CG2 3.48Å; V556-G558 VanDerWaalsContact C-N 3.28Å; V556-G558 PolarHBondContact O-N 2.88Å; V556-I559 PolarHBondContact O-N 2.82Å
557	E	27.1	Very low	35.1	Very low	167 Å²	167	115.8 Å²	115.8	78%	0.78	62%	0.62	S	S	*	*	H	α-helix	trans	-68.6	-26.6	173.6	-68.8	-164.6	155.6	0	0	112.5	S555	S555-E557 PolarHBondContact O-N 3.45Å
558	G	26	Very low	36.5	Very low	48 Å²	48	109.9 Å²	109.9	50%	0.495	59%	0.589	S	S	.	*	H	α-helix	trans	-71.3	-31.1	174.4	0	0	0	0	0	114.2	S555 V556 S560 S561	S555-G558 PolarHBondContact O-N 2.93Å; V556-G558 VanDerWaalsContact C-N 3.28Å; V556-G558 PolarHBondContact O-N 2.88Å; G558-S560 VanDerWaalsContact C-N 3.29Å; G558-S560 PolarHBondContact O-N 2.95Å; G558-S561 WeakPolarHBondContact O-CB 3.2Å; G558-S561 PolarHBondContact O-N 3.25Å; G558-S561 PolarHBondContact O-OG 3.14Å
559	I	30.4	Very low	38.2	Very low	84 Å²	84	104 Å²	104	43%	0.431	56%	0.561	S	S	.	*	H	α-helix	trans	-76.5	-18.7	-177.5	-58.5	172.5	0	0	0	111.6	F552 V556 S561 S562	F552-I559 HydrophobicContact CE1-CD1 4.11Å; F552-I559 HydrophobicContact CZ-CD1 4.46Å; V556-I559 PolarHBondContact O-N 2.82Å; I559-S561 PolarHBondContact O-N 3.14Å; I559-S562 PolarHBondContact O-N 3.1Å; I559-S562 PolarHBondContact O-OG 2.67Å
560	S	30.4	Very low	40.2	Very low	79 Å²	79	99.8 Å²	99.8	55%	0.552	53%	0.53	S	S	*	.	H	α-helix	trans	-65.7	-21.5	172.6	-58.8	0	0	0	0	112.9	G558 S564	G558-S560 VanDerWaalsContact C-N 3.29Å; G558-S560 PolarHBondContact O-N 2.95Å; S560-S564 PolarHBondContact O-N 3.34Å; S560-S564 PolarHBondContact O-OG 3.39Å
561	S	32.5	Very low	42.4	Very low	71 Å²	71	95.5 Å²	95.5	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-77.9	-24.4	-178.4	74.4	0	0	0	0	114.5	G558 I559 S564	G558-S561 WeakPolarHBondContact O-CB 3.2Å; G558-S561 PolarHBondContact O-N 3.25Å; G558-S561 PolarHBondContact O-OG 3.14Å; I559-S561 PolarHBondContact O-N 3.14Å; S561-S564 PolarHBondContact O-OG 3.48Å; S561-S564 VanDerWaalsContact O-OG 3.04Å
562	S	34.9	Very low	44.5	Very low	60 Å²	60	88.3 Å²	88.3	42%	0.42	47%	0.474	S	S	.	.	H	α-helix	trans	-87.9	-39.8	178.8	62.8	0	0	0	0	112.3	I559 S564 K565 H566	I559-S562 PolarHBondContact O-N 3.1Å; I559-S562 PolarHBondContact O-OG 2.67Å; S562-S564 VanDerWaalsContact C-N 3.29Å; S562-S564 PolarHBondContact O-N 2.8Å; S562-K565 PolarHBondContact O-N 3.33Å; S562-H566 PolarHBondContact O-CD2 2.95Å
563	R	38.9	Very low	46.9	Very low	185 Å²	185	82.3 Å²	82.3	70%	0.698	45%	0.448	S	S	*	.	H	α-helix	trans	-60.3	-36.9	174.5	-77.7	-176.3	173.7	178	-1.5	112.5	K565 H566 H567	R563-K565 VanDerWaalsContact C-N 3.34Å; R563-K565 PolarHBondContact O-N 2.93Å; R563-H566 PolarHBondContact O-N 3.35Å; R563-H567 PolarHBondContact O-CD2 3Å; R563-H567 PolarHBondContact O-N 3.48Å
564	S	44.5	Very low	49.3	Very low	67 Å²	67	76.7 Å²	76.7	47%	0.469	41%	0.413	S	S	.	.	H	α-helix	trans	-64.8	-33.7	179.7	61.1	0	0	0	0	113.5	S560 S561 S562 H567 S568	S560-S564 PolarHBondContact O-N 3.34Å; S560-S564 PolarHBondContact O-OG 3.39Å; S561-S564 PolarHBondContact O-OG 3.48Å; S561-S564 VanDerWaalsContact O-OG 3.04Å; S562-S564 VanDerWaalsContact C-N 3.29Å; S562-S564 PolarHBondContact O-N 2.8Å; S564-H567 PolarHBondContact O-N 3.41Å; S564-S568 PolarHBondContact O-N 3.08Å
565	K	48.2	Very low	51.9	Low	146 Å²	146	70.1 Å²	70.1	64%	0.635	39%	0.386	S	S	*	.	H	α-helix	trans	-67.7	-37.5	177.8	-67.7	179.9	-178.4	176.6	0	113	S562 R563 S568 S569	S562-K565 PolarHBondContact O-N 3.33Å; R563-K565 VanDerWaalsContact C-N 3.34Å; R563-K565 PolarHBondContact O-N 2.93Å; K565-S568 PolarHBondContact O-OG 3.32Å; K565-S569 PolarHBondContact O-N 2.79Å
566	H	56.2	Low	54.5	Low	118 Å²	118	67.7 Å²	67.7	55%	0.546	37%	0.369	S	S	.	.	H	α-helix	trans	-69.3	-38.8	177.6	-71	-71.3	0	0	0	111.7	S562 R563 S569 I570	S562-H566 PolarHBondContact O-CD2 2.95Å; R563-H566 PolarHBondContact O-N 3.35Å; H566-S569 PolarHBondContact O-N 3.5Å; H566-I570 WeakPolarHBondContact O-CD1 3.49Å; H566-I570 WeakPolarHBondContact O-CG1 3.32Å; H566-I570 PolarHBondContact O-N 2.89Å; H566-I570 VanDerWaalsContact O-N 3.13Å
567	H	59	Low	57.2	Low	67 Å²	67	64.2 Å²	64.2	31%	0.31	35%	0.348	S	S	.	.	H	α-helix	trans	-66.8	-38.8	177.7	-74.3	-57.6	0	0	0	113.3	R563 S564 I570 L571 I849	R563-H567 PolarHBondContact O-CD2 3Å; R563-H567 PolarHBondContact O-N 3.48Å; S564-H567 PolarHBondContact O-N 3.41Å; H567-I570 PolarHBondContact O-N 3.4Å; H567-L571 WeakPolarHBondContact O-CG 3.44Å; H567-L571 PolarHBondContact O-N 2.5Å; H567-I849 VanDerWaalsContact CE1-CD1 3.41Å; H567-I849 WeakPolarHBondContact CE1-CD1 3.31Å; H567-I849 WeakPolarHBondContact CE1-CG2 3.41Å; H567-I849 WeakPolarHBondContact NE2-CD1 3.23Å
568	S	61.5	Low	60.1	Low	21 Å²	21	57.5 Å²	57.5	15%	0.147	32%	0.315	C	S	.	.	H	α-helix	trans	-65.1	-41.9	176.5	66.9	0	0	0	0	111.8	S564 K565 I570 L571 S572 A602 D603	S564-S568 PolarHBondContact O-N 3.08Å; K565-S568 PolarHBondContact O-OG 3.32Å; S568-I570 PolarHBondContact O-N 3.33Å; S568-L571 PolarHBondContact O-N 3.21Å; S568-S572 PolarHBondContact O-N 2.77Å; S568-S572 VanDerWaalsContact O-N 3.08Å; S568-A602 WeakPolarHBondContact CB-O 3.49Å; S568-A602 PolarHBondContact OG-O 3.5Å; S568-D603 WeakPolarHBondContact CB-OD1 3.33Å
569	S	67.2	Low	63.1	Low	27 Å²	27	56 Å²	56	19%	0.189	30%	0.295	C	S	.	.	H	α-helix	trans	-59.4	-46.4	175.8	-173.8	0	0	0	0	112.1	K565 H566 L571 S572 V573	K565-S569 PolarHBondContact O-N 2.79Å; H566-S569 PolarHBondContact O-N 3.5Å; S569-L571 VanDerWaalsContact C-N 3.35Å; S569-L571 PolarHBondContact O-N 3.05Å; S569-S572 WeakPolarHBondContact O-CB 3.37Å; S569-S572 PolarHBondContact O-N 2.83Å; S569-S572 VanDerWaalsContact O-N 3.16Å; S569-S572 PolarHBondContact O-OG 2.78Å; S569-V573 WeakPolarHBondContact O-CG2 3.48Å; S569-V573 PolarHBondContact O-N 2.87Å; S569-V573 VanDerWaalsContact O-N 3.09Å
570	I	73.6	Confident	65.9	Low	29 Å²	29	52 Å²	52	15%	0.149	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-42.1	179.5	-67.2	162.1	0	0	0	111.6	M528 F532 H566 H567 S568 S572 V573 I574 L855	M528-I570 HydrophobicContact CE-CG2 4.49Å; F532-I570 HydrophobicContact CE1-CD1 4.5Å; F532-I570 HydrophobicContact CZ-CD1 4.43Å; H566-I570 WeakPolarHBondContact O-CD1 3.49Å; H566-I570 WeakPolarHBondContact O-CG1 3.32Å; H566-I570 PolarHBondContact O-N 2.89Å; H566-I570 VanDerWaalsContact O-N 3.13Å; H567-I570 PolarHBondContact O-N 3.4Å; S568-I570 PolarHBondContact O-N 3.33Å; I570-S572 VanDerWaalsContact C-N 3.32Å; I570-S572 PolarHBondContact O-N 3.23Å; I570-V573 PolarHBondContact O-N 2.92Å; I570-I574 HydrophobicContact CG2-CD1 3.85Å; I570-I574 HydrophobicContact CG2-CG1 4.42Å; I570-I574 WeakPolarHBondContact O-CG1 3.48Å; I570-I574 PolarHBondContact O-N 3.21Å; I570-L855 HydrophobicContact CD1-CD1 4.14Å; I570-L855 HydrophobicContact CG2-CD2 3.96Å
571	L	74.7	Confident	68.7	Low	109 Å²	109	48.2 Å²	48.2	57%	0.571	25%	0.248	S	C	*	.	H	α-helix	trans	-65.1	-36.2	177.8	-70.9	173.2	0	0	0	112.3	H567 S568 S569 V573 T575	H567-L571 WeakPolarHBondContact O-CG 3.44Å; H567-L571 PolarHBondContact O-N 2.5Å; S568-L571 PolarHBondContact O-N 3.21Å; S569-L571 VanDerWaalsContact C-N 3.35Å; S569-L571 PolarHBondContact O-N 3.05Å; L571-V573 VanDerWaalsContact C-N 3.34Å; L571-T575 WeakPolarHBondContact O-CB 2.92Å; L571-T575 PolarHBondContact O-N 2.82Å; L571-T575 PolarHBondContact O-OG1 3.02Å
572	S	76	Confident	71.4	Confident	5 Å²	5	44.9 Å²	44.9	4%	0.035	23%	0.225	C	C	.	.	H	α-helix	trans	-63.9	-40.2	175.2	79.1	0	0	0	0	111.6	S568 S569 I570 T575 A576	S568-S572 PolarHBondContact O-N 2.77Å; S568-S572 VanDerWaalsContact O-N 3.08Å; S569-S572 WeakPolarHBondContact O-CB 3.37Å; S569-S572 PolarHBondContact O-N 2.83Å; S569-S572 VanDerWaalsContact O-N 3.16Å; S569-S572 PolarHBondContact O-OG 2.78Å; I570-S572 VanDerWaalsContact C-N 3.32Å; I570-S572 PolarHBondContact O-N 3.23Å; S572-T575 WeakPolarHBondContact O-CB 3.33Å; S572-T575 PolarHBondContact O-N 3.44Å; S572-A576 PolarHBondContact O-N 3.01Å
573	V	80	Confident	74	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-68.7	-46.2	176.9	176.8	0	0	0	0	111.6	W527 M528 S569 I570 L571 T575 A576 F577 L605	W527-V573 HydrophobicContact CE3-CG2 4.24Å; W527-V573 HydrophobicContact CZ3-CG2 3.7Å; M528-V573 HydrophobicContact CE-CG1 4.22Å; M528-V573 HydrophobicContact CG-CG1 3.71Å; M528-V573 HydrophobicContact SD-CB 4.04Å; M528-V573 HydrophobicContact SD-CG1 3.65Å; M528-V573 HydrophobicContact SD-CG2 3.98Å; S569-V573 WeakPolarHBondContact O-CG2 3.48Å; S569-V573 PolarHBondContact O-N 2.87Å; S569-V573 VanDerWaalsContact O-N 3.09Å; I570-V573 PolarHBondContact O-N 2.92Å; L571-V573 VanDerWaalsContact C-N 3.34Å; V573-T575 PolarHBondContact O-N 2.79Å; V573-A576 WeakPolarHBondContact O-CA 3.31Å; V573-A576 VanDerWaalsContact O-CB 3.31Å; V573-A576 WeakPolarHBondContact O-CB 3.28Å; V573-A576 PolarHBondContact O-N 3.02Å; V573-F577 HydrophobicContact CG1-CD2 3.69Å; V573-F577 HydrophobicContact CG1-CE2 3.51Å; V573-F577 WeakPolarHBondContact O-CD2 3.29Å; V573-F577 PolarHBondContact O-N 2.71Å; V573-L605 HydrophobicContact CB-CD2 4.4Å; V573-L605 HydrophobicContact CG2-CD2 3.55Å
574	I	82.8	Confident	76.2	Confident	15 Å²	15	33.2 Å²	33.2	8%	0.077	17%	0.172	C	C	.	.	H	α-helix	trans	-56.5	-39.6	174.1	-68.9	168.8	0	0	0	110.4	I570 A576 F577 R578 W772 M804 F859	I570-I574 HydrophobicContact CG2-CD1 3.85Å; I570-I574 HydrophobicContact CG2-CG1 4.42Å; I570-I574 WeakPolarHBondContact O-CG1 3.48Å; I570-I574 PolarHBondContact O-N 3.21Å; I574-A576 VanDerWaalsContact C-N 3.35Å; I574-F577 PolarHBondContact O-N 3.35Å; I574-R578 WeakPolarHBondContact O-CG 3.47Å; I574-R578 PolarHBondContact O-N 2.8Å; I574-W772 HydrophobicContact CG2-CZ2 3.95Å; I574-M804 HydrophobicContact CG1-CE 4.35Å; I574-M804 HydrophobicContact CG2-SD 4.01Å; I574-F859 HydrophobicContact CG1-CZ 3.93Å
575	T	83.8	Confident	78.2	Confident	48 Å²	48	31.6 Å²	31.6	29%	0.294	16%	0.156	S	C	.	.	H	α-helix	trans	-65.3	-38.8	175.6	-57.4	0	0	0	0	111.8	L571 S572 V573 R578 K579	L571-T575 WeakPolarHBondContact O-CB 2.92Å; L571-T575 PolarHBondContact O-N 2.82Å; L571-T575 PolarHBondContact O-OG1 3.02Å; S572-T575 WeakPolarHBondContact O-CB 3.33Å; S572-T575 PolarHBondContact O-N 3.44Å; V573-T575 PolarHBondContact O-N 2.79Å; T575-R578 PolarHBondContact O-N 3.16Å; T575-K579 WeakPolarHBondContact O-CG 3.48Å; T575-K579 PolarHBondContact O-N 3Å
576	A	85.6	Confident	79.9	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.4	-47.7	174.9	0	0	0	0	0	112.1	L524 S572 V573 I574 R578 K579 L580 L587 L605	L524-A576 HydrophobicContact CD2-CB 4.49Å; S572-A576 PolarHBondContact O-N 3.01Å; V573-A576 WeakPolarHBondContact O-CA 3.31Å; V573-A576 VanDerWaalsContact O-CB 3.31Å; V573-A576 WeakPolarHBondContact O-CB 3.28Å; V573-A576 PolarHBondContact O-N 3.02Å; I574-A576 VanDerWaalsContact C-N 3.35Å; A576-R578 PolarHBondContact O-N 3.32Å; A576-K579 PolarHBondContact O-N 3.28Å; A576-L580 WeakPolarHBondContact O-CB 3.42Å; A576-L580 PolarHBondContact O-N 2.68Å; A576-L587 HydrophobicContact CB-CD1 3.83Å; A576-L605 HydrophobicContact CB-CD1 4.21Å
577	F	87	Confident	81.3	Confident	2 Å²	2	19.3 Å²	19.3	1%	0.009	10%	0.101	C	C	.	.	H	α-helix	trans	-57.2	-46.9	174.3	-82.8	-82.3	0	0	0	111.9	E521 L524 M528 V573 I574 K579 L580 H581 M804 F859	E521-F577 HydrophobicContact CG-CD1 4.12Å; E521-F577 HydrophobicContact CG-CE1 3.71Å; L524-F577 HydrophobicContact CB-CD1 4.47Å; L524-F577 HydrophobicContact CB-CD2 4.43Å; L524-F577 HydrophobicContact CB-CE1 3.75Å; L524-F577 HydrophobicContact CB-CE2 3.7Å; L524-F577 HydrophobicContact CB-CZ 3.32Å; L524-F577 HydrophobicContact CD1-CD1 4.05Å; L524-F577 HydrophobicContact CD1-CD2 4.29Å; L524-F577 HydrophobicContact CD1-CE1 4.15Å; L524-F577 HydrophobicContact CD1-CE2 4.36Å; L524-F577 HydrophobicContact CD1-CG 4.14Å; L524-F577 HydrophobicContact CD1-CZ 4.31Å; L524-F577 HydrophobicContact CG-CZ 4.42Å; M528-F577 HydrophobicContact CG-CE2 4.44Å; V573-F577 HydrophobicContact CG1-CD2 3.69Å; V573-F577 HydrophobicContact CG1-CE2 3.51Å; V573-F577 WeakPolarHBondContact O-CD2 3.29Å; V573-F577 PolarHBondContact O-N 2.71Å; I574-F577 PolarHBondContact O-N 3.35Å; F577-K579 VanDerWaalsContact C-N 3.31Å; F577-K579 PolarHBondContact O-N 3.43Å; F577-L580 WeakPolarHBondContact O-CB 3.46Å; F577-L580 PolarHBondContact O-N 3.48Å; F577-L580 VanDerWaalsContact O-N 3.16Å; F577-H581 PolarHBondContact O-CD2 2.75Å; F577-H581 PolarHBondContact O-N 3.43Å; F577-M804 HydrophobicContact CB-CE 3.46Å; F577-M804 VanDerWaalsContact CB-CE 3.46Å; F577-M804 HydrophobicContact CB-SD 3.92Å; F577-M804 HydrophobicContact CD1-CE 4.11Å; F577-M804 HydrophobicContact CD2-CE 3.41Å; F577-M804 VanDerWaalsContact CD2-CE 3.41Å; F577-M804 HydrophobicContact CE2-CE 4.1Å; F577-M804 HydrophobicContact CG-CE 3.42Å; F577-M804 VanDerWaalsContact CG-CE 3.42Å; F577-M804 HydrophobicContact CG-SD 4.5Å; F577-F859 HydrophobicContact CD2-CD1 4.33Å; F577-F859 AromaticContact CD2-CE1 3.79Å; F577-F859 HydrophobicContact CD2-CE1 3.79Å; F577-F859 AromaticContact CE2-CD1 3.65Å; F577-F859 HydrophobicContact CE2-CD1 3.65Å; F577-F859 AromaticContact CE2-CE1 3.44Å; F577-F859 HydrophobicContact CE2-CE1 3.44Å; F577-F859 VanDerWaalsContact CE2-CE1 3.44Å; F577-F859 AromaticContact CZ-CD1 3.83Å; F577-F859 HydrophobicContact CZ-CD1 3.83Å; F577-F859 HydrophobicContact CZ-CE1 4.11Å
578	R	89.4	Confident	82.3	Confident	27 Å²	27	17.3 Å²	17.3	10%	0.102	9%	0.09	C	C	.	.	H	α-helix	trans	-62.8	-35.9	178.2	-69.6	-176.3	77	-174.4	7.8	112.9	I574 T575 A576 N582 F698 M770	I574-R578 WeakPolarHBondContact O-CG 3.47Å; I574-R578 PolarHBondContact O-N 2.8Å; T575-R578 PolarHBondContact O-N 3.16Å; A576-R578 PolarHBondContact O-N 3.32Å; R578-N582 PolarHBondContact O-N 3.26Å; R578-N582 PolarHBondContact O-ND2 3.41Å; R578-F698 HydrophobicContact CB-CE2 4.27Å; R578-F698 HydrophobicContact CB-CZ 4.05Å; R578-M770 PolarHBondContact NH2-O 3.04Å
579	K	89.3	Confident	83.2	Confident	15 Å²	15	18.3 Å²	18.3	7%	0.065	9%	0.094	C	C	.	.	H	α-helix	trans	-69.2	-40.6	174.1	-72.9	-174.4	-177.5	-157.6	0	111.7	T575 A576 F577 N582 H583 L586 Y590	T575-K579 WeakPolarHBondContact O-CG 3.48Å; T575-K579 PolarHBondContact O-N 3Å; A576-K579 PolarHBondContact O-N 3.28Å; F577-K579 VanDerWaalsContact C-N 3.31Å; F577-K579 PolarHBondContact O-N 3.43Å; K579-N582 PolarHBondContact O-N 3.3Å; K579-H583 CarbonylContact O-C 3.53Å; K579-H583 PolarHBondContact O-N 3.21Å; K579-L586 HydrophobicContact CB-CB 4.14Å; K579-Y590 HydrophobicContact CD-CD1 4.2Å; K579-Y590 HydrophobicContact CD-CD2 4.28Å; K579-Y590 HydrophobicContact CD-CG 3.81Å
580	L	89.4	Confident	83.8	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-61.3	-49.7	177.4	178.1	60.9	0	0	0	112.3	Q517 L520 E521 L524 A576 F577 N582 H583 P584 L587	Q517-L580 HydrophobicContact CG-CD1 4.22Å; Q517-L580 PolarHBondContact NE2-O 3.26Å; L520-L580 HydrophobicContact CB-CD1 3.83Å; L520-L580 HydrophobicContact CB-CD2 3.74Å; L520-L580 HydrophobicContact CB-CG 4.45Å; L520-L580 HydrophobicContact CD1-CD1 3.57Å; L520-L580 HydrophobicContact CG-CD1 4.37Å; E521-L580 HydrophobicContact CB-CD2 4.12Å; L524-L580 HydrophobicContact CD1-CD2 3.87Å; A576-L580 WeakPolarHBondContact O-CB 3.42Å; A576-L580 PolarHBondContact O-N 2.68Å; F577-L580 WeakPolarHBondContact O-CB 3.46Å; F577-L580 PolarHBondContact O-N 3.48Å; F577-L580 VanDerWaalsContact O-N 3.16Å; L580-N582 PolarHBondContact O-N 3.12Å; L580-H583 PolarHBondContact O-N 2.96Å; L580-P584 HydrophobicContact CD1-CG 4.45Å; L580-L587 HydrophobicContact CB-CD2 4.27Å; L580-L587 HydrophobicContact CD1-CD2 4.06Å
581	H	87.9	Confident	84	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.2	-32.1	179.2	-68	-51.2	0	0	0	112.7	Q517 E521 F577 M804 E805	Q517-H581 PolarHBondContact NE2-O 3.41Å; E521-H581 IonicContact OE1-CE1 3.62Å; E521-H581 PolarHBondContact OE1-CE1 3.24Å; E521-H581 IonicContact OE1-NE2 3.91Å; E521-H581 IonicContact OE2-CE1 3.81Å; E521-H581 PolarHBondContact OE2-CE1 3.23Å; E521-H581 IonicContact OE2-ND1 3.82Å; F577-H581 PolarHBondContact O-CD2 2.75Å; F577-H581 PolarHBondContact O-N 3.43Å; H581-M804 PolarHBondContact NE2-N 2.91Å; H581-M804 VanDerWaalsContact NE2-N 3.17Å; H581-E805 HydrophobicContact CB-CG 4.09Å
582	N	89.3	Confident	84.1	Confident	1 Å²	1	15.6 Å²	15.6	1%	0.005	8%	0.075	C	C	.	.	H	α-helix	trans	-70.5	-62.6	171.3	-74.8	-20.9	0	0	0	111.3	R578 K579 L580 L586 S640 F643 T701 F768	R578-N582 PolarHBondContact O-N 3.26Å; R578-N582 PolarHBondContact O-ND2 3.41Å; K579-N582 PolarHBondContact O-N 3.3Å; L580-N582 PolarHBondContact O-N 3.12Å; N582-L586 HydrophobicContact CB-CD1 3.82Å; N582-S640 PolarHBondContact O-OG 3.17Å; N582-F643 VanDerWaalsContact O-CD2 3.3Å; N582-F643 WeakPolarHBondContact O-CD2 3.33Å; N582-F643 WeakPolarHBondContact O-CE2 3.45Å; N582-T701 HydrophobicContact CB-CG2 4.46Å; N582-T701 PolarHBondContact ND2-OG1 2.91Å; N582-F768 HydrophobicContact CB-CE1 4.03Å; N582-F768 WeakPolarHBondContact OD1-CE1 3.29Å
583	H	89.1	Confident	83.9	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.095	C	C	.	.			trans	-162.6	135.2	177.8	-162.7	-83.3	0	0	0	112.5	K579 L580 Y585 L586 F636 F643 L704	K579-H583 CarbonylContact O-C 3.53Å; K579-H583 PolarHBondContact O-N 3.21Å; L580-H583 PolarHBondContact O-N 2.96Å; H583-Y585 VanDerWaalsContact C-N 3.27Å; H583-Y585 WeakPolarHBondContact ND1-CB 3.13Å; H583-Y585 PolarHBondContact ND1-N 3.47Å; H583-Y585 PolarHBondContact O-N 3.49Å; H583-L586 HydrophobicContact CB-CD1 4.19Å; H583-L586 HydrophobicContact CB-CG 4.2Å; H583-L586 WeakPolarHBondContact O-CB 3.39Å; H583-L586 PolarHBondContact O-N 2.93Å; H583-F636 AromaticContact CE1-CD2 3.97Å; H583-F636 AromaticContact CE1-CE1 3.76Å; H583-F636 AromaticContact CE1-CE2 3.39Å; H583-F636 WeakPolarHBondContact CE1-CE2 3.34Å; H583-F636 AromaticContact CE1-CZ 3.27Å; H583-F636 WeakPolarHBondContact CE1-CZ 3.48Å; H583-F636 AromaticContact ND1-CZ 3.9Å; H583-F636 AromaticContact NE2-CD1 3.78Å; H583-F636 AromaticContact NE2-CE1 3.39Å; H583-F636 WeakPolarHBondContact NE2-CE1 3.26Å; H583-F636 AromaticContact NE2-CE2 3.83Å; H583-F636 AromaticContact NE2-CZ 3.42Å; H583-F636 WeakPolarHBondContact NE2-CZ 3.45Å; H583-F636 PolarHBondContact NE2-O 3.26Å; H583-F643 HydrophobicContact CB-CD2 4.27Å; H583-F643 HydrophobicContact CB-CE2 3.84Å; H583-F643 HydrophobicContact CB-CZ 4.44Å; H583-F643 AromaticContact CD2-CD2 3.66Å; H583-F643 AromaticContact CD2-CE2 3.87Å; H583-F643 AromaticContact CD2-CG 3.83Å; H583-L704 HydrophobicContact CB-CD1 4.23Å
584	P	86.5	Confident	83.2	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-54.7	-36.8	177.7	-27.8	35.2	0	0	0	114.5	L516 Q517 L520 L580 L586 L587 R588 L617 L623 L639	L516-P584 HydrophobicContact CD2-CB 4.02Å; L516-P584 HydrophobicContact CD2-CG 4.08Å; Q517-P584 HydrophobicContact CG-CG 3.9Å; L520-P584 HydrophobicContact CD1-CB 4.47Å; L580-P584 HydrophobicContact CD1-CG 4.45Å; P584-L586 PolarHBondContact O-N 3.48Å; P584-L587 WeakPolarHBondContact O-CB 3.35Å; P584-L587 PolarHBondContact O-N 3.27Å; P584-R588 PolarHBondContact O-N 3.02Å; P584-L617 HydrophobicContact CB-CD2 3.97Å; P584-L623 HydrophobicContact CB-CD1 4.14Å; P584-L623 HydrophobicContact CB-CD2 4.34Å; P584-L639 HydrophobicContact CG-CB 4.49Å; P584-L639 WeakPolarHBondContact CG-O 3.34Å
585	Y	85.1	Confident	82.1	Confident	34 Å²	34	24.5 Å²	24.5	13%	0.133	12%	0.121	C	C	.	.	H	α-helix	trans	-54.9	-34.9	173.1	-174.5	-106.3	0	0	0	114.1	H583 R588 N589 L623 F636 L704	H583-Y585 VanDerWaalsContact C-N 3.27Å; H583-Y585 WeakPolarHBondContact ND1-CB 3.13Å; H583-Y585 PolarHBondContact ND1-N 3.47Å; H583-Y585 PolarHBondContact O-N 3.49Å; Y585-R588 PolarHBondContact O-N 3.35Å; Y585-N589 WeakPolarHBondContact CD1-ND2 3.28Å; Y585-N589 WeakPolarHBondContact CE1-ND2 3.5Å; Y585-N589 PolarHBondContact O-N 3.1Å; Y585-L623 HydrophobicContact CD2-CD2 4.32Å; Y585-F636 HydrophobicContact CG-CE2 4.41Å; Y585-L704 HydrophobicContact CD1-CD1 4.12Å; Y585-L704 HydrophobicContact CD1-CD2 3.84Å; Y585-L704 HydrophobicContact CE1-CD2 3.98Å
586	L	85.6	Confident	80.9	Confident	5 Å²	5	26.3 Å²	26.3	3%	0.026	14%	0.136	C	C	.	.	H	α-helix	trans	-69.7	-36.4	177.3	-65.3	173.8	0	0	0	111.6	K579 N582 H583 P584 Y590 Q700 T701 L704	K579-L586 HydrophobicContact CB-CB 4.14Å; N582-L586 HydrophobicContact CB-CD1 3.82Å; H583-L586 HydrophobicContact CB-CD1 4.19Å; H583-L586 HydrophobicContact CB-CG 4.2Å; H583-L586 WeakPolarHBondContact O-CB 3.39Å; H583-L586 PolarHBondContact O-N 2.93Å; P584-L586 PolarHBondContact O-N 3.48Å; L586-Y590 VanDerWaalsContact O-CB 3.29Å; L586-Y590 WeakPolarHBondContact O-CB 3.19Å; L586-Y590 PolarHBondContact O-N 3.37Å; L586-Y590 VanDerWaalsContact O-N 3.08Å; L586-Q700 HydrophobicContact CD2-CB 3.72Å; L586-T701 VanDerWaalsContact CD1-OG1 3.31Å; L586-T701 WeakPolarHBondContact CD1-OG1 3.44Å; L586-L704 HydrophobicContact CD1-CD1 4.19Å; L586-L704 HydrophobicContact CD2-CD1 3.58Å; L586-L704 HydrophobicContact CD2-CG 4.29Å; L586-L704 HydrophobicContact CG-CD1 3.67Å
587	L	84.5	Confident	79.3	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65.6	-46.9	173	-179.1	63.9	0	0	0	110.1	L520 A576 L580 P584 N589 Y590 L591 L617	L520-L587 HydrophobicContact CD1-CD2 4.45Å; A576-L587 HydrophobicContact CB-CD1 3.83Å; L580-L587 HydrophobicContact CB-CD2 4.27Å; L580-L587 HydrophobicContact CD1-CD2 4.06Å; P584-L587 WeakPolarHBondContact O-CB 3.35Å; P584-L587 PolarHBondContact O-N 3.27Å; L587-N589 PolarHBondContact O-N 3.4Å; L587-Y590 WeakPolarHBondContact O-CB 3.37Å; L587-Y590 PolarHBondContact O-N 2.82Å; L587-Y590 VanDerWaalsContact O-N 3.11Å; L587-L591 HydrophobicContact CD1-CD1 4.27Å; L587-L591 HydrophobicContact CD1-CG 4.24Å; L587-L591 HydrophobicContact CG-CD1 4.01Å; L587-L591 HydrophobicContact CG-CG 4.38Å; L587-L591 WeakPolarHBondContact O-CG 3.45Å; L587-L591 PolarHBondContact O-N 3.36Å; L587-L617 HydrophobicContact CD2-CD1 4.16Å; L587-L617 HydrophobicContact CG-CD1 4.15Å
588	R	81	Confident	77.3	Confident	25 Å²	25	39.3 Å²	39.3	9%	0.094	20%	0.199	C	C	.	.	H	α-helix	trans	-54.9	-51.1	177	-174.8	175.8	178.8	-90.3	-1.7	112.3	P584 Y585 Y590 L591 I592 L617 N618 L623	P584-R588 PolarHBondContact O-N 3.02Å; Y585-R588 PolarHBondContact O-N 3.35Å; R588-Y590 VanDerWaalsContact C-N 3.28Å; R588-Y590 PolarHBondContact O-N 2.94Å; R588-L591 PolarHBondContact O-N 3.48Å; R588-I592 HydrophobicContact CG-CD1 3.85Å; R588-I592 VanDerWaalsContact O-CG1 3.32Å; R588-I592 WeakPolarHBondContact O-CG1 3.42Å; R588-I592 PolarHBondContact O-N 3.38Å; R588-L617 HydrophobicContact CB-CB 4.49Å; R588-L617 HydrophobicContact CB-CD1 4.07Å; R588-L617 HydrophobicContact CG-CB 4.49Å; R588-N618 PolarHBondContact NE-OD1 3.31Å; R588-N618 VanDerWaalsContact NE-OD1 3.1Å; R588-N618 PolarHBondContact NH2-OD1 2.85Å; R588-L623 PolarHBondContact NH1-O 3.32Å
589	N	80.5	Confident	74.8	Confident	42 Å²	42	44.3 Å²	44.3	23%	0.225	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-36.2	178.3	-77.1	-21.8	0	0	0	112.7	Y585 L587 Q593	Y585-N589 WeakPolarHBondContact CD1-ND2 3.28Å; Y585-N589 WeakPolarHBondContact CE1-ND2 3.5Å; Y585-N589 PolarHBondContact O-N 3.1Å; L587-N589 PolarHBondContact O-N 3.4Å; N589-Q593 WeakPolarHBondContact O-CB 3.33Å; N589-Q593 WeakPolarHBondContact O-CG 3.42Å; N589-Q593 PolarHBondContact O-N 2.88Å
590	Y	79.5	Confident	72.4	Confident	40 Å²	40	52 Å²	52	16%	0.157	26%	0.264	C	S	.	.	H	α-helix	trans	-64.6	-44.1	175.7	179.6	-119.7	0	0	0	112.1	K579 L586 L587 R588 Q593 S594 L605	K579-Y590 HydrophobicContact CD-CD1 4.2Å; K579-Y590 HydrophobicContact CD-CD2 4.28Å; K579-Y590 HydrophobicContact CD-CG 3.81Å; L586-Y590 VanDerWaalsContact O-CB 3.29Å; L586-Y590 WeakPolarHBondContact O-CB 3.19Å; L586-Y590 PolarHBondContact O-N 3.37Å; L586-Y590 VanDerWaalsContact O-N 3.08Å; L587-Y590 WeakPolarHBondContact O-CB 3.37Å; L587-Y590 PolarHBondContact O-N 2.82Å; L587-Y590 VanDerWaalsContact O-N 3.11Å; R588-Y590 VanDerWaalsContact C-N 3.28Å; R588-Y590 PolarHBondContact O-N 2.94Å; Y590-Q593 PolarHBondContact O-N 3.42Å; Y590-S594 PolarHBondContact O-N 3.37Å; Y590-L605 HydrophobicContact CD1-CD1 4.41Å; Y590-L605 HydrophobicContact CE1-CD1 3.85Å
591	L	77.5	Confident	70.1	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-66.4	-42.2	177.7	-64.1	173.5	0	0	0	111.6	L587 R588 Q593 S594 N595 L605 T610 L613 L614 L617	L587-L591 HydrophobicContact CD1-CD1 4.27Å; L587-L591 HydrophobicContact CD1-CG 4.24Å; L587-L591 HydrophobicContact CG-CD1 4.01Å; L587-L591 HydrophobicContact CG-CG 4.38Å; L587-L591 WeakPolarHBondContact O-CG 3.45Å; L587-L591 PolarHBondContact O-N 3.36Å; R588-L591 PolarHBondContact O-N 3.48Å; L591-Q593 PolarHBondContact O-N 2.88Å; L591-S594 WeakPolarHBondContact CA-OG 3.09Å; L591-S594 PolarHBondContact O-N 3.06Å; L591-S594 PolarHBondContact O-OG 3.21Å; L591-N595 PolarHBondContact O-N 2.93Å; L591-L605 HydrophobicContact CD2-CD1 3.58Å; L591-T610 HydrophobicContact CB-CG2 4.34Å; L591-T610 HydrophobicContact CD2-CG2 4.14Å; L591-L613 HydrophobicContact CD1-CB 3.63Å; L591-L613 HydrophobicContact CD1-CD1 4.14Å; L591-L613 HydrophobicContact CD2-CD1 4.44Å; L591-L614 HydrophobicContact CB-CD1 4.42Å; L591-L614 HydrophobicContact CB-CD2 3.89Å; L591-L614 HydrophobicContact CB-CG 4.08Å; L591-L614 HydrophobicContact CD1-CD2 4.3Å; L591-L614 HydrophobicContact CD1-CG 4.21Å; L591-L617 HydrophobicContact CD1-CD1 3.82Å
592	I	76.2	Confident	68	Low	68 Å²	68	63.1 Å²	63.1	35%	0.349	33%	0.333	S	S	.	.	H	α-helix	trans	-62.4	-45.6	176.5	-66.7	167.8	0	0	0	111.3	R588 S594 N595 S596 L614	R588-I592 HydrophobicContact CG-CD1 3.85Å; R588-I592 VanDerWaalsContact O-CG1 3.32Å; R588-I592 WeakPolarHBondContact O-CG1 3.42Å; R588-I592 PolarHBondContact O-N 3.38Å; I592-S594 VanDerWaalsContact C-N 3.27Å; I592-S594 PolarHBondContact O-N 3.45Å; I592-N595 PolarHBondContact O-N 2.95Å; I592-N595 VanDerWaalsContact O-N 3.14Å; I592-S596 PolarHBondContact O-N 2.06Å; I592-L614 HydrophobicContact CG1-CD2 4.21Å
593	Q	71.3	Confident	66.2	Low	96 Å²	96	67.9 Å²	67.9	45%	0.449	36%	0.358	S	S	.	.	H	α-helix	trans	-62.1	-35.7	177.1	-74.9	173.6	-0.4	0	0	112.2	N589 Y590 L591 N595 S596	N589-Q593 WeakPolarHBondContact O-CB 3.33Å; N589-Q593 WeakPolarHBondContact O-CG 3.42Å; N589-Q593 PolarHBondContact O-N 2.88Å; Y590-Q593 PolarHBondContact O-N 3.42Å; L591-Q593 PolarHBondContact O-N 2.88Å; Q593-N595 VanDerWaalsContact C-N 3.26Å; Q593-N595 PolarHBondContact O-N 3.43Å; Q593-S596 PolarHBondContact O-OG 3.22Å
594	S	65.5	Low	64.6	Low	27 Å²	27	74.1 Å²	74.1	19%	0.189	38%	0.382	C	S	.	.	H	α-helix	trans	-68.1	-25.9	177.3	72.9	0	0	0	0	113.3	Y590 L591 I592	Y590-S594 PolarHBondContact O-N 3.37Å; L591-S594 WeakPolarHBondContact CA-OG 3.09Å; L591-S594 PolarHBondContact O-N 3.06Å; L591-S594 PolarHBondContact O-OG 3.21Å; I592-S594 VanDerWaalsContact C-N 3.27Å; I592-S594 PolarHBondContact O-N 3.45Å
595	N	61.2	Low	63.5	Low	84 Å²	84	74.5 Å²	74.5	45%	0.449	38%	0.384	S	S	.	.	H	α-helix	trans	-83.8	-29.9	178	-79.5	-20.1	0	0	0	113.7	L591 I592 Q593 L614	L591-N595 PolarHBondContact O-N 2.93Å; I592-N595 PolarHBondContact O-N 2.95Å; I592-N595 VanDerWaalsContact O-N 3.14Å; Q593-N595 VanDerWaalsContact C-N 3.26Å; Q593-N595 PolarHBondContact O-N 3.43Å; N595-L614 WeakPolarHBondContact ND2-CD1 3.37Å
596	S	58.7	Low	62.6	Low	86 Å²	86	74.7 Å²	74.7	60%	0.601	39%	0.389	S	S	*	.	H	α-helix	trans	-81.3	-25.2	-175.9	62.4	0	0	0	0	114.4	I592 Q593 Q598	I592-S596 PolarHBondContact O-N 2.06Å; Q593-S596 PolarHBondContact O-OG 3.22Å; S596-Q598 PolarHBondContact O-N 3.22Å; S596-Q598 VanDerWaalsContact O-N 3.1Å
597	I	51.5	Low	61.6	Low	109 Å²	109	79.5 Å²	79.5	56%	0.559	42%	0.419	S	S	*	.			trans	-84.3	89.8	179.3	-56.6	172.6	0	0	0	108.6	N599 R604	I597-N599 PolarHBondContact O-N 3.32Å; I597-R604 PolarHBondContact O-NH2 3.37Å
598	Q	43.5	Very low	60.9	Low	167 Å²	167	87.4 Å²	87.4	78%	0.78	45%	0.453	S	S	*	.			trans	-70.8	-3.6	-178.4	-92.3	-174.1	-16.5	0	0	115.3	S596	S596-Q598 PolarHBondContact O-N 3.22Å; S596-Q598 VanDerWaalsContact O-N 3.1Å
599	N	37.2	Very low	60.4	Low	132 Å²	132	86.4 Å²	86.4	71%	0.706	45%	0.45	S	S	*	.	S	Bend	trans	-142.3	122.7	-175	-78.6	-45.9	0	0	0	113.4	I597	I597-N599 PolarHBondContact O-N 3.32Å
600	Q	39.4	Very low	60	Low	176 Å²	176	84.6 Å²	84.6	82%	0.822	44%	0.44	S	S	*	.			trans	72	103.9	161.2	-55.2	179.5	-2.3	0	0	117.5
601	L	41.9	Very low	59.5	Low	161 Å²	161	85.4 Å²	85.4	84%	0.843	46%	0.455	S	S	*	.			trans	155.6	141.8	135.5	-78.9	157.2	0	0	0	111	D603	L601-D603 PolarHBondContact O-N 3.32Å
602	A	42.5	Very low	59.4	Low	73 Å²	73	89.9 Å²	89.9	60%	0.603	48%	0.479	S	S	*	.	S	Bend	trans	-73.2	29	-161.3	0	0	0	0	0	117.2	S568	S568-A602 WeakPolarHBondContact CB-O 3.49Å; S568-A602 PolarHBondContact OG-O 3.5Å
603	D	51.9	Low	59.5	Low	101 Å²	101	86.6 Å²	86.6	54%	0.54	46%	0.462	S	S	.	.			trans	-117.7	36.7	-170.7	-69.9	-24.7	0	0	0	113.3	S568 L601	S568-D603 WeakPolarHBondContact CB-OD1 3.33Å; L601-D603 PolarHBondContact O-N 3.32Å
604	R	55.8	Low	59.7	Low	131 Å²	131	83.1 Å²	83.1	49%	0.494	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-90.3	130.9	178.9	-82.4	-171.7	176	174.1	1.2	112	I597	I597-R604 PolarHBondContact O-NH2 3.37Å
605	L	62.8	Low	60.2	Low	7 Å²	7	88.8 Å²	88.8	4%	0.037	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-60.2	145.8	155	-73.8	160.3	0	0	0	108.6	V573 A576 Y590 L591 L609	V573-L605 HydrophobicContact CB-CD2 4.4Å; V573-L605 HydrophobicContact CG2-CD2 3.55Å; A576-L605 HydrophobicContact CB-CD1 4.21Å; Y590-L605 HydrophobicContact CD1-CD1 4.41Å; Y590-L605 HydrophobicContact CE1-CD1 3.85Å; L591-L605 HydrophobicContact CD2-CD1 3.58Å; L605-L609 HydrophobicContact CB-CD2 4.16Å; L605-L609 HydrophobicContact CD1-CD2 4.47Å; L605-L609 HydrophobicContact CD2-CD2 3.7Å; L605-L609 HydrophobicContact CG-CD2 4.33Å
606	P	65.9	Low	60.9	Low	38 Å²	38	87.2 Å²	87.2	25%	0.247	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-58.3	144	177.9	-9.7	14	0	0	0	111.7	W527 K608 L609 T610	W527-P606 HydrophobicContact CD2-CG 4.4Å; W527-P606 VanDerWaalsContact CE2-CG 3.44Å; W527-P606 HydrophobicContact CH2-CG 3.5Å; W527-P606 VanDerWaalsContact CH2-CG 3.5Å; W527-P606 HydrophobicContact CZ2-CB 4.15Å; W527-P606 HydrophobicContact CZ2-CG 2.95Å; W527-P606 HydrophobicContact CZ3-CG 4.43Å; P606-K608 VanDerWaalsContact C-N 3.3Å; P606-K608 PolarHBondContact O-N 3.36Å; P606-L609 HydrophobicContact CB-CB 4.47Å; P606-L609 HydrophobicContact CG-CB 4.41Å; P606-L609 PolarHBondContact O-N 2.64Å; P606-T610 WeakPolarHBondContact O-CB 3.4Å; P606-T610 PolarHBondContact O-N 3.37Å; P606-T610 PolarHBondContact O-OG1 3.25Å
607	T	65.9	Low	61.7	Low	107 Å²	107	83.1 Å²	83.1	66%	0.656	43%	0.433	S	S	*	.	H	α-helix	trans	-61.9	-35.6	-176.2	50.1	0	0	0	0	112.9	T610 A611	T607-T610 PolarHBondContact O-N 3.22Å; T607-A611 PolarHBondContact O-N 3.41Å
608	K	68.8	Low	62.8	Low	166 Å²	166	81.6 Å²	81.6	72%	0.722	43%	0.425	S	S	*	.	H	α-helix	trans	-63.5	-52.9	175.9	-68.3	-173.7	178.1	-177.1	0	111.8	P606 T610 A611 D612	P606-K608 VanDerWaalsContact C-N 3.3Å; P606-K608 PolarHBondContact O-N 3.36Å; K608-T610 VanDerWaalsContact C-N 3.27Å; K608-T610 PolarHBondContact O-N 3.04Å; K608-A611 WeakPolarHBondContact O-CB 3.32Å; K608-A611 PolarHBondContact O-N 2.94Å; K608-D612 PolarHBondContact O-N 3.07Å
609	L	71.4	Confident	64.1	Low	3 Å²	3	77 Å²	77	2%	0.016	41%	0.412	C	S	.	.	H	α-helix	trans	-58.7	-40.5	176.2	-179.7	119.2	0	0	0	111.8	L524 W527 L605 P606 A611 D612 L613	L524-L609 HydrophobicContact CD2-CD1 4.27Å; L524-L609 HydrophobicContact CD2-CD2 4.11Å; W527-L609 HydrophobicContact CB-CD1 3.27Å; W527-L609 HydrophobicContact CD2-CD1 3.68Å; W527-L609 HydrophobicContact CE3-CD1 4.19Å; W527-L609 HydrophobicContact CG-CB 4.45Å; W527-L609 HydrophobicContact CG-CD1 3.21Å; W527-L609 HydrophobicContact CG-CG 4.41Å; L605-L609 HydrophobicContact CB-CD2 4.16Å; L605-L609 HydrophobicContact CD1-CD2 4.47Å; L605-L609 HydrophobicContact CD2-CD2 3.7Å; L605-L609 HydrophobicContact CG-CD2 4.33Å; P606-L609 HydrophobicContact CB-CB 4.47Å; P606-L609 HydrophobicContact CG-CB 4.41Å; P606-L609 PolarHBondContact O-N 2.64Å; L609-A611 VanDerWaalsContact C-N 3.3Å; L609-A611 PolarHBondContact O-N 2.96Å; L609-D612 PolarHBondContact O-N 3.43Å; L609-L613 HydrophobicContact CD2-CD1 3.62Å; L609-L613 HydrophobicContact CG-CD1 3.88Å; L609-L613 HydrophobicContact CG-CG 4.34Å; L609-L613 WeakPolarHBondContact O-CB 3.5Å; L609-L613 VanDerWaalsContact O-CG 3.25Å; L609-L613 WeakPolarHBondContact O-CG 3.34Å; L609-L613 PolarHBondContact O-N 3.1Å
610	T	71	Confident	65.5	Low	4 Å²	4	74.1 Å²	74.1	3%	0.025	39%	0.394	C	S	.	.	H	α-helix	trans	-61.8	-39.3	177.2	-56.7	0	0	0	0	111.5	L591 P606 T607 K608 L614	L591-T610 HydrophobicContact CB-CG2 4.34Å; L591-T610 HydrophobicContact CD2-CG2 4.14Å; P606-T610 WeakPolarHBondContact O-CB 3.4Å; P606-T610 PolarHBondContact O-N 3.37Å; P606-T610 PolarHBondContact O-OG1 3.25Å; T607-T610 PolarHBondContact O-N 3.22Å; K608-T610 VanDerWaalsContact C-N 3.27Å; K608-T610 PolarHBondContact O-N 3.04Å; T610-L614 HydrophobicContact CG2-CD1 3.92Å; T610-L614 VanDerWaalsContact O-CB 3.27Å; T610-L614 WeakPolarHBondContact O-CB 3.32Å; T610-L614 WeakPolarHBondContact O-CG 3.5Å; T610-L614 PolarHBondContact O-N 2.96Å
611	A	70.6	Confident	66.6	Low	57 Å²	57	70.4 Å²	70.4	47%	0.471	39%	0.385	S	S	.	.	H	α-helix	trans	-68.3	-45.4	176.9	0	0	0	0	0	112	T607 K608 L609 L613 L614 H615	T607-A611 PolarHBondContact O-N 3.41Å; K608-A611 WeakPolarHBondContact O-CB 3.32Å; K608-A611 PolarHBondContact O-N 2.94Å; L609-A611 VanDerWaalsContact C-N 3.3Å; L609-A611 PolarHBondContact O-N 2.96Å; A611-L613 PolarHBondContact O-N 2.98Å; A611-L614 PolarHBondContact O-N 2.98Å; A611-H615 WeakPolarHBondContact O-CB 3.45Å; A611-H615 PolarHBondContact O-N 2.99Å
612	D	74.9	Confident	67.5	Low	94 Å²	94	63.2 Å²	63.2	50%	0.503	35%	0.348	S	S	.	.	H	α-helix	trans	-62.1	-44.9	-179.7	-61.8	-21.9	0	0	0	111.3	K608 L609 H615 L616	K608-D612 PolarHBondContact O-N 3.07Å; L609-D612 PolarHBondContact O-N 3.43Å; D612-H615 PolarHBondContact O-N 3.42Å; D612-L616 PolarHBondContact O-N 2.61Å
613	L	77.9	Confident	68.3	Low	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-66.3	-42.2	176.5	-66.8	172	0	0	0	112	L520 I523 L524 L591 L609 A611 H615 L616 L617	L520-L613 HydrophobicContact CD2-CD2 3.7Å; I523-L613 HydrophobicContact CB-CD2 4.37Å; I523-L613 HydrophobicContact CG2-CD2 4.02Å; L524-L613 HydrophobicContact CD2-CD1 3.77Å; L524-L613 HydrophobicContact CD2-CD2 4.43Å; L524-L613 HydrophobicContact CG-CD1 4.45Å; L524-L613 HydrophobicContact CG-CD2 4.27Å; L591-L613 HydrophobicContact CD1-CB 3.63Å; L591-L613 HydrophobicContact CD1-CD1 4.14Å; L591-L613 HydrophobicContact CD2-CD1 4.44Å; L609-L613 HydrophobicContact CD2-CD1 3.62Å; L609-L613 HydrophobicContact CG-CD1 3.88Å; L609-L613 HydrophobicContact CG-CG 4.34Å; L609-L613 WeakPolarHBondContact O-CB 3.5Å; L609-L613 VanDerWaalsContact O-CG 3.25Å; L609-L613 WeakPolarHBondContact O-CG 3.34Å; L609-L613 PolarHBondContact O-N 3.1Å; A611-L613 PolarHBondContact O-N 2.98Å; L613-H615 VanDerWaalsContact C-N 3.29Å; L613-H615 PolarHBondContact O-N 3.38Å; L613-L616 PolarHBondContact O-N 3.32Å; L613-L617 WeakPolarHBondContact O-CB 3.12Å; L613-L617 WeakPolarHBondContact O-CD1 3.4Å; L613-L617 WeakPolarHBondContact O-CG 3.45Å; L613-L617 PolarHBondContact O-N 3.2Å
614	L	76.2	Confident	68.6	Low	23 Å²	23	58 Å²	58	12%	0.12	31%	0.313	C	S	.	.	H	α-helix	trans	-66.3	-32	177.7	-78.7	172.2	0	0	0	112.2	L591 I592 N595 T610 A611 L617 N618	L591-L614 HydrophobicContact CB-CD1 4.42Å; L591-L614 HydrophobicContact CB-CD2 3.89Å; L591-L614 HydrophobicContact CB-CG 4.08Å; L591-L614 HydrophobicContact CD1-CD2 4.3Å; L591-L614 HydrophobicContact CD1-CG 4.21Å; I592-L614 HydrophobicContact CG1-CD2 4.21Å; N595-L614 WeakPolarHBondContact ND2-CD1 3.37Å; T610-L614 HydrophobicContact CG2-CD1 3.92Å; T610-L614 VanDerWaalsContact O-CB 3.27Å; T610-L614 WeakPolarHBondContact O-CB 3.32Å; T610-L614 WeakPolarHBondContact O-CG 3.5Å; T610-L614 PolarHBondContact O-N 2.96Å; A611-L614 PolarHBondContact O-N 2.98Å; L614-L617 PolarHBondContact O-N 3.09Å; L614-N618 VanDerWaalsContact O-CB 3.23Å; L614-N618 WeakPolarHBondContact O-CB 3.45Å; L614-N618 PolarHBondContact O-N 2.91Å; L614-N618 PolarHBondContact O-ND2 3.26Å
615	H	75.6	Confident	68.5	Low	145 Å²	145	54 Å²	54	67%	0.671	31%	0.308	S	S	*	.	H	α-helix	trans	-62.3	-50	177	-174.3	-86.2	0	0	0	111.2	A611 D612 L613 N618 S619	A611-H615 WeakPolarHBondContact O-CB 3.45Å; A611-H615 PolarHBondContact O-N 2.99Å; D612-H615 PolarHBondContact O-N 3.42Å; L613-H615 VanDerWaalsContact C-N 3.29Å; L613-H615 PolarHBondContact O-N 3.38Å; H615-N618 PolarHBondContact O-N 2.8Å; H615-S619 PolarHBondContact O-N 3.43Å; H615-S619 VanDerWaalsContact O-N 3.16Å
616	L	76.2	Confident	68.1	Low	51 Å²	51	60.3 Å²	60.3	27%	0.267	34%	0.337	S	S	.	.	H	α-helix	trans	-68.3	-33.7	176.2	-79.2	152.9	0	0	0	113.5	L520 I523 D612 L613 N618 S619	L520-L616 HydrophobicContact CD2-CB 4.03Å; I523-L616 HydrophobicContact CD1-CD1 3.03Å; D612-L616 PolarHBondContact O-N 2.61Å; L613-L616 PolarHBondContact O-N 3.32Å; L616-N618 VanDerWaalsContact C-N 3.34Å; L616-S619 PolarHBondContact O-OG 3.32Å
617	L	74.8	Confident	67.5	Low	0 Å²	0	64.1 Å²	64.1	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-74.1	-26.1	177.5	-73.8	166.3	0	0	0	113.1	L520 P584 L587 R588 L591 L613 L614 L623	L520-L617 HydrophobicContact CD1-CD2 3.62Å; L520-L617 HydrophobicContact CD1-CG 4.18Å; L520-L617 HydrophobicContact CD2-CG 4.21Å; P584-L617 HydrophobicContact CB-CD2 3.97Å; L587-L617 HydrophobicContact CD2-CD1 4.16Å; L587-L617 HydrophobicContact CG-CD1 4.15Å; R588-L617 HydrophobicContact CB-CB 4.49Å; R588-L617 HydrophobicContact CB-CD1 4.07Å; R588-L617 HydrophobicContact CG-CB 4.49Å; L591-L617 HydrophobicContact CD1-CD1 3.82Å; L613-L617 WeakPolarHBondContact O-CB 3.12Å; L613-L617 WeakPolarHBondContact O-CD1 3.4Å; L613-L617 WeakPolarHBondContact O-CG 3.45Å; L613-L617 PolarHBondContact O-N 3.2Å; L614-L617 PolarHBondContact O-N 3.09Å; L617-L623 HydrophobicContact CD2-CD1 3.77Å
618	N	74.9	Confident	66.9	Low	77 Å²	77	60.8 Å²	60.8	41%	0.412	33%	0.334	S	S	.	.	H	α-helix	trans	-90.9	-13.8	178.5	-70.1	-35.2	0	0	0	113	R588 L614 H615 L616	R588-N618 PolarHBondContact NE-OD1 3.31Å; R588-N618 VanDerWaalsContact NE-OD1 3.1Å; R588-N618 PolarHBondContact NH2-OD1 2.85Å; L614-N618 VanDerWaalsContact O-CB 3.23Å; L614-N618 WeakPolarHBondContact O-CB 3.45Å; L614-N618 PolarHBondContact O-N 2.91Å; L614-N618 PolarHBondContact O-ND2 3.26Å; H615-N618 PolarHBondContact O-N 2.8Å; L616-N618 VanDerWaalsContact C-N 3.34Å
619	S	69.8	Low	66	Low	71 Å²	71	56.3 Å²	56.3	50%	0.497	32%	0.322	S	S	.	.	H	α-helix	trans	-70.3	-22.9	171.7	54.9	0	0	0	0	112.7	H615 L616 P621	H615-S619 PolarHBondContact O-N 3.43Å; H615-S619 VanDerWaalsContact O-N 3.16Å; L616-S619 PolarHBondContact O-OG 3.32Å; S619-P621 WeakPolarHBondContact O-CD 3.5Å
620	E	68.1	Low	64.9	Low	71 Å²	71	65.5 Å²	65.5	33%	0.332	36%	0.358	S	S	.	.			trans	-87.8	111.4	178.2	-71.2	-65.7	160.2	0	0	111.6	L516 S622 L623	L516-E620 HydrophobicContact CD1-CG 4.1Å; L516-E620 HydrophobicContact CD2-CG 4.03Å; E620-S622 VanDerWaalsContact C-N 3.27Å; E620-S622 PolarHBondContact O-N 2.92Å; E620-L623 HydrophobicContact CB-CD1 4.05Å; E620-L623 HydrophobicContact CB-CG 4.35Å; E620-L623 PolarHBondContact O-N 3.11Å
621	P	61.2	Low	63.8	Low	98 Å²	98	70.9 Å²	70.9	64%	0.636	39%	0.391	S	S	*	.	H	α-helix	trans	-64.9	-31.1	-172.7	24.8	-33.1	0	0	0	113	S619 L623 V624 A625	S619-P621 WeakPolarHBondContact O-CD 3.5Å; P621-L623 PolarHBondContact O-N 3.09Å; P621-V624 PolarHBondContact O-N 2.8Å; P621-V624 VanDerWaalsContact O-N 3.17Å; P621-A625 PolarHBondContact O-N 3.32Å
622	S	61	Low	63.4	Low	10 Å²	10	70.7 Å²	70.7	7%	0.07	38%	0.382	C	S	.	.	H	α-helix	trans	-65.5	-22.7	179.8	55	0	0	0	0	113.7	E620 L639	E620-S622 VanDerWaalsContact C-N 3.27Å; E620-S622 PolarHBondContact O-N 2.92Å; S622-L639 WeakPolarHBondContact OG-CD1 3.23Å
623	L	59	Low	63.2	Low	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-87.2	-19.8	176	-71.6	174.9	0	0	0	113.6	L516 P584 Y585 R588 L617 E620 P621 L639	L516-L623 HydrophobicContact CD2-CD1 3.88Å; P584-L623 HydrophobicContact CB-CD1 4.14Å; P584-L623 HydrophobicContact CB-CD2 4.34Å; Y585-L623 HydrophobicContact CD2-CD2 4.32Å; R588-L623 PolarHBondContact NH1-O 3.32Å; L617-L623 HydrophobicContact CD2-CD1 3.77Å; E620-L623 HydrophobicContact CB-CD1 4.05Å; E620-L623 HydrophobicContact CB-CG 4.35Å; E620-L623 PolarHBondContact O-N 3.11Å; P621-L623 PolarHBondContact O-N 3.09Å; L623-L639 HydrophobicContact CD2-CD1 3.66Å; L623-L639 HydrophobicContact CG-CD1 3.81Å
624	V	58.1	Low	62.9	Low	66 Å²	66	71.5 Å²	71.5	40%	0.4	39%	0.386	S	S	.	.	H	α-helix	trans	-86.7	-30.8	-179.3	-177.9	0	0	0	0	110.8	P621 Q626	P621-V624 PolarHBondContact O-N 2.8Å; P621-V624 VanDerWaalsContact O-N 3.17Å; V624-Q626 PolarHBondContact O-N 3.36Å
625	A	55.5	Low	62.7	Low	47 Å²	47	75.1 Å²	75.1	39%	0.388	40%	0.403	S	S	.	.			trans	-64.4	102.8	169.9	0	0	0	0	0	110.2	P621 D627	P621-A625 PolarHBondContact O-N 3.32Å; A625-D627 PolarHBondContact O-N 2.82Å
626	Q	53.7	Low	62.9	Low	139 Å²	139	68.9 Å²	68.9	65%	0.65	37%	0.373	S	S	*	.	S	Bend	trans	-67.7	-15.2	-175.8	-69.9	-179.7	-6	0	0	113.5	V624	V624-Q626 PolarHBondContact O-N 3.36Å
627	D	52.3	Low	63	Low	118 Å²	118	66.5 Å²	66.5	63%	0.631	36%	0.361	S	S	*	.	S	Bend	trans	-112.3	122.2	-179.5	-67.5	-39.7	0	0	0	110.2	A625 C629	A625-D627 PolarHBondContact O-N 2.82Å; D627-C629 PolarHBondContact O-N 3.35Å
628	L	54.4	Low	63.4	Low	37 Å²	37	71.5 Å²	71.5	19%	0.194	39%	0.385	C	S	.	.			trans	-66.6	83.2	166.1	-83.1	86.1	0	0	0	108	L633 F636 K707 L711	L628-L633 HydrophobicContact CD2-CD1 3.8Å; L628-F636 HydrophobicContact CD1-CD2 4.46Å; L628-F636 HydrophobicContact CD1-CE1 4.39Å; L628-F636 HydrophobicContact CD1-CE2 4.17Å; L628-F636 HydrophobicContact CD1-CZ 4.13Å; L628-F636 HydrophobicContact CD2-CD1 3.81Å; L628-F636 HydrophobicContact CD2-CE1 4.02Å; L628-F636 HydrophobicContact CD2-CG 4.19Å; L628-F636 HydrophobicContact CG-CD1 4.35Å; L628-F636 HydrophobicContact CG-CD2 4.41Å; L628-F636 HydrophobicContact CG-CG 4.29Å; L628-K707 HydrophobicContact CD1-CD 4.24Å; L628-L711 HydrophobicContact CB-CD1 4.44Å; L628-L711 HydrophobicContact CD2-CD1 4.22Å
629	C	49.5	Very low	63.7	Low	71 Å²	71	68.5 Å²	68.5	48%	0.48	37%	0.368	S	S	.	.			trans	-69.2	143.9	165.5	-73.3	0	0	0	0	109.3	D627 T631 N632	D627-C629 PolarHBondContact O-N 3.35Å; C629-T631 PolarHBondContact O-N 2.93Å; C629-N632 PolarHBondContact O-N 2.84Å
630	Y	47.5	Very low	64.4	Low	197 Å²	197	65.1 Å²	65.1	77%	0.773	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-50	-28.1	-177.7	-70.3	-85.7	0	0	0	114.2	L711	Y630-L711 HydrophobicContact CD1-CD2 3.97Å; Y630-L711 HydrophobicContact CE1-CD2 3.44Å; Y630-L711 VanDerWaalsContact CE1-CD2 3.44Å
631	T	48.9	Very low	65.2	Low	116 Å²	116	62.2 Å²	62.2	71%	0.712	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-71	-28.7	-179.9	53.6	0	0	0	0	113.2	C629	C629-T631 PolarHBondContact O-N 2.93Å
632	N	62.3	Low	66.5	Low	54 Å²	54	57.6 Å²	57.6	29%	0.289	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-108	10.3	-170.8	-61.5	15.6	0	0	0	112.6	C629 N634 E635 F636	C629-N632 PolarHBondContact O-N 2.84Å; N632-N634 PolarHBondContact O-N 3.46Å; N632-E635 PolarHBondContact O-N 2.87Å; N632-F636 WeakPolarHBondContact O-CB 3.48Å; N632-F636 PolarHBondContact O-N 3.39Å
633	L	71.2	Confident	67.9	Low	20 Å²	20	57.1 Å²	57.1	11%	0.105	30%	0.3	C	S	.	.	H	α-helix	trans	-64.4	-42.4	-176.6	-176.6	65.2	0	0	0	111.8	L628 F636 V637 Y647 L711	L628-L633 HydrophobicContact CD2-CD1 3.8Å; L633-F636 PolarHBondContact O-N 3.12Å; L633-V637 HydrophobicContact CD1-CG2 4.19Å; L633-V637 HydrophobicContact CG-CG2 4.33Å; L633-V637 VanDerWaalsContact O-CB 3.32Å; L633-V637 WeakPolarHBondContact O-CB 3.45Å; L633-V637 WeakPolarHBondContact O-CG2 3.46Å; L633-V637 PolarHBondContact O-N 3.01Å; L633-Y647 HydrophobicContact CD2-CE2 4.32Å; L633-L711 HydrophobicContact CD1-CD1 3.83Å; L633-L711 HydrophobicContact CD2-CB 4.17Å; L633-L711 HydrophobicContact CD2-CD1 4.34Å
634	N	71.3	Confident	69.2	Low	91 Å²	91	59.6 Å²	59.6	49%	0.487	31%	0.312	S	S	.	.	H	α-helix	trans	-63	-45.8	179.8	-71.5	-19.3	0	0	0	111	N632 V637 Q638 Y647	N632-N634 PolarHBondContact O-N 3.46Å; N634-V637 PolarHBondContact O-N 3.47Å; N634-Q638 WeakPolarHBondContact O-CB 3.26Å; N634-Q638 VanDerWaalsContact O-CG 3.27Å; N634-Q638 WeakPolarHBondContact O-CG 3.48Å; N634-Q638 PolarHBondContact O-N 3.21Å; N634-Y647 PolarHBondContact OD1-OH 3.1Å
635	E	72.5	Confident	70.5	Confident	99 Å²	99	56.8 Å²	56.8	46%	0.463	30%	0.295	S	S	.	.	H	α-helix	trans	-60.3	-48.4	175.6	-65.9	-178.4	173.4	0	0	111.1	N632 V637 Q638 L639	N632-E635 PolarHBondContact O-N 2.87Å; E635-V637 VanDerWaalsContact C-N 3.29Å; E635-V637 PolarHBondContact O-N 2.67Å; E635-Q638 PolarHBondContact O-N 3.29Å; E635-Q638 VanDerWaalsContact O-N 3.15Å; E635-L639 WeakPolarHBondContact O-CG 3.34Å; E635-L639 PolarHBondContact O-N 2.91Å
636	F	78.4	Confident	72.1	Confident	13 Å²	13	54.6 Å²	54.6	6%	0.057	28%	0.276	C	S	.	.	H	α-helix	trans	-58.9	-41.2	179.2	-175.9	-91.4	0	0	0	112.1	H583 Y585 L628 N632 L633 L639 F643 L704	H583-F636 AromaticContact CE1-CD2 3.97Å; H583-F636 AromaticContact CE1-CE1 3.76Å; H583-F636 AromaticContact CE1-CE2 3.39Å; H583-F636 WeakPolarHBondContact CE1-CE2 3.34Å; H583-F636 AromaticContact CE1-CZ 3.27Å; H583-F636 WeakPolarHBondContact CE1-CZ 3.48Å; H583-F636 AromaticContact ND1-CZ 3.9Å; H583-F636 AromaticContact NE2-CD1 3.78Å; H583-F636 AromaticContact NE2-CE1 3.39Å; H583-F636 WeakPolarHBondContact NE2-CE1 3.26Å; H583-F636 AromaticContact NE2-CE2 3.83Å; H583-F636 AromaticContact NE2-CZ 3.42Å; H583-F636 WeakPolarHBondContact NE2-CZ 3.45Å; H583-F636 PolarHBondContact NE2-O 3.26Å; Y585-F636 HydrophobicContact CG-CE2 4.41Å; L628-F636 HydrophobicContact CD1-CD2 4.46Å; L628-F636 HydrophobicContact CD1-CE1 4.39Å; L628-F636 HydrophobicContact CD1-CE2 4.17Å; L628-F636 HydrophobicContact CD1-CZ 4.13Å; L628-F636 HydrophobicContact CD2-CD1 3.81Å; L628-F636 HydrophobicContact CD2-CE1 4.02Å; L628-F636 HydrophobicContact CD2-CG 4.19Å; L628-F636 HydrophobicContact CG-CD1 4.35Å; L628-F636 HydrophobicContact CG-CD2 4.41Å; L628-F636 HydrophobicContact CG-CG 4.29Å; N632-F636 WeakPolarHBondContact O-CB 3.48Å; N632-F636 PolarHBondContact O-N 3.39Å; L633-F636 PolarHBondContact O-N 3.12Å; F636-L639 WeakPolarHBondContact O-CB 3.48Å; F636-L639 PolarHBondContact O-N 2.93Å; F636-F643 HydrophobicContact CE1-CD1 4.48Å; F636-F643 HydrophobicContact CE1-CE1 4.45Å; F636-L704 HydrophobicContact CZ-CD2 4.41Å
637	V	79.9	Confident	73.6	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.012	25%	0.254	C	S	.	.	H	α-helix	trans	-67.8	-37.5	178.5	165.2	0	0	0	0	111.6	L633 N634 E635 L639 S640 H644 Y647 L708	L633-V637 HydrophobicContact CD1-CG2 4.19Å; L633-V637 HydrophobicContact CG-CG2 4.33Å; L633-V637 VanDerWaalsContact O-CB 3.32Å; L633-V637 WeakPolarHBondContact O-CB 3.45Å; L633-V637 WeakPolarHBondContact O-CG2 3.46Å; L633-V637 PolarHBondContact O-N 3.01Å; N634-V637 PolarHBondContact O-N 3.47Å; E635-V637 VanDerWaalsContact C-N 3.29Å; E635-V637 PolarHBondContact O-N 2.67Å; V637-L639 VanDerWaalsContact C-N 3.27Å; V637-L639 PolarHBondContact O-N 3.26Å; V637-S640 PolarHBondContact O-N 3.11Å; V637-H644 VanDerWaalsContact CG1-CA 3.44Å; V637-H644 HydrophobicContact CG1-CB 4.16Å; V637-H644 PolarHBondContact O-N 3.47Å; V637-Y647 HydrophobicContact CG1-CD1 4.14Å; V637-Y647 HydrophobicContact CG1-CG 3.89Å; V637-Y647 HydrophobicContact CG2-CD2 4.39Å; V637-Y647 HydrophobicContact CG2-CG 4.37Å; V637-L708 HydrophobicContact CG2-CD1 3.77Å
638	Q	81.2	Confident	75.1	Confident	105 Å²	105	46.5 Å²	46.5	49%	0.491	23%	0.234	S	C	.	.	H	α-helix	trans	-68.7	-21.9	177.9	-75	172	-14.3	0	0	113.3	N634 E635 S640	N634-Q638 WeakPolarHBondContact O-CB 3.26Å; N634-Q638 VanDerWaalsContact O-CG 3.27Å; N634-Q638 WeakPolarHBondContact O-CG 3.48Å; N634-Q638 PolarHBondContact O-N 3.21Å; E635-Q638 PolarHBondContact O-N 3.29Å; E635-Q638 VanDerWaalsContact O-N 3.15Å; Q638-S640 PolarHBondContact O-N 3.02Å
639	L	81.7	Confident	76.5	Confident	14 Å²	14	45.7 Å²	45.7	7%	0.073	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-21.1	176.2	-64.7	173.7	0	0	0	113.8	S514 L516 P584 S622 L623 E635 F636 V637	S514-L639 WeakPolarHBondContact CB-O 3.27Å; S514-L639 PolarHBondContact OG-O 2.98Å; L516-L639 HydrophobicContact CD2-CD2 4.03Å; P584-L639 HydrophobicContact CG-CB 4.49Å; P584-L639 WeakPolarHBondContact CG-O 3.34Å; S622-L639 WeakPolarHBondContact OG-CD1 3.23Å; L623-L639 HydrophobicContact CD2-CD1 3.66Å; L623-L639 HydrophobicContact CG-CD1 3.81Å; E635-L639 WeakPolarHBondContact O-CG 3.34Å; E635-L639 PolarHBondContact O-N 2.91Å; F636-L639 WeakPolarHBondContact O-CB 3.48Å; F636-L639 PolarHBondContact O-N 2.93Å; V637-L639 VanDerWaalsContact C-N 3.27Å; V637-L639 PolarHBondContact O-N 3.26Å
640	S	85.7	Confident	78.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-131.2	123.2	177.1	171.7	0	0	0	0	111.1	Q517 N582 V637 Q638 K642 F643 H644	Q517-S640 PolarHBondContact NE2-OG 2.65Å; N582-S640 PolarHBondContact O-OG 3.17Å; V637-S640 PolarHBondContact O-N 3.11Å; Q638-S640 PolarHBondContact O-N 3.02Å; S640-K642 PolarHBondContact O-N 2.92Å; S640-K642 VanDerWaalsContact O-N 3.16Å; S640-F643 PolarHBondContact O-N 3.13Å; S640-H644 PolarHBondContact O-N 3.01Å
641	G	84.5	Confident	79.8	Confident	10 Å²	10	37.6 Å²	37.6	10%	0.103	19%	0.19	C	C	.	.	H	α-helix	trans	-55.3	-37	179.5	0	0	0	0	0	113.8	R512 Q517 V645	R512-G641 VanDerWaalsContact O-CA 3.23Å; R512-G641 WeakPolarHBondContact O-CA 3.35Å; Q517-G641 VanDerWaalsContact OE1-N 3.1Å; G641-V645 WeakPolarHBondContact O-CG2 3.26Å; G641-V645 PolarHBondContact O-N 3.43Å; G641-V645 VanDerWaalsContact O-N 3.08Å
642	K	88.9	Confident	81.1	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-69.2	-42.2	176.6	-70.2	-171.6	177.6	-171.7	0	113	C511 S640 H644 V645 L646 F768 L798 T800 E805	C511-K642 HydrophobicContact CB-CG 4.17Å; S640-K642 PolarHBondContact O-N 2.92Å; S640-K642 VanDerWaalsContact O-N 3.16Å; K642-H644 VanDerWaalsContact C-N 3.29Å; K642-V645 PolarHBondContact O-N 3.44Å; K642-L646 VanDerWaalsContact O-CB 3.29Å; K642-L646 WeakPolarHBondContact O-CB 3.27Å; K642-L646 PolarHBondContact O-N 3.49Å; K642-F768 HydrophobicContact CB-CE2 4.01Å; K642-F768 HydrophobicContact CB-CZ 3.86Å; K642-F768 HydrophobicContact CD-CE1 4.25Å; K642-F768 HydrophobicContact CD-CZ 4.1Å; K642-F768 PolarHBondContact NZ-O 3.38Å; K642-L798 HydrophobicContact CD-CB 4.42Å; K642-T800 WeakPolarHBondContact CE-OG1 3.41Å; K642-E805 WeakPolarHBondContact CE-OE2 3.49Å; K642-E805 IonicContact NZ-OE1 3.48Å; K642-E805 PolarHBondContact NZ-OE1 3.46Å; K642-E805 IonicContact NZ-OE2 3.69Å; K642-E805 PolarHBondContact NZ-OE2 3.25Å
643	F	89.2	Confident	81.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-64.8	-39.1	177.4	-89.2	-108.9	0	0	0	110.3	N582 H583 F636 S640 L646 Y647 L704 L705 L708 F768	N582-F643 VanDerWaalsContact O-CD2 3.3Å; N582-F643 WeakPolarHBondContact O-CD2 3.33Å; N582-F643 WeakPolarHBondContact O-CE2 3.45Å; H583-F643 HydrophobicContact CB-CD2 4.27Å; H583-F643 HydrophobicContact CB-CE2 3.84Å; H583-F643 HydrophobicContact CB-CZ 4.44Å; H583-F643 AromaticContact CD2-CD2 3.66Å; H583-F643 AromaticContact CD2-CE2 3.87Å; H583-F643 AromaticContact CD2-CG 3.83Å; F636-F643 HydrophobicContact CE1-CD1 4.48Å; F636-F643 HydrophobicContact CE1-CE1 4.45Å; S640-F643 PolarHBondContact O-N 3.13Å; F643-L646 PolarHBondContact O-N 3.1Å; F643-Y647 WeakPolarHBondContact O-CB 3.41Å; F643-Y647 PolarHBondContact O-N 3.46Å; F643-L704 HydrophobicContact CE1-CB 4.16Å; F643-L704 HydrophobicContact CZ-CB 3.92Å; F643-L704 HydrophobicContact CZ-CD1 4.39Å; F643-L705 HydrophobicContact CE1-CD2 4.09Å; F643-L705 HydrophobicContact CZ-CD2 3.94Å; F643-L705 HydrophobicContact CZ-CG 4.45Å; F643-L708 HydrophobicContact CD1-CD1 3.5Å; F643-L708 HydrophobicContact CE1-CD1 4.04Å; F643-F768 HydrophobicContact CD2-CE2 4.22Å; F643-F768 AromaticContact CD2-CZ 3.6Å; F643-F768 HydrophobicContact CD2-CZ 3.6Å; F643-F768 HydrophobicContact CE2-CE1 4.05Å; F643-F768 HydrophobicContact CE2-CE2 4.19Å; F643-F768 AromaticContact CE2-CZ 3.38Å; F643-F768 HydrophobicContact CE2-CZ 3.38Å; F643-F768 HydrophobicContact CZ-CZ 4.28Å
644	H	85.9	Confident	81.7	Confident	52 Å²	52	35 Å²	35	24%	0.241	17%	0.165	C	C	.	.	H	α-helix	trans	-59.2	-52.2	174.6	-172.7	73.5	0	0	0	112.7	V637 S640 K642 L646 Y647 I648	V637-H644 VanDerWaalsContact CG1-CA 3.44Å; V637-H644 HydrophobicContact CG1-CB 4.16Å; V637-H644 PolarHBondContact O-N 3.47Å; S640-H644 PolarHBondContact O-N 3.01Å; K642-H644 VanDerWaalsContact C-N 3.29Å; H644-L646 VanDerWaalsContact C-N 3.32Å; H644-L646 PolarHBondContact O-N 2.81Å; H644-Y647 PolarHBondContact O-N 3.15Å; H644-I648 WeakPolarHBondContact NE2-CD1 3.48Å; H644-I648 WeakPolarHBondContact O-CG1 3.28Å; H644-I648 PolarHBondContact O-N 3.29Å; H644-I648 VanDerWaalsContact O-N 3.1Å
645	V	86.9	Confident	81.3	Confident	8 Å²	8	35.9 Å²	35.9	5%	0.048	17%	0.17	C	C	.	.	H	α-helix	trans	-60.6	-42.9	176	173.4	0	0	0	0	111.2	L509 C511 G641 K642 Y647 I648 M649 L798 I951	L509-V645 HydrophobicContact CD1-CG1 4.3Å; C511-V645 HydrophobicContact CB-CG2 4.21Å; G641-V645 WeakPolarHBondContact O-CG2 3.26Å; G641-V645 PolarHBondContact O-N 3.43Å; G641-V645 VanDerWaalsContact O-N 3.08Å; K642-V645 PolarHBondContact O-N 3.44Å; V645-Y647 PolarHBondContact O-N 3.32Å; V645-I648 PolarHBondContact O-N 3.42Å; V645-M649 HydrophobicContact CG1-CG 4.42Å; V645-M649 HydrophobicContact CG1-SD 4.11Å; V645-M649 VanDerWaalsContact O-CG 3.29Å; V645-M649 WeakPolarHBondContact O-CG 3.49Å; V645-M649 PolarHBondContact O-N 3.39Å; V645-L798 HydrophobicContact CG1-CD2 4.31Å; V645-I951 HydrophobicContact CG2-CD1 4.41Å; V645-I951 HydrophobicContact CG2-CG1 4.21Å
646	L	88	Confident	80.3	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-41.8	178.2	-179.4	65.4	0	0	0	112.4	K642 F643 H644 M649 L650 L694 L705 L708 I766 F768 L798	K642-L646 VanDerWaalsContact O-CB 3.29Å; K642-L646 WeakPolarHBondContact O-CB 3.27Å; K642-L646 PolarHBondContact O-N 3.49Å; F643-L646 PolarHBondContact O-N 3.1Å; H644-L646 VanDerWaalsContact C-N 3.32Å; H644-L646 PolarHBondContact O-N 2.81Å; L646-M649 PolarHBondContact O-N 3.44Å; L646-L650 HydrophobicContact CD1-CD1 4.27Å; L646-L650 HydrophobicContact CD1-CG 4.2Å; L646-L650 HydrophobicContact CD2-CD1 4.49Å; L646-L650 HydrophobicContact CG-CD1 3.96Å; L646-L650 HydrophobicContact CG-CG 4.32Å; L646-L650 WeakPolarHBondContact O-CB 3.43Å; L646-L650 VanDerWaalsContact O-CG 3.3Å; L646-L650 WeakPolarHBondContact O-CG 3.17Å; L646-L650 PolarHBondContact O-N 3.08Å; L646-L694 HydrophobicContact CD1-CD2 4.07Å; L646-L705 HydrophobicContact CD2-CD2 3.34Å; L646-L708 HydrophobicContact CD2-CD2 4.43Å; L646-I766 HydrophobicContact CD1-CD1 3.8Å; L646-F768 HydrophobicContact CD2-CD2 4.13Å; L646-F768 HydrophobicContact CD2-CE2 4.03Å; L646-L798 HydrophobicContact CB-CD1 4.49Å
647	Y	86.3	Confident	78.3	Confident	46 Å²	46	46.5 Å²	46.5	18%	0.18	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-45.4	177.4	172.9	-104.3	0	0	0	111.3	L633 N634 V637 F643 H644 V645 M649 L650 K651 V712	L633-Y647 HydrophobicContact CD2-CE2 4.32Å; N634-Y647 PolarHBondContact OD1-OH 3.1Å; V637-Y647 HydrophobicContact CG1-CD1 4.14Å; V637-Y647 HydrophobicContact CG1-CG 3.89Å; V637-Y647 HydrophobicContact CG2-CD2 4.39Å; V637-Y647 HydrophobicContact CG2-CG 4.37Å; F643-Y647 WeakPolarHBondContact O-CB 3.41Å; F643-Y647 PolarHBondContact O-N 3.46Å; H644-Y647 PolarHBondContact O-N 3.15Å; V645-Y647 PolarHBondContact O-N 3.32Å; Y647-M649 VanDerWaalsContact C-N 3.35Å; Y647-M649 PolarHBondContact O-N 3.22Å; Y647-L650 PolarHBondContact O-N 2.98Å; Y647-K651 WeakPolarHBondContact O-CB 3.33Å; Y647-K651 PolarHBondContact O-N 3.44Å; Y647-V712 HydrophobicContact CD2-CG2 3.6Å; Y647-V712 HydrophobicContact CE2-CG2 3.72Å
648	I	83.8	Confident	76	Confident	42 Å²	42	55.3 Å²	55.3	22%	0.215	26%	0.263	C	S	.	.	H	α-helix	trans	-61	-44.9	175.4	-65.9	167.5	0	0	0	110.7	H644 V645 K651 R652	H644-I648 WeakPolarHBondContact NE2-CD1 3.48Å; H644-I648 WeakPolarHBondContact O-CG1 3.28Å; H644-I648 PolarHBondContact O-N 3.29Å; H644-I648 VanDerWaalsContact O-N 3.1Å; V645-I648 PolarHBondContact O-N 3.42Å; I648-K651 PolarHBondContact O-N 3.41Å; I648-R652 PolarHBondContact O-N 3.16Å
649	M	83.9	Confident	73.5	Confident	20 Å²	20	54.3 Å²	54.3	10%	0.099	27%	0.268	C	S	.	.	H	α-helix	trans	-60.7	-45.8	177.1	-72.3	178.8	76.3	0	0	111.8	L509 V645 L646 Y647 R652 L653 I766 Y796 L798	L509-M649 HydrophobicContact CD1-CE 4.2Å; L509-M649 HydrophobicContact CD1-SD 3.74Å; V645-M649 HydrophobicContact CG1-CG 4.42Å; V645-M649 HydrophobicContact CG1-SD 4.11Å; V645-M649 VanDerWaalsContact O-CG 3.29Å; V645-M649 WeakPolarHBondContact O-CG 3.49Å; V645-M649 PolarHBondContact O-N 3.39Å; L646-M649 PolarHBondContact O-N 3.44Å; Y647-M649 VanDerWaalsContact C-N 3.35Å; Y647-M649 PolarHBondContact O-N 3.22Å; M649-R652 PolarHBondContact O-N 3.04Å; M649-L653 WeakPolarHBondContact O-CB 3.42Å; M649-L653 VanDerWaalsContact O-CG 3.23Å; M649-L653 WeakPolarHBondContact O-CG 3.48Å; M649-L653 PolarHBondContact O-N 3.2Å; M649-I766 HydrophobicContact CE-CD1 3.74Å; M649-I766 HydrophobicContact CE-CG1 4.21Å; M649-I766 HydrophobicContact SD-CD1 4.32Å; M649-Y796 HydrophobicContact CE-CD1 3.8Å; M649-Y796 HydrophobicContact CE-CD2 3.87Å; M649-Y796 HydrophobicContact CE-CE1 4.03Å; M649-Y796 HydrophobicContact CE-CE2 4.1Å; M649-Y796 HydrophobicContact CE-CG 3.71Å; M649-L798 HydrophobicContact SD-CD2 4.47Å
650	L	83.8	Confident	71.1	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-65.7	-42.5	179.6	-72.1	171.6	0	0	0	111.9	L646 Y647 R652 L653 F654 L692 L708 V712 I745	L646-L650 HydrophobicContact CD1-CD1 4.27Å; L646-L650 HydrophobicContact CD1-CG 4.2Å; L646-L650 HydrophobicContact CD2-CD1 4.49Å; L646-L650 HydrophobicContact CG-CD1 3.96Å; L646-L650 HydrophobicContact CG-CG 4.32Å; L646-L650 WeakPolarHBondContact O-CB 3.43Å; L646-L650 VanDerWaalsContact O-CG 3.3Å; L646-L650 WeakPolarHBondContact O-CG 3.17Å; L646-L650 PolarHBondContact O-N 3.08Å; Y647-L650 PolarHBondContact O-N 2.98Å; L650-R652 PolarHBondContact O-N 3.37Å; L650-L653 PolarHBondContact O-N 3.26Å; L650-F654 HydrophobicContact CD2-CD2 4.1Å; L650-F654 HydrophobicContact CD2-CE2 3.72Å; L650-F654 WeakPolarHBondContact O-CB 3.49Å; L650-F654 WeakPolarHBondContact O-CD2 3.36Å; L650-F654 PolarHBondContact O-N 3.5Å; L650-L692 HydrophobicContact CD2-CD2 3.42Å; L650-L692 VanDerWaalsContact CD2-CD2 3.42Å; L650-L708 HydrophobicContact CD1-CD2 3.31Å; L650-V712 HydrophobicContact CB-CG1 3.85Å; L650-I745 HydrophobicContact CD2-CD1 4.13Å
651	K	80.9	Confident	68.4	Low	98 Å²	98	64.5 Å²	64.5	43%	0.426	34%	0.34	S	S	.	.	H	α-helix	trans	-59.6	-47.4	176.4	-170.7	175.6	179.5	-176.8	0	110.5	Y647 I648 L653 F654 D655	Y647-K651 WeakPolarHBondContact O-CB 3.33Å; Y647-K651 PolarHBondContact O-N 3.44Å; I648-K651 PolarHBondContact O-N 3.41Å; K651-L653 PolarHBondContact O-N 3Å; K651-F654 PolarHBondContact O-N 3.22Å; K651-D655 WeakPolarHBondContact CG-OD2 3.39Å; K651-D655 WeakPolarHBondContact O-CA 3.24Å; K651-D655 WeakPolarHBondContact O-CB 3.22Å; K651-D655 PolarHBondContact O-N 2.99Å
652	R	75.9	Confident	65.9	Low	76 Å²	76	69.5 Å²	69.5	29%	0.287	37%	0.373	S	S	.	.	H	α-helix	trans	-67.3	-36	178.2	-72.3	-173.3	173.1	172.8	0.3	114	I648 M649 L650 F913 S917	I648-R652 PolarHBondContact O-N 3.16Å; M649-R652 PolarHBondContact O-N 3.04Å; L650-R652 PolarHBondContact O-N 3.37Å; R652-F913 HydrophobicContact CB-CZ 4.41Å; R652-F913 VanDerWaalsContact NH1-CE1 3.3Å; R652-F913 PolarHBondContact NH1-O 3.2Å; R652-F913 VanDerWaalsContact NH1-O 3.13Å; R652-F913 PolarHBondContact NH2-O 3.44Å; R652-S917 PolarHBondContact NH2-OG 3.1Å; R652-S917 VanDerWaalsContact NH2-OG 3.07Å
653	L	75.7	Confident	63.1	Low	33 Å²	33	79.7 Å²	79.7	17%	0.173	42%	0.418	C	S	.	.	H	α-helix	trans	-73.2	-30.1	179.2	-74.4	171.7	0	0	0	113	M649 L650 K651 Y764	M649-L653 WeakPolarHBondContact O-CB 3.42Å; M649-L653 VanDerWaalsContact O-CG 3.23Å; M649-L653 WeakPolarHBondContact O-CG 3.48Å; M649-L653 PolarHBondContact O-N 3.2Å; L650-L653 PolarHBondContact O-N 3.26Å; K651-L653 PolarHBondContact O-N 3Å; L653-Y764 HydrophobicContact CD2-CD2 4.32Å; L653-Y764 HydrophobicContact CD2-CE1 4.19Å; L653-Y764 HydrophobicContact CD2-CE2 3.87Å
654	F	71	Confident	60.4	Low	27 Å²	27	84.4 Å²	84.4	12%	0.118	45%	0.451	C	S	.	.	H	α-helix	trans	-115.4	-3.6	-172.8	-63.6	-63.4	0	0	0	115	L650 K651 K656 L692 T713 R744 I745	L650-F654 HydrophobicContact CD2-CD2 4.1Å; L650-F654 HydrophobicContact CD2-CE2 3.72Å; L650-F654 WeakPolarHBondContact O-CB 3.49Å; L650-F654 WeakPolarHBondContact O-CD2 3.36Å; L650-F654 PolarHBondContact O-N 3.5Å; K651-F654 PolarHBondContact O-N 3.22Å; F654-K656 PolarHBondContact O-N 3.49Å; F654-K656 VanDerWaalsContact O-N 3.1Å; F654-L692 HydrophobicContact CE2-CD2 4.32Å; F654-L692 HydrophobicContact CZ-CB 4.33Å; F654-T713 HydrophobicContact CB-CG2 4.31Å; F654-T713 HydrophobicContact CD2-CG2 3.55Å; F654-T713 HydrophobicContact CE2-CG2 3.96Å; F654-T713 HydrophobicContact CG-CG2 3.87Å; F654-R744 HydrophobicContact CE1-CB 3.71Å; F654-R744 HydrophobicContact CE1-CG 4.27Å; F654-R744 HydrophobicContact CZ-CB 4.13Å; F654-I745 HydrophobicContact CD2-CD1 4.46Å; F654-I745 HydrophobicContact CE2-CD1 3.7Å; F654-I745 HydrophobicContact CE2-CG1 3.92Å; F654-I745 HydrophobicContact CZ-CD1 4.06Å; F654-I745 HydrophobicContact CZ-CG1 3.76Å
655	D	63.6	Low	57.7	Low	109 Å²	109	89.5 Å²	89.5	58%	0.583	48%	0.48	S	S	*	.			trans	-61.1	117.2	175.7	-111.7	-25.2	0	0	0	110	K651 E657	K651-D655 WeakPolarHBondContact CG-OD2 3.39Å; K651-D655 WeakPolarHBondContact O-CA 3.24Å; K651-D655 WeakPolarHBondContact O-CB 3.22Å; K651-D655 PolarHBondContact O-N 2.99Å; D655-E657 PolarHBondContact O-N 3.22Å
656	K	50.5	Low	55.2	Low	173 Å²	173	94.8 Å²	94.8	75%	0.752	52%	0.517	S	S	*	.			trans	-74.2	110.9	169.1	-71.9	174.8	178.6	172.2	0	106.2	F654 L658	F654-K656 PolarHBondContact O-N 3.49Å; F654-K656 VanDerWaalsContact O-N 3.1Å; K656-L658 PolarHBondContact O-N 3.41Å
657	E	36.7	Very low	52.4	Low	162 Å²	162	101.9 Å²	101.9	76%	0.757	56%	0.555	S	S	*	*			trans	-48.7	118.6	162.8	-81.3	-168.1	163.5	0	0	109	D655 S659	D655-E657 PolarHBondContact O-N 3.22Å; E657-S659 PolarHBondContact O-N 3.06Å
658	L	31.3	Very low	49.8	Very low	187 Å²	187	106.4 Å²	106.4	98%	0.979	59%	0.587	S	S	*	*			trans	-57	81.3	161.7	-114.1	89.4	0	0	0	108.2	K656	K656-L658 PolarHBondContact O-N 3.41Å
659	S	29	Very low	47.3	Very low	84 Å²	84	108.8 Å²	108.8	59%	0.587	61%	0.614	S	S	*	*			trans	-139.9	47.7	176.4	63	0	0	0	0	112.2	E657	E657-S659 PolarHBondContact O-N 3.06Å
660	S	30.9	Very low	44.7	Very low	109 Å²	109	115.3 Å²	115.3	76%	0.762	65%	0.649	S	S	*	*	S	Bend	trans	-174.3	135.1	151.9	42.8	0	0	0	0	111.7
661	S	29.8	Very low	42.3	Very low	118 Å²	118	122.3 Å²	122.3	83%	0.825	69%	0.691	S	S	*	*			trans	76	107.7	-178	76.6	0	0	0	0	114.4
662	S	32.3	Very low	40	Very low	115 Å²	115	125.5 Å²	125.5	80%	0.804	71%	0.708	S	S	*	*				-156	124.2	60.5	-62.6	0	0	0	0	111.7
663	K	29.2	Very low	37.9	Very low	215 Å²	215	131 Å²	131	94%	0.935	73%	0.734	S	S	*	*			trans	-82.8	116.9	162.9	-73.5	174.9	176	174.4	0	108.1
664	S	32.2	Very low	35.8	Very low	99 Å²	99	138.8 Å²	138.8	69%	0.692	77%	0.766	S	S	*	*			trans	-172.9	112.7	147	51.9	0	0	0	0	112.2
665	N	28.8	Very low	33.8	Very low	159 Å²	159	142.8 Å²	142.8	85%	0.85	80%	0.795	S	S	*	*			trans	55	108.8	141.6	-58.7	-11.8	0	0	0	120
666	S	35.8	Very low	32	Very low	119 Å²	119	148.4 Å²	148.4	83%	0.832	81%	0.808	S	S	*	*				179.3	129.7	97.4	56.1	0	0	0	0	112.4
667	N	29.3	Very low	31	Very low	148 Å²	148	148.8 Å²	148.8	79%	0.791	82%	0.817	S	S	*	*			trans	-36	139.2	172.3	-52.4	-39.6	0	0	0	116.2
668	T	31.1	Very low	30.5	Very low	141 Å²	141	145.4 Å²	145.4	87%	0.865	81%	0.812	S	S	*	*				168.1	149.5	103.4	35.2	0	0	0	0	113.1
669	A	31.1	Very low	30.2	Very low	93 Å²	93	143.6 Å²	143.6	77%	0.769	80%	0.803	S	S	*	*			trans	81.1	81.6	158.8	0	0	0	0	0	120.2
670	N	28.9	Very low	30.2	Very low	156 Å²	156	145.5 Å²	145.5	83%	0.834	82%	0.816	S	S	*	*				15.3	113	127.8	-69	-23.1	0	0	0	118.9
671	V	34.2	Very low	29.9	Very low	148 Å²	148	146 Å²	146	90%	0.897	82%	0.82	S	S	*	*				-145	120.8	126.7	177.3	0	0	0	0	109.4
672	Q	32	Very low	29.8	Very low	164 Å²	164	145.8 Å²	145.8	77%	0.766	82%	0.818	S	S	*	*			trans	-73.9	137	171.7	-62.3	170	-14.9	0	0	110.4
673	K	31.8	Very low	29.7	Very low	191 Å²	191	150 Å²	150	83%	0.83	82%	0.822	S	S	*	*				176.6	115.9	119.4	-95.3	163.3	-175.9	175.5	0	114.3
674	K	31.2	Very low	29.8	Very low	197 Å²	197	144.7 Å²	144.7	86%	0.857	80%	0.804	S	S	*	*			trans	89.9	128.7	141.1	-77.5	-174.6	174.8	-179	0	121.3
675	P	30.8	Very low	29.7	Very low	111 Å²	111	146.9 Å²	146.9	72%	0.721	81%	0.808	S	S	*	*			trans	-113	173	-174.4	45.3	-35.7	0	0	0	114.2
676	R	24.9	Very low	30.4	Very low	227 Å²	227	144.2 Å²	144.2	86%	0.857	79%	0.793	S	S	*	*			trans	79.9	106.1	156.5	-65.1	177.2	177	176	-2.1	118.8
677	L	29.9	Very low	31.1	Very low	181 Å²	181	145.3 Å²	145.3	95%	0.948	79%	0.785	S	S	*	*				-142.5	115.9	122.6	-100.2	130.7	0	0	0	109.4
678	S	25.8	Very low	32.5	Very low	92 Å²	92	143.3 Å²	143.3	64%	0.643	78%	0.778	S	S	*	*			trans	-78.1	151.4	171.6	46.2	0	0	0	0	110.8
679	N	25.5	Very low	34.5	Very low	149 Å²	149	140.6 Å²	140.6	80%	0.797	76%	0.758	S	S	*	*			trans	104.6	92.4	161.1	-54.8	-14.4	0	0	0	116.3
680	S	28.3	Very low	37	Very low	124 Å²	124	137.1 Å²	137.1	87%	0.867	73%	0.727	S	S	*	*				-177.8	111.4	118.6	34.8	0	0	0	0	109.7	S682	S680-S682 PolarHBondContact O-N 3.01Å
681	S	25	Very low	39.8	Very low	120 Å²	120	130 Å²	130	84%	0.839	69%	0.688	S	S	*	*			trans	-79.4	108.9	-178.6	-49	0	0	0	0	109.6
682	S	28.1	Very low	42.5	Very low	113 Å²	113	123 Å²	123	79%	0.79	65%	0.646	S	S	*	*			trans	-167.8	68.3	158.6	-77.2	0	0	0	0	108.4	S680	S680-S682 PolarHBondContact O-N 3.01Å
683	K	29.9	Very low	45.4	Very low	203 Å²	203	115.1 Å²	115.1	88%	0.883	61%	0.609	S	S	*	*			trans	-84.7	120	171.3	-79.1	-174.7	173.9	-175.2	0	108.6	N685	K683-N685 PolarHBondContact O-N 3.47Å
684	N	30.9	Very low	48.3	Very low	104 Å²	104	106 Å²	106	56%	0.556	57%	0.569	S	S	*	*			trans	-51.4	100.2	177.2	-64.9	-26.6	0	0	0	111.8	L686	N684-L686 PolarHBondContact O-N 3.27Å
685	N	30.7	Very low	51.3	Low	144 Å²	144	96.8 Å²	96.8	77%	0.77	53%	0.53	S	S	*	.			trans	-80.7	90.2	165.6	-85.7	-26.4	0	0	0	108.4	K683 H687	K683-N685 PolarHBondContact O-N 3.47Å; N685-H687 PolarHBondContact O-N 3.06Å; N685-H687 VanDerWaalsContact O-N 3.16Å
686	L	42.3	Very low	54.3	Low	104 Å²	104	91.5 Å²	91.5	55%	0.545	50%	0.495	S	S	.	.			trans	-62.9	115.2	165.8	-156.8	73.8	0	0	0	107.5	N684 T688	N684-L686 PolarHBondContact O-N 3.27Å; L686-T688 PolarHBondContact O-N 3.41Å
687	H	52.4	Low	57.4	Low	141 Å²	141	82 Å²	82	65%	0.653	46%	0.461	S	S	*	.			trans	-65.2	126.8	-170.5	-78.3	-73.2	0	0	0	110.9	N685 N689 D690	N685-H687 PolarHBondContact O-N 3.06Å; N685-H687 VanDerWaalsContact O-N 3.16Å; H687-N689 PolarHBondContact O-N 3.4Å; H687-D690 PolarHBondContact O-N 3.4Å
688	T	57.9	Low	60.2	Low	107 Å²	107	75.4 Å²	75.4	66%	0.656	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	6.1	179.8	54.2	0	0	0	0	115.9	L686 R744	L686-T688 PolarHBondContact O-N 3.41Å; T688-R744 PolarHBondContact O-NH2 3.27Å
689	N	72.9	Confident	63.3	Low	84 Å²	84	74.5 Å²	74.5	45%	0.449	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120	9.7	-172.1	-78.2	-23.4	0	0	0	113.9	H687 R791	H687-N689 PolarHBondContact O-N 3.4Å; N689-R791 VanDerWaalsContact C-NH1 3.32Å; N689-R791 PolarHBondContact O-NH1 3.26Å
690	D	83.1	Confident	66.3	Low	19 Å²	19	70.3 Å²	70.3	10%	0.102	39%	0.391	C	S	.	.			trans	-63.6	141.1	179.9	-71.7	-16.8	0	0	0	112.6	H687 N763 Y764 R791	H687-D690 PolarHBondContact O-N 3.4Å; D690-N763 WeakPolarHBondContact CA-OD1 3.09Å; D690-N763 PolarHBondContact OD1-ND2 3.22Å; D690-Y764 HydrophobicContact CB-CD2 4.19Å; D690-Y764 HydrophobicContact CB-CE2 3.93Å; D690-Y764 WeakPolarHBondContact OD2-CE2 3.2Å; D690-R791 IonicContact OD1-NH1 3.36Å
691	R	88.5	Confident	69.4	Low	6 Å²	6	64.4 Å²	64.4	2%	0.023	35%	0.35	C	S	.	.			trans	-131.1	131.4	-173.1	-69.5	-177.6	-172.4	-177.7	-1.9	110.3	I736 D738 P739 S741 R744 G761 A762 N763 Y764	R691-I736 VanDerWaalsContact NH1-C 3.34Å; R691-I736 PolarHBondContact NH1-O 2.74Å; R691-D738 PolarHBondContact NH1-O 3.43Å; R691-D738 PolarHBondContact NH2-O 3.34Å; R691-P739 PolarHBondContact NH2-O 3.37Å; R691-S741 PolarHBondContact NH1-OG 3.2Å; R691-S741 PolarHBondContact NH2-O 2.82Å; R691-S741 VanDerWaalsContact NH2-O 3.08Å; R691-S741 PolarHBondContact NH2-OG 3.29Å; R691-R744 CarbonylContact C-O 3.54Å; R691-R744 VanDerWaalsContact CA-O 3.29Å; R691-R744 WeakPolarHBondContact CA-O 3.19Å; R691-G761 WeakPolarHBondContact CD-O 3.36Å; R691-A762 HydrophobicContact CB-CB 4.43Å; R691-N763 PolarHBondContact N-OD1 2.66Å; R691-N763 PolarHBondContact O-N 2.77Å; R691-N763 PolarHBondContact O-OD1 3.14Å; R691-Y764 PolarHBondContact O-N 2.72Å; R691-Y764 VanDerWaalsContact O-N 3.08Å
692	L	90.9	Very high	72.5	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.9	-171.3	174.3	64.7	0	0	0	111.2	L650 F654 L694 R744 I745 L746 Y764 I766	L650-L692 HydrophobicContact CD2-CD2 3.42Å; L650-L692 VanDerWaalsContact CD2-CD2 3.42Å; F654-L692 HydrophobicContact CE2-CD2 4.32Å; F654-L692 HydrophobicContact CZ-CB 4.33Å; L692-L694 HydrophobicContact CD1-CD2 4.14Å; L692-L694 HydrophobicContact CD2-CD2 3.85Å; L692-L694 HydrophobicContact CD2-CG 4.18Å; L692-L694 HydrophobicContact CG-CD2 4Å; L692-L694 HydrophobicContact CG-CG 4.23Å; L692-R744 PolarHBondContact N-O 2.98Å; L692-I745 WeakPolarHBondContact O-CA 3.11Å; L692-L746 PolarHBondContact O-N 2.93Å; L692-Y764 WeakPolarHBondContact CA-O 3.05Å; L692-I766 HydrophobicContact CD1-CD1 3.65Å; L692-I766 HydrophobicContact CD1-CG1 3.74Å; L692-I766 HydrophobicContact CD2-CD1 4.19Å
693	V	92.6	Very high	75.5	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	117.3	169.5	-177.2	0	0	0	0	109.3	V695 L746 L748 A762 Y764 L765 I766 I784	V693-V695 HydrophobicContact CG1-CG2 4.1Å; V693-L746 CarbonylContact C-O 3.59Å; V693-L746 VanDerWaalsContact CA-O 3.31Å; V693-L746 WeakPolarHBondContact CA-O 3.49Å; V693-L746 HydrophobicContact CG1-CD2 4.48Å; V693-L746 HydrophobicContact CG2-CB 4.3Å; V693-L746 HydrophobicContact CG2-CD2 4.23Å; V693-L748 HydrophobicContact CG1-CB 4.06Å; V693-L748 HydrophobicContact CG1-CD2 4.2Å; V693-A762 HydrophobicContact CG2-CB 3.47Å; V693-A762 VanDerWaalsContact CG2-CB 3.47Å; V693-Y764 PolarHBondContact N-O 2.93Å; V693-L765 WeakPolarHBondContact O-CA 3.28Å; V693-I766 PolarHBondContact O-N 3.23Å; V693-I784 HydrophobicContact CB-CD1 3.91Å; V693-I784 HydrophobicContact CG2-CD1 3.68Å; V693-I784 HydrophobicContact CG2-CG1 4.4Å
694	L	93.4	Very high	78.3	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	122.2	173.2	-63.3	-177.7	0	0	0	109.3	L646 L692 C709 I745 L746 L747 L748 I766	L646-L694 HydrophobicContact CD1-CD2 4.07Å; L692-L694 HydrophobicContact CD1-CD2 4.14Å; L692-L694 HydrophobicContact CD2-CD2 3.85Å; L692-L694 HydrophobicContact CD2-CG 4.18Å; L692-L694 HydrophobicContact CG-CD2 4Å; L692-L694 HydrophobicContact CG-CG 4.23Å; L694-C709 WeakPolarHBondContact CD1-SG 3.42Å; L694-I745 HydrophobicContact CD1-CG2 4.42Å; L694-L746 PolarHBondContact N-O 3.29Å; L694-L747 HydrophobicContact CB-CD2 3.86Å; L694-L747 HydrophobicContact CD1-CD2 3.75Å; L694-L747 HydrophobicContact CG-CD2 4.24Å; L694-L748 PolarHBondContact O-N 3.06Å; L694-I766 HydrophobicContact CD2-CB 3.65Å; L694-I766 HydrophobicContact CD2-CD1 3.77Å; L694-I766 HydrophobicContact CD2-CG1 4.11Å; L694-I766 HydrophobicContact CD2-CG2 4.3Å
695	V	93.3	Very high	81.1	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.018	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130.4	179.4	-172.1	0	0	0	0	110	V693 L748 L765 I766 L767 F768 A780	V693-V695 HydrophobicContact CG1-CG2 4.1Å; V695-L748 VanDerWaalsContact CA-O 3.26Å; V695-L748 WeakPolarHBondContact CA-O 3.27Å; V695-L748 HydrophobicContact CG2-CB 4.35Å; V695-L748 HydrophobicContact CG2-CD2 4.24Å; V695-L765 HydrophobicContact CG2-CD1 4.37Å; V695-L765 HydrophobicContact CG2-CD2 4.28Å; V695-L765 HydrophobicContact CG2-CG 4.24Å; V695-I766 PolarHBondContact N-O 2.93Å; V695-L767 HydrophobicContact CB-CD2 3.65Å; V695-L767 HydrophobicContact CG1-CD2 3.96Å; V695-L767 HydrophobicContact CG2-CD2 3.98Å; V695-F768 WeakPolarHBondContact O-CB 3.45Å; V695-F768 PolarHBondContact O-N 3.29Å; V695-A780 HydrophobicContact CG1-CB 4.15Å
696	S	93.5	Very high	84	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	146.5	172	-179.8	0	0	0	0	112.3	F698 L748 S749 S750 D769	S696-F698 PolarHBondContact OG-N 2.98Å; S696-F698 PolarHBondContact OG-O 3.19Å; S696-L748 PolarHBondContact N-O 2.92Å; S696-L748 VanDerWaalsContact N-O 3.08Å; S696-S749 CarbonylContact O-C 3.5Å; S696-S749 WeakPolarHBondContact O-CA 3.25Å; S696-S750 PolarHBondContact O-N 3.29Å; S696-D769 WeakPolarHBondContact CA-OD1 3.31Å; S696-D769 WeakPolarHBondContact CB-OD1 3.41Å; S696-D769 PolarHBondContact OG-OD1 2.89Å
697	N	90.1	Very high	86.1	Confident	27 Å²	27	37.9 Å²	37.9	14%	0.144	19%	0.194	C	C	.	.	S	Bend	trans	-76.8	-26.3	173.4	-57.5	-62.9	0	0	0	112.1	S750 D769	N697-S750 WeakPolarHBondContact CA-OG 3.19Å; N697-S750 WeakPolarHBondContact OD1-CB 3.5Å; N697-S750 PolarHBondContact OD1-OG 3.07Å; N697-D769 WeakPolarHBondContact CA-OD2 3.32Å; N697-D769 WeakPolarHBondContact CB-OD2 3.36Å; N697-D769 PolarHBondContact N-OD1 3.4Å; N697-D769 PolarHBondContact N-OD2 3.38Å; N697-D769 PolarHBondContact ND2-O 3.03Å; N697-D769 VanDerWaalsContact ND2-O 3.12Å; N697-D769 PolarHBondContact ND2-OD2 3.33Å
698	F	89.8	Confident	87.7	Confident	43 Å²	43	31.1 Å²	31.1	19%	0.189	16%	0.163	C	C	.	.			trans	-104.6	122	-173.7	-61.9	-84.5	0	0	0	111.8	R578 S696 Q700 T701 L702 D769	R578-F698 HydrophobicContact CB-CE2 4.27Å; R578-F698 HydrophobicContact CB-CZ 4.05Å; S696-F698 PolarHBondContact OG-N 2.98Å; S696-F698 PolarHBondContact OG-O 3.19Å; F698-Q700 PolarHBondContact O-N 2.88Å; F698-T701 WeakPolarHBondContact O-CB 3.48Å; F698-T701 PolarHBondContact O-N 2.98Å; F698-T701 VanDerWaalsContact O-N 3.12Å; F698-L702 PolarHBondContact O-N 3.12Å; F698-L702 VanDerWaalsContact O-N 3.14Å; F698-D769 WeakPolarHBondContact CD2-OD2 3.31Å
699	T	90.3	Very high	89	Confident	72 Å²	72	26 Å²	26	44%	0.442	13%	0.131	S	C	.	.	H	α-helix	trans	-63.7	-29.9	176.5	53.3	0	0	0	0	112.9	T701 L702 N703	T699-T701 VanDerWaalsContact C-N 3.33Å; T699-L702 PolarHBondContact O-N 2.81Å; T699-N703 PolarHBondContact O-N 2.85Å; T699-N703 VanDerWaalsContact O-N 3.12Å; T699-N703 PolarHBondContact O-OD1 3.46Å
700	Q	89.3	Confident	89.6	Confident	61 Å²	61	24.7 Å²	24.7	29%	0.285	12%	0.124	S	C	.	.	H	α-helix	trans	-64.1	-38.9	174.6	-62	-178.5	-18.4	0	0	111.5	L586 F698 N703 L704	L586-Q700 HydrophobicContact CD2-CB 3.72Å; F698-Q700 PolarHBondContact O-N 2.88Å; Q700-N703 PolarHBondContact O-N 3.26Å; Q700-L704 PolarHBondContact O-N 3.23Å
701	T	91.6	Very high	89.6	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-66.4	-43	174	-53.1	0	0	0	0	110.7	N582 L586 F698 T699 N703 L704 L705 F768	N582-T701 HydrophobicContact CB-CG2 4.46Å; N582-T701 PolarHBondContact ND2-OG1 2.91Å; L586-T701 VanDerWaalsContact CD1-OG1 3.31Å; L586-T701 WeakPolarHBondContact CD1-OG1 3.44Å; F698-T701 WeakPolarHBondContact O-CB 3.48Å; F698-T701 PolarHBondContact O-N 2.98Å; F698-T701 VanDerWaalsContact O-N 3.12Å; T699-T701 VanDerWaalsContact C-N 3.33Å; T701-N703 VanDerWaalsContact C-N 3.26Å; T701-N703 PolarHBondContact O-N 2.78Å; T701-L704 PolarHBondContact O-N 3.24Å; T701-L705 HydrophobicContact CG2-CD1 4.04Å; T701-L705 HydrophobicContact CG2-CG 4.23Å; T701-L705 WeakPolarHBondContact O-CG 3.23Å; T701-L705 PolarHBondContact O-N 2.86Å; T701-F768 HydrophobicContact CG2-CD1 3.61Å; T701-F768 HydrophobicContact CG2-CE1 3.51Å; T701-F768 HydrophobicContact CG2-CZ 4.42Å
702	L	91.7	Very high	89.2	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-56.5	-38.1	175.5	-67.8	177.9	0	0	0	112.7	F698 T699 L704 L705 E706 L747	F698-L702 PolarHBondContact O-N 3.12Å; F698-L702 VanDerWaalsContact O-N 3.14Å; T699-L702 PolarHBondContact O-N 2.81Å; L702-L704 VanDerWaalsContact C-N 3.31Å; L702-L704 PolarHBondContact O-N 2.7Å; L702-L705 HydrophobicContact CD2-CD1 4.41Å; L702-L705 PolarHBondContact O-N 3.44Å; L702-E706 WeakPolarHBondContact O-CB 3.38Å; L702-E706 PolarHBondContact O-N 3.24Å; L702-L747 HydrophobicContact CD2-CB 4.28Å
703	N	90.6	Very high	88.6	Confident	71 Å²	71	29 Å²	29	38%	0.38	15%	0.15	S	C	.	.	H	α-helix	trans	-62.8	-36.6	176.4	-63.4	-16.9	0	0	0	112.6	T699 Q700 T701 K707 R719	T699-N703 PolarHBondContact O-N 2.85Å; T699-N703 VanDerWaalsContact O-N 3.12Å; T699-N703 PolarHBondContact O-OD1 3.46Å; Q700-N703 PolarHBondContact O-N 3.26Å; T701-N703 VanDerWaalsContact C-N 3.26Å; T701-N703 PolarHBondContact O-N 2.78Å; N703-K707 PolarHBondContact O-N 2.81Å; N703-R719 PolarHBondContact OD1-NH1 2.92Å; N703-R719 PolarHBondContact OD1-NH2 2.82Å
704	L	88.6	Confident	87.8	Confident	11 Å²	11	32.3 Å²	32.3	6%	0.058	18%	0.184	C	C	.	.	H	α-helix	trans	-74	-41.7	176.7	-63.5	-179.2	0	0	0	111.3	H583 Y585 L586 F636 F643 Q700 T701 L702 E706 K707 L708	H583-L704 HydrophobicContact CB-CD1 4.23Å; Y585-L704 HydrophobicContact CD1-CD1 4.12Å; Y585-L704 HydrophobicContact CD1-CD2 3.84Å; Y585-L704 HydrophobicContact CE1-CD2 3.98Å; L586-L704 HydrophobicContact CD1-CD1 4.19Å; L586-L704 HydrophobicContact CD2-CD1 3.58Å; L586-L704 HydrophobicContact CD2-CG 4.29Å; L586-L704 HydrophobicContact CG-CD1 3.67Å; F636-L704 HydrophobicContact CZ-CD2 4.41Å; F643-L704 HydrophobicContact CE1-CB 4.16Å; F643-L704 HydrophobicContact CZ-CB 3.92Å; F643-L704 HydrophobicContact CZ-CD1 4.39Å; Q700-L704 PolarHBondContact O-N 3.23Å; T701-L704 PolarHBondContact O-N 3.24Å; L702-L704 VanDerWaalsContact C-N 3.31Å; L702-L704 PolarHBondContact O-N 2.7Å; L704-E706 VanDerWaalsContact C-N 3.3Å; L704-E706 PolarHBondContact O-N 3.46Å; L704-K707 PolarHBondContact O-N 3.26Å; L704-L708 PolarHBondContact O-N 2.72Å
705	L	90.6	Very high	87.1	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.9	-38.8	175.8	-67.3	176.8	0	0	0	111.6	F643 L646 T701 L702 K707 L708 C709 L747 F768	F643-L705 HydrophobicContact CE1-CD2 4.09Å; F643-L705 HydrophobicContact CZ-CD2 3.94Å; F643-L705 HydrophobicContact CZ-CG 4.45Å; L646-L705 HydrophobicContact CD2-CD2 3.34Å; T701-L705 HydrophobicContact CG2-CD1 4.04Å; T701-L705 HydrophobicContact CG2-CG 4.23Å; T701-L705 WeakPolarHBondContact O-CG 3.23Å; T701-L705 PolarHBondContact O-N 2.86Å; L702-L705 HydrophobicContact CD2-CD1 4.41Å; L702-L705 PolarHBondContact O-N 3.44Å; L705-K707 PolarHBondContact O-N 3.42Å; L705-L708 PolarHBondContact O-N 3.39Å; L705-C709 VanDerWaalsContact O-CB 3.32Å; L705-C709 WeakPolarHBondContact O-CB 3.06Å; L705-C709 PolarHBondContact O-N 2.88Å; L705-C709 PolarHBondContact O-SG 2.97Å; L705-L747 HydrophobicContact CB-CD2 4.42Å; L705-F768 HydrophobicContact CD1-CB 4.45Å; L705-F768 HydrophobicContact CD1-CD1 4.5Å; L705-F768 HydrophobicContact CD1-CD2 4.32Å; L705-F768 HydrophobicContact CD1-CG 4.15Å; L705-F768 HydrophobicContact CD2-CD2 4.14Å; L705-F768 HydrophobicContact CD2-CE2 4.03Å; L705-F768 HydrophobicContact CD2-CZ 4.49Å
706	E	90.5	Very high	86.7	Confident	55 Å²	55	39.5 Å²	39.5	26%	0.257	23%	0.225	S	C	.	.	H	α-helix	trans	-58.2	-47.6	174.9	-171.7	170.5	175.9	0	0	111.7	L702 L704 N710 R719 L747	L702-E706 WeakPolarHBondContact O-CB 3.38Å; L702-E706 PolarHBondContact O-N 3.24Å; L704-E706 VanDerWaalsContact C-N 3.3Å; L704-E706 PolarHBondContact O-N 3.46Å; E706-N710 VanDerWaalsContact O-CB 3.31Å; E706-N710 WeakPolarHBondContact O-CB 3.26Å; E706-N710 PolarHBondContact O-N 2.93Å; E706-N710 PolarHBondContact O-ND2 3.15Å; E706-N710 PolarHBondContact O-OD1 2.89Å; E706-R719 IonicContact OE2-CZ 3.92Å; E706-R719 IonicContact OE2-NH1 3.99Å; E706-R719 PolarHBondContact OE2-NH1 3.18Å; E706-L747 HydrophobicContact CB-CD1 3.52Å; E706-L747 HydrophobicContact CG-CD1 3.94Å
707	K	86.5	Confident	86.5	Confident	94 Å²	94	40.2 Å²	40.2	41%	0.409	23%	0.23	S	C	.	.	H	α-helix	trans	-60.1	-48.4	174.8	-67.9	-176.7	179.2	-168.5	0	111.3	L628 N703 L704 L705 N710 L711	L628-K707 HydrophobicContact CD1-CD 4.24Å; N703-K707 PolarHBondContact O-N 2.81Å; L704-K707 PolarHBondContact O-N 3.26Å; L705-K707 PolarHBondContact O-N 3.42Å; K707-N710 PolarHBondContact O-N 3.23Å; K707-L711 WeakPolarHBondContact O-CB 3.44Å; K707-L711 WeakPolarHBondContact O-CG 3.42Å; K707-L711 PolarHBondContact O-N 2.82Å
708	L	85.9	Confident	86.5	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-47	-179.2	-176.5	147.2	0	0	0	112.2	V637 F643 L646 L650 L704 L705 N710 L711 V712	V637-L708 HydrophobicContact CG2-CD1 3.77Å; F643-L708 HydrophobicContact CD1-CD1 3.5Å; F643-L708 HydrophobicContact CE1-CD1 4.04Å; L646-L708 HydrophobicContact CD2-CD2 4.43Å; L650-L708 HydrophobicContact CD1-CD2 3.31Å; L704-L708 PolarHBondContact O-N 2.72Å; L705-L708 PolarHBondContact O-N 3.39Å; L708-N710 PolarHBondContact O-N 2.74Å; L708-L711 PolarHBondContact O-N 3.01Å; L708-V712 HydrophobicContact CD2-CG2 4.23Å; L708-V712 HydrophobicContact CG-CG2 4.45Å; L708-V712 VanDerWaalsContact O-CG2 3.3Å; L708-V712 WeakPolarHBondContact O-CG2 3.4Å; L708-V712 PolarHBondContact O-N 3.39Å
709	C	86	Confident	86.6	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.1	-42.3	179.5	-70.9	0	0	0	0	112.1	L694 L705 L711 V712 T713 I745	L694-C709 WeakPolarHBondContact CD1-SG 3.42Å; L705-C709 VanDerWaalsContact O-CB 3.32Å; L705-C709 WeakPolarHBondContact O-CB 3.06Å; L705-C709 PolarHBondContact O-N 2.88Å; L705-C709 PolarHBondContact O-SG 2.97Å; C709-L711 VanDerWaalsContact C-N 3.31Å; C709-L711 PolarHBondContact O-N 3.48Å; C709-V712 PolarHBondContact O-N 3.21Å; C709-T713 WeakPolarHBondContact O-CB 3.34Å; C709-T713 PolarHBondContact O-N 2.87Å; C709-T713 PolarHBondContact O-OG1 3.39Å; C709-I745 HydrophobicContact CB-CD1 3.91Å; C709-I745 HydrophobicContact CB-CG2 4.41Å
710	N	85.9	Confident	86.6	Confident	55 Å²	55	36.9 Å²	36.9	29%	0.294	21%	0.208	S	C	.	.	H	α-helix	trans	-65.3	-37.1	178.7	-65.6	-8.2	0	0	0	111.2	E706 K707 L708 G714 Q715 S717	E706-N710 VanDerWaalsContact O-CB 3.31Å; E706-N710 WeakPolarHBondContact O-CB 3.26Å; E706-N710 PolarHBondContact O-N 2.93Å; E706-N710 PolarHBondContact O-ND2 3.15Å; E706-N710 PolarHBondContact O-OD1 2.89Å; K707-N710 PolarHBondContact O-N 3.23Å; L708-N710 PolarHBondContact O-N 2.74Å; N710-G714 VanDerWaalsContact O-CA 3.31Å; N710-G714 WeakPolarHBondContact O-CA 3.4Å; N710-G714 PolarHBondContact O-N 3.27Å; N710-Q715 PolarHBondContact OD1-O 3.03Å; N710-S717 PolarHBondContact OD1-N 2.76Å; N710-S717 PolarHBondContact OD1-OG 3.44Å
711	L	82	Confident	86.5	Confident	48 Å²	48	34.3 Å²	34.3	25%	0.251	20%	0.196	S	C	.	.	H	α-helix	trans	-69.4	-45	177	-71.1	170.2	0	0	0	112.5	L628 Y630 L633 K707 L708 C709	L628-L711 HydrophobicContact CB-CD1 4.44Å; L628-L711 HydrophobicContact CD2-CD1 4.22Å; Y630-L711 HydrophobicContact CD1-CD2 3.97Å; Y630-L711 HydrophobicContact CE1-CD2 3.44Å; Y630-L711 VanDerWaalsContact CE1-CD2 3.44Å; L633-L711 HydrophobicContact CD1-CD1 3.83Å; L633-L711 HydrophobicContact CD2-CB 4.17Å; L633-L711 HydrophobicContact CD2-CD1 4.34Å; K707-L711 WeakPolarHBondContact O-CB 3.44Å; K707-L711 WeakPolarHBondContact O-CG 3.42Å; K707-L711 PolarHBondContact O-N 2.82Å; L708-L711 PolarHBondContact O-N 3.01Å; C709-L711 VanDerWaalsContact C-N 3.31Å; C709-L711 PolarHBondContact O-N 3.48Å
712	V	79.8	Confident	86.1	Confident	38 Å²	38	37.7 Å²	37.7	23%	0.23	23%	0.23	C	C	.	.	H	α-helix	trans	-72.4	-43	-177.2	177	0	0	0	0	112	Y647 L650 L708 C709	Y647-V712 HydrophobicContact CD2-CG2 3.6Å; Y647-V712 HydrophobicContact CE2-CG2 3.72Å; L650-V712 HydrophobicContact CB-CG1 3.85Å; L708-V712 HydrophobicContact CD2-CG2 4.23Å; L708-V712 HydrophobicContact CG-CG2 4.45Å; L708-V712 VanDerWaalsContact O-CG2 3.3Å; L708-V712 WeakPolarHBondContact O-CG2 3.4Å; L708-V712 PolarHBondContact O-N 3.39Å; C709-V712 PolarHBondContact O-N 3.21Å
713	T	78.2	Confident	85.7	Confident	32 Å²	32	46 Å²	46	20%	0.196	27%	0.269	C	S	.	.	H	α-helix	trans	-88.7	-18.4	-175.7	62	0	0	0	0	114	F654 C709 Q715 I745	F654-T713 HydrophobicContact CB-CG2 4.31Å; F654-T713 HydrophobicContact CD2-CG2 3.55Å; F654-T713 HydrophobicContact CE2-CG2 3.96Å; F654-T713 HydrophobicContact CG-CG2 3.87Å; C709-T713 WeakPolarHBondContact O-CB 3.34Å; C709-T713 PolarHBondContact O-N 2.87Å; C709-T713 PolarHBondContact O-OG1 3.39Å; T713-Q715 PolarHBondContact O-N 2.99Å; T713-Q715 PolarHBondContact OG1-N 2.75Å; T713-Q715 PolarHBondContact OG1-O 3.2Å; T713-I745 HydrophobicContact CG2-CD1 3.43Å; T713-I745 VanDerWaalsContact CG2-CD1 3.43Å; T713-I745 HydrophobicContact CG2-CG1 4.46Å
714	G	76.7	Confident	85.4	Confident	69 Å²	69	44.2 Å²	44.2	71%	0.711	26%	0.259	S	S	*	.	S	Bend	trans	63.6	11	-169.4	0	0	0	0	0	113.8	N710	N710-G714 VanDerWaalsContact O-CA 3.31Å; N710-G714 WeakPolarHBondContact O-CA 3.4Å; N710-G714 PolarHBondContact O-N 3.27Å
715	Q	78.9	Confident	85.2	Confident	61 Å²	61	47.3 Å²	47.3	29%	0.285	28%	0.279	S	S	.	.	S	Bend	trans	-119.5	145.9	180	-66	-171.2	-46.1	0	0	110.5	N710 T713 S717 H742	N710-Q715 PolarHBondContact OD1-O 3.03Å; T713-Q715 PolarHBondContact O-N 2.99Å; T713-Q715 PolarHBondContact OG1-N 2.75Å; T713-Q715 PolarHBondContact OG1-O 3.2Å; Q715-S717 PolarHBondContact O-N 3.19Å; Q715-H742 PolarHBondContact OE1-O 3.14Å
716	P	84.9	Confident	84.6	Confident	93 Å²	93	52.1 Å²	52.1	60%	0.604	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-66.9	130.8	173.6	28.4	-33.5	0	0	0	110.4
717	S	88.1	Confident	84.2	Confident	14 Å²	14	57 Å²	57	10%	0.098	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-79.3	144	171.8	51.4	0	0	0	0	111.6	N710 Q715	N710-S717 PolarHBondContact OD1-N 2.76Å; N710-S717 PolarHBondContact OD1-OG 3.44Å; Q715-S717 PolarHBondContact O-N 3.19Å
718	L	91.3	Very high	84.2	Confident	17 Å²	17	57 Å²	57	9%	0.089	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	144.1	170.8	-66.3	174.9	0	0	0	109.2	V732 R735 I736 D743 I745 L746 L747	L718-V732 HydrophobicContact CB-CG1 4.1Å; L718-V732 HydrophobicContact CD1-CG1 4.27Å; L718-R735 HydrophobicContact CD1-CB 4.28Å; L718-I736 HydrophobicContact CD1-CB 4.35Å; L718-I736 HydrophobicContact CD1-CD1 4.41Å; L718-D743 HydrophobicContact CD1-CB 3.64Å; L718-D743 HydrophobicContact CG-CB 3.98Å; L718-I745 PolarHBondContact N-O 2.96Å; L718-L746 HydrophobicContact CB-CD1 3.64Å; L718-L746 CarbonylContact O-C 3.44Å; L718-L746 WeakPolarHBondContact O-CA 3.49Å; L718-L747 PolarHBondContact O-N 3.26Å
719	R	91.7	Very high	84.2	Confident	54 Å²	54	58.4 Å²	58.4	20%	0.204	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	138.6	-179.1	-178.5	174.3	170.3	149.1	-0.1	111.5	N703 E706 D721 I724 L747	N703-R719 PolarHBondContact OD1-NH1 2.92Å; N703-R719 PolarHBondContact OD1-NH2 2.82Å; E706-R719 IonicContact OE2-CZ 3.92Å; E706-R719 IonicContact OE2-NH1 3.99Å; E706-R719 PolarHBondContact OE2-NH1 3.18Å; R719-D721 IonicContact CZ-OD2 2.96Å; R719-D721 IonicContact NE-OD2 2.61Å; R719-D721 PolarHBondContact NE-OD2 2.82Å; R719-D721 IonicContact NH2-OD2 3.1Å; R719-D721 PolarHBondContact NH2-OD2 3.14Å; R719-I724 WeakPolarHBondContact O-CD1 3.3Å; R719-L747 CarbonylContact C-O 3.58Å
720	L	89.5	Confident	84.1	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.01	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	99.6	174.7	-76.7	-179.3	0	0	0	111	I724 R729 V732 V733 L746 L747 L748 S749 L757	L720-I724 HydrophobicContact CD2-CD1 4.27Å; L720-R729 HydrophobicContact CD2-CB 4.38Å; L720-R729 HydrophobicContact CD2-CG 3.99Å; L720-V732 HydrophobicContact CD1-CG1 4.08Å; L720-V732 HydrophobicContact CD2-CB 3.88Å; L720-V732 HydrophobicContact CD2-CG1 3.76Å; L720-V732 HydrophobicContact CD2-CG2 4.36Å; L720-V732 HydrophobicContact CG-CB 4.41Å; L720-V732 HydrophobicContact CG-CG1 3.74Å; L720-V733 HydrophobicContact CD1-CG2 4.14Å; L720-L746 HydrophobicContact CD1-CD1 3.95Å; L720-L746 HydrophobicContact CD1-CD2 4.13Å; L720-L746 HydrophobicContact CG-CD1 3.94Å; L720-L747 PolarHBondContact N-O 3.21Å; L720-L748 HydrophobicContact CB-CD1 3.74Å; L720-L748 HydrophobicContact CD1-CD1 4.25Å; L720-S749 PolarHBondContact O-N 3.46Å; L720-L757 HydrophobicContact CD1-CD1 4.23Å
721	D	87.5	Confident	84.2	Confident	7 Å²	7	61.4 Å²	61.4	4%	0.037	35%	0.351	C	S	.	.			trans	-127.5	-173.9	174.7	68.7	21.3	0	0	0	112.5	R719 Q723	R719-D721 IonicContact CZ-OD2 2.96Å; R719-D721 IonicContact NE-OD2 2.61Å; R719-D721 PolarHBondContact NE-OD2 2.82Å; R719-D721 IonicContact NH2-OD2 3.1Å; R719-D721 PolarHBondContact NH2-OD2 3.14Å; D721-Q723 VanDerWaalsContact C-N 3.26Å; D721-Q723 PolarHBondContact O-N 3.29Å; D721-Q723 WeakPolarHBondContact OD1-CB 3.32Å; D721-Q723 PolarHBondContact OD1-N 3.08Å
722	G	82.4	Confident	84.5	Confident	70 Å²	70	60 Å²	60	72%	0.722	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-11.1	-178.6	0	0	0	0	0	115
723	Q	84.2	Confident	84.9	Confident	174 Å²	174	59.2 Å²	59.2	81%	0.813	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-20.3	-179.2	-60.7	-174.5	-1.5	0	0	112.2	D721	D721-Q723 VanDerWaalsContact C-N 3.26Å; D721-Q723 PolarHBondContact O-N 3.29Å; D721-Q723 WeakPolarHBondContact OD1-CB 3.32Å; D721-Q723 PolarHBondContact OD1-N 3.08Å
724	I	85.3	Confident	85.3	Confident	34 Å²	34	64 Å²	64	17%	0.174	36%	0.36	C	S	.	.	S	Bend	trans	-74.5	131.7	-178.4	-62.1	-179.8	0	0	0	111.2	R719 L720 Q728 R729	R719-I724 WeakPolarHBondContact O-CD1 3.3Å; L720-I724 HydrophobicContact CD2-CD1 4.27Å; I724-Q728 HydrophobicContact CG2-CB 3.49Å; I724-Q728 VanDerWaalsContact CG2-CB 3.49Å; I724-R729 HydrophobicContact CG2-CB 4.31Å
725	T	83.9	Confident	85.9	Confident	76 Å²	76	67 Å²	67	47%	0.466	35%	0.35	S	S	.	.			trans	-65.6	154.8	177.5	66.4	0	0	0	0	111.8	K727 Q728 R729	T725-K727 PolarHBondContact O-N 3.29Å; T725-K727 VanDerWaalsContact O-N 3.17Å; T725-Q728 PolarHBondContact O-N 3.31Å; T725-Q728 VanDerWaalsContact OG1-CD 3.3Å; T725-Q728 WeakPolarHBondContact OG1-CG 3.45Å; T725-Q728 PolarHBondContact OG1-N 3.43Å; T725-Q728 PolarHBondContact OG1-OE1 3.17Å; T725-R729 WeakPolarHBondContact O-CB 3.5Å; T725-R729 PolarHBondContact O-N 3.48Å
726	N	77.6	Confident	86.3	Confident	102 Å²	102	64.1 Å²	64.1	55%	0.545	34%	0.336	S	S	.	.	H	α-helix	trans	-58.8	-31.6	-179.4	-73.2	-26.3	0	0	0	113.5	A730	N726-A730 PolarHBondContact O-N 2.84Å
727	K	82.4	Confident	86.5	Confident	158 Å²	158	61.6 Å²	61.6	69%	0.687	32%	0.318	S	S	*	.	H	α-helix	trans	-67.7	-52.5	176.9	-174	-177.4	174.4	-173.3	0	111	T725 R729 A730 E731	T725-K727 PolarHBondContact O-N 3.29Å; T725-K727 VanDerWaalsContact O-N 3.17Å; K727-R729 VanDerWaalsContact C-N 3.28Å; K727-R729 PolarHBondContact O-N 3.01Å; K727-A730 WeakPolarHBondContact O-CB 3.3Å; K727-A730 PolarHBondContact O-N 3.18Å; K727-A730 VanDerWaalsContact O-N 3.12Å; K727-E731 WeakPolarHBondContact CE-OE1 3.49Å; K727-E731 PolarHBondContact O-N 3.35Å; K727-E731 VanDerWaalsContact O-N 3.15Å
728	Q	86.4	Confident	86.5	Confident	94 Å²	94	64.4 Å²	64.4	44%	0.439	33%	0.332	S	S	.	.	H	α-helix	trans	-60.4	-38.1	176.4	-71.8	166.7	-35	0	0	111.9	I724 T725 A730 E731 V732	I724-Q728 HydrophobicContact CG2-CB 3.49Å; I724-Q728 VanDerWaalsContact CG2-CB 3.49Å; T725-Q728 PolarHBondContact O-N 3.31Å; T725-Q728 VanDerWaalsContact OG1-CD 3.3Å; T725-Q728 WeakPolarHBondContact OG1-CG 3.45Å; T725-Q728 PolarHBondContact OG1-N 3.43Å; T725-Q728 PolarHBondContact OG1-OE1 3.17Å; Q728-A730 VanDerWaalsContact C-N 3.31Å; Q728-A730 PolarHBondContact O-N 3.13Å; Q728-E731 WeakPolarHBondContact O-CB 3.4Å; Q728-E731 PolarHBondContact O-N 3.49Å; Q728-E731 VanDerWaalsContact O-N 3.17Å; Q728-V732 WeakPolarHBondContact O-CG2 3.46Å; Q728-V732 PolarHBondContact O-N 2.77Å
729	R	85	Confident	86.1	Confident	29 Å²	29	68.1 Å²	68.1	11%	0.109	36%	0.357	C	S	.	.	H	α-helix	trans	-57.6	-44	175	-177.4	-179.5	-63.8	169.5	1.5	111.8	L720 I724 T725 K727 E731 V732 V733 L757	L720-R729 HydrophobicContact CD2-CB 4.38Å; L720-R729 HydrophobicContact CD2-CG 3.99Å; I724-R729 HydrophobicContact CG2-CB 4.31Å; T725-R729 WeakPolarHBondContact O-CB 3.5Å; T725-R729 PolarHBondContact O-N 3.48Å; K727-R729 VanDerWaalsContact C-N 3.28Å; K727-R729 PolarHBondContact O-N 3.01Å; R729-E731 VanDerWaalsContact C-N 3.35Å; R729-V732 PolarHBondContact O-N 2.89Å; R729-V733 WeakPolarHBondContact O-CG2 3.43Å; R729-V733 PolarHBondContact O-N 3.33Å; R729-V733 VanDerWaalsContact O-N 3.08Å; R729-L757 HydrophobicContact CG-CD2 4.4Å
730	A	83.6	Confident	85.7	Confident	42 Å²	42	73.8 Å²	73.8	35%	0.347	38%	0.383	S	S	.	.	H	α-helix	trans	-65.4	-38.8	177.4	0	0	0	0	0	112	N726 K727 Q728 V733 Q734	N726-A730 PolarHBondContact O-N 2.84Å; K727-A730 WeakPolarHBondContact O-CB 3.3Å; K727-A730 PolarHBondContact O-N 3.18Å; K727-A730 VanDerWaalsContact O-N 3.12Å; Q728-A730 VanDerWaalsContact C-N 3.31Å; Q728-A730 PolarHBondContact O-N 3.13Å; A730-V733 PolarHBondContact O-N 3.33Å; A730-Q734 VanDerWaalsContact O-CG 3.31Å; A730-Q734 WeakPolarHBondContact O-CG 3.39Å; A730-Q734 PolarHBondContact O-N 2.95Å
731	E	88.1	Confident	85.3	Confident	75 Å²	75	74.8 Å²	74.8	35%	0.35	39%	0.39	S	S	.	.	H	α-helix	trans	-63.5	-46.3	176.1	-67.7	169.9	-168.6	0	0	111.7	K727 Q728 R729 V733 Q734 R735	K727-E731 WeakPolarHBondContact CE-OE1 3.49Å; K727-E731 PolarHBondContact O-N 3.35Å; K727-E731 VanDerWaalsContact O-N 3.15Å; Q728-E731 WeakPolarHBondContact O-CB 3.4Å; Q728-E731 PolarHBondContact O-N 3.49Å; Q728-E731 VanDerWaalsContact O-N 3.17Å; R729-E731 VanDerWaalsContact C-N 3.35Å; E731-V733 VanDerWaalsContact C-N 3.35Å; E731-V733 PolarHBondContact O-N 2.84Å; E731-Q734 PolarHBondContact O-N 2.78Å; E731-R735 WeakPolarHBondContact O-CG 3.21Å; E731-R735 PolarHBondContact O-N 2.76Å
732	V	89	Confident	85	Confident	19 Å²	19	81.8 Å²	81.8	12%	0.115	42%	0.422	C	S	.	.	H	α-helix	trans	-61.8	-42.4	177.3	173.9	0	0	0	0	111.5	L718 L720 Q728 R729 Q734 R735 I736 L746	L718-V732 HydrophobicContact CB-CG1 4.1Å; L718-V732 HydrophobicContact CD1-CG1 4.27Å; L720-V732 HydrophobicContact CD1-CG1 4.08Å; L720-V732 HydrophobicContact CD2-CB 3.88Å; L720-V732 HydrophobicContact CD2-CG1 3.76Å; L720-V732 HydrophobicContact CD2-CG2 4.36Å; L720-V732 HydrophobicContact CG-CB 4.41Å; L720-V732 HydrophobicContact CG-CG1 3.74Å; Q728-V732 WeakPolarHBondContact O-CG2 3.46Å; Q728-V732 PolarHBondContact O-N 2.77Å; R729-V732 PolarHBondContact O-N 2.89Å; V732-Q734 VanDerWaalsContact C-N 3.32Å; V732-Q734 PolarHBondContact O-N 3.44Å; V732-R735 PolarHBondContact O-N 2.81Å; V732-I736 PolarHBondContact O-N 3.22Å; V732-L746 HydrophobicContact CG1-CD1 3.81Å
733	V	87.3	Confident	85.1	Confident	21 Å²	21	80.1 Å²	80.1	13%	0.127	40%	0.397	C	S	.	.	H	α-helix	trans	-65.9	-34.3	176.5	172.6	0	0	0	0	111.9	L720 R729 A730 E731 I736 N737 L757 L759	L720-V733 HydrophobicContact CD1-CG2 4.14Å; R729-V733 WeakPolarHBondContact O-CG2 3.43Å; R729-V733 PolarHBondContact O-N 3.33Å; R729-V733 VanDerWaalsContact O-N 3.08Å; A730-V733 PolarHBondContact O-N 3.33Å; E731-V733 VanDerWaalsContact C-N 3.35Å; E731-V733 PolarHBondContact O-N 2.84Å; V733-I736 WeakPolarHBondContact O-CG2 3.45Å; V733-N737 WeakPolarHBondContact O-CB 3.29Å; V733-N737 VanDerWaalsContact O-CG 3.31Å; V733-N737 PolarHBondContact O-N 3.35Å; V733-N737 PolarHBondContact O-ND2 3.45Å; V733-L757 HydrophobicContact CG2-CD2 4.04Å; V733-L759 HydrophobicContact CG1-CD2 4.42Å; V733-L759 HydrophobicContact CG2-CD2 4.26Å
734	Q	87.7	Confident	85.1	Confident	132 Å²	132	74.9 Å²	74.9	62%	0.617	37%	0.369	S	S	*	.	H	α-helix	trans	-68.9	-43.3	174.2	-76.8	174.5	-5.7	0	0	111.4	A730 E731 V732 N737 D738	A730-Q734 VanDerWaalsContact O-CG 3.31Å; A730-Q734 WeakPolarHBondContact O-CG 3.39Å; A730-Q734 PolarHBondContact O-N 2.95Å; E731-Q734 PolarHBondContact O-N 2.78Å; V732-Q734 VanDerWaalsContact C-N 3.32Å; V732-Q734 PolarHBondContact O-N 3.44Å; Q734-N737 PolarHBondContact O-N 3.12Å; Q734-D738 PolarHBondContact O-N 2.95Å
735	R	89.6	Confident	85.3	Confident	133 Å²	133	73.4 Å²	73.4	50%	0.502	36%	0.362	S	S	.	.	H	α-helix	trans	-58	-51.3	177.1	-70.7	-177.7	-166.8	-177.6	4.8	111.8	L718 E731 V732 N737 D738 S741	L718-R735 HydrophobicContact CD1-CB 4.28Å; E731-R735 WeakPolarHBondContact O-CG 3.21Å; E731-R735 PolarHBondContact O-N 2.76Å; V732-R735 PolarHBondContact O-N 2.81Å; R735-N737 PolarHBondContact O-N 3.41Å; R735-D738 PolarHBondContact O-N 3.36Å; R735-S741 WeakPolarHBondContact O-CB 3.47Å; R735-S741 PolarHBondContact O-OG 2.88Å
736	I	87.8	Confident	85.7	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-68.1	-19.3	-178.3	-162.1	64	0	0	0	113.8	R691 L718 V732 V733 L746 L759	R691-I736 VanDerWaalsContact NH1-C 3.34Å; R691-I736 PolarHBondContact NH1-O 2.74Å; L718-I736 HydrophobicContact CD1-CB 4.35Å; L718-I736 HydrophobicContact CD1-CD1 4.41Å; V732-I736 PolarHBondContact O-N 3.22Å; V733-I736 WeakPolarHBondContact O-CG2 3.45Å; I736-L746 HydrophobicContact CD1-CB 4.19Å; I736-L746 HydrophobicContact CG1-CB 4.26Å; I736-L746 HydrophobicContact CG1-CD2 4.29Å; I736-L746 HydrophobicContact CG2-CD2 4.34Å; I736-L759 HydrophobicContact CG2-CD2 3.88Å
737	N	88	Confident	86.5	Confident	41 Å²	41	65 Å²	65	22%	0.219	31%	0.314	C	S	.	.	H	α-helix	trans	-93.4	-18.8	176.3	-73.8	-39.8	0	0	0	113.1	V733 Q734 R735 P739 N758 I760 G761	V733-N737 WeakPolarHBondContact O-CB 3.29Å; V733-N737 VanDerWaalsContact O-CG 3.31Å; V733-N737 PolarHBondContact O-N 3.35Å; V733-N737 PolarHBondContact O-ND2 3.45Å; Q734-N737 PolarHBondContact O-N 3.12Å; R735-N737 PolarHBondContact O-N 3.41Å; N737-P739 WeakPolarHBondContact O-CD 3.29Å; N737-N758 PolarHBondContact ND2-O 3.1Å; N737-I760 PolarHBondContact OD1-N 3.13Å; N737-G761 PolarHBondContact OD1-N 3.33Å
738	D	88.5	Confident	86.9	Confident	73 Å²	73	57.5 Å²	57.5	39%	0.39	28%	0.281	S	S	.	.			trans	-71.9	116.8	178.1	-178.8	2.5	0	0	0	109.3	R691 Q734 R735 K740 S741	R691-D738 PolarHBondContact NH1-O 3.43Å; R691-D738 PolarHBondContact NH2-O 3.34Å; Q734-D738 PolarHBondContact O-N 2.95Å; R735-D738 PolarHBondContact O-N 3.36Å; D738-K740 PolarHBondContact O-N 3.4Å; D738-K740 WeakPolarHBondContact OD1-CB 3.26Å; D738-K740 PolarHBondContact OD1-N 2.77Å; D738-S741 PolarHBondContact O-N 2.8Å; D738-S741 PolarHBondContact O-OG 2.81Å; D738-S741 VanDerWaalsContact O-OG 3.11Å
739	P	82.7	Confident	87.2	Confident	95 Å²	95	53.5 Å²	53.5	62%	0.617	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-18	178.9	25.1	-35.6	0	0	0	113.6	R691 N737	R691-P739 PolarHBondContact NH2-O 3.37Å; N737-P739 WeakPolarHBondContact O-CD 3.29Å
740	K	82.5	Confident	87.1	Confident	173 Å²	173	52.6 Å²	52.6	75%	0.752	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-12.6	177.4	-60.5	-179.6	-179.2	179.5	0	114	D738	D738-K740 PolarHBondContact O-N 3.4Å; D738-K740 WeakPolarHBondContact OD1-CB 3.26Å; D738-K740 PolarHBondContact OD1-N 2.77Å
741	S	82.7	Confident	86.9	Confident	23 Å²	23	61 Å²	61	16%	0.161	29%	0.285	C	S	.	.			trans	-66.5	137.2	-178.9	74.7	0	0	0	0	111.6	R691 R735 D738 D743	R691-S741 PolarHBondContact NH1-OG 3.2Å; R691-S741 PolarHBondContact NH2-O 2.82Å; R691-S741 VanDerWaalsContact NH2-O 3.08Å; R691-S741 PolarHBondContact NH2-OG 3.29Å; R735-S741 WeakPolarHBondContact O-CB 3.47Å; R735-S741 PolarHBondContact O-OG 2.88Å; D738-S741 PolarHBondContact O-N 2.8Å; D738-S741 PolarHBondContact O-OG 2.81Å; D738-S741 VanDerWaalsContact O-OG 3.11Å; S741-D743 VanDerWaalsContact C-N 3.27Å
742	H	80.8	Confident	86.4	Confident	153 Å²	153	57.8 Å²	57.8	71%	0.708	27%	0.271	S	S	*	.			trans	-79.2	-12.3	171.7	-65.3	-64.3	0	0	0	112.8	Q715 R744	Q715-H742 PolarHBondContact OE1-O 3.14Å; H742-R744 PolarHBondContact O-N 3.2Å
743	D	83.3	Confident	85.3	Confident	36 Å²	36	56.9 Å²	56.9	19%	0.193	27%	0.266	C	S	.	.			trans	-69.7	117.5	179.3	-56.9	-37.1	0	0	0	110.6	L718 S741	L718-D743 HydrophobicContact CD1-CB 3.64Å; L718-D743 HydrophobicContact CG-CB 3.98Å; S741-D743 VanDerWaalsContact C-N 3.27Å
744	R	84.7	Confident	84.2	Confident	63 Å²	63	56.9 Å²	56.9	24%	0.238	27%	0.27	C	S	.	.			trans	-104.3	-24.7	-176.6	-64.5	-177.9	173.5	-176.4	-7.7	114.6	F654 T688 R691 L692 H742	F654-R744 HydrophobicContact CE1-CB 3.71Å; F654-R744 HydrophobicContact CE1-CG 4.27Å; F654-R744 HydrophobicContact CZ-CB 4.13Å; T688-R744 PolarHBondContact O-NH2 3.27Å; R691-R744 CarbonylContact C-O 3.54Å; R691-R744 VanDerWaalsContact CA-O 3.29Å; R691-R744 WeakPolarHBondContact CA-O 3.19Å; L692-R744 PolarHBondContact N-O 2.98Å; H742-R744 PolarHBondContact O-N 3.2Å
745	I	90.3	Very high	83.1	Confident	4 Å²	4	51.5 Å²	51.5	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	131.1	-174.6	-60.5	-179.6	0	0	0	110.6	L650 F654 L692 L694 C709 T713 L718 L747	L650-I745 HydrophobicContact CD2-CD1 4.13Å; F654-I745 HydrophobicContact CD2-CD1 4.46Å; F654-I745 HydrophobicContact CE2-CD1 3.7Å; F654-I745 HydrophobicContact CE2-CG1 3.92Å; F654-I745 HydrophobicContact CZ-CD1 4.06Å; F654-I745 HydrophobicContact CZ-CG1 3.76Å; L692-I745 WeakPolarHBondContact O-CA 3.11Å; L694-I745 HydrophobicContact CD1-CG2 4.42Å; C709-I745 HydrophobicContact CB-CD1 3.91Å; C709-I745 HydrophobicContact CB-CG2 4.41Å; T713-I745 HydrophobicContact CG2-CD1 3.43Å; T713-I745 VanDerWaalsContact CG2-CD1 3.43Å; T713-I745 HydrophobicContact CG2-CG1 4.46Å; L718-I745 PolarHBondContact N-O 2.96Å; I745-L747 HydrophobicContact CG2-CD2 4.21Å
746	L	92.3	Very high	82.1	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	120.3	171.9	178.6	68.9	0	0	0	110.7	L692 V693 L694 L718 L720 V732 I736 L759	L692-L746 PolarHBondContact O-N 2.93Å; V693-L746 CarbonylContact C-O 3.59Å; V693-L746 VanDerWaalsContact CA-O 3.31Å; V693-L746 WeakPolarHBondContact CA-O 3.49Å; V693-L746 HydrophobicContact CG1-CD2 4.48Å; V693-L746 HydrophobicContact CG2-CB 4.3Å; V693-L746 HydrophobicContact CG2-CD2 4.23Å; L694-L746 PolarHBondContact N-O 3.29Å; L718-L746 HydrophobicContact CB-CD1 3.64Å; L718-L746 CarbonylContact O-C 3.44Å; L718-L746 WeakPolarHBondContact O-CA 3.49Å; L720-L746 HydrophobicContact CD1-CD1 3.95Å; L720-L746 HydrophobicContact CD1-CD2 4.13Å; L720-L746 HydrophobicContact CG-CD1 3.94Å; V732-L746 HydrophobicContact CG1-CD1 3.81Å; I736-L746 HydrophobicContact CD1-CB 4.19Å; I736-L746 HydrophobicContact CG1-CB 4.26Å; I736-L746 HydrophobicContact CG1-CD2 4.29Å; I736-L746 HydrophobicContact CG2-CD2 4.34Å; L746-L759 HydrophobicContact CD2-CD1 3.95Å; L746-L759 HydrophobicContact CD2-CD2 3.84Å
747	L	93.1	Very high	81.8	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	122.2	171.9	-55.8	-179	0	0	0	109.6	L694 L702 L705 E706 L718 R719 L720 I745	L694-L747 HydrophobicContact CB-CD2 3.86Å; L694-L747 HydrophobicContact CD1-CD2 3.75Å; L694-L747 HydrophobicContact CG-CD2 4.24Å; L702-L747 HydrophobicContact CD2-CB 4.28Å; L705-L747 HydrophobicContact CB-CD2 4.42Å; E706-L747 HydrophobicContact CB-CD1 3.52Å; E706-L747 HydrophobicContact CG-CD1 3.94Å; L718-L747 PolarHBondContact O-N 3.26Å; R719-L747 CarbonylContact C-O 3.58Å; L720-L747 PolarHBondContact N-O 3.21Å; I745-L747 HydrophobicContact CG2-CD2 4.21Å
748	L	92.3	Very high	81.6	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	126.6	-176.5	-176.3	64.6	0	0	0	110.4	V693 L694 V695 S696 L720 A752 L757 L759	V693-L748 HydrophobicContact CG1-CB 4.06Å; V693-L748 HydrophobicContact CG1-CD2 4.2Å; L694-L748 PolarHBondContact O-N 3.06Å; V695-L748 VanDerWaalsContact CA-O 3.26Å; V695-L748 WeakPolarHBondContact CA-O 3.27Å; V695-L748 HydrophobicContact CG2-CB 4.35Å; V695-L748 HydrophobicContact CG2-CD2 4.24Å; S696-L748 PolarHBondContact N-O 2.92Å; S696-L748 VanDerWaalsContact N-O 3.08Å; L720-L748 HydrophobicContact CB-CD1 3.74Å; L720-L748 HydrophobicContact CD1-CD1 4.25Å; L748-A752 HydrophobicContact CD1-CB 4.24Å; L748-L757 HydrophobicContact CD1-CD1 4.06Å; L748-L759 HydrophobicContact CD2-CD1 4.16Å
749	S	90.9	Very high	81.5	Confident	10 Å²	10	44.8 Å²	44.8	7%	0.07	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	133.9	164.9	176.7	0	0	0	0	109.5	S696 L720 R751 A752 G753	S696-S749 CarbonylContact O-C 3.5Å; S696-S749 WeakPolarHBondContact O-CA 3.25Å; L720-S749 PolarHBondContact O-N 3.46Å; S749-R751 PolarHBondContact O-N 3.22Å; S749-R751 VanDerWaalsContact O-N 3.16Å; S749-A752 CarbonylContact O-C 3.56Å; S749-A752 WeakPolarHBondContact O-CA 3.45Å; S749-A752 WeakPolarHBondContact O-CB 3.5Å; S749-A752 PolarHBondContact O-N 3.29Å; S749-G753 PolarHBondContact O-N 2.92Å
750	S	84.4	Confident	81.8	Confident	10 Å²	10	42.4 Å²	42.4	7%	0.07	21%	0.207	C	C	.	.	H	α-helix	trans	-51.5	-41.3	179.3	64.2	0	0	0	0	113	S696 N697 G753 G754	S696-S750 PolarHBondContact O-N 3.29Å; N697-S750 WeakPolarHBondContact CA-OG 3.19Å; N697-S750 WeakPolarHBondContact OD1-CB 3.5Å; N697-S750 PolarHBondContact OD1-OG 3.07Å; S750-G753 CarbonylContact O-C 3.49Å; S750-G753 WeakPolarHBondContact O-CA 3.32Å; S750-G753 PolarHBondContact O-N 3.16Å; S750-G753 VanDerWaalsContact O-N 3.16Å; S750-G754 PolarHBondContact O-N 2.9Å
751	R	78.8	Confident	82	Confident	219 Å²	219	34.9 Å²	34.9	83%	0.826	18%	0.179	S	C	*	.	H	α-helix	trans	-67.1	-35.8	175.9	-65	-172.8	-179.5	-175.2	1.2	112.9	S749 G754	S749-R751 PolarHBondContact O-N 3.22Å; S749-R751 VanDerWaalsContact O-N 3.16Å; R751-G754 PolarHBondContact O-N 3.13Å
752	A	77.1	Confident	82.3	Confident	8 Å²	8	33.8 Å²	33.8	7%	0.066	17%	0.171	C	C	.	.	H	α-helix	trans	-70.9	-33.7	172.3	0	0	0	0	0	111.1	L748 S749 G754 V755	L748-A752 HydrophobicContact CD1-CB 4.24Å; S749-A752 CarbonylContact O-C 3.56Å; S749-A752 WeakPolarHBondContact O-CA 3.45Å; S749-A752 WeakPolarHBondContact O-CB 3.5Å; S749-A752 PolarHBondContact O-N 3.29Å; A752-G754 PolarHBondContact O-N 2.9Å; A752-V755 WeakPolarHBondContact O-CG2 3.48Å; A752-V755 PolarHBondContact O-N 2.77Å
753	G	66.6	Low	82.8	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-70.1	-17.6	171.3	0	0	0	0	0	114.2	S749 S750 V755 R783	S749-G753 PolarHBondContact O-N 2.92Å; S750-G753 CarbonylContact O-C 3.49Å; S750-G753 WeakPolarHBondContact O-CA 3.32Å; S750-G753 PolarHBondContact O-N 3.16Å; S750-G753 VanDerWaalsContact O-N 3.16Å; G753-V755 PolarHBondContact O-N 2.92Å; G753-V755 VanDerWaalsContact O-O 3.12Å; G753-R783 PolarHBondContact O-NE 3.35Å; G753-R783 PolarHBondContact O-NH2 2.88Å
754	G	63.6	Low	83.2	Confident	20 Å²	20	26.3 Å²	26.3	21%	0.206	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-19.4	170.3	0	0	0	0	0	113.7	S750 R751 A752 Q779 R783	S750-G754 PolarHBondContact O-N 2.9Å; R751-G754 PolarHBondContact O-N 3.13Å; A752-G754 PolarHBondContact O-N 2.9Å; G754-Q779 PolarHBondContact O-NE2 2.91Å; G754-R783 PolarHBondContact O-NH2 2.84Å
755	V	65.2	Low	83.5	Confident	20 Å²	20	23.3 Å²	23.3	12%	0.121	12%	0.123	C	C	.	.	S	Bend	trans	-80.8	153.4	174.8	-45.7	0	0	0	0	110	T296 A752 G753 L757 R783	T296-V755 HydrophobicContact CG2-CG1 3.82Å; A752-V755 WeakPolarHBondContact O-CG2 3.48Å; A752-V755 PolarHBondContact O-N 2.77Å; G753-V755 PolarHBondContact O-N 2.92Å; G753-V755 VanDerWaalsContact O-O 3.12Å; V755-L757 HydrophobicContact CG2-CD1 4.01Å; V755-L757 HydrophobicContact CG2-CD2 3.57Å; V755-L757 HydrophobicContact CG2-CG 3.51Å; V755-L757 PolarHBondContact O-N 2.78Å; V755-R783 PolarHBondContact O-NE 3.32Å; V755-R783 VanDerWaalsContact O-NE 3.14Å; V755-R783 PolarHBondContact O-NH2 3.45Å; V755-R783 VanDerWaalsContact O-NH2 3.1Å
756	G	69.1	Low	83.7	Confident	24 Å²	24	23.1 Å²	23.1	25%	0.247	12%	0.122	C	C	.	.			trans	-60.2	45	-174.4	0	0	0	0	0	117.9
757	L	80	Confident	83.7	Confident	16 Å²	16	23.2 Å²	23.2	8%	0.084	12%	0.123	C	C	.	.			trans	-70.3	149.1	-176.2	-57.3	178.9	0	0	0	111.6	L720 R729 V733 L748 V755 L759 R783	L720-L757 HydrophobicContact CD1-CD1 4.23Å; R729-L757 HydrophobicContact CG-CD2 4.4Å; V733-L757 HydrophobicContact CG2-CD2 4.04Å; L748-L757 HydrophobicContact CD1-CD1 4.06Å; V755-L757 HydrophobicContact CG2-CD1 4.01Å; V755-L757 HydrophobicContact CG2-CD2 3.57Å; V755-L757 HydrophobicContact CG2-CG 3.51Å; V755-L757 PolarHBondContact O-N 2.78Å; L757-L759 HydrophobicContact CB-CG 4.25Å; L757-R783 VanDerWaalsContact O-CD 3.28Å; L757-R783 WeakPolarHBondContact O-CD 3.47Å
758	N	85.6	Confident	83.7	Confident	65 Å²	65	23.3 Å²	23.3	35%	0.348	12%	0.123	S	C	.	.			trans	-117	104.5	172.5	-167.8	37.5	0	0	0	108.1	N737 I760 R786	N737-N758 PolarHBondContact ND2-O 3.1Å; N758-I760 WeakPolarHBondContact OD1-CG2 3.2Å; N758-R786 VanDerWaalsContact OD1-CD 3.26Å; N758-R786 WeakPolarHBondContact OD1-CD 3.26Å
759	L	86.3	Confident	83.6	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.005	12%	0.124	C	C	.	.			trans	-115.4	44.8	-174.6	-60	176.6	0	0	0	110.7	V733 I736 L746 L748 L757 G761 A762 R783 I784	V733-L759 HydrophobicContact CG1-CD2 4.42Å; V733-L759 HydrophobicContact CG2-CD2 4.26Å; I736-L759 HydrophobicContact CG2-CD2 3.88Å; L746-L759 HydrophobicContact CD2-CD1 3.95Å; L746-L759 HydrophobicContact CD2-CD2 3.84Å; L748-L759 HydrophobicContact CD2-CD1 4.16Å; L757-L759 HydrophobicContact CB-CG 4.25Å; L759-G761 PolarHBondContact O-N 2.93Å; L759-A762 PolarHBondContact O-N 3.42Å; L759-R783 HydrophobicContact CD1-CB 4.2Å; L759-R783 HydrophobicContact CG-CB 4.45Å; L759-R783 PolarHBondContact N-O 3.26Å; L759-I784 HydrophobicContact CB-CG1 4.15Å
760	I	87.7	Confident	83.5	Confident	44 Å²	44	23 Å²	23	23%	0.226	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-17	-177.3	54.6	167.8	0	0	0	113.7	N737 N758 A762 R786 Q789	N737-I760 PolarHBondContact OD1-N 3.13Å; N758-I760 WeakPolarHBondContact OD1-CG2 3.2Å; I760-A762 PolarHBondContact O-N 2.65Å; I760-R786 HydrophobicContact CG2-CB 3.94Å; I760-Q789 PolarHBondContact O-NE2 3.43Å; I760-Q789 VanDerWaalsContact O-NE2 3.13Å; I760-Q789 PolarHBondContact O-OE1 3.45Å
761	G	86.6	Confident	83.6	Confident	16 Å²	16	24 Å²	24	17%	0.165	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-21.1	174.9	0	0	0	0	0	113.7	R691 N737 L759	R691-G761 WeakPolarHBondContact CD-O 3.36Å; N737-G761 PolarHBondContact OD1-N 3.33Å; L759-G761 PolarHBondContact O-N 2.93Å
762	A	90.1	Very high	83.8	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.097	C	C	.	.			trans	-85.4	150.2	177.9	0	0	0	0	0	112.1	R691 V693 L759 I760 I784 Q789	R691-A762 HydrophobicContact CB-CB 4.43Å; V693-A762 HydrophobicContact CG2-CB 3.47Å; V693-A762 VanDerWaalsContact CG2-CB 3.47Å; L759-A762 PolarHBondContact O-N 3.42Å; I760-A762 PolarHBondContact O-N 2.65Å; A762-I784 HydrophobicContact CB-CD1 3.77Å; A762-I784 HydrophobicContact CB-CG1 4.17Å; A762-I784 HydrophobicContact CB-CG2 4.36Å; A762-I784 WeakPolarHBondContact O-CG2 3.5Å; A762-Q789 PolarHBondContact O-NE2 2.98Å
763	N	90.1	Very high	84	Confident	4 Å²	4	16.9 Å²	16.9	2%	0.021	10%	0.098	C	C	.	.			trans	-122.4	-19.6	174.1	60.4	-45.3	0	0	0	113.2	D690 R691 R791 V793 N794	D690-N763 WeakPolarHBondContact CA-OD1 3.09Å; D690-N763 PolarHBondContact OD1-ND2 3.22Å; R691-N763 PolarHBondContact N-OD1 2.66Å; R691-N763 PolarHBondContact O-N 2.77Å; R691-N763 PolarHBondContact O-OD1 3.14Å; N763-R791 HydrophobicContact CB-CB 4.11Å; N763-V793 WeakPolarHBondContact O-CA 3.4Å; N763-N794 PolarHBondContact O-N 3.45Å
764	Y	91.5	Very high	84.8	Confident	27 Å²	27	17.3 Å²	17.3	11%	0.106	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	135.9	174.9	-69.4	-78.7	0	0	0	111.2	L653 D690 R691 L692 V693 N794 Y796	L653-Y764 HydrophobicContact CD2-CD2 4.32Å; L653-Y764 HydrophobicContact CD2-CE1 4.19Å; L653-Y764 HydrophobicContact CD2-CE2 3.87Å; D690-Y764 HydrophobicContact CB-CD2 4.19Å; D690-Y764 HydrophobicContact CB-CE2 3.93Å; D690-Y764 WeakPolarHBondContact OD2-CE2 3.2Å; R691-Y764 PolarHBondContact O-N 2.72Å; R691-Y764 VanDerWaalsContact O-N 3.08Å; L692-Y764 WeakPolarHBondContact CA-O 3.05Å; V693-Y764 PolarHBondContact N-O 2.93Å; Y764-N794 WeakPolarHBondContact CA-O 3.49Å; Y764-N794 HydrophobicContact CD1-CB 3.62Å; Y764-N794 HydrophobicContact CE1-CB 3.6Å; Y764-N794 WeakPolarHBondContact CE1-ND2 3.39Å; Y764-Y796 AromaticContact CD1-CE2 3.79Å; Y764-Y796 HydrophobicContact CD1-CE2 3.79Å; Y764-Y796 HydrophobicContact CE1-CE2 4.09Å
765	L	92.6	Very high	85.6	Confident	1 Å²	1	16.7 Å²	16.7	1%	0.005	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	129.9	169.5	-165.3	142.2	0	0	0	109.6	V693 V695 L767 M781 I784 N794 L795 Y796	V693-L765 WeakPolarHBondContact O-CA 3.28Å; V695-L765 HydrophobicContact CG2-CD1 4.37Å; V695-L765 HydrophobicContact CG2-CD2 4.28Å; V695-L765 HydrophobicContact CG2-CG 4.24Å; L765-L767 HydrophobicContact CD2-CD2 3.65Å; L765-L767 HydrophobicContact CD2-CG 3.64Å; L765-M781 HydrophobicContact CD2-CG 4.06Å; L765-I784 HydrophobicContact CB-CD1 3.73Å; L765-I784 HydrophobicContact CD1-CD1 3.52Å; L765-I784 HydrophobicContact CD1-CG1 4.07Å; L765-I784 HydrophobicContact CG-CD1 4.05Å; L765-N794 PolarHBondContact N-O 3.13Å; L765-L795 HydrophobicContact CB-CD2 3.46Å; L765-L795 VanDerWaalsContact CB-CD2 3.46Å; L765-L795 HydrophobicContact CD1-CD2 4.31Å; L765-L795 HydrophobicContact CD2-CD2 4.37Å; L765-L795 HydrophobicContact CG-CD2 4.26Å; L765-Y796 PolarHBondContact O-N 3.3Å
766	I	93.5	Very high	86.5	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	115.8	171.4	-57.5	170.4	0	0	0	108.2	L646 M649 L692 V693 L694 V695 F768 Y796 L798	L646-I766 HydrophobicContact CD1-CD1 3.8Å; M649-I766 HydrophobicContact CE-CD1 3.74Å; M649-I766 HydrophobicContact CE-CG1 4.21Å; M649-I766 HydrophobicContact SD-CD1 4.32Å; L692-I766 HydrophobicContact CD1-CD1 3.65Å; L692-I766 HydrophobicContact CD1-CG1 3.74Å; L692-I766 HydrophobicContact CD2-CD1 4.19Å; V693-I766 PolarHBondContact O-N 3.23Å; L694-I766 HydrophobicContact CD2-CB 3.65Å; L694-I766 HydrophobicContact CD2-CD1 3.77Å; L694-I766 HydrophobicContact CD2-CG1 4.11Å; L694-I766 HydrophobicContact CD2-CG2 4.3Å; V695-I766 PolarHBondContact N-O 2.93Å; I766-F768 PolarHBondContact O-N 3.44Å; I766-Y796 CarbonylContact C-O 3.54Å; I766-Y796 WeakPolarHBondContact CA-O 3.34Å; I766-Y796 HydrophobicContact CG1-CD2 4.24Å; I766-Y796 HydrophobicContact CG1-CG 4.47Å; I766-L798 HydrophobicContact CG2-CD1 3.9Å; I766-L798 HydrophobicContact CG2-CD2 4.48Å; I766-L798 HydrophobicContact CG2-CG 3.86Å
767	L	92.8	Very high	87.4	Confident	2 Å²	2	17 Å²	17	1%	0.01	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	105.1	165	-65.7	-176.2	0	0	0	107.6	V695 L765 D777 A780 M781 Y796 R797 L798	V695-L767 HydrophobicContact CB-CD2 3.65Å; V695-L767 HydrophobicContact CG1-CD2 3.96Å; V695-L767 HydrophobicContact CG2-CD2 3.98Å; L765-L767 HydrophobicContact CD2-CD2 3.65Å; L765-L767 HydrophobicContact CD2-CG 3.64Å; L767-D777 HydrophobicContact CD1-CB 4.04Å; L767-A780 HydrophobicContact CD2-CB 4.48Å; L767-M781 HydrophobicContact CD1-CG 3.79Å; L767-M781 HydrophobicContact CD1-SD 3.77Å; L767-M781 HydrophobicContact CD2-CG 4.46Å; L767-M781 HydrophobicContact CG-CG 4.29Å; L767-Y796 PolarHBondContact N-O 2.89Å; L767-R797 HydrophobicContact CB-CG 4.32Å; L767-R797 HydrophobicContact CD1-CG 4.03Å; L767-R797 VanDerWaalsContact CD1-NH1 3.28Å; L767-L798 PolarHBondContact O-N 3.36Å
768	F	93.2	Very high	87.5	Confident	1 Å²	1	18.1 Å²	18.1	0%	0.004	10%	0.1	C	C	.	.			trans	-74.9	-36.1	-176.6	-172.1	-92.6	0	0	0	112.3	N582 K642 F643 L646 V695 T701 L705 I766 L798	N582-F768 HydrophobicContact CB-CE1 4.03Å; N582-F768 WeakPolarHBondContact OD1-CE1 3.29Å; K642-F768 HydrophobicContact CB-CE2 4.01Å; K642-F768 HydrophobicContact CB-CZ 3.86Å; K642-F768 HydrophobicContact CD-CE1 4.25Å; K642-F768 HydrophobicContact CD-CZ 4.1Å; K642-F768 PolarHBondContact NZ-O 3.38Å; F643-F768 HydrophobicContact CD2-CE2 4.22Å; F643-F768 AromaticContact CD2-CZ 3.6Å; F643-F768 HydrophobicContact CD2-CZ 3.6Å; F643-F768 HydrophobicContact CE2-CE1 4.05Å; F643-F768 HydrophobicContact CE2-CE2 4.19Å; F643-F768 AromaticContact CE2-CZ 3.38Å; F643-F768 HydrophobicContact CE2-CZ 3.38Å; F643-F768 HydrophobicContact CZ-CZ 4.28Å; L646-F768 HydrophobicContact CD2-CD2 4.13Å; L646-F768 HydrophobicContact CD2-CE2 4.03Å; V695-F768 WeakPolarHBondContact O-CB 3.45Å; V695-F768 PolarHBondContact O-N 3.29Å; T701-F768 HydrophobicContact CG2-CD1 3.61Å; T701-F768 HydrophobicContact CG2-CE1 3.51Å; T701-F768 HydrophobicContact CG2-CZ 4.42Å; L705-F768 HydrophobicContact CD1-CB 4.45Å; L705-F768 HydrophobicContact CD1-CD1 4.5Å; L705-F768 HydrophobicContact CD1-CD2 4.32Å; L705-F768 HydrophobicContact CD1-CG 4.15Å; L705-F768 HydrophobicContact CD2-CD2 4.14Å; L705-F768 HydrophobicContact CD2-CE2 4.03Å; L705-F768 HydrophobicContact CD2-CZ 4.49Å; I766-F768 PolarHBondContact O-N 3.44Å; F768-L798 HydrophobicContact CD2-CD1 3.8Å; F768-L798 HydrophobicContact CE2-CD1 4.13Å
769	D	90.9	Very high	87.5	Confident	4 Å²	4	15.9 Å²	15.9	2%	0.021	9%	0.088	C	C	.	.	S	Bend	trans	-140.1	139.9	178.7	61.5	-76.6	0	0	0	111.7	S696 N697 F698	S696-D769 WeakPolarHBondContact CA-OD1 3.31Å; S696-D769 WeakPolarHBondContact CB-OD1 3.41Å; S696-D769 PolarHBondContact OG-OD1 2.89Å; N697-D769 WeakPolarHBondContact CA-OD2 3.32Å; N697-D769 WeakPolarHBondContact CB-OD2 3.36Å; N697-D769 PolarHBondContact N-OD1 3.4Å; N697-D769 PolarHBondContact N-OD2 3.38Å; N697-D769 PolarHBondContact ND2-O 3.03Å; N697-D769 VanDerWaalsContact ND2-O 3.12Å; N697-D769 PolarHBondContact ND2-OD2 3.33Å; F698-D769 WeakPolarHBondContact CD2-OD2 3.31Å
770	M	88	Confident	87.5	Confident	1 Å²	1	15.9 Å²	15.9	1%	0.005	9%	0.088	C	C	.	.			trans	-87	141.7	-174.8	-60.2	-69.2	-61.6	0	0	110.8	R578 D777 R797 V799 I808 F809	R578-M770 PolarHBondContact NH2-O 3.04Å; M770-D777 WeakPolarHBondContact CE-OD2 3.3Å; M770-R797 HydrophobicContact SD-CB 4.24Å; M770-R797 HydrophobicContact SD-CG 4.26Å; M770-V799 HydrophobicContact CG-CG2 4.3Å; M770-I808 HydrophobicContact CB-CG2 4.39Å; M770-F809 HydrophobicContact CE-CD2 3.93Å
771	D	86.6	Confident	87.3	Confident	30 Å²	30	14.6 Å²	14.6	16%	0.16	8%	0.081	C	C	.	.			trans	-88.3	166.9	172.6	-158.6	2.7	0	0	0	111.9	N773 N776 D777 I808 Q812	D771-N773 PolarHBondContact O-N 3.44Å; D771-N776 HydrophobicContact CB-CB 4.45Å; D771-N776 PolarHBondContact OD2-ND2 3.12Å; D771-D777 WeakPolarHBondContact CB-OD1 3.2Å; D771-D777 PolarHBondContact N-OD1 2.93Å; D771-D777 PolarHBondContact N-OD2 3.48Å; D771-I808 WeakPolarHBondContact O-CG2 3.49Å; D771-Q812 PolarHBondContact O-NE2 3.32Å
772	W	82.4	Confident	87.2	Confident	64 Å²	64	14.7 Å²	14.7	24%	0.242	8%	0.08	C	C	.	.	S	Bend	trans	-74.2	-19.7	173.5	-73.2	95	0	0	0	113.2	I574 I808 K815 L858	I574-W772 HydrophobicContact CG2-CZ2 3.95Å; W772-I808 HydrophobicContact CD2-CD1 4.37Å; W772-I808 HydrophobicContact CD2-CG1 4.24Å; W772-I808 HydrophobicContact CE3-CG1 4.08Å; W772-I808 HydrophobicContact CE3-CG2 4.45Å; W772-I808 HydrophobicContact CH2-CD1 4.05Å; W772-I808 HydrophobicContact CH2-CG1 3.6Å; W772-I808 HydrophobicContact CZ2-CD1 3.68Å; W772-I808 HydrophobicContact CZ2-CG1 3.78Å; W772-I808 HydrophobicContact CZ3-CG1 3.76Å; W772-K815 PolarHBondContact O-NZ 3.4Å; W772-L858 HydrophobicContact CH2-CD1 3.67Å; W772-L858 HydrophobicContact CH2-CD2 4.1Å; W772-L858 HydrophobicContact CZ3-CD1 4.34Å; W772-L858 HydrophobicContact CZ3-CD2 4.38Å
773	N	81.4	Confident	87	Confident	14 Å²	14	14.9 Å²	14.9	8%	0.075	8%	0.081	C	C	.	.	S	Bend	trans	-109.3	110.7	-178.6	-179.6	12	0	0	0	109.9	D771 A775 N776	D771-N773 PolarHBondContact O-N 3.44Å; N773-A775 PolarHBondContact O-N 3.26Å; N773-A775 VanDerWaalsContact O-N 3.07Å; N773-A775 VanDerWaalsContact OD1-CB 3.29Å; N773-A775 WeakPolarHBondContact OD1-CB 3.3Å; N773-A775 PolarHBondContact OD1-N 3.06Å; N773-N776 PolarHBondContact O-N 3.16Å; N773-N776 VanDerWaalsContact O-N 3.11Å
774	P	83.9	Confident	86.8	Confident	9 Å²	9	14.7 Å²	14.7	6%	0.058	8%	0.08	C	C	.	.	H	α-helix	trans	-61.5	-22.5	-178.1	24.8	-33	0	0	0	113.2	N776 D777 A778 Q812 K815 L816	P774-N776 VanDerWaalsContact C-N 3.31Å; P774-N776 PolarHBondContact O-N 3.1Å; P774-D777 PolarHBondContact O-N 2.91Å; P774-A778 WeakPolarHBondContact O-CB 3.4Å; P774-A778 PolarHBondContact O-N 3.15Å; P774-Q812 HydrophobicContact CB-CB 4.04Å; P774-Q812 HydrophobicContact CB-CG 4.02Å; P774-Q812 HydrophobicContact CG-CB 4.46Å; P774-Q812 HydrophobicContact CG-CG 4.46Å; P774-K815 HydrophobicContact CG-CB 4.32Å; P774-L816 HydrophobicContact CB-CD1 3.99Å; P774-L816 HydrophobicContact CB-CD2 4Å; P774-L816 HydrophobicContact CB-CG 3.85Å; P774-L816 HydrophobicContact CG-CD2 4.11Å; P774-L816 HydrophobicContact CG-CG 4.01Å
775	A	81.3	Confident	86.5	Confident	8 Å²	8	15 Å²	15	7%	0.066	8%	0.081	C	C	.	.	H	α-helix	trans	-62	-35.7	177	0	0	0	0	0	113.1	T395 Q398 N773 Q779	T395-A775 HydrophobicContact CG2-CB 3.64Å; Q398-A775 HydrophobicContact CG-CB 4.16Å; N773-A775 PolarHBondContact O-N 3.26Å; N773-A775 VanDerWaalsContact O-N 3.07Å; N773-A775 VanDerWaalsContact OD1-CB 3.29Å; N773-A775 WeakPolarHBondContact OD1-CB 3.3Å; N773-A775 PolarHBondContact OD1-N 3.06Å; A775-Q779 VanDerWaalsContact O-CB 3.23Å; A775-Q779 WeakPolarHBondContact O-CB 3.28Å; A775-Q779 PolarHBondContact O-N 2.95Å
776	N	84	Confident	86	Confident	49 Å²	49	17 Å²	17	26%	0.262	9%	0.089	S	C	.	.	H	α-helix	trans	-70.5	-42.1	-178.9	-68.9	-14.9	0	0	0	110.7	D771 N773 P774 Q779 A780	D771-N776 HydrophobicContact CB-CB 4.45Å; D771-N776 PolarHBondContact OD2-ND2 3.12Å; N773-N776 PolarHBondContact O-N 3.16Å; N773-N776 VanDerWaalsContact O-N 3.11Å; P774-N776 VanDerWaalsContact C-N 3.31Å; P774-N776 PolarHBondContact O-N 3.1Å; N776-Q779 PolarHBondContact O-N 2.97Å; N776-A780 PolarHBondContact O-N 2.99Å
777	D	86.6	Confident	85.2	Confident	2 Å²	2	20.7 Å²	20.7	1%	0.011	11%	0.113	C	C	.	.	H	α-helix	trans	-66.3	-45.7	176.8	-63.7	-5.5	0	0	0	110.8	L767 M770 D771 P774 Q779 A780 M781 R797 Q812	L767-D777 HydrophobicContact CD1-CB 4.04Å; M770-D777 WeakPolarHBondContact CE-OD2 3.3Å; D771-D777 WeakPolarHBondContact CB-OD1 3.2Å; D771-D777 PolarHBondContact N-OD1 2.93Å; D771-D777 PolarHBondContact N-OD2 3.48Å; P774-D777 PolarHBondContact O-N 2.91Å; D777-Q779 VanDerWaalsContact C-N 3.27Å; D777-Q779 PolarHBondContact O-N 3.42Å; D777-A780 PolarHBondContact O-N 2.82Å; D777-M781 WeakPolarHBondContact O-CG 3.48Å; D777-M781 PolarHBondContact O-N 2.91Å; D777-R797 IonicContact OD2-NH1 3.99Å; D777-Q812 PolarHBondContact OD2-NE2 3.35Å
778	A	83.2	Confident	84.7	Confident	38 Å²	38	23.5 Å²	23.5	31%	0.314	14%	0.142	S	C	.	.	H	α-helix	trans	-58	-39.8	174.2	0	0	0	0	0	112.2	P774 M781 A782	P774-A778 WeakPolarHBondContact O-CB 3.4Å; P774-A778 PolarHBondContact O-N 3.15Å; A778-M781 PolarHBondContact O-N 3.04Å; A778-A782 VanDerWaalsContact O-CB 3.32Å; A778-A782 WeakPolarHBondContact O-CB 3.27Å; A778-A782 PolarHBondContact O-N 3.36Å
779	Q	84.5	Confident	84.3	Confident	19 Å²	19	24.3 Å²	24.3	9%	0.089	15%	0.146	C	C	.	.	H	α-helix	trans	-65.9	-37.8	177.7	-178.8	169.5	49.3	0	0	112.8	M259 G754 A775 N776 D777 R783	M259-Q779 HydrophobicContact CE-CB 4.44Å; M259-Q779 HydrophobicContact CE-CG 3.7Å; M259-Q779 HydrophobicContact SD-CB 3.77Å; M259-Q779 HydrophobicContact SD-CG 3.69Å; G754-Q779 PolarHBondContact O-NE2 2.91Å; A775-Q779 VanDerWaalsContact O-CB 3.23Å; A775-Q779 WeakPolarHBondContact O-CB 3.28Å; A775-Q779 PolarHBondContact O-N 2.95Å; N776-Q779 PolarHBondContact O-N 2.97Å; D777-Q779 VanDerWaalsContact C-N 3.27Å; D777-Q779 PolarHBondContact O-N 3.42Å; Q779-R783 WeakPolarHBondContact O-CG 3.28Å; Q779-R783 PolarHBondContact O-NE 3.21Å; Q779-R783 VanDerWaalsContact O-NE 3.14Å
780	A	85.8	Confident	83.9	Confident	1 Å²	1	29 Å²	29	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-69.5	-42.7	175.2	0	0	0	0	0	112	V695 L767 N776 D777 A782 R783	V695-A780 HydrophobicContact CG1-CB 4.15Å; L767-A780 HydrophobicContact CD2-CB 4.48Å; N776-A780 PolarHBondContact O-N 2.99Å; D777-A780 PolarHBondContact O-N 2.82Å; A780-A782 PolarHBondContact O-N 3.45Å; A780-R783 WeakPolarHBondContact O-CB 3.47Å; A780-R783 VanDerWaalsContact O-CG 3.31Å; A780-R783 WeakPolarHBondContact O-CG 3.09Å; A780-R783 PolarHBondContact O-N 3.04Å
781	M	85.4	Confident	83.8	Confident	16 Å²	16	32.2 Å²	32.2	8%	0.079	19%	0.191	C	C	.	.	H	α-helix	trans	-64.6	-38.1	177.8	-67.7	-172.3	-50.7	0	0	112.9	L765 L767 D777 A778 R783 I784 L795 R797	L765-M781 HydrophobicContact CD2-CG 4.06Å; L767-M781 HydrophobicContact CD1-CG 3.79Å; L767-M781 HydrophobicContact CD1-SD 3.77Å; L767-M781 HydrophobicContact CD2-CG 4.46Å; L767-M781 HydrophobicContact CG-CG 4.29Å; D777-M781 WeakPolarHBondContact O-CG 3.48Å; D777-M781 PolarHBondContact O-N 2.91Å; A778-M781 PolarHBondContact O-N 3.04Å; M781-R783 PolarHBondContact O-N 3Å; M781-I784 PolarHBondContact O-N 3.49Å; M781-L795 HydrophobicContact CB-CD1 4.13Å; M781-L795 HydrophobicContact CG-CD1 4.33Å; M781-L795 HydrophobicContact SD-CD1 4.02Å; M781-R797 PolarHBondContact SD-NH2 3.43Å; M781-R797 VanDerWaalsContact SD-NH2 3.38Å
782	A	84.1	Confident	83.8	Confident	18 Å²	18	33.9 Å²	33.9	15%	0.149	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	11.5	179.9	0	0	0	0	0	114.7	M259 A778 A780 R786	M259-A782 HydrophobicContact CB-CB 3.79Å; A778-A782 VanDerWaalsContact O-CB 3.32Å; A778-A782 WeakPolarHBondContact O-CB 3.27Å; A778-A782 PolarHBondContact O-N 3.36Å; A780-A782 PolarHBondContact O-N 3.45Å; A782-R786 PolarHBondContact O-NE 3.2Å; A782-R786 PolarHBondContact O-NH2 3.47Å
783	R	84.5	Confident	84.1	Confident	5 Å²	5	30.8 Å²	30.8	2%	0.019	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-23.3	177	-57	-55.7	176.3	-167.3	1.7	113.7	G753 G754 V755 L757 L759 Q779 A780 M781	G753-R783 PolarHBondContact O-NE 3.35Å; G753-R783 PolarHBondContact O-NH2 2.88Å; G754-R783 PolarHBondContact O-NH2 2.84Å; V755-R783 PolarHBondContact O-NE 3.32Å; V755-R783 VanDerWaalsContact O-NE 3.14Å; V755-R783 PolarHBondContact O-NH2 3.45Å; V755-R783 VanDerWaalsContact O-NH2 3.1Å; L757-R783 VanDerWaalsContact O-CD 3.28Å; L757-R783 WeakPolarHBondContact O-CD 3.47Å; L759-R783 HydrophobicContact CD1-CB 4.2Å; L759-R783 HydrophobicContact CG-CB 4.45Å; L759-R783 PolarHBondContact N-O 3.26Å; Q779-R783 WeakPolarHBondContact O-CG 3.28Å; Q779-R783 PolarHBondContact O-NE 3.21Å; Q779-R783 VanDerWaalsContact O-NE 3.14Å; A780-R783 WeakPolarHBondContact O-CB 3.47Å; A780-R783 VanDerWaalsContact O-CG 3.31Å; A780-R783 WeakPolarHBondContact O-CG 3.09Å; A780-R783 PolarHBondContact O-N 3.04Å; M781-R783 PolarHBondContact O-N 3Å
784	I	87.3	Confident	84.5	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-49.6	-178.6	-63.2	-177.7	0	0	0	111.4	V693 L759 A762 L765 M781 R786 V793	V693-I784 HydrophobicContact CB-CD1 3.91Å; V693-I784 HydrophobicContact CG2-CD1 3.68Å; V693-I784 HydrophobicContact CG2-CG1 4.4Å; L759-I784 HydrophobicContact CB-CG1 4.15Å; A762-I784 HydrophobicContact CB-CD1 3.77Å; A762-I784 HydrophobicContact CB-CG1 4.17Å; A762-I784 HydrophobicContact CB-CG2 4.36Å; A762-I784 WeakPolarHBondContact O-CG2 3.5Å; L765-I784 HydrophobicContact CB-CD1 3.73Å; L765-I784 HydrophobicContact CD1-CD1 3.52Å; L765-I784 HydrophobicContact CD1-CG1 4.07Å; L765-I784 HydrophobicContact CG-CD1 4.05Å; M781-I784 PolarHBondContact O-N 3.49Å; I784-R786 PolarHBondContact O-N 3.12Å; I784-V793 HydrophobicContact CG2-CG1 3.85Å; I784-V793 HydrophobicContact CG2-CG2 4.04Å
785	W	84.5	Confident	84.9	Confident	34 Å²	34	31 Å²	31	13%	0.129	19%	0.194	C	C	.	.	S	Bend	trans	-80.5	88	-179.7	-166.9	65.2	0	0	0	110.5	C494 A498 L501 T502 K504 V793	C494-W785 HydrophobicContact CB-CH2 4.18Å; C494-W785 HydrophobicContact CB-CZ3 3.6Å; A498-W785 HydrophobicContact CB-CH2 4.31Å; L501-W785 HydrophobicContact CB-CZ2 3.69Å; L501-W785 HydrophobicContact CD1-CD2 4.11Å; L501-W785 HydrophobicContact CD1-CE3 4.27Å; L501-W785 HydrophobicContact CD1-CH2 3.75Å; L501-W785 HydrophobicContact CD1-CZ2 3.53Å; L501-W785 HydrophobicContact CD1-CZ3 4.12Å; L501-W785 HydrophobicContact CG-CZ2 4.24Å; T502-W785 PolarHBondContact O-NE1 2.92Å; K504-W785 HydrophobicContact CB-CD2 4.22Å; K504-W785 HydrophobicContact CB-CG 4.36Å; K504-W785 HydrophobicContact CB-CZ2 4.24Å; K504-W785 HydrophobicContact CD-CD2 3.82Å; K504-W785 HydrophobicContact CD-CE3 3.8Å; K504-W785 HydrophobicContact CD-CG 4.24Å; K504-W785 HydrophobicContact CD-CH2 4.46Å; K504-W785 HydrophobicContact CD-CZ2 4.5Å; K504-W785 HydrophobicContact CD-CZ3 4.11Å; K504-W785 HydrophobicContact CG-CD2 4.42Å; K504-W785 HydrophobicContact CG-CG 4.47Å; W785-V793 HydrophobicContact CB-CG1 4.44Å; W785-V793 HydrophobicContact CB-CG2 4.44Å
786	R	82.2	Confident	85.4	Confident	42 Å²	42	32.6 Å²	32.6	16%	0.158	20%	0.199	C	C	.	.	S	Bend	trans	-137.8	160.5	-176.4	-73.2	-172.9	171	-133.8	-10.5	111.4	N758 I760 A782 I784 G788 Q789	N758-R786 VanDerWaalsContact OD1-CD 3.26Å; N758-R786 WeakPolarHBondContact OD1-CD 3.26Å; I760-R786 HydrophobicContact CG2-CB 3.94Å; A782-R786 PolarHBondContact O-NE 3.2Å; A782-R786 PolarHBondContact O-NH2 3.47Å; I784-R786 PolarHBondContact O-N 3.12Å; R786-G788 PolarHBondContact O-N 3.42Å; R786-Q789 WeakPolarHBondContact O-CB 3.43Å; R786-Q789 PolarHBondContact O-N 3.14Å
787	P	77.2	Confident	85.8	Confident	78 Å²	78	31.4 Å²	31.4	51%	0.506	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	124.3	171	-24.3	33.8	0	0	0	111.1	L501	L501-P787 HydrophobicContact CD2-CG 4.44Å
788	G	80.7	Confident	86.1	Confident	61 Å²	61	31.3 Å²	31.3	63%	0.629	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	107.7	-7.7	-173.7	0	0	0	0	0	114.4	R786	R786-G788 PolarHBondContact O-N 3.42Å
789	Q	85	Confident	86.4	Confident	17 Å²	17	29.5 Å²	29.5	8%	0.079	18%	0.175	C	C	.	.			trans	-66.4	132.3	166.7	179.8	58.5	-90.6	0	0	110	T502 I760 A762 R786 R791 V793	T502-Q789 WeakPolarHBondContact OG1-CG 3.45Å; I760-Q789 PolarHBondContact O-NE2 3.43Å; I760-Q789 VanDerWaalsContact O-NE2 3.13Å; I760-Q789 PolarHBondContact O-OE1 3.45Å; A762-Q789 PolarHBondContact O-NE2 2.98Å; R786-Q789 WeakPolarHBondContact O-CB 3.43Å; R786-Q789 PolarHBondContact O-N 3.14Å; Q789-R791 VanDerWaalsContact CG-O 3.23Å; Q789-R791 WeakPolarHBondContact CG-O 3.48Å; Q789-V793 HydrophobicContact CG-CG2 3.68Å
790	S	83	Confident	86.6	Confident	102 Å²	102	28.7 Å²	28.7	71%	0.713	17%	0.171	S	C	*	.			trans	-111.7	-13.3	-179.4	58	0	0	0	0	113.4
791	R	85.8	Confident	86.5	Confident	69 Å²	69	28.8 Å²	28.8	26%	0.26	17%	0.172	S	C	.	.	S	Bend	trans	-110.6	155.5	-178.9	-55.8	-176.5	-168.5	171.2	7.9	111.4	T502 N689 D690 N763 Q789	T502-R791 VanDerWaalsContact CB-O 3.26Å; T502-R791 WeakPolarHBondContact CB-O 3.3Å; T502-R791 PolarHBondContact OG1-O 3.3Å; N689-R791 VanDerWaalsContact C-NH1 3.32Å; N689-R791 PolarHBondContact O-NH1 3.26Å; D690-R791 IonicContact OD1-NH1 3.36Å; N763-R791 HydrophobicContact CB-CB 4.11Å; Q789-R791 VanDerWaalsContact CG-O 3.23Å; Q789-R791 WeakPolarHBondContact CG-O 3.48Å
792	S	86.7	Confident	85.9	Confident	65 Å²	65	29.8 Å²	29.8	46%	0.455	18%	0.181	S	C	.	.			trans	-60.7	137.1	169.3	50.6	0	0	0	0	109.8	D503	D503-S792 WeakPolarHBondContact O-CA 3.37Å
793	V	89.1	Confident	85.6	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	121.2	-176.6	178.9	0	0	0	0	109.3	D503 K504 T505 N763 I784 W785 Q789 L795	D503-V793 PolarHBondContact O-N 2.87Å; K504-V793 WeakPolarHBondContact CA-O 3.43Å; T505-V793 PolarHBondContact N-O 3.23Å; T505-V793 PolarHBondContact OG1-O 2.99Å; N763-V793 WeakPolarHBondContact O-CA 3.4Å; I784-V793 HydrophobicContact CG2-CG1 3.85Å; I784-V793 HydrophobicContact CG2-CG2 4.04Å; W785-V793 HydrophobicContact CB-CG1 4.44Å; W785-V793 HydrophobicContact CB-CG2 4.44Å; Q789-V793 HydrophobicContact CG-CG2 3.68Å; V793-L795 HydrophobicContact CG1-CD2 3.69Å; V793-L795 HydrophobicContact CG1-CG 4.19Å
794	N	90.2	Very high	85.5	Confident	25 Å²	25	29.1 Å²	29.1	13%	0.134	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	117.6	176.2	-58.4	-72.1	0	0	0	109.8	T505 N763 Y764 L765 Y796	T505-N794 WeakPolarHBondContact OG1-CA 3.2Å; T505-N794 PolarHBondContact OG1-OD1 3.38Å; N763-N794 PolarHBondContact O-N 3.45Å; Y764-N794 WeakPolarHBondContact CA-O 3.49Å; Y764-N794 HydrophobicContact CD1-CB 3.62Å; Y764-N794 HydrophobicContact CE1-CB 3.6Å; Y764-N794 WeakPolarHBondContact CE1-ND2 3.39Å; L765-N794 PolarHBondContact N-O 3.13Å; N794-Y796 HydrophobicContact CB-CD2 4.49Å; N794-Y796 HydrophobicContact CB-CE2 3.73Å
795	L	91.2	Very high	85.4	Confident	3 Å²	3	29.2 Å²	29.2	2%	0.016	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	126.2	177.8	-53.5	-177.8	0	0	0	109.6	K504 T505 E506 H507 L765 M781 V793	K504-L795 HydrophobicContact CD-CD1 4.37Å; K504-L795 HydrophobicContact CG-CD1 4.31Å; T505-L795 PolarHBondContact O-N 3.04Å; E506-L795 WeakPolarHBondContact CA-O 3.49Å; E506-L795 HydrophobicContact CG-CB 4.25Å; E506-L795 HydrophobicContact CG-CD1 4.04Å; H507-L795 PolarHBondContact N-O 3.41Å; L765-L795 HydrophobicContact CB-CD2 3.46Å; L765-L795 VanDerWaalsContact CB-CD2 3.46Å; L765-L795 HydrophobicContact CD1-CD2 4.31Å; L765-L795 HydrophobicContact CD2-CD2 4.37Å; L765-L795 HydrophobicContact CG-CD2 4.26Å; M781-L795 HydrophobicContact CB-CD1 4.13Å; M781-L795 HydrophobicContact CG-CD1 4.33Å; M781-L795 HydrophobicContact SD-CD1 4.02Å; V793-L795 HydrophobicContact CG1-CD2 3.69Å; V793-L795 HydrophobicContact CG1-CG 4.19Å
796	Y	92.5	Very high	85.4	Confident	41 Å²	41	27.6 Å²	27.6	16%	0.161	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	135.8	178.7	-65.5	-85.8	0	0	0	110.7	H507 L509 M649 Y764 L765 I766 L767 N794	H507-Y796 HydrophobicContact CB-CD1 3.61Å; H507-Y796 HydrophobicContact CB-CE1 3.83Å; H507-Y796 HydrophobicContact CB-CG 4.48Å; H507-Y796 AromaticContact CD2-CE1 3.69Å; H507-Y796 AromaticContact CD2-CZ 3.98Å; H507-Y796 AromaticContact CG-CE1 3.86Å; H507-Y796 CarbonylContact O-C 3.53Å; H507-Y796 WeakPolarHBondContact O-CA 3.31Å; L509-Y796 HydrophobicContact CD1-CD1 3.78Å; L509-Y796 HydrophobicContact CD1-CE1 4.49Å; L509-Y796 HydrophobicContact CD2-CD1 4.44Å; L509-Y796 HydrophobicContact CG-CD1 4.17Å; M649-Y796 HydrophobicContact CE-CD1 3.8Å; M649-Y796 HydrophobicContact CE-CD2 3.87Å; M649-Y796 HydrophobicContact CE-CE1 4.03Å; M649-Y796 HydrophobicContact CE-CE2 4.1Å; M649-Y796 HydrophobicContact CE-CG 3.71Å; Y764-Y796 AromaticContact CD1-CE2 3.79Å; Y764-Y796 HydrophobicContact CD1-CE2 3.79Å; Y764-Y796 HydrophobicContact CE1-CE2 4.09Å; L765-Y796 PolarHBondContact O-N 3.3Å; I766-Y796 CarbonylContact C-O 3.54Å; I766-Y796 WeakPolarHBondContact CA-O 3.34Å; I766-Y796 HydrophobicContact CG1-CD2 4.24Å; I766-Y796 HydrophobicContact CG1-CG 4.47Å; L767-Y796 PolarHBondContact N-O 2.89Å; N794-Y796 HydrophobicContact CB-CD2 4.49Å; N794-Y796 HydrophobicContact CB-CE2 3.73Å
797	R	92.4	Very high	85.4	Confident	24 Å²	24	26.9 Å²	26.9	9%	0.091	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	119.4	171.5	-65.5	178.3	-178.9	-101.2	17.9	109.2	H507 V508 L509 L767 M770 D777 M781	H507-R797 PolarHBondContact O-N 2.9Å; V508-R797 HydrophobicContact CG2-CB 4.47Å; L509-R797 PolarHBondContact N-O 3.18Å; L767-R797 HydrophobicContact CB-CG 4.32Å; L767-R797 HydrophobicContact CD1-CG 4.03Å; L767-R797 VanDerWaalsContact CD1-NH1 3.28Å; M770-R797 HydrophobicContact SD-CB 4.24Å; M770-R797 HydrophobicContact SD-CG 4.26Å; D777-R797 IonicContact OD2-NH1 3.99Å; M781-R797 PolarHBondContact SD-NH2 3.43Å; M781-R797 VanDerWaalsContact SD-NH2 3.38Å
798	L	92.3	Very high	85.8	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	121.2	174.2	-56	-174.8	0	0	0	109.4	L509 K642 V645 L646 M649 I766 L767 F768	L509-L798 HydrophobicContact CB-CD2 3.87Å; L509-L798 HydrophobicContact CD1-CD2 3.64Å; L509-L798 HydrophobicContact CG-CD2 4.2Å; K642-L798 HydrophobicContact CD-CB 4.42Å; V645-L798 HydrophobicContact CG1-CD2 4.31Å; L646-L798 HydrophobicContact CB-CD1 4.49Å; M649-L798 HydrophobicContact SD-CD2 4.47Å; I766-L798 HydrophobicContact CG2-CD1 3.9Å; I766-L798 HydrophobicContact CG2-CD2 4.48Å; I766-L798 HydrophobicContact CG2-CG 3.86Å; L767-L798 PolarHBondContact O-N 3.36Å; F768-L798 HydrophobicContact CD2-CD1 3.8Å; F768-L798 HydrophobicContact CE2-CD1 4.13Å
799	V	90.8	Very high	86.1	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	128	178.9	-179	0	0	0	0	108	V508 L509 F510 C511 M770 A801 E805 E806	V508-V799 HydrophobicContact CG1-CG2 4Å; L509-V799 PolarHBondContact O-N 3.42Å; F510-V799 CarbonylContact C-O 3.58Å; F510-V799 WeakPolarHBondContact CA-O 3.2Å; F510-V799 HydrophobicContact CD1-CB 4.24Å; F510-V799 HydrophobicContact CD1-CG1 4.14Å; F510-V799 HydrophobicContact CE1-CB 4.4Å; F510-V799 HydrophobicContact CE1-CG1 4.12Å; C511-V799 PolarHBondContact N-O 3.02Å; M770-V799 HydrophobicContact CG-CG2 4.3Å; V799-A801 PolarHBondContact O-N 3.32Å; V799-E805 HydrophobicContact CG1-CB 4.38Å; V799-E806 HydrophobicContact CG1-CB 4Å
800	T	87.7	Confident	86	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.006	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	122.3	171.7	-59	0	0	0	0	110	C511 P513 K642 E805	C511-T800 WeakPolarHBondContact O-CA 3.4Å; P513-T800 HydrophobicContact CB-CG2 4.01Å; P513-T800 HydrophobicContact CG-CG2 4.41Å; K642-T800 WeakPolarHBondContact CE-OG1 3.41Å; T800-E805 PolarHBondContact N-OE2 2.79Å; T800-E805 PolarHBondContact OG1-OE2 2.94Å
801	A	83.7	Confident	85.9	Confident	3 Å²	3	20.1 Å²	20.1	3%	0.025	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	143	178.6	0	0	0	0	0	111.2	F510 C511 V799 G803	F510-A801 HydrophobicContact CB-CB 4.23Å; C511-A801 PolarHBondContact O-N 3.45Å; V799-A801 PolarHBondContact O-N 3.32Å; A801-G803 PolarHBondContact O-N 3.14Å
802	S	73.6	Confident	85.7	Confident	38 Å²	38	17.1 Å²	17.1	27%	0.266	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	4.3	179	-54.3	0	0	0	0	115.7	E806	S802-E806 PolarHBondContact N-OE2 3.36Å
803	G	76.2	Confident	85.5	Confident	4 Å²	4	16.1 Å²	16.1	4%	0.041	8%	0.084	C	C	.	.	S	Bend	trans	-98.7	177.7	-178.8	0	0	0	0	0	114.4	E521 A801 E805 E806	E521-G803 VanDerWaalsContact OE1-CA 3.29Å; E521-G803 WeakPolarHBondContact OE1-CA 3.35Å; A801-G803 PolarHBondContact O-N 3.14Å; G803-E805 PolarHBondContact O-N 3.02Å; G803-E806 PolarHBondContact O-N 3.29Å; G803-E806 VanDerWaalsContact O-N 3.14Å
804	M	82.8	Confident	84.7	Confident	4 Å²	4	17.8 Å²	17.8	2%	0.02	10%	0.097	C	C	.	.	H	α-helix	trans	-56.4	-33.3	176	-178.3	-171.5	-66.1	0	0	112.6	I574 F577 H581 E806 R807 I808 F859	I574-M804 HydrophobicContact CG1-CE 4.35Å; I574-M804 HydrophobicContact CG2-SD 4.01Å; F577-M804 HydrophobicContact CB-CE 3.46Å; F577-M804 VanDerWaalsContact CB-CE 3.46Å; F577-M804 HydrophobicContact CB-SD 3.92Å; F577-M804 HydrophobicContact CD1-CE 4.11Å; F577-M804 HydrophobicContact CD2-CE 3.41Å; F577-M804 VanDerWaalsContact CD2-CE 3.41Å; F577-M804 HydrophobicContact CE2-CE 4.1Å; F577-M804 HydrophobicContact CG-CE 3.42Å; F577-M804 VanDerWaalsContact CG-CE 3.42Å; F577-M804 HydrophobicContact CG-SD 4.5Å; H581-M804 PolarHBondContact NE2-N 2.91Å; H581-M804 VanDerWaalsContact NE2-N 3.17Å; M804-E806 VanDerWaalsContact C-N 3.32Å; M804-E806 PolarHBondContact O-N 3.25Å; M804-R807 WeakPolarHBondContact O-CB 3.42Å; M804-R807 PolarHBondContact O-N 3.32Å; M804-R807 VanDerWaalsContact O-N 3.17Å; M804-I808 HydrophobicContact CG-CD1 4.33Å; M804-I808 WeakPolarHBondContact O-CG1 3.26Å; M804-I808 PolarHBondContact O-N 2.8Å; M804-F859 HydrophobicContact CE-CD1 3.82Å; M804-F859 HydrophobicContact CE-CE1 3.16Å; M804-F859 HydrophobicContact CE-CZ 3.89Å
805	E	85.4	Confident	83.9	Confident	2 Å²	2	19.4 Å²	19.4	1%	0.009	10%	0.103	C	C	.	.	H	α-helix	trans	-64.6	-33.8	179.7	-72.2	-168.7	149.9	0	0	114	H581 K642 V799 T800 G803 R807 I808 F809	H581-E805 HydrophobicContact CB-CG 4.09Å; K642-E805 WeakPolarHBondContact CE-OE2 3.49Å; K642-E805 IonicContact NZ-OE1 3.48Å; K642-E805 PolarHBondContact NZ-OE1 3.46Å; K642-E805 IonicContact NZ-OE2 3.69Å; K642-E805 PolarHBondContact NZ-OE2 3.25Å; V799-E805 HydrophobicContact CG1-CB 4.38Å; T800-E805 PolarHBondContact N-OE2 2.79Å; T800-E805 PolarHBondContact OG1-OE2 2.94Å; G803-E805 PolarHBondContact O-N 3.02Å; E805-R807 VanDerWaalsContact C-N 3.29Å; E805-R807 PolarHBondContact O-N 2.94Å; E805-I808 WeakPolarHBondContact O-CB 3.27Å; E805-I808 PolarHBondContact O-N 2.99Å; E805-F809 PolarHBondContact O-N 2.85Å
806	E	85.9	Confident	83.1	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.1	-38	174.2	-177.5	161.8	-160.1	0	0	110.7	F510 V799 S802 G803 M804 F809 Q810 S868 W869 T870	F510-E806 HydrophobicContact CD1-CG 4.5Å; F510-E806 HydrophobicContact CE1-CG 3.96Å; F510-E806 VanDerWaalsContact CE1-OE1 3.22Å; F510-E806 WeakPolarHBondContact CE1-OE1 3.47Å; V799-E806 HydrophobicContact CG1-CB 4Å; S802-E806 PolarHBondContact N-OE2 3.36Å; G803-E806 PolarHBondContact O-N 3.29Å; G803-E806 VanDerWaalsContact O-N 3.14Å; M804-E806 VanDerWaalsContact C-N 3.32Å; M804-E806 PolarHBondContact O-N 3.25Å; E806-F809 WeakPolarHBondContact O-CB 3.27Å; E806-F809 PolarHBondContact O-N 2.82Å; E806-Q810 VanDerWaalsContact O-CG 3.32Å; E806-Q810 WeakPolarHBondContact O-CG 3.43Å; E806-Q810 PolarHBondContact O-N 3.25Å; E806-S868 PolarHBondContact OE1-OG 2.89Å; E806-W869 PolarHBondContact OE1-N 2.66Å; E806-T870 WeakPolarHBondContact CG-OG1 3.32Å; E806-T870 VanDerWaalsContact OE1-CB 3.27Å; E806-T870 WeakPolarHBondContact OE1-CB 3.39Å; E806-T870 PolarHBondContact OE1-N 2.9Å; E806-T870 PolarHBondContact OE1-OG1 3.3Å
807	R	81.7	Confident	82	Confident	27 Å²	27	23 Å²	23	10%	0.102	13%	0.129	C	C	.	.	H	α-helix	trans	-64.9	-38.7	172.2	-59.9	-100.7	-178.1	-169.3	-8.1	112.2	M804 E805 F809 Q810 R811 E857 L858 L860 W869	M804-R807 WeakPolarHBondContact O-CB 3.42Å; M804-R807 PolarHBondContact O-N 3.32Å; M804-R807 VanDerWaalsContact O-N 3.17Å; E805-R807 VanDerWaalsContact C-N 3.29Å; E805-R807 PolarHBondContact O-N 2.94Å; R807-F809 VanDerWaalsContact C-N 3.32Å; R807-Q810 PolarHBondContact O-N 3.09Å; R807-R811 WeakPolarHBondContact O-CG 3.38Å; R807-R811 PolarHBondContact O-N 2.74Å; R807-E857 WeakPolarHBondContact CD-O 3.37Å; R807-E857 PolarHBondContact NE-O 3.39Å; R807-E857 PolarHBondContact NH1-O 2.85Å; R807-E857 PolarHBondContact NH2-O 3.21Å; R807-L858 HydrophobicContact CB-CD2 3.69Å; R807-L858 HydrophobicContact CG-CD2 4.43Å; R807-L860 PolarHBondContact NH2-O 3.44Å; R807-W869 HydrophobicContact CG-CZ3 3.87Å; R807-W869 VanDerWaalsContact CZ-CZ2 3.44Å; R807-W869 VanDerWaalsContact NE-CH2 3.29Å; R807-W869 VanDerWaalsContact NH2-CZ2 3.27Å; R807-W869 VanDerWaalsContact NH2-CZ3 3.31Å
808	I	84.9	Confident	80.7	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-61.3	-44.9	174.5	-65.5	171.2	0	0	0	109.6	M770 D771 W772 M804 E805 R811 Q812	M770-I808 HydrophobicContact CB-CG2 4.39Å; D771-I808 WeakPolarHBondContact O-CG2 3.49Å; W772-I808 HydrophobicContact CD2-CD1 4.37Å; W772-I808 HydrophobicContact CD2-CG1 4.24Å; W772-I808 HydrophobicContact CE3-CG1 4.08Å; W772-I808 HydrophobicContact CE3-CG2 4.45Å; W772-I808 HydrophobicContact CH2-CD1 4.05Å; W772-I808 HydrophobicContact CH2-CG1 3.6Å; W772-I808 HydrophobicContact CZ2-CD1 3.68Å; W772-I808 HydrophobicContact CZ2-CG1 3.78Å; W772-I808 HydrophobicContact CZ3-CG1 3.76Å; M804-I808 HydrophobicContact CG-CD1 4.33Å; M804-I808 WeakPolarHBondContact O-CG1 3.26Å; M804-I808 PolarHBondContact O-N 2.8Å; E805-I808 WeakPolarHBondContact O-CB 3.27Å; E805-I808 PolarHBondContact O-N 2.99Å; I808-R811 PolarHBondContact O-N 2.97Å; I808-Q812 WeakPolarHBondContact O-CG 3.4Å; I808-Q812 PolarHBondContact O-N 2.97Å
809	F	87.4	Confident	79.5	Confident	31 Å²	31	25.5 Å²	25.5	14%	0.136	15%	0.145	C	C	.	.	H	α-helix	trans	-60.4	-46.5	176.3	175.6	-105.7	0	0	0	112.4	V508 F510 M770 E805 E806 R807 R811 Q812 A813 T870	V508-F809 HydrophobicContact CG1-CE1 4.5Å; V508-F809 HydrophobicContact CG1-CE2 4.4Å; V508-F809 HydrophobicContact CG1-CZ 4.21Å; V508-F809 HydrophobicContact CG2-CE2 4.19Å; V508-F809 HydrophobicContact CG2-CZ 4.01Å; F510-F809 HydrophobicContact CZ-CE1 4.42Å; M770-F809 HydrophobicContact CE-CD2 3.93Å; E805-F809 PolarHBondContact O-N 2.85Å; E806-F809 WeakPolarHBondContact O-CB 3.27Å; E806-F809 PolarHBondContact O-N 2.82Å; R807-F809 VanDerWaalsContact C-N 3.32Å; F809-R811 VanDerWaalsContact C-N 3.32Å; F809-R811 PolarHBondContact O-N 2.92Å; F809-Q812 WeakPolarHBondContact O-CB 3.37Å; F809-Q812 PolarHBondContact O-N 3.47Å; F809-A813 PolarHBondContact O-N 2.85Å; F809-T870 HydrophobicContact CD1-CG2 4.42Å; F809-T870 HydrophobicContact CE1-CG2 4.21Å
810	Q	82.9	Confident	78.3	Confident	34 Å²	34	27 Å²	27	16%	0.159	16%	0.155	C	C	.	.	H	α-helix	trans	-58.7	-42.8	175.7	-69.3	164.9	6.4	0	0	112.1	E806 R807 A813 A814 W869 T870 L873	E806-Q810 VanDerWaalsContact O-CG 3.32Å; E806-Q810 WeakPolarHBondContact O-CG 3.43Å; E806-Q810 PolarHBondContact O-N 3.25Å; R807-Q810 PolarHBondContact O-N 3.09Å; Q810-A813 PolarHBondContact O-N 3.07Å; Q810-A814 PolarHBondContact O-N 3.42Å; Q810-W869 VanDerWaalsContact NE2-CZ3 3.32Å; Q810-T870 HydrophobicContact CG-CG2 4.26Å; Q810-T870 PolarHBondContact NE2-OG1 2.6Å; Q810-T870 VanDerWaalsContact NE2-OG1 3.1Å; Q810-L873 HydrophobicContact CG-CD1 4.42Å; Q810-L873 VanDerWaalsContact NE2-CD1 3.28Å
811	R	80	Confident	77.1	Confident	51 Å²	51	30.3 Å²	30.3	19%	0.192	17%	0.171	C	C	.	.	H	α-helix	trans	-66	-38.3	176.2	-75.9	-179.6	171.4	-179.5	1.8	112.7	R807 I808 F809 A813 A814 K815 L850 E854 L858	R807-R811 WeakPolarHBondContact O-CG 3.38Å; R807-R811 PolarHBondContact O-N 2.74Å; I808-R811 PolarHBondContact O-N 2.97Å; F809-R811 VanDerWaalsContact C-N 3.32Å; F809-R811 PolarHBondContact O-N 2.92Å; R811-A813 VanDerWaalsContact C-N 3.35Å; R811-A814 PolarHBondContact O-N 2.85Å; R811-K815 WeakPolarHBondContact O-CB 3.3Å; R811-K815 WeakPolarHBondContact O-CG 3.34Å; R811-K815 PolarHBondContact O-N 3.46Å; R811-L850 VanDerWaalsContact NH1-CD1 3.28Å; R811-E854 PolarHBondContact NH2-O 2.9Å; R811-L858 VanDerWaalsContact NH1-CD2 3.3Å; R811-L858 VanDerWaalsContact NH1-CG 3.33Å
812	Q	82.7	Confident	76.1	Confident	5 Å²	5	30.6 Å²	30.6	2%	0.023	17%	0.172	C	C	.	.	H	α-helix	trans	-60.3	-46.7	172.2	-77	-162.2	-8.5	0	0	111.2	D771 P774 D777 I808 F809 A814 K815 L816	D771-Q812 PolarHBondContact O-NE2 3.32Å; P774-Q812 HydrophobicContact CB-CB 4.04Å; P774-Q812 HydrophobicContact CB-CG 4.02Å; P774-Q812 HydrophobicContact CG-CB 4.46Å; P774-Q812 HydrophobicContact CG-CG 4.46Å; D777-Q812 PolarHBondContact OD2-NE2 3.35Å; I808-Q812 WeakPolarHBondContact O-CG 3.4Å; I808-Q812 PolarHBondContact O-N 2.97Å; F809-Q812 WeakPolarHBondContact O-CB 3.37Å; F809-Q812 PolarHBondContact O-N 3.47Å; Q812-A814 PolarHBondContact O-N 3.37Å; Q812-K815 PolarHBondContact O-N 3.02Å; Q812-L816 WeakPolarHBondContact O-CG 3.41Å; Q812-L816 PolarHBondContact O-N 3.42Å
813	A	81.7	Confident	75.7	Confident	45 Å²	45	29.2 Å²	29.2	37%	0.372	16%	0.162	S	C	.	.	H	α-helix	trans	-60	-44.9	178.1	0	0	0	0	0	111.6	F809 Q810 R811 K815 L816 A817	F809-A813 PolarHBondContact O-N 2.85Å; Q810-A813 PolarHBondContact O-N 3.07Å; R811-A813 VanDerWaalsContact C-N 3.35Å; A813-K815 PolarHBondContact O-N 3.04Å; A813-L816 PolarHBondContact O-N 3.35Å; A813-A817 WeakPolarHBondContact O-CB 3.35Å; A813-A817 PolarHBondContact O-N 3.29Å
814	A	73.2	Confident	74.7	Confident	34 Å²	34	31.3 Å²	31.3	28%	0.281	17%	0.174	S	C	.	.	H	α-helix	trans	-60	-46.4	175	0	0	0	0	0	112.1	Q810 R811 Q812 L816 A817 L818	Q810-A814 PolarHBondContact O-N 3.42Å; R811-A814 PolarHBondContact O-N 2.85Å; Q812-A814 PolarHBondContact O-N 3.37Å; A814-L816 VanDerWaalsContact C-N 3.33Å; A814-L816 PolarHBondContact O-N 3.35Å; A814-A817 PolarHBondContact O-N 3Å; A814-L818 VanDerWaalsContact O-CG 3.32Å; A814-L818 WeakPolarHBondContact O-CG 3.47Å; A814-L818 PolarHBondContact O-N 2.9Å
815	K	73.1	Confident	73	Confident	60 Å²	60	35.9 Å²	35.9	26%	0.261	20%	0.198	S	C	.	.	H	α-helix	trans	-61.5	-39.4	177	-75.2	178.9	-178.1	-178.1	0	112.7	W772 P774 R811 Q812 A813 T819	W772-K815 PolarHBondContact O-NZ 3.4Å; P774-K815 HydrophobicContact CG-CB 4.32Å; R811-K815 WeakPolarHBondContact O-CB 3.3Å; R811-K815 WeakPolarHBondContact O-CG 3.34Å; R811-K815 PolarHBondContact O-N 3.46Å; Q812-K815 PolarHBondContact O-N 3.02Å; A813-K815 PolarHBondContact O-N 3.04Å; K815-T819 WeakPolarHBondContact O-CB 3.49Å; K815-T819 PolarHBondContact O-N 3.18Å; K815-T819 PolarHBondContact O-OG1 3.27Å
816	L	74.9	Confident	70.7	Confident	84 Å²	84	38.6 Å²	38.6	44%	0.44	22%	0.215	S	C	.	.	H	α-helix	trans	-66.3	-43.4	176	-73.7	172.9	0	0	0	111.3	P774 Q812 A813 A814 L818 T819 S820	P774-L816 HydrophobicContact CB-CD1 3.99Å; P774-L816 HydrophobicContact CB-CD2 4Å; P774-L816 HydrophobicContact CB-CG 3.85Å; P774-L816 HydrophobicContact CG-CD2 4.11Å; P774-L816 HydrophobicContact CG-CG 4.01Å; Q812-L816 WeakPolarHBondContact O-CG 3.41Å; Q812-L816 PolarHBondContact O-N 3.42Å; A813-L816 PolarHBondContact O-N 3.35Å; A814-L816 VanDerWaalsContact C-N 3.33Å; A814-L816 PolarHBondContact O-N 3.35Å; L816-L818 PolarHBondContact O-N 2.78Å; L816-T819 WeakPolarHBondContact O-CB 3.19Å; L816-T819 PolarHBondContact O-N 3.29Å; L816-S820 PolarHBondContact O-N 2.91Å; L816-S820 PolarHBondContact O-OG 3.29Å
817	A	67.8	Low	68.2	Low	34 Å²	34	44.5 Å²	44.5	28%	0.281	26%	0.256	S	S	.	.	H	α-helix	trans	-59.6	-45.9	176.5	0	0	0	0	0	112	A813 A814 T819 S820 Q821	A813-A817 WeakPolarHBondContact O-CB 3.35Å; A813-A817 PolarHBondContact O-N 3.29Å; A814-A817 PolarHBondContact O-N 3Å; A817-T819 VanDerWaalsContact C-N 3.32Å; A817-T819 PolarHBondContact O-N 3.32Å; A817-S820 PolarHBondContact O-N 3.08Å; A817-Q821 WeakPolarHBondContact O-CG 3.32Å; A817-Q821 PolarHBondContact O-N 2.95Å
818	L	65.8	Low	65.7	Low	59 Å²	59	49.8 Å²	49.8	31%	0.309	28%	0.284	S	S	.	.	H	α-helix	trans	-61.2	-40.5	176	-68.4	-179.9	0	0	0	112.7	R435 A814 L816 T822	R435-L818 VanDerWaalsContact CZ-CD2 3.47Å; A814-L818 VanDerWaalsContact O-CG 3.32Å; A814-L818 WeakPolarHBondContact O-CG 3.47Å; A814-L818 PolarHBondContact O-N 2.9Å; L816-L818 PolarHBondContact O-N 2.78Å; L818-T822 PolarHBondContact O-N 3.35Å; L818-T822 VanDerWaalsContact O-N 3.14Å; L818-T822 PolarHBondContact O-OG1 2.69Å
819	T	66.5	Low	63.2	Low	18 Å²	18	57 Å²	57	11%	0.11	31%	0.312	C	S	.	.	H	α-helix	trans	-65.7	-40.9	178.4	-65.2	0	0	0	0	111.4	L397 K815 L816 A817 L823	L397-T819 HydrophobicContact CB-CG2 3.95Å; L397-T819 HydrophobicContact CD1-CG2 4.17Å; K815-T819 WeakPolarHBondContact O-CB 3.49Å; K815-T819 PolarHBondContact O-N 3.18Å; K815-T819 PolarHBondContact O-OG1 3.27Å; L816-T819 WeakPolarHBondContact O-CB 3.19Å; L816-T819 PolarHBondContact O-N 3.29Å; A817-T819 VanDerWaalsContact C-N 3.32Å; A817-T819 PolarHBondContact O-N 3.32Å; T819-L823 HydrophobicContact CG2-CD1 4.16Å; T819-L823 WeakPolarHBondContact O-CB 3.11Å; T819-L823 PolarHBondContact O-N 3.48Å
820	S	65.9	Low	60.7	Low	31 Å²	31	61.4 Å²	61.4	22%	0.217	34%	0.337	C	S	.	.	H	α-helix	trans	-65.4	-50.9	176.3	-66	0	0	0	0	110.7	L816 A817 T822 L823 V824	L816-S820 PolarHBondContact O-N 2.91Å; L816-S820 PolarHBondContact O-OG 3.29Å; A817-S820 PolarHBondContact O-N 3.08Å; S820-T822 VanDerWaalsContact C-N 3.26Å; S820-T822 PolarHBondContact O-N 2.64Å; S820-L823 PolarHBondContact O-N 3.19Å; S820-L823 VanDerWaalsContact O-N 3.13Å; S820-V824 CarbonylContact O-C 3.47Å; S820-V824 WeakPolarHBondContact O-CA 3.15Å; S820-V824 PolarHBondContact O-N 3.24Å
821	Q	63	Low	58.4	Low	71 Å²	71	65.7 Å²	65.7	33%	0.332	36%	0.357	S	S	.	.	H	α-helix	trans	-57	-36.3	179.2	-72.5	174.8	-4.7	0	0	113.8	A817 L834	A817-Q821 WeakPolarHBondContact O-CG 3.32Å; A817-Q821 PolarHBondContact O-N 2.95Å; Q821-L834 VanDerWaalsContact NE2-CD2 3.33Å
822	T	62.8	Low	56.2	Low	9 Å²	9	67.1 Å²	67.1	6%	0.055	37%	0.368	C	S	.	.	H	α-helix	trans	-76.7	-29.1	-178.3	-51.7	0	0	0	0	112.6	L401 L481 L818 S820	L401-T822 HydrophobicContact CD2-CG2 3.87Å; L481-T822 HydrophobicContact CD2-CG2 3.84Å; L818-T822 PolarHBondContact O-N 3.35Å; L818-T822 VanDerWaalsContact O-N 3.14Å; L818-T822 PolarHBondContact O-OG1 2.69Å; S820-T822 VanDerWaalsContact C-N 3.26Å; S820-T822 PolarHBondContact O-N 2.64Å
823	L	64.7	Low	54	Low	9 Å²	9	71.4 Å²	71.4	5%	0.047	39%	0.391	C	S	.	.	H	α-helix	trans	-117.7	-14.3	-167.4	-64.3	178.3	0	0	0	114.5	P396 L397 L404 F482 L485 F489 T819 S820	P396-L823 HydrophobicContact CB-CD1 4.15Å; P396-L823 HydrophobicContact CG-CD1 3.49Å; P396-L823 VanDerWaalsContact CG-CD1 3.49Å; L397-L823 HydrophobicContact CD1-CD1 3.59Å; L397-L823 HydrophobicContact CD1-CD2 4.49Å; L397-L823 HydrophobicContact CD1-CG 3.92Å; L397-L823 HydrophobicContact CG-CD1 4.04Å; L404-L823 HydrophobicContact CD2-CD2 4.39Å; F482-L823 WeakPolarHBondContact CE2-O 3.39Å; L485-L823 HydrophobicContact CD1-CD2 3.94Å; F489-L823 HydrophobicContact CE1-CD2 3.98Å; F489-L823 HydrophobicContact CZ-CD1 4.14Å; F489-L823 HydrophobicContact CZ-CD2 4Å; T819-L823 HydrophobicContact CG2-CD1 4.16Å; T819-L823 WeakPolarHBondContact O-CB 3.11Å; T819-L823 PolarHBondContact O-N 3.48Å; S820-L823 PolarHBondContact O-N 3.19Å; S820-L823 VanDerWaalsContact O-N 3.13Å
824	V	56.5	Low	51.9	Low	49 Å²	49	72 Å²	72	30%	0.297	39%	0.388	S	S	.	.	S	Bend	trans	-137.8	113.4	-179.4	-166.6	0	0	0	0	104.7	S820 T826	S820-V824 CarbonylContact O-C 3.47Å; S820-V824 WeakPolarHBondContact O-CA 3.15Å; S820-V824 PolarHBondContact O-N 3.24Å; V824-T826 VanDerWaalsContact CG1-OG1 3.26Å; V824-T826 WeakPolarHBondContact CG1-OG1 3.43Å; V824-T826 PolarHBondContact O-N 3.36Å
825	N	46.1	Very low	50.1	Low	100 Å²	100	74.6 Å²	74.6	54%	0.535	39%	0.393	S	S	.	.			trans	-65.7	50.6	178.8	-80.5	-2.6	0	0	0	112.4	F482 S827	F482-N825 VanDerWaalsContact CD1-ND2 3.34Å; F482-N825 WeakPolarHBondContact CD1-ND2 3.41Å; F482-N825 VanDerWaalsContact CE1-ND2 3.3Å; F482-N825 WeakPolarHBondContact CE1-ND2 3.31Å; N825-S827 PolarHBondContact O-N 3.01Å
826	T	36.7	Very low	48.4	Very low	58 Å²	58	76 Å²	76	36%	0.356	40%	0.399	S	S	.	.			trans	-90.9	93.8	177	-52.3	0	0	0	0	107.2	V824 M828 Y829	V824-T826 VanDerWaalsContact CG1-OG1 3.26Å; V824-T826 WeakPolarHBondContact CG1-OG1 3.43Å; V824-T826 PolarHBondContact O-N 3.36Å; T826-M828 HydrophobicContact CG2-CB 3.64Å; T826-M828 PolarHBondContact O-N 3.35Å; T826-Y829 HydrophobicContact CG2-CD2 4.45Å; T826-Y829 HydrophobicContact CG2-CE2 4.23Å
827	S	33.5	Very low	46.8	Very low	125 Å²	125	77.1 Å²	77.1	87%	0.874	41%	0.409	S	S	*	.			trans	-67	24.7	169.6	58.4	0	0	0	0	113.3	N825	N825-S827 PolarHBondContact O-N 3.01Å
828	M	29.5	Very low	45.3	Very low	138 Å²	138	78.1 Å²	78.1	68%	0.68	41%	0.408	S	S	*	.			trans	-130.5	37.7	-157.3	-123.5	-173.4	96.5	0	0	114.6	T826	T826-M828 HydrophobicContact CG2-CB 3.64Å; T826-M828 PolarHBondContact O-N 3.35Å
829	Y	33.5	Very low	43.9	Very low	152 Å²	152	84.1 Å²	84.1	60%	0.596	43%	0.431	S	S	*	.	S	Bend	trans	-120.1	125.2	164.7	-74.4	-77.8	0	0	0	109.7	T826 E831	T826-Y829 HydrophobicContact CG2-CD2 4.45Å; T826-Y829 HydrophobicContact CG2-CE2 4.23Å; Y829-E831 PolarHBondContact O-N 2.92Å
830	N	34.8	Very low	42.4	Very low	123 Å²	123	90.4 Å²	90.4	66%	0.658	46%	0.457	S	S	*	.			trans	-28.6	116.4	-175	-86.4	-22.4	0	0	0	114	N832 L833	N830-N832 PolarHBondContact O-N 2.7Å; N830-L833 PolarHBondContact O-N 3.46Å
831	E	33.7	Very low	40.9	Very low	124 Å²	124	97.5 Å²	97.5	58%	0.579	48%	0.484	S	S	*	.	H	α-helix	trans	-48.5	-26.9	170.9	-72.7	-165.6	159.2	0	0	112.5	Y829 L834 K835	Y829-E831 PolarHBondContact O-N 2.92Å; E831-L834 PolarHBondContact O-N 3.2Å; E831-K835 VanDerWaalsContact O-CG 3.31Å; E831-K835 WeakPolarHBondContact O-CG 3.34Å; E831-K835 PolarHBondContact O-N 3.35Å; E831-K835 IonicContact OE2-NZ 2.82Å
832	N	33.8	Very low	39.5	Very low	81 Å²	81	102 Å²	102	43%	0.433	51%	0.505	S	S	.	.	H	α-helix	trans	-73.1	-27.7	-176.3	-63.5	-15.7	0	0	0	113.7	N830 K835 F836	N830-N832 PolarHBondContact O-N 2.7Å; N832-K835 PolarHBondContact OD1-NZ 3.42Å; N832-K835 VanDerWaalsContact OD1-NZ 3.13Å; N832-F836 WeakPolarHBondContact O-CD2 3.45Å; N832-F836 WeakPolarHBondContact O-CE2 3.3Å
833	L	37.2	Very low	38.2	Very low	96 Å²	96	106.2 Å²	106.2	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-81.8	-23.2	177.3	-126.1	153.5	0	0	0	112	N830 I874	N830-L833 PolarHBondContact O-N 3.46Å; L833-I874 HydrophobicContact CD1-CG1 4.09Å; L833-I874 HydrophobicContact CG-CG1 4.42Å
834	L	38.1	Very low	36.6	Very low	57 Å²	57	112.5 Å²	112.5	30%	0.298	57%	0.566	S	S	.	*	H	α-helix	trans	-77	-38.7	176.4	-77.9	148	0	0	0	111.7	Q821 E831 F836 V837 E838	Q821-L834 VanDerWaalsContact NE2-CD2 3.33Å; E831-L834 PolarHBondContact O-N 3.2Å; L834-F836 PolarHBondContact O-N 2.91Å; L834-V837 PolarHBondContact O-N 2.68Å; L834-E838 WeakPolarHBondContact O-CG 3.19Å
835	K	33.7	Very low	35.5	Very low	89 Å²	89	118.8 Å²	118.8	39%	0.387	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-55.7	-22.3	176.8	-75.5	169.2	-167.5	163.1	0	115.1	E831 N832 E838	E831-K835 VanDerWaalsContact O-CG 3.31Å; E831-K835 WeakPolarHBondContact O-CG 3.34Å; E831-K835 PolarHBondContact O-N 3.35Å; E831-K835 IonicContact OE2-NZ 2.82Å; N832-K835 PolarHBondContact OD1-NZ 3.42Å; N832-K835 VanDerWaalsContact OD1-NZ 3.13Å; K835-E838 WeakPolarHBondContact CA-OE2 3.3Å
836	F	37.6	Very low	34.7	Very low	88 Å²	88	120.6 Å²	120.6	39%	0.386	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.6	-19.2	-176.8	-75.3	-74.8	0	0	0	115	N832 L834 E838 L873 Q875	N832-F836 WeakPolarHBondContact O-CD2 3.45Å; N832-F836 WeakPolarHBondContact O-CE2 3.3Å; L834-F836 PolarHBondContact O-N 2.91Å; F836-E838 PolarHBondContact O-N 3.32Å; F836-L873 WeakPolarHBondContact CD2-O 3.39Å; F836-Q875 HydrophobicContact CE2-CG 4.06Å; F836-Q875 HydrophobicContact CZ-CG 3.92Å; F836-Q875 VanDerWaalsContact CZ-NE2 3.31Å
837	V	41.3	Very low	34.5	Very low	108 Å²	108	124.5 Å²	124.5	66%	0.655	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-75.3	-14.3	175	-176.9	0	0	0	0	110.9	L834 K839	L834-V837 PolarHBondContact O-N 2.68Å; V837-K839 PolarHBondContact O-N 2.88Å
838	E	37.8	Very low	34.7	Very low	55 Å²	55	122.4 Å²	122.4	26%	0.257	62%	0.616	S	S	.	*	G	3₁₀ helix	trans	-85.1	-6.3	-163.4	-67.1	169.5	-178.5	0	0	115.5	Q439 L834 K835 F836	Q439-E838 VanDerWaalsContact NE2-CB 3.3Å; Q439-E838 PolarHBondContact NE2-OE2 2.89Å; L834-E838 WeakPolarHBondContact O-CG 3.19Å; K835-E838 WeakPolarHBondContact CA-OE2 3.3Å; F836-E838 PolarHBondContact O-N 3.32Å
839	K	35.7	Very low	35.4	Very low	185 Å²	185	118.9 Å²	118.9	80%	0.804	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-82.1	-13.3	-165.5	-102.6	-175.8	179.9	179.9	0	117.9	V837	V837-K839 PolarHBondContact O-N 2.88Å
840	K	35.1	Very low	36.2	Very low	151 Å²	151	113.8 Å²	113.8	66%	0.657	58%	0.582	S	S	*	*	S	Bend	trans	-151.8	111	-174	-68.3	-171.1	178.7	168.9	0	117.6
841	K	33.6	Very low	37	Very low	180 Å²	180	110.2 Å²	110.2	78%	0.783	56%	0.564	S	S	*	*			trans	64.9	142.2	142.2	-72.8	-175.3	174.4	-175.2	0	122.3
842	E	33.4	Very low	38	Very low	165 Å²	165	108.9 Å²	108.9	77%	0.771	55%	0.554	S	S	*	*			trans	-48.4	140.6	-172.3	-59.4	-179.6	135.9	0	0	116.4	D844	E842-D844 PolarHBondContact O-N 2.93Å
843	P	35	Very low	38.6	Very low	98 Å²	98	107.8 Å²	107.8	64%	0.636	55%	0.548	S	S	*	.			trans	-87.3	95.1	169.2	33.4	-27.6	0	0	0	109.8	L432	L432-P843 HydrophobicContact CD1-CG 4.37Å
844	D	31.9	Very low	39.6	Very low	140 Å²	140	107 Å²	107	75%	0.749	54%	0.542	S	S	*	.			trans	-62.3	152	169.2	-112.4	-28	0	0	0	112.3	E842 N846	E842-D844 PolarHBondContact O-N 2.93Å; D844-N846 PolarHBondContact O-N 2.8Å
845	K	32.7	Very low	40.7	Very low	181 Å²	181	104.9 Å²	104.9	79%	0.787	53%	0.531	S	S	*	.	S	Bend	trans	-60.5	127.6	-169.8	-62.8	161.2	-176.4	166.7	0	112
846	N	29.2	Very low	42	Very low	138 Å²	138	103.9 Å²	103.9	74%	0.738	53%	0.527	S	S	*	.	S	Bend	trans	96.4	135.7	158.4	-54.7	-39.2	0	0	0	118.5	D844	D844-N846 PolarHBondContact O-N 2.8Å
847	L	33	Very low	43.2	Very low	141 Å²	141	103.3 Å²	103.3	74%	0.738	53%	0.525	S	S	*	.	S	Bend	trans	75.1	141.6	170.3	-111.7	68.1	0	0	0	117.2	I849	L847-I849 HydrophobicContact CB-CB 4.46Å; L847-I849 HydrophobicContact CB-CD1 3.67Å; L847-I849 HydrophobicContact CB-CG1 3.94Å; L847-I849 HydrophobicContact CD2-CD1 3.4Å; L847-I849 HydrophobicContact CD2-CG1 4.09Å; L847-I849 HydrophobicContact CG-CD1 4.12Å; L847-I849 HydrophobicContact CG-CG1 4.49Å; L847-I849 PolarHBondContact O-N 3.08Å
848	G	38.2	Very low	44.4	Very low	81 Å²	81	98.4 Å²	98.4	84%	0.835	50%	0.495	S	S	*	.	S	Bend	trans	-67.9	48.3	170.2	0	0	0	0	0	113
849	I	43.7	Very low	45.6	Very low	64 Å²	64	96 Å²	96	33%	0.328	48%	0.484	S	S	.	.			trans	-105.2	121.3	174.4	-69	165.7	0	0	0	104.5	H567 L847 T851	H567-I849 VanDerWaalsContact CE1-CD1 3.41Å; H567-I849 WeakPolarHBondContact CE1-CD1 3.31Å; H567-I849 WeakPolarHBondContact CE1-CG2 3.41Å; H567-I849 WeakPolarHBondContact NE2-CD1 3.23Å; L847-I849 HydrophobicContact CB-CB 4.46Å; L847-I849 HydrophobicContact CB-CD1 3.67Å; L847-I849 HydrophobicContact CB-CG1 3.94Å; L847-I849 HydrophobicContact CD2-CD1 3.4Å; L847-I849 HydrophobicContact CD2-CG1 4.09Å; L847-I849 HydrophobicContact CG-CD1 4.12Å; L847-I849 HydrophobicContact CG-CG1 4.49Å; L847-I849 PolarHBondContact O-N 3.08Å; I849-T851 PolarHBondContact O-N 3.42Å
850	L	51.6	Low	46.9	Very low	45 Å²	45	91.8 Å²	91.8	24%	0.236	47%	0.469	C	S	.	.			trans	-53.1	131.3	170.1	-64.2	170	0	0	0	109.1	R811 E854 L855 L858	R811-L850 VanDerWaalsContact NH1-CD1 3.28Å; L850-E854 VanDerWaalsContact CA-OE2 3.24Å; L850-E854 WeakPolarHBondContact CA-OE2 3.47Å; L850-E854 HydrophobicContact CB-CB 4.1Å; L850-E854 HydrophobicContact CD2-CB 4.44Å; L850-L855 HydrophobicContact CB-CD1 4.48Å; L850-L855 HydrophobicContact CB-CD2 3.71Å; L850-L855 HydrophobicContact CB-CG 3.64Å; L850-L855 HydrophobicContact CD1-CD2 3.72Å; L850-L855 HydrophobicContact CD1-CG 4.5Å; L850-L855 HydrophobicContact CG-CD2 4.35Å; L850-L855 WeakPolarHBondContact O-CD1 3.39Å; L850-L858 HydrophobicContact CD1-CD1 3.23Å; L850-L858 HydrophobicContact CD1-CG 4.27Å
851	T	50.7	Low	48	Very low	48 Å²	48	88.9 Å²	88.9	29%	0.294	46%	0.461	S	S	.	.			trans	-55.8	155.8	176.2	68	0	0	0	0	109.5	I849 D853 E854 L855	I849-T851 PolarHBondContact O-N 3.42Å; T851-D853 PolarHBondContact O-N 3.41Å; T851-D853 VanDerWaalsContact O-N 3.11Å; T851-E854 PolarHBondContact N-OE2 2.89Å; T851-E854 CarbonylContact O-C 3.49Å; T851-E854 WeakPolarHBondContact O-CA 3.2Å; T851-E854 WeakPolarHBondContact O-CB 3.44Å; T851-E854 PolarHBondContact O-N 2.96Å; T851-E854 WeakPolarHBondContact OG1-CB 2.9Å; T851-E854 WeakPolarHBondContact OG1-CG 3.21Å; T851-E854 PolarHBondContact OG1-N 3.4Å; T851-E854 VanDerWaalsContact OG1-N 3.11Å; T851-L855 PolarHBondContact O-N 3.4Å
852	R	54.4	Low	49.2	Very low	96 Å²	96	81.4 Å²	81.4	36%	0.362	43%	0.43	S	S	.	.	H	α-helix	trans	-55.8	-33.6	-179.8	-176	177.3	174.1	166.9	-5.2	112	F532 S535 K856	F532-R852 HydrophobicContact CD1-CG 4.28Å; F532-R852 PolarHBondContact O-NH2 3.15Å; S535-R852 VanDerWaalsContact OG-CZ 3.23Å; S535-R852 PolarHBondContact OG-NH1 3.23Å; S535-R852 PolarHBondContact OG-NH2 2.82Å; R852-K856 WeakPolarHBondContact O-CG 3.26Å; R852-K856 PolarHBondContact O-N 3.08Å
853	D	47.4	Very low	49.9	Very low	58 Å²	58	81.6 Å²	81.6	31%	0.31	44%	0.437	S	S	.	.	H	α-helix	trans	-74	-40.6	176.1	-68.1	-20	0	0	0	111.4	T851 L855 K856 E857	T851-D853 PolarHBondContact O-N 3.41Å; T851-D853 VanDerWaalsContact O-N 3.11Å; D853-L855 VanDerWaalsContact C-N 3.3Å; D853-L855 PolarHBondContact O-N 2.99Å; D853-K856 PolarHBondContact O-N 3.4Å; D853-E857 WeakPolarHBondContact O-CG 3.43Å; D853-E857 PolarHBondContact O-N 3.38Å
854	E	57	Low	50.7	Low	79 Å²	79	78.4 Å²	78.4	37%	0.369	42%	0.416	S	S	.	.	H	α-helix	trans	-63.7	-32.5	171.1	-77.6	173.8	173.7	0	0	113.3	R811 L850 T851 L858	R811-E854 PolarHBondContact NH2-O 2.9Å; L850-E854 VanDerWaalsContact CA-OE2 3.24Å; L850-E854 WeakPolarHBondContact CA-OE2 3.47Å; L850-E854 HydrophobicContact CB-CB 4.1Å; L850-E854 HydrophobicContact CD2-CB 4.44Å; T851-E854 PolarHBondContact N-OE2 2.89Å; T851-E854 CarbonylContact O-C 3.49Å; T851-E854 WeakPolarHBondContact O-CA 3.2Å; T851-E854 WeakPolarHBondContact O-CB 3.44Å; T851-E854 PolarHBondContact O-N 2.96Å; T851-E854 WeakPolarHBondContact OG1-CB 2.9Å; T851-E854 WeakPolarHBondContact OG1-CG 3.21Å; T851-E854 PolarHBondContact OG1-N 3.4Å; T851-E854 VanDerWaalsContact OG1-N 3.11Å; E854-L858 WeakPolarHBondContact O-CG 3.37Å; E854-L858 PolarHBondContact O-N 3.26Å; E854-L858 VanDerWaalsContact O-N 3.12Å
855	L	61.9	Low	51.6	Low	12 Å²	12	78 Å²	78	6%	0.063	42%	0.423	C	S	.	.	H	α-helix	trans	-68.9	-49.7	172.6	-76.4	168.9	0	0	0	109.5	F532 I570 L850 T851 D853 E857 L858 F859	F532-L855 HydrophobicContact CE1-CB 4.2Å; F532-L855 HydrophobicContact CE1-CD1 4.06Å; F532-L855 HydrophobicContact CE2-CB 4.42Å; F532-L855 HydrophobicContact CZ-CB 3.74Å; F532-L855 HydrophobicContact CZ-CD1 3.96Å; F532-L855 HydrophobicContact CZ-CG 4.34Å; I570-L855 HydrophobicContact CD1-CD1 4.14Å; I570-L855 HydrophobicContact CG2-CD2 3.96Å; L850-L855 HydrophobicContact CB-CD1 4.48Å; L850-L855 HydrophobicContact CB-CD2 3.71Å; L850-L855 HydrophobicContact CB-CG 3.64Å; L850-L855 HydrophobicContact CD1-CD2 3.72Å; L850-L855 HydrophobicContact CD1-CG 4.5Å; L850-L855 HydrophobicContact CG-CD2 4.35Å; L850-L855 WeakPolarHBondContact O-CD1 3.39Å; T851-L855 PolarHBondContact O-N 3.4Å; D853-L855 VanDerWaalsContact C-N 3.3Å; D853-L855 PolarHBondContact O-N 2.99Å; L855-E857 VanDerWaalsContact C-N 3.25Å; L855-E857 PolarHBondContact O-N 2.86Å; L855-L858 WeakPolarHBondContact O-CB 3.31Å; L855-L858 PolarHBondContact O-N 2.92Å; L855-F859 HydrophobicContact CB-CE2 4.47Å; L855-F859 HydrophobicContact CD2-CE2 4.18Å; L855-F859 WeakPolarHBondContact O-CD2 3.47Å; L855-F859 PolarHBondContact O-N 3.5Å
856	K	61.7	Low	52.6	Low	69 Å²	69	70.8 Å²	70.8	30%	0.3	40%	0.395	S	S	.	.	H	α-helix	trans	-53.7	-46.8	174.8	-77.2	176	176.8	-176.2	0	111	R852 D853 L858 F859 L860	R852-K856 WeakPolarHBondContact O-CG 3.26Å; R852-K856 PolarHBondContact O-N 3.08Å; D853-K856 PolarHBondContact O-N 3.4Å; K856-L858 VanDerWaalsContact C-N 3.32Å; K856-L858 PolarHBondContact O-N 3.24Å; K856-F859 CarbonylContact O-C 3.57Å; K856-F859 PolarHBondContact O-N 2.96Å; K856-L860 WeakPolarHBondContact O-CG 3.31Å; K856-L860 PolarHBondContact O-N 3.38Å
857	E	62.5	Low	54.1	Low	75 Å²	75	65.1 Å²	65.1	35%	0.35	37%	0.369	S	S	.	.	H	α-helix	trans	-60.4	-36.9	177.1	-76.2	-172.3	175.1	0	0	113.5	R807 D853 L855 F859 L860	R807-E857 WeakPolarHBondContact CD-O 3.37Å; R807-E857 PolarHBondContact NE-O 3.39Å; R807-E857 PolarHBondContact NH1-O 2.85Å; R807-E857 PolarHBondContact NH2-O 3.21Å; D853-E857 WeakPolarHBondContact O-CG 3.43Å; D853-E857 PolarHBondContact O-N 3.38Å; L855-E857 VanDerWaalsContact C-N 3.25Å; L855-E857 PolarHBondContact O-N 2.86Å; E857-F859 PolarHBondContact O-N 3.45Å; E857-L860 HydrophobicContact CG-CD1 4.3Å; E857-L860 PolarHBondContact O-N 3.33Å
858	L	65.7	Low	55.8	Low	5 Å²	5	58.4 Å²	58.4	3%	0.026	33%	0.334	C	S	.	.	H	α-helix	trans	-60.3	-30.2	174.7	-81	-174.6	0	0	0	114	W772 R807 R811 L850 E854 L855 K856	W772-L858 HydrophobicContact CH2-CD1 3.67Å; W772-L858 HydrophobicContact CH2-CD2 4.1Å; W772-L858 HydrophobicContact CZ3-CD1 4.34Å; W772-L858 HydrophobicContact CZ3-CD2 4.38Å; R807-L858 HydrophobicContact CB-CD2 3.69Å; R807-L858 HydrophobicContact CG-CD2 4.43Å; R811-L858 VanDerWaalsContact NH1-CD2 3.3Å; R811-L858 VanDerWaalsContact NH1-CG 3.33Å; L850-L858 HydrophobicContact CD1-CD1 3.23Å; L850-L858 HydrophobicContact CD1-CG 4.27Å; E854-L858 WeakPolarHBondContact O-CG 3.37Å; E854-L858 PolarHBondContact O-N 3.26Å; E854-L858 VanDerWaalsContact O-N 3.12Å; L855-L858 WeakPolarHBondContact O-CB 3.31Å; L855-L858 PolarHBondContact O-N 2.92Å; K856-L858 VanDerWaalsContact C-N 3.32Å; K856-L858 PolarHBondContact O-N 3.24Å
859	F	63.9	Low	57.4	Low	6 Å²	6	56.1 Å²	56.1	3%	0.026	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	6.2	-174.5	-55.9	-73.7	0	0	0	112.8	T525 M528 F532 I574 F577 M804 L855 K856 E857 L861	T525-F859 WeakPolarHBondContact CG2-O 3.42Å; M528-F859 HydrophobicContact CE-CD2 3.89Å; M528-F859 HydrophobicContact CE-CE1 3.97Å; M528-F859 HydrophobicContact CE-CE2 3.32Å; M528-F859 HydrophobicContact CE-CZ 3.36Å; M528-F859 HydrophobicContact CG-CD1 4.47Å; M528-F859 HydrophobicContact CG-CE1 4.41Å; F532-F859 HydrophobicContact CE2-CD2 4.05Å; F532-F859 HydrophobicContact CE2-CE2 4.18Å; I574-F859 HydrophobicContact CG1-CZ 3.93Å; F577-F859 HydrophobicContact CD2-CD1 4.33Å; F577-F859 AromaticContact CD2-CE1 3.79Å; F577-F859 HydrophobicContact CD2-CE1 3.79Å; F577-F859 AromaticContact CE2-CD1 3.65Å; F577-F859 HydrophobicContact CE2-CD1 3.65Å; F577-F859 AromaticContact CE2-CE1 3.44Å; F577-F859 HydrophobicContact CE2-CE1 3.44Å; F577-F859 VanDerWaalsContact CE2-CE1 3.44Å; F577-F859 AromaticContact CZ-CD1 3.83Å; F577-F859 HydrophobicContact CZ-CD1 3.83Å; F577-F859 HydrophobicContact CZ-CE1 4.11Å; M804-F859 HydrophobicContact CE-CD1 3.82Å; M804-F859 HydrophobicContact CE-CE1 3.16Å; M804-F859 HydrophobicContact CE-CZ 3.89Å; L855-F859 HydrophobicContact CB-CE2 4.47Å; L855-F859 HydrophobicContact CD2-CE2 4.18Å; L855-F859 WeakPolarHBondContact O-CD2 3.47Å; L855-F859 PolarHBondContact O-N 3.5Å; K856-F859 CarbonylContact O-C 3.57Å; K856-F859 PolarHBondContact O-N 2.96Å; E857-F859 PolarHBondContact O-N 3.45Å; F859-L861 PolarHBondContact O-N 3.46Å
860	L	61.9	Low	59	Low	95 Å²	95	53.9 Å²	53.9	50%	0.497	29%	0.289	S	S	.	.			trans	-74.2	113.9	171.9	-77.4	173.3	0	0	0	109.3	R807 K856 E857 P862	R807-L860 PolarHBondContact NH2-O 3.44Å; K856-L860 WeakPolarHBondContact O-CG 3.31Å; K856-L860 PolarHBondContact O-N 3.38Å; E857-L860 HydrophobicContact CG-CD1 4.3Å; E857-L860 PolarHBondContact O-N 3.33Å; L860-P862 WeakPolarHBondContact O-CD 3.48Å
861	L	59.5	Low	60.1	Low	90 Å²	90	53 Å²	53	47%	0.471	28%	0.284	S	S	.	.			trans	-63.5	124.3	166.7	-70.8	165.5	0	0	0	108.7	T525 F859	T525-L861 HydrophobicContact CG2-CD1 4.1Å; T525-L861 HydrophobicContact CG2-CG 4.17Å; F859-L861 PolarHBondContact O-N 3.46Å
862	P	57.2	Low	61.1	Low	23 Å²	23	54.8 Å²	54.8	15%	0.149	29%	0.289	C	S	.	.			trans	-67.3	133.5	174.5	-15	29.4	0	0	0	110.3	L860 T864 W869	L860-P862 WeakPolarHBondContact O-CD 3.48Å; P862-T864 HydrophobicContact CB-CG2 3.62Å; P862-T864 PolarHBondContact O-N 2.82Å; P862-W869 HydrophobicContact CB-CB 4.06Å; P862-W869 HydrophobicContact CB-CD2 3.83Å; P862-W869 HydrophobicContact CB-CG 3.59Å; P862-W869 HydrophobicContact CG-CB 3.87Å; P862-W869 HydrophobicContact CG-CD2 3.45Å; P862-W869 VanDerWaalsContact CG-CD2 3.45Å; P862-W869 HydrophobicContact CG-CE3 3.66Å; P862-W869 HydrophobicContact CG-CG 3.56Å
863	N	49.6	Very low	61.9	Low	170 Å²	170	52.6 Å²	52.6	91%	0.909	28%	0.284	S	S	*	.			trans	-78.5	65.4	167.6	-74.3	-11.8	0	0	0	109.1
864	T	50.7	Low	63.1	Low	31 Å²	31	53.2 Å²	53.2	19%	0.19	29%	0.287	C	S	.	.			trans	-120.7	116.2	-172.9	61.6	0	0	0	0	111.4	P862 T866 W869 E872	P862-T864 HydrophobicContact CB-CG2 3.62Å; P862-T864 PolarHBondContact O-N 2.82Å; T864-T866 PolarHBondContact O-N 3.29Å; T864-T866 PolarHBondContact OG1-O 2.88Å; T864-W869 HydrophobicContact CG2-CG 4.4Å; T864-E872 WeakPolarHBondContact CB-OE2 3.11Å; T864-E872 WeakPolarHBondContact CG2-OE2 3.3Å
865	S	50.5	Low	63.7	Low	130 Å²	130	55.2 Å²	55.2	91%	0.909	30%	0.296	S	S	*	.	S	Bend	trans	-68.1	-7.9	161.3	53.2	0	0	0	0	112.1
866	T	53.5	Low	64.1	Low	30 Å²	30	57.3 Å²	57.3	18%	0.184	31%	0.311	C	S	.	.	S	Bend	trans	-95.2	131.6	-179.4	74.5	0	0	0	0	110.6	T864 S868 E872	T864-T866 PolarHBondContact O-N 3.29Å; T864-T866 PolarHBondContact OG1-O 2.88Å; T866-S868 PolarHBondContact O-N 3.01Å; T866-E872 PolarHBondContact OG1-OE2 3.42Å
867	G	61.2	Low	64.3	Low	19 Å²	19	59.6 Å²	59.6	20%	0.196	33%	0.326	C	S	.	.	S	Bend	trans	-70.4	8	-170.9	0	0	0	0	0	117.4
868	S	69.6	Low	64.4	Low	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.324	C	S	.	.			trans	-153.6	124.6	169.9	164.5	0	0	0	0	108.7	E806 T866 T870 H871 E872	E806-S868 PolarHBondContact OE1-OG 2.89Å; T866-S868 PolarHBondContact O-N 3.01Å; S868-T870 PolarHBondContact OG-N 3.39Å; S868-H871 WeakPolarHBondContact O-CB 3.46Å; S868-H871 PolarHBondContact O-N 2.85Å; S868-H871 PolarHBondContact OG-N 3.36Å; S868-E872 PolarHBondContact O-N 3.02Å
869	W	71.7	Confident	63.8	Low	34 Å²	34	61.5 Å²	61.5	13%	0.129	34%	0.342	C	S	.	.	H	α-helix	trans	-78.9	-27.8	-179.6	-178.5	39.9	0	0	0	112.1	E806 R807 Q810 P862 T864 H871 E872 L873	E806-W869 PolarHBondContact OE1-N 2.66Å; R807-W869 HydrophobicContact CG-CZ3 3.87Å; R807-W869 VanDerWaalsContact CZ-CZ2 3.44Å; R807-W869 VanDerWaalsContact NE-CH2 3.29Å; R807-W869 VanDerWaalsContact NH2-CZ2 3.27Å; R807-W869 VanDerWaalsContact NH2-CZ3 3.31Å; Q810-W869 VanDerWaalsContact NE2-CZ3 3.32Å; P862-W869 HydrophobicContact CB-CB 4.06Å; P862-W869 HydrophobicContact CB-CD2 3.83Å; P862-W869 HydrophobicContact CB-CG 3.59Å; P862-W869 HydrophobicContact CG-CB 3.87Å; P862-W869 HydrophobicContact CG-CD2 3.45Å; P862-W869 VanDerWaalsContact CG-CD2 3.45Å; P862-W869 HydrophobicContact CG-CE3 3.66Å; P862-W869 HydrophobicContact CG-CG 3.56Å; T864-W869 HydrophobicContact CG2-CG 4.4Å; W869-H871 VanDerWaalsContact C-N 3.28Å; W869-H871 PolarHBondContact O-N 3.25Å; W869-E872 PolarHBondContact O-N 3.03Å; W869-L873 HydrophobicContact CD2-CD1 4.32Å; W869-L873 HydrophobicContact CH2-CD1 3.75Å; W869-L873 HydrophobicContact CZ2-CD1 3.79Å; W869-L873 HydrophobicContact CZ2-CD2 4.03Å; W869-L873 HydrophobicContact CZ2-CG 4.19Å; W869-L873 HydrophobicContact CZ3-CD1 4.26Å; W869-L873 VanDerWaalsContact O-CG 3.31Å; W869-L873 WeakPolarHBondContact O-CG 3.25Å; W869-L873 PolarHBondContact O-N 2.94Å
870	T	76.3	Confident	63	Low	17 Å²	17	67.7 Å²	67.7	10%	0.104	37%	0.371	C	S	.	.	H	α-helix	trans	-59.7	-40.4	170.3	-53	0	0	0	0	111.5	E806 F809 Q810 S868 E872 L873 I874	E806-T870 WeakPolarHBondContact CG-OG1 3.32Å; E806-T870 VanDerWaalsContact OE1-CB 3.27Å; E806-T870 WeakPolarHBondContact OE1-CB 3.39Å; E806-T870 PolarHBondContact OE1-N 2.9Å; E806-T870 PolarHBondContact OE1-OG1 3.3Å; F809-T870 HydrophobicContact CD1-CG2 4.42Å; F809-T870 HydrophobicContact CE1-CG2 4.21Å; Q810-T870 HydrophobicContact CG-CG2 4.26Å; Q810-T870 PolarHBondContact NE2-OG1 2.6Å; Q810-T870 VanDerWaalsContact NE2-OG1 3.1Å; S868-T870 PolarHBondContact OG-N 3.39Å; T870-E872 VanDerWaalsContact C-N 3.34Å; T870-L873 PolarHBondContact O-N 3.15Å; T870-I874 HydrophobicContact CG2-CD1 4.16Å; T870-I874 WeakPolarHBondContact O-CD1 3.31Å; T870-I874 VanDerWaalsContact O-CG1 3.26Å; T870-I874 WeakPolarHBondContact O-CG1 3.48Å; T870-I874 PolarHBondContact O-N 3.26Å; T870-I874 VanDerWaalsContact O-N 3.1Å
871	H	75.6	Confident	62	Low	25 Å²	25	67.2 Å²	67.2	12%	0.116	38%	0.376	C	S	.	.	H	α-helix	trans	-63.3	-41.5	176.7	-177.5	-102.1	0	0	0	112.5	S868 W869 I874 C876 C878 F954	S868-H871 WeakPolarHBondContact O-CB 3.46Å; S868-H871 PolarHBondContact O-N 2.85Å; S868-H871 PolarHBondContact OG-N 3.36Å; W869-H871 VanDerWaalsContact C-N 3.28Å; W869-H871 PolarHBondContact O-N 3.25Å; H871-I874 PolarHBondContact O-N 2.9Å; H871-C876 WeakPolarHBondContact NE2-CB 3.38Å; H871-C878 PolarHBondContact CE1-SG 3.22Å; H871-C878 PolarHBondContact NE2-SG 3Å; H871-F954 HydrophobicContact CB-CE1 4.21Å; H871-F954 HydrophobicContact CB-CZ 3.74Å; H871-F954 AromaticContact CD2-CE1 3.2Å; H871-F954 WeakPolarHBondContact CD2-CE1 3.39Å; H871-F954 AromaticContact CD2-CZ 3.57Å; H871-F954 AromaticContact CG-CE1 3.84Å; H871-F954 AromaticContact CG-CZ 3.7Å; H871-F954 AromaticContact NE2-CE1 3.86Å
872	E	71.2	Confident	61	Low	86 Å²	86	69.5 Å²	69.5	40%	0.402	39%	0.388	S	S	.	.	H	α-helix	trans	-65.8	-40.7	176.6	-166.1	170.1	141.6	0	0	111.8	T864 T866 S868 W869 T870 I874 Q875	T864-E872 WeakPolarHBondContact CB-OE2 3.11Å; T864-E872 WeakPolarHBondContact CG2-OE2 3.3Å; T866-E872 PolarHBondContact OG1-OE2 3.42Å; S868-E872 PolarHBondContact O-N 3.02Å; W869-E872 PolarHBondContact O-N 3.03Å; T870-E872 VanDerWaalsContact C-N 3.34Å; E872-I874 VanDerWaalsContact C-N 3.27Å; E872-I874 PolarHBondContact O-N 2.99Å; E872-Q875 PolarHBondContact O-N 3.44Å
873	L	71.6	Confident	59.9	Low	50 Å²	50	76.1 Å²	76.1	26%	0.262	42%	0.417	S	S	.	.	H	α-helix	trans	-63.3	-30.5	175.2	-71.8	172	0	0	0	113.5	Q810 F836 W869 T870 Q875	Q810-L873 HydrophobicContact CG-CD1 4.42Å; Q810-L873 VanDerWaalsContact NE2-CD1 3.28Å; F836-L873 WeakPolarHBondContact CD2-O 3.39Å; W869-L873 HydrophobicContact CD2-CD1 4.32Å; W869-L873 HydrophobicContact CH2-CD1 3.75Å; W869-L873 HydrophobicContact CZ2-CD1 3.79Å; W869-L873 HydrophobicContact CZ2-CD2 4.03Å; W869-L873 HydrophobicContact CZ2-CG 4.19Å; W869-L873 HydrophobicContact CZ3-CD1 4.26Å; W869-L873 VanDerWaalsContact O-CG 3.31Å; W869-L873 WeakPolarHBondContact O-CG 3.25Å; W869-L873 PolarHBondContact O-N 2.94Å; T870-L873 PolarHBondContact O-N 3.15Å; L873-Q875 PolarHBondContact O-N 3.2Å
874	I	72.7	Confident	59	Low	71 Å²	71	74.9 Å²	74.9	36%	0.364	41%	0.41	S	S	.	.	H	α-helix	trans	-71.9	-17.3	176.1	-68.4	163.6	0	0	0	111.2	L833 T870 H871 E872 C876	L833-I874 HydrophobicContact CD1-CG1 4.09Å; L833-I874 HydrophobicContact CG-CG1 4.42Å; T870-I874 HydrophobicContact CG2-CD1 4.16Å; T870-I874 WeakPolarHBondContact O-CD1 3.31Å; T870-I874 VanDerWaalsContact O-CG1 3.26Å; T870-I874 WeakPolarHBondContact O-CG1 3.48Å; T870-I874 PolarHBondContact O-N 3.26Å; T870-I874 VanDerWaalsContact O-N 3.1Å; H871-I874 PolarHBondContact O-N 2.9Å; E872-I874 VanDerWaalsContact C-N 3.27Å; E872-I874 PolarHBondContact O-N 2.99Å; I874-C876 VanDerWaalsContact C-N 3.26Å; I874-C876 HydrophobicContact CG2-CB 4.42Å; I874-C876 PolarHBondContact O-N 3.39Å
875	Q	68	Low	57.8	Low	122 Å²	122	82.1 Å²	82.1	57%	0.57	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	46	-173	-58.4	-171.1	-37.2	0	0	111.7	F836 E872 L873 N877	F836-Q875 HydrophobicContact CE2-CG 4.06Å; F836-Q875 HydrophobicContact CZ-CG 3.92Å; F836-Q875 VanDerWaalsContact CZ-NE2 3.31Å; E872-Q875 PolarHBondContact O-N 3.44Å; L873-Q875 PolarHBondContact O-N 3.2Å; Q875-N877 PolarHBondContact O-N 3.21Å
876	C	70.9	Confident	56.7	Low	55 Å²	55	80.9 Å²	80.9	37%	0.372	43%	0.43	S	S	.	.			trans	-65.3	128.9	179.2	178.5	0	0	0	0	111.1	H871 I874 C878	H871-C876 WeakPolarHBondContact NE2-CB 3.38Å; I874-C876 VanDerWaalsContact C-N 3.26Å; I874-C876 HydrophobicContact CG2-CB 4.42Å; I874-C876 PolarHBondContact O-N 3.39Å; C876-C878 WeakPolarHBondContact CB-SG 3.33Å; C876-C878 PolarHBondContact O-N 3.02Å; C876-C878 WeakPolarHBondContact SG-CB 2.97Å; C876-C878 PolarHBondContact SG-N 2.81Å; C876-C878 VanDerWaalsContact SG-N 3.4Å; C876-C878 CovalentContact SG-SG 2.06Å; C876-C878 PolarHBondContact SG-SG 3.47Å
877	N	66.2	Low	55.4	Low	117 Å²	117	89.4 Å²	89.4	63%	0.626	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-70.9	5.4	176.2	-66.1	-2	0	0	0	113.9	Q875 N879 Q880	Q875-N877 PolarHBondContact O-N 3.21Å; N877-N879 VanDerWaalsContact C-N 3.25Å; N877-N879 PolarHBondContact O-N 3.2Å; N877-Q880 WeakPolarHBondContact O-CB 3.44Å; N877-Q880 PolarHBondContact O-N 3.25Å; N877-Q880 VanDerWaalsContact O-N 3.07Å
878	C	64.6	Low	53.7	Low	44 Å²	44	94 Å²	94	30%	0.297	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-69.3	-14.3	-172.6	38.4	0	0	0	0	114.9	H871 C876 S881	H871-C878 PolarHBondContact CE1-SG 3.22Å; H871-C878 PolarHBondContact NE2-SG 3Å; C876-C878 WeakPolarHBondContact CB-SG 3.33Å; C876-C878 PolarHBondContact O-N 3.02Å; C876-C878 WeakPolarHBondContact SG-CB 2.97Å; C876-C878 PolarHBondContact SG-N 2.81Å; C876-C878 VanDerWaalsContact SG-N 3.4Å; C876-C878 CovalentContact SG-SG 2.06Å; C876-C878 PolarHBondContact SG-SG 3.47Å; C878-S881 PolarHBondContact O-OG 3.22Å; C878-S881 VanDerWaalsContact O-OG 3.07Å
879	N	52.8	Low	51.6	Low	77 Å²	77	100.2 Å²	100.2	41%	0.412	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-80.8	-20	170.3	-81.3	-0.3	0	0	0	113.2	N877 S881 L882	N877-N879 VanDerWaalsContact C-N 3.25Å; N877-N879 PolarHBondContact O-N 3.2Å; N879-S881 PolarHBondContact O-N 3.19Å; N879-L882 PolarHBondContact O-N 3.36Å
880	Q	47.9	Very low	49.4	Very low	136 Å²	136	103.7 Å²	103.7	64%	0.636	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-15.9	179.9	-66.9	179.3	-5	0	0	113	N877	N877-Q880 WeakPolarHBondContact O-CB 3.44Å; N877-Q880 PolarHBondContact O-N 3.25Å; N877-Q880 VanDerWaalsContact O-N 3.07Å
881	S	40.6	Very low	47.1	Very low	85 Å²	85	108.2 Å²	108.2	59%	0.594	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-11.7	178.6	48.6	0	0	0	0	114.5	C878 N879	C878-S881 PolarHBondContact O-OG 3.22Å; C878-S881 VanDerWaalsContact O-OG 3.07Å; N879-S881 PolarHBondContact O-N 3.19Å
882	L	39.2	Very low	44.7	Very low	137 Å²	137	112 Å²	112	72%	0.717	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-23.3	180	-80.2	155.2	0	0	0	113.3	N879	N879-L882 PolarHBondContact O-N 3.36Å
883	E	33.5	Very low	42.6	Very low	163 Å²	163	115.5 Å²	115.5	76%	0.762	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-4.9	-177.3	-72.1	-179.8	168.3	0	0	115
884	N	29.9	Very low	40.4	Very low	143 Å²	143	117.6 Å²	117.6	77%	0.765	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	21.4	-179.8	-82	-24.9	0	0	0	115.3
885	K	27.2	Very low	38.1	Very low	183 Å²	183	119 Å²	119	80%	0.796	67%	0.673	S	S	*	*			trans	-119.2	62.2	171.8	-77.7	-176.5	178.1	175.6	0	111.8	F887	K885-F887 PolarHBondContact O-N 2.98Å
886	S	27.4	Very low	36.3	Very low	104 Å²	104	121.2 Å²	121.2	73%	0.727	69%	0.687	S	S	*	*			trans	-69.9	119.7	158	54.4	0	0	0	0	109.1	T888	S886-T888 PolarHBondContact O-N 2.86Å
887	F	25	Very low	34.1	Very low	209 Å²	209	122.9 Å²	122.9	92%	0.917	70%	0.7	S	S	*	*			trans	-50	115.6	173.6	-89.3	-106.8	0	0	0	111.8	K885	K885-F887 PolarHBondContact O-N 2.98Å
888	T	26.4	Very low	32.2	Very low	116 Å²	116	123.7 Å²	123.7	71%	0.712	70%	0.704	S	S	*	*			trans	-130.1	121.8	152.7	54.3	0	0	0	0	107.9	S886	S886-T888 PolarHBondContact O-N 2.86Å
889	P	25.3	Very low	30.4	Very low	131 Å²	131	128.4 Å²	128.4	85%	0.851	73%	0.725	S	S	*	*			trans	-83.4	120.4	179.6	32.3	-28.2	0	0	0	108.8
890	S	25.3	Very low	29.1	Very low	106 Å²	106	132.7 Å²	132.7	74%	0.741	74%	0.742	S	S	*	*			trans	-149.2	144.3	160.7	47	0	0	0	0	111.6
891	P	27	Very low	28	Very low	113 Å²	113	132.7 Å²	132.7	73%	0.734	75%	0.752	S	S	*	*			trans	-98.6	158.3	-153.7	35.6	-27.2	0	0	0	113
892	S	25.2	Very low	27.4	Very low	103 Å²	103	139.3 Å²	139.3	72%	0.72	77%	0.766	S	S	*	*			trans	61.5	119.3	157	62.1	0	0	0	0	117.9
893	I	28.3	Very low	27	Very low	161 Å²	161	140.3 Å²	140.3	83%	0.826	77%	0.772	S	S	*	*				-173.8	142.6	102.8	-87.4	153.6	0	0	0	108.9
894	S	24.5	Very low	26.8	Very low	94 Å²	94	136.2 Å²	136.2	66%	0.657	76%	0.761	S	S	*	*			trans	-60.5	167.9	-172.5	47.1	0	0	0	0	117.2
895	S	25.7	Very low	27	Very low	99 Å²	99	132 Å²	132	69%	0.692	75%	0.746	S	S	*	*			trans	75.1	103.2	150.4	61.9	0	0	0	0	117.8
896	L	29.7	Very low	27.5	Very low	169 Å²	169	129.6 Å²	129.6	89%	0.885	74%	0.742	S	S	*	*				-168.4	113.3	104.8	-99.8	140.6	0	0	0	109.5
897	S	23.9	Very low	27.8	Very low	91 Å²	91	131.9 Å²	131.9	64%	0.636	74%	0.741	S	S	*	*			trans	-65.5	141.1	159.6	50.5	0	0	0	0	108.8
898	D	26.1	Very low	28	Very low	134 Å²	134	125.5 Å²	125.5	72%	0.717	72%	0.717	S	S	*	*				167.7	140.6	121.3	-79.2	-13.1	0	0	0	110.3
899	I	27.9	Very low	28.5	Very low	142 Å²	142	123 Å²	123	73%	0.728	70%	0.701	S	S	*	*			trans	101.9	93.3	151.2	-61.6	142.9	0	0	0	118.4
900	E	26.2	Very low	29	Very low	167 Å²	167	120 Å²	120	78%	0.78	68%	0.68	S	S	*	*				93.4	92.7	127.8	-68.3	175.5	-159.9	0	0	120.8
901	T	24.4	Very low	29.3	Very low	137 Å²	137	121.2 Å²	121.2	84%	0.84	67%	0.672	S	S	*	*			trans	-34.6	121.4	153.9	27.7	0	0	0	0	116.1
902	Y	28.4	Very low	29.5	Very low	224 Å²	224	118.6 Å²	118.6	88%	0.878	65%	0.654	S	S	*	*			trans	-136.2	144.4	151.8	-100.7	-89.9	0	0	0	109.8
903	D	29.3	Very low	29.8	Very low	157 Å²	157	117.4 Å²	117.4	84%	0.84	64%	0.636	S	S	*	*			trans	-43.9	125.8	-156.1	-87.7	-46.2	0	0	0	118.6
904	S	30.9	Very low	30.1	Very low	78 Å²	78	114.2 Å²	114.2	55%	0.545	62%	0.619	S	S	.	*			trans	-103.5	21.8	-176.3	57.9	0	0	0	0	114.6	N908	S904-N908 PolarHBondContact O-ND2 3.4Å; S904-N908 VanDerWaalsContact O-ND2 3.1Å
905	A	32.1	Very low	30.4	Very low	53 Å²	53	114 Å²	114	44%	0.438	61%	0.611	S	S	.	*	H	α-helix	trans	-79.7	-38.1	-177.7	0	0	0	0	0	113.8	N908	A905-N908 PolarHBondContact O-N 3.01Å
906	D	37.8	Very low	30.8	Very low	134 Å²	134	115.5 Å²	115.5	72%	0.717	60%	0.603	S	S	*	*	H	α-helix	trans	-82.4	-29.4	-174	-73.2	-25.9	0	0	0	113.7	N908 V909	D906-N908 VanDerWaalsContact C-N 3.26Å; D906-N908 PolarHBondContact O-N 3.27Å; D906-V909 PolarHBondContact O-N 2.91Å
907	Q	34.9	Very low	31.1	Very low	152 Å²	152	108.4 Å²	108.4	71%	0.71	57%	0.567	S	S	*	*	H	α-helix	trans	-69.5	-26.8	172.5	-73.1	-173.5	-2.2	0	0	112.2	V910 K911	Q907-V910 PolarHBondContact O-N 3.16Å; Q907-K911 WeakPolarHBondContact O-CB 3.47Å; Q907-K911 PolarHBondContact O-N 3.39Å
908	N	28.8	Very low	31.5	Very low	75 Å²	75	112.4 Å²	112.4	40%	0.401	57%	0.569	S	S	.	*	H	α-helix	trans	-70.2	-34.5	177.3	-80.6	-22	0	0	0	111.5	S904 A905 D906 V910 K911 T912	S904-N908 PolarHBondContact O-ND2 3.4Å; S904-N908 VanDerWaalsContact O-ND2 3.1Å; A905-N908 PolarHBondContact O-N 3.01Å; D906-N908 VanDerWaalsContact C-N 3.26Å; D906-N908 PolarHBondContact O-N 3.27Å; N908-V910 VanDerWaalsContact C-N 3.35Å; N908-V910 PolarHBondContact O-N 3.05Å; N908-K911 PolarHBondContact O-N 2.74Å; N908-T912 VanDerWaalsContact O-CB 3.22Å; N908-T912 WeakPolarHBondContact O-CB 3.19Å; N908-T912 PolarHBondContact O-N 3.28Å; N908-T912 PolarHBondContact O-OG1 3.14Å
909	V	35.9	Very low	31.9	Very low	62 Å²	62	111.1 Å²	111.1	38%	0.376	56%	0.559	S	S	.	*	H	α-helix	trans	-65.1	-41.7	174.9	-178.3	0	0	0	0	110.4	D906 T912 F913	D906-V909 PolarHBondContact O-N 2.91Å; V909-T912 PolarHBondContact O-N 3.28Å; V909-F913 HydrophobicContact CG1-CD2 3.82Å; V909-F913 HydrophobicContact CG1-CE2 3.84Å; V909-F913 WeakPolarHBondContact O-CB 3.3Å; V909-F913 WeakPolarHBondContact O-CD2 3.38Å; V909-F913 PolarHBondContact O-N 2.75Å
910	V	37.3	Very low	32.1	Very low	68 Å²	68	109.1 Å²	109.1	41%	0.412	55%	0.549	S	S	.	.	H	α-helix	trans	-70.3	-38.8	178.9	-176.8	0	0	0	0	112.5	Q907 N908 F913 I914	Q907-V910 PolarHBondContact O-N 3.16Å; N908-V910 VanDerWaalsContact C-N 3.35Å; N908-V910 PolarHBondContact O-N 3.05Å; V910-F913 VanDerWaalsContact O-CB 3.31Å; V910-F913 WeakPolarHBondContact O-CB 3.39Å; V910-F913 PolarHBondContact O-N 3.45Å; V910-I914 WeakPolarHBondContact O-CG1 3.31Å; V910-I914 PolarHBondContact O-N 2.89Å
911	K	30.6	Very low	32.3	Very low	133 Å²	133	102.8 Å²	102.8	58%	0.578	53%	0.529	S	S	*	.	H	α-helix	trans	-66.9	-42.2	171.1	-104.7	-179.5	173.5	178.2	0	112.1	Q907 N908 F913 I914 D915	Q907-K911 WeakPolarHBondContact O-CB 3.47Å; Q907-K911 PolarHBondContact O-N 3.39Å; N908-K911 PolarHBondContact O-N 2.74Å; K911-F913 PolarHBondContact O-N 3.43Å; K911-I914 CarbonylContact O-C 3.56Å; K911-I914 PolarHBondContact O-N 3.44Å; K911-D915 WeakPolarHBondContact O-CB 3.49Å; K911-D915 VanDerWaalsContact O-CG 3.22Å; K911-D915 PolarHBondContact O-N 3.31Å
912	T	31	Very low	32.8	Very low	58 Å²	58	103.1 Å²	103.1	36%	0.356	53%	0.526	S	S	.	.	H	α-helix	trans	-64.1	-33.3	173.7	-41.1	0	0	0	0	110.3	N908 V909 I914 Y916	N908-T912 VanDerWaalsContact O-CB 3.22Å; N908-T912 WeakPolarHBondContact O-CB 3.19Å; N908-T912 PolarHBondContact O-N 3.28Å; N908-T912 PolarHBondContact O-OG1 3.14Å; V909-T912 PolarHBondContact O-N 3.28Å; T912-I914 PolarHBondContact O-N 3.29Å; T912-Y916 HydrophobicContact CG2-CD2 3.73Å; T912-Y916 HydrophobicContact CG2-CE2 4.42Å; T912-Y916 VanDerWaalsContact O-CB 3.26Å; T912-Y916 WeakPolarHBondContact O-CB 3.33Å; T912-Y916 PolarHBondContact O-N 2.91Å
913	F	32.6	Very low	33.2	Very low	78 Å²	78	100.5 Å²	100.5	34%	0.342	52%	0.519	S	S	.	.	H	α-helix	trans	-62.4	-25.7	173.2	-103.8	-111.1	0	0	0	113.1	R652 V909 V910 K911 S917	R652-F913 HydrophobicContact CB-CZ 4.41Å; R652-F913 VanDerWaalsContact NH1-CE1 3.3Å; R652-F913 PolarHBondContact NH1-O 3.2Å; R652-F913 VanDerWaalsContact NH1-O 3.13Å; R652-F913 PolarHBondContact NH2-O 3.44Å; V909-F913 HydrophobicContact CG1-CD2 3.82Å; V909-F913 HydrophobicContact CG1-CE2 3.84Å; V909-F913 WeakPolarHBondContact O-CB 3.3Å; V909-F913 WeakPolarHBondContact O-CD2 3.38Å; V909-F913 PolarHBondContact O-N 2.75Å; V910-F913 VanDerWaalsContact O-CB 3.31Å; V910-F913 WeakPolarHBondContact O-CB 3.39Å; V910-F913 PolarHBondContact O-N 3.45Å; K911-F913 PolarHBondContact O-N 3.43Å; F913-S917 PolarHBondContact O-OG 3.25Å
914	I	35.2	Very low	33.3	Very low	93 Å²	93	101 Å²	101	48%	0.477	52%	0.516	S	S	.	.	H	α-helix	trans	-93.9	-45.3	177.7	-65	167.7	0	0	0	110.1	V910 K911 T912 S917 Y918	V910-I914 WeakPolarHBondContact O-CG1 3.31Å; V910-I914 PolarHBondContact O-N 2.89Å; K911-I914 CarbonylContact O-C 3.56Å; K911-I914 PolarHBondContact O-N 3.44Å; T912-I914 PolarHBondContact O-N 3.29Å; I914-S917 WeakPolarHBondContact O-CB 3.34Å; I914-S917 PolarHBondContact O-N 3.19Å; I914-Y918 HydrophobicContact CG2-CE2 4.11Å; I914-Y918 WeakPolarHBondContact O-CD2 3.2Å
915	D	30.3	Very low	33.3	Very low	91 Å²	91	104.5 Å²	104.5	49%	0.487	53%	0.529	S	S	.	.	H	α-helix	trans	-73.1	-35.9	-174.9	-64.5	-23.9	0	0	0	113.1	K911 S917 Y918	K911-D915 WeakPolarHBondContact O-CB 3.49Å; K911-D915 VanDerWaalsContact O-CG 3.22Å; K911-D915 PolarHBondContact O-N 3.31Å; D915-S917 PolarHBondContact O-N 3.46Å; D915-Y918 PolarHBondContact O-N 3.2Å
916	Y	33.4	Very low	33.1	Very low	130 Å²	130	110.6 Å²	110.6	51%	0.51	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.3	-12.6	174.7	-118.4	-96.8	0	0	0	113.3	T912 Y918	T912-Y916 HydrophobicContact CG2-CD2 3.73Å; T912-Y916 HydrophobicContact CG2-CE2 4.42Å; T912-Y916 VanDerWaalsContact O-CB 3.26Å; T912-Y916 WeakPolarHBondContact O-CB 3.33Å; T912-Y916 PolarHBondContact O-N 2.91Å; Y916-Y918 VanDerWaalsContact C-N 3.29Å
917	S	35.6	Very low	32.6	Very low	20 Å²	20	113.5 Å²	113.5	14%	0.14	56%	0.557	C	S	.	*	T	Hydrogen-bonded Turn	trans	-78.2	-19.1	176.5	-49.7	0	0	0	0	111.6	R652 F913 I914 D915	R652-S917 PolarHBondContact NH2-OG 3.1Å; R652-S917 VanDerWaalsContact NH2-OG 3.07Å; F913-S917 PolarHBondContact O-OG 3.25Å; I914-S917 WeakPolarHBondContact O-CB 3.34Å; I914-S917 PolarHBondContact O-N 3.19Å; D915-S917 PolarHBondContact O-N 3.46Å
918	Y	33.4	Very low	32.3	Very low	175 Å²	175	115.2 Å²	115.2	69%	0.686	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-27.4	172.1	-69.3	-81	0	0	0	112.8	I914 D915 Y916	I914-Y918 HydrophobicContact CG2-CE2 4.11Å; I914-Y918 WeakPolarHBondContact O-CD2 3.2Å; D915-Y918 PolarHBondContact O-N 3.2Å; Y916-Y918 VanDerWaalsContact C-N 3.29Å
919	E	34.1	Very low	32.4	Very low	107 Å²	107	119.2 Å²	119.2	50%	0.5	58%	0.584	S	S	.	*	S	Bend	trans	-86.3	-9.5	-174.6	-71.2	-169.8	162.8	0	0	115.3
920	L	32.7	Very low	31.8	Very low	99 Å²	99	125.3 Å²	125.3	52%	0.518	61%	0.609	S	S	.	*	S	Bend	trans	-95	-14.4	-179.3	-82.4	159.3	0	0	0	113.9
921	G	30.5	Very low	31.4	Very low	35 Å²	35	127 Å²	127	36%	0.361	62%	0.624	S	S	.	*	S	Bend	trans	-80.7	-24.4	174.2	0	0	0	0	0	114.6	K923	G921-K923 PolarHBondContact O-N 3.1Å
922	D	34.8	Very low	31.3	Very low	143 Å²	143	126.6 Å²	126.6	77%	0.765	64%	0.637	S	S	*	*	S	Bend	trans	-86.8	-2.6	-172.5	-79.3	-21.8	0	0	0	114.9
923	K	35.2	Very low	31	Very low	170 Å²	170	131.8 Å²	131.8	74%	0.739	66%	0.658	S	S	*	*	S	Bend	trans	-115.1	-3.8	-170.5	-72.6	-179.9	-178.1	160.4	0	115.7	G921	G921-K923 PolarHBondContact O-N 3.1Å
924	E	33.1	Very low	30.8	Very low	167 Å²	167	135.7 Å²	135.7	78%	0.78	68%	0.677	S	S	*	*	S	Bend	trans	-110.1	-3.3	-176.9	-65.6	-168.9	162	0	0	114.9
925	N	30.7	Very low	30.4	Very low	151 Å²	151	136.9 Å²	136.9	81%	0.807	69%	0.688	S	S	*	*	S	Bend	trans	-110.7	30.5	-175.8	-82.4	-15.5	0	0	0	116.4
926	M	27.9	Very low	30.2	Very low	181 Å²	181	139.1 Å²	139.1	89%	0.892	71%	0.705	S	S	*	*	S	Bend	trans	-121.9	26.6	-174.3	-107.6	-120.7	168.4	0	0	116.4
927	K	27.5	Very low	29.8	Very low	196 Å²	196	136.5 Å²	136.5	85%	0.852	72%	0.718	S	S	*	*	S	Bend	trans	-148.1	125.1	167.4	-67.8	-175.1	-178.5	170.7	0	109.9
928	E	26.9	Very low	29.2	Very low	188 Å²	188	143.3 Å²	143.3	88%	0.879	75%	0.752	S	S	*	*			trans	118.8	130.8	167.1	-64.5	179.1	176.7	0	0	113.9
929	I	30.8	Very low	29	Very low	159 Å²	159	140.8 Å²	140.8	82%	0.815	75%	0.754	S	S	*	*			trans	92	69.1	163.2	-37.6	179.7	0	0	0	117.1
930	E	25.3	Very low	28.5	Very low	189 Å²	189	142.9 Å²	142.9	88%	0.883	77%	0.769	S	S	*	*			trans	-81.4	120	139.1	-79.3	-179.7	161.8	0	0	108.2
931	S	27.1	Very low	28.2	Very low	105 Å²	105	145.2 Å²	145.2	73%	0.734	78%	0.782	S	S	*	*			trans	145.6	136.6	142.8	59.2	0	0	0	0	113.9
932	S	30.1	Very low	28.1	Very low	123 Å²	123	152.1 Å²	152.1	86%	0.86	81%	0.805	S	S	*	*			trans	95	93.4	168.3	71.5	0	0	0	0	118.2
933	E	24.8	Very low	27.8	Very low	167 Å²	167	152 Å²	152	78%	0.78	80%	0.804	S	S	*	*			trans	-64.5	139.1	159.2	-57.8	170.3	143.1	0	0	110.9
934	H	27	Very low	27.5	Very low	161 Å²	161	153.3 Å²	153.3	75%	0.745	81%	0.813	S	S	*	*				170	135.5	111.1	-93	-56.6	0	0	0	114.1
935	T	28.1	Very low	27.4	Very low	117 Å²	117	153.1 Å²	153.1	72%	0.718	82%	0.817	S	S	*	*			trans	81.3	87.9	145.1	44.6	0	0	0	0	121.5
936	T	24.5	Very low	27.8	Very low	138 Å²	138	151.4 Å²	151.4	85%	0.847	81%	0.808	S	S	*	*				53.2	109.4	120.6	59.1	0	0	0	0	120.5
937	G	25.5	Very low	28.3	Very low	76 Å²	76	149.4 Å²	149.4	78%	0.784	80%	0.797	S	S	*	*			trans	-163.7	107.2	154.2	0	0	0	0	0	109.5	T939	G937-T939 PolarHBondContact O-N 2.99Å
938	I	24.1	Very low	28.6	Very low	163 Å²	163	146.7 Å²	146.7	84%	0.836	78%	0.782	S	S	*	*			trans	-76.7	113.2	-176.1	-64.9	164.3	0	0	0	109.5
939	T	27.4	Very low	28.9	Very low	121 Å²	121	140.4 Å²	140.4	74%	0.742	76%	0.759	S	S	*	*			trans	-148.1	124.5	150.5	46.6	0	0	0	0	108.6	G937 D941	G937-T939 PolarHBondContact O-N 2.99Å; T939-D941 PolarHBondContact O-N 3.46Å
940	N	23.9	Very low	29.3	Very low	152 Å²	152	135.6 Å²	135.6	81%	0.813	74%	0.735	S	S	*	*			trans	-67.4	111.6	179.5	-60.1	-27.9	0	0	0	110
941	D	27.9	Very low	30.1	Very low	148 Å²	148	130 Å²	130	79%	0.791	71%	0.71	S	S	*	*			trans	-120.2	92.1	162.1	-89.3	-34	0	0	0	107.7	T939	T939-D941 PolarHBondContact O-N 3.46Å
942	E	27.8	Very low	30.7	Very low	179 Å²	179	130 Å²	130	84%	0.836	69%	0.694	S	S	*	*			trans	-80.8	101.5	160.4	-66	177.5	166.3	0	0	106.3
943	N	28.6	Very low	31.1	Very low	141 Å²	141	127.9 Å²	127.9	75%	0.754	67%	0.672	S	S	*	*			trans	-175.7	80.5	162.5	-82.9	-39.1	0	0	0	111.1
944	E	28.9	Very low	31.7	Very low	197 Å²	197	122.7 Å²	122.7	92%	0.921	65%	0.648	S	S	*	*			trans	-125.5	10.2	168.6	-76.3	-167.4	160.1	0	0	114.6
945	D	30.7	Very low	32	Very low	163 Å²	163	121 Å²	121	87%	0.872	64%	0.64	S	S	*	*			trans	-103.7	13	-171.2	-68	-33.4	0	0	0	116.5
946	D	38.2	Very low	32.4	Very low	115 Å²	115	119.5 Å²	119.5	62%	0.615	63%	0.627	S	S	*	*			trans	-97.5	5.2	-163.4	-97.4	-24	0	0	0	117.8	Y948 S949	D946-Y948 VanDerWaalsContact C-N 3.26Å; D946-Y948 PolarHBondContact O-N 3.44Å; D946-Y948 VanDerWaalsContact O-N 3.11Å; D946-S949 PolarHBondContact O-OG 3.46Å
947	E	38.2	Very low	32.6	Very low	139 Å²	139	115.6 Å²	115.6	65%	0.65	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-17.8	-170.5	-91.7	-166.8	147.7	0	0	115.7	N950	E947-N950 PolarHBondContact O-ND2 2.96Å
948	Y	34.2	Very low	32.7	Very low	140 Å²	140	116.4 Å²	116.4	55%	0.549	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.8	3.2	-170.8	-63.5	-80.3	0	0	0	115.4	D946 N950	D946-Y948 VanDerWaalsContact C-N 3.26Å; D946-Y948 PolarHBondContact O-N 3.44Å; D946-Y948 VanDerWaalsContact O-N 3.11Å; Y948-N950 PolarHBondContact O-N 3.12Å
949	S	33.9	Very low	33	Very low	55 Å²	55	112.7 Å²	112.7	39%	0.385	60%	0.599	S	S	.	*			trans	-75.8	-4.6	-178.5	68.1	0	0	0	0	113.9	R512 D946 I951	R512-S949 PolarHBondContact NH1-O 3.46Å; R512-S949 PolarHBondContact NH1-OG 2.94Å; R512-S949 PolarHBondContact NH2-O 3.41Å; D946-S949 PolarHBondContact O-OG 3.46Å; S949-I951 PolarHBondContact O-N 3.29Å
950	N	39.3	Very low	33	Very low	58 Å²	58	112.5 Å²	112.5	31%	0.31	59%	0.594	S	S	.	*			trans	-80.8	2.6	-157.7	-70.2	-38.6	0	0	0	118.3	R512 E947 Y948	R512-N950 PolarHBondContact NH1-OD1 3.17Å; E947-N950 PolarHBondContact O-ND2 2.96Å; Y948-N950 PolarHBondContact O-N 3.12Å
951	I	41.1	Very low	33.1	Very low	73 Å²	73	109.9 Å²	109.9	37%	0.374	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.7	113.4	-177.3	-54.9	177.1	0	0	0	110.1	V645 S949 L953	V645-I951 HydrophobicContact CG2-CD1 4.41Å; V645-I951 HydrophobicContact CG2-CG1 4.21Å; S949-I951 PolarHBondContact O-N 3.29Å; I951-L953 HydrophobicContact CG2-CD1 4.14Å; I951-L953 HydrophobicContact CG2-CG 4.27Å
952	R	40.9	Very low	32.9	Very low	104 Å²	104	107.7 Å²	107.7	39%	0.392	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.7	115.7	164.2	-72.5	-170.6	179.5	-175.3	0.6	109.2	F954	R952-F954 HydrophobicContact CB-CE2 4.32Å
953	L	37.1	Very low	32.8	Very low	78 Å²	78	106.4 Å²	106.4	41%	0.408	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90	121.5	175.5	-84.7	135.3	0	0	0	109.4	L509 I951	L509-L953 HydrophobicContact CD2-CD2 3.2Å; L509-L953 HydrophobicContact CD2-CG 3.7Å; I951-L953 HydrophobicContact CG2-CD1 4.14Å; I951-L953 HydrophobicContact CG2-CG 4.27Å
954	F	38.6	Very low	32.5	Very low	59 Å²	59	105.5 Å²	105.5	26%	0.259	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.2	113.6	162.2	-66.9	-84.9	0	0	0	108.5	V508 F510 H871 R952	V508-F954 PolarHBondContact N-O 3.1Å; V508-F954 PolarHBondContact O-N 3.23Å; F510-F954 AromaticContact CD2-CD2 3.42Å; F510-F954 HydrophobicContact CD2-CD2 3.42Å; F510-F954 VanDerWaalsContact CD2-CD2 3.42Å; F510-F954 AromaticContact CD2-CE2 3.74Å; F510-F954 HydrophobicContact CD2-CE2 3.74Å; F510-F954 AromaticContact CE2-CD2 3.46Å; F510-F954 HydrophobicContact CE2-CD2 3.46Å; F510-F954 VanDerWaalsContact CE2-CD2 3.46Å; F510-F954 AromaticContact CE2-CE2 3.93Å; F510-F954 HydrophobicContact CE2-CE2 3.93Å; F510-F954 HydrophobicContact CE2-CG 4.28Å; H871-F954 HydrophobicContact CB-CE1 4.21Å; H871-F954 HydrophobicContact CB-CZ 3.74Å; H871-F954 AromaticContact CD2-CE1 3.2Å; H871-F954 WeakPolarHBondContact CD2-CE1 3.39Å; H871-F954 AromaticContact CD2-CZ 3.57Å; H871-F954 AromaticContact CG-CE1 3.84Å; H871-F954 AromaticContact CG-CZ 3.7Å; H871-F954 AromaticContact NE2-CE1 3.86Å; R952-F954 HydrophobicContact CB-CE2 4.32Å
955	Q	33.2	Very low	32.4	Very low	125 Å²	125	102.9 Å²	102.9	58%	0.584	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-82.1	115.7	167.9	-174.3	171.3	-2.3	0	0	107.5	G957	Q955-G957 PolarHBondContact O-N 2.92Å
956	L	37.3	Very low	32.1	Very low	86 Å²	86	99.9 Å²	99.9	45%	0.45	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.9	115.6	163.6	-68	169.4	0	0	0	105.3	E506 V508	E506-L956 PolarHBondContact O-N 3.39Å; V508-L956 HydrophobicContact CG2-CD1 3.73Å; V508-L956 HydrophobicContact CG2-CG 4.36Å
957	G	27.9	Very low	31.6	Very low	55 Å²	55	101.1 Å²	101.1	57%	0.567	57%	0.567	S	S	*	*			trans	-53.1	154.1	178	0	0	0	0	0	110.9	Q955 A959	Q955-G957 PolarHBondContact O-N 2.92Å; G957-A959 PolarHBondContact O-N 2.83Å
958	P	27.6	Very low	31	Very low	94 Å²	94	103.5 Å²	103.5	61%	0.61	58%	0.575	S	S	*	*			trans	-53.1	144.7	172.2	24.7	-32.7	0	0	0	108.8	N960	P958-N960 PolarHBondContact O-N 3.34Å
959	A	30.8	Very low	30.5	Very low	85 Å²	85	102 Å²	102	70%	0.702	59%	0.585	S	S	*	*	S	Bend	trans	-68.2	32.7	178.2	0	0	0	0	0	113.7	G957	G957-A959 PolarHBondContact O-N 2.83Å
960	N	27.8	Very low	30.3	Very low	116 Å²	116	105.1 Å²	105.1	62%	0.62	60%	0.604	S	S	*	*			trans	-114.7	110	173.8	-74.7	-19.7	0	0	0	108.5	P958 C962	P958-N960 PolarHBondContact O-N 3.34Å; N960-C962 VanDerWaalsContact C-N 3.26Å; N960-C962 PolarHBondContact O-N 3.33Å
961	P	25.3	Very low	29.5	Very low	97 Å²	97	111.5 Å²	111.5	63%	0.63	63%	0.629	S	S	*	*			trans	-68	98.3	154.3	28.9	-25.3	0	0	0	105.7	I963	P961-I963 VanDerWaalsContact C-N 3.3Å; P961-I963 PolarHBondContact O-N 2.9Å
962	C	23.8	Very low	28.8	Very low	103 Å²	103	113 Å²	113	70%	0.696	65%	0.646	S	S	*	*			trans	-60.2	103.5	160.1	-76.4	0	0	0	0	106.2	N960 T964	N960-C962 VanDerWaalsContact C-N 3.26Å; N960-C962 PolarHBondContact O-N 3.33Å; C962-T964 HydrophobicContact CB-CG2 4.41Å; C962-T964 PolarHBondContact O-N 3.1Å
963	I	25.7	Very low	28.1	Very low	152 Å²	152	116.5 Å²	116.5	78%	0.779	67%	0.667	S	S	*	*			trans	-63.8	87.8	162.4	-60.6	170.2	0	0	0	105.3	P961 D965	P961-I963 VanDerWaalsContact C-N 3.3Å; P961-I963 PolarHBondContact O-N 2.9Å; I963-D965 VanDerWaalsContact C-N 3.3Å; I963-D965 PolarHBondContact O-N 3.41Å
964	T	22.4	Very low	27.5	Very low	122 Å²	122	122.1 Å²	122.1	75%	0.748	69%	0.688	S	S	*	*			trans	-90	79.5	159.3	54.4	0	0	0	0	106.3	C962	C962-T964 HydrophobicContact CB-CG2 4.41Å; C962-T964 PolarHBondContact O-N 3.1Å
965	D	27.1	Very low	26.8	Very low	142 Å²	142	125 Å²	125	76%	0.759	71%	0.711	S	S	*	*			trans	-126	121.3	154	-92.8	-34.5	0	0	0	108.3	I963	I963-D965 VanDerWaalsContact C-N 3.3Å; I963-D965 PolarHBondContact O-N 3.41Å
966	S	24.7	Very low	26.4	Very low	99 Å²	99	128.7 Å²	128.7	69%	0.692	72%	0.721	S	S	*	*			trans	-48.7	148.7	177.8	51.4	0	0	0	0	113.9
967	L	26.5	Very low	25.8	Very low	142 Å²	142	130.7 Å²	130.7	74%	0.743	73%	0.732	S	S	*	*			trans	109.7	96.6	161.7	-64.2	144.3	0	0	0	116.6
968	K	26.5	Very low	25.6	Very low	188 Å²	188	134.5 Å²	134.5	82%	0.817	73%	0.732	S	S	*	*			trans	75.3	115.2	142.6	-61.2	177.6	179.6	176.9	0	118
969	S	23.2	Very low	25.4	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	74%	0.738	S	S	*	*			trans	-29.8	159.2	160.5	63.2	0	0	0	0	115.9
970	P	29.8	Very low	25.2	Very low	121 Å²	121	141.1 Å²	141.1	79%	0.786	74%	0.741	S	S	*	*			cis	-154.3	176.2	40.2	39	-15.4	0	0	0	119.2
971	K	23.1	Very low	25	Very low	192 Å²	192	140.5 Å²	140.5	84%	0.835	75%	0.745	S	S	*	*			trans	-58.6	147.7	160.7	-67.4	172	176.6	173.8	0	111.3
972	S	25.2	Very low	25	Very low	105 Å²	105	141.2 Å²	141.2	73%	0.734	75%	0.753	S	S	*	*			trans	60.6	118.8	163.6	65.3	0	0	0	0	117.5
973	Q	26	Very low	25.2	Very low	178 Å²	178	141.5 Å²	141.5	83%	0.832	76%	0.756	S	S	*	*			trans	178.7	89.8	133.1	-97.1	163.3	22.3	0	0	110.6
974	F	24.8	Very low	25.3	Very low	195 Å²	195	141.8 Å²	141.8	86%	0.855	76%	0.757	S	S	*	*	S	Bend	trans	-71.2	134.7	136.9	-108.9	-99	0	0	0	106.6
975	T	24.8	Very low	25.5	Very low	119 Å²	119	140.9 Å²	140.9	73%	0.73	76%	0.756	S	S	*	*			trans	63.3	103.9	168.2	38.2	0	0	0	0	119.2
976	Y	23.7	Very low	25.4	Very low	203 Å²	203	139.7 Å²	139.7	80%	0.796	75%	0.754	S	S	*	*				-171.4	130.5	128.7	-124.8	-124.9	0	0	0	114
977	L	24.4	Very low	25.7	Very low	129 Å²	129	142.9 Å²	142.9	68%	0.675	76%	0.762	S	S	*	*			trans	68.8	110.2	148.4	-69	173.1	0	0	0	124.4
978	K	23.8	Very low	25.6	Very low	134 Å²	134	141.6 Å²	141.6	58%	0.583	76%	0.76	S	S	*	*				-47.5	128.7	122.9	-99.1	170	152	168	0	111.9	D1026	K978-D1026 WeakPolarHBondContact CD-OD2 3.4Å; K978-D1026 WeakPolarHBondContact CE-OD1 3.25Å; K978-D1026 WeakPolarHBondContact CE-OD2 2.73Å; K978-D1026 IonicContact NZ-OD1 2.58Å; K978-D1026 PolarHBondContact NZ-OD1 3.49Å; K978-D1026 IonicContact NZ-OD2 2.77Å; K978-D1026 PolarHBondContact NZ-OD2 3.29Å
979	Q	25	Very low	25.7	Very low	156 Å²	156	137.6 Å²	137.6	73%	0.729	76%	0.755	S	S	*	*			trans	169.5	130.5	130.2	-96.5	171.8	-7.2	0	0	111.7
980	Q	25.2	Very low	26.1	Very low	163 Å²	163	142.1 Å²	142.1	76%	0.762	76%	0.761	S	S	*	*			trans	61.4	101.1	142	-66.4	178.5	0.3	0	0	118.4
981	S	23.7	Very low	26	Very low	102 Å²	102	144.2 Å²	144.2	71%	0.713	77%	0.765	S	S	*	*				78.7	125.5	87.3	68.3	0	0	0	0	116.5
982	S	25.1	Very low	26.4	Very low	112 Å²	112	140.5 Å²	140.5	78%	0.783	76%	0.761	S	S	*	*			trans	99.7	141.1	150.4	78	0	0	0	0	120.7
983	S	28.8	Very low	26.9	Very low	109 Å²	109	140.5 Å²	140.5	76%	0.762	76%	0.761	S	S	*	*			trans	78.2	96.2	173	60.3	0	0	0	0	117.7
984	I	27.3	Very low	27	Very low	158 Å²	158	137.1 Å²	137.1	81%	0.81	76%	0.757	S	S	*	*				65.3	105.6	68.5	-59.7	175.4	0	0	0	114.4
985	S	27.5	Very low	27.3	Very low	104 Å²	104	135.9 Å²	135.9	73%	0.727	76%	0.759	S	S	*	*				162.5	108	116.4	46	0	0	0	0	109.7
986	T	25	Very low	27.6	Very low	116 Å²	116	135.5 Å²	135.5	71%	0.712	76%	0.761	S	S	*	*				66.5	109.2	94	-40.6	0	0	0	0	113.4
987	I	30.8	Very low	28	Very low	167 Å²	167	132.9 Å²	132.9	86%	0.856	76%	0.76	S	S	*	*				-168	122.5	119.4	-86.9	148.4	0	0	0	109
988	T	25.1	Very low	28.4	Very low	115 Å²	115	129.9 Å²	129.9	71%	0.706	76%	0.76	S	S	*	*			trans	-73.5	150.2	179.2	47.1	0	0	0	0	113
989	S	28.3	Very low	28.9	Very low	103 Å²	103	132.7 Å²	132.7	72%	0.72	77%	0.773	S	S	*	*				164.5	143.9	103.8	58.8	0	0	0	0	114.9
990	K	30.2	Very low	29.4	Very low	203 Å²	203	132.1 Å²	132.1	88%	0.883	77%	0.774	S	S	*	*			trans	92.7	89.2	158.3	-60.3	-174.2	-179.7	-179.7	0	119.5
991	L	28.1	Very low	29.8	Very low	165 Å²	165	131.1 Å²	131.1	86%	0.864	77%	0.773	S	S	*	*			trans	-95.5	162.3	137.9	-101.8	99.8	0	0	0	109.4
992	P	31.7	Very low	30.3	Very low	114 Å²	114	132.7 Å²	132.7	74%	0.74	77%	0.773	S	S	*	*				-141.8	165.1	120.8	33.2	-16.2	0	0	0	116.7
993	S	35.5	Very low	30.8	Very low	105 Å²	105	138 Å²	138	73%	0.734	78%	0.776	S	S	*	*			trans	68.4	104.7	167	59.7	0	0	0	0	118.2
994	S	28.7	Very low	31	Very low	107 Å²	107	141.9 Å²	141.9	75%	0.748	78%	0.78	S	S	*	*			cis	83.3	81.8	39.8	84.4	0	0	0	0	114.9
995	D	30.4	Very low	31.5	Very low	170 Å²	170	142.5 Å²	142.5	91%	0.909	78%	0.779	S	S	*	*			trans	-160.9	28.7	161.5	-99.8	-16.6	0	0	0	115.8
996	S	32.3	Very low	32.1	Very low	110 Å²	110	142.2 Å²	142.2	77%	0.769	78%	0.776	S	S	*	*	S	Bend	trans	-148.4	17.2	-178.7	47.8	0	0	0	0	117.1
997	L	31.3	Very low	32.8	Very low	149 Å²	149	143.5 Å²	143.5	78%	0.78	77%	0.772	S	S	*	*			trans	-98	17.2	177	-91.8	163.3	0	0	0	114.6
998	G	33.6	Very low	33.5	Very low	65 Å²	65	138.4 Å²	138.4	67%	0.67	75%	0.752	S	S	*	*	S	Bend	trans	-91	-16.9	176	0	0	0	0	0	115.2
999	F	33.9	Very low	34.5	Very low	193 Å²	193	137 Å²	137	85%	0.846	75%	0.747	S	S	*	*	S	Bend	trans	-90.6	-17.9	-171.2	-116.2	-94.2	0	0	0	114.5
1000	L	34.5	Very low	35.4	Very low	144 Å²	144	139 Å²	139	75%	0.754	74%	0.744	S	S	*	*	S	Bend	trans	-90.9	-1.9	-171.9	-86.1	160.6	0	0	0	115.2
1001	L	34.4	Very low	36.3	Very low	143 Å²	143	133.7 Å²	133.7	75%	0.749	72%	0.723	S	S	*	*	S	Bend	trans	-102.7	-6.7	-178.3	-85	158.9	0	0	0	114.8
1002	N	33.8	Very low	37.2	Very low	134 Å²	134	129.8 Å²	129.8	72%	0.717	70%	0.702	S	S	*	*	S	Bend	trans	-94.2	-7.5	-177.9	-109.6	-8.6	0	0	0	115.2	K1004	N1002-K1004 PolarHBondContact O-N 2.89Å
1003	W	35.4	Very low	37.8	Very low	224 Å²	224	128.7 Å²	128.7	85%	0.848	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-85.9	-1.4	-176.7	-102	33.3	0	0	0	115.2	H1005	W1003-H1005 VanDerWaalsContact C-N 3.32Å; W1003-H1005 PolarHBondContact O-N 3.46Å
1004	K	34.1	Very low	38.5	Very low	191 Å²	191	130.2 Å²	130.2	83%	0.83	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-83.1	-0.4	-173.8	-133.1	-179.6	-178.2	-176.2	0	114.9	N1002	N1002-K1004 PolarHBondContact O-N 2.89Å
1005	H	38.1	Very low	39.2	Very low	171 Å²	171	130.2 Å²	130.2	79%	0.792	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-110.8	5.9	-172.2	-81.4	-72.5	0	0	0	115.8	W1003	W1003-H1005 VanDerWaalsContact C-N 3.32Å; W1003-H1005 PolarHBondContact O-N 3.46Å
1006	S	38.9	Very low	39.7	Very low	97 Å²	97	126 Å²	126	68%	0.678	65%	0.654	S	S	*	*			trans	-112.1	7.6	-167.4	-55.5	0	0	0	0	116.4
1007	F	39.7	Very low	40.3	Very low	143 Å²	143	126.3 Å²	126.3	63%	0.627	65%	0.647	S	S	*	*			trans	-109.8	120	176.4	-76.9	-78.7	0	0	0	111.8	I1012	F1007-I1012 HydrophobicContact CB-CD1 4.48Å
1008	S	46.6	Very low	40.9	Very low	60 Å²	60	129.5 Å²	129.5	42%	0.42	65%	0.649	S	S	.	*			trans	-68.4	148	172.4	62.2	0	0	0	0	111.7	E1010 Q1011	S1008-E1010 PolarHBondContact O-N 2.83Å; S1008-Q1011 PolarHBondContact O-N 2.84Å; S1008-Q1011 VanDerWaalsContact O-N 3.08Å; S1008-Q1011 WeakPolarHBondContact OG-CG 3.47Å
1009	S	44.6	Very low	41.2	Very low	86 Å²	86	131 Å²	131	60%	0.601	64%	0.641	S	S	*	*	H	α-helix	trans	-59.6	-30.4	-178.1	70.3	0	0	0	0	113.6	Q1011 I1012 D1013	S1009-Q1011 VanDerWaalsContact C-N 3.34Å; S1009-Q1011 PolarHBondContact O-N 3.32Å; S1009-I1012 PolarHBondContact O-N 2.88Å; S1009-D1013 PolarHBondContact O-N 2.57Å
1010	E	46.9	Very low	41.5	Very low	144 Å²	144	128.4 Å²	128.4	67%	0.673	64%	0.635	S	S	*	*	H	α-helix	trans	-65.5	-32.9	176.4	-78.2	-177	146.6	0	0	113.4	S1008 I1012 D1013 Q1014	S1008-E1010 PolarHBondContact O-N 2.83Å; E1010-I1012 VanDerWaalsContact C-N 3.34Å; E1010-D1013 PolarHBondContact O-N 3.42Å; E1010-Q1014 WeakPolarHBondContact O-CG 3.45Å; E1010-Q1014 PolarHBondContact O-N 3.35Å
1011	Q	49.4	Very low	41.8	Very low	92 Å²	92	128.4 Å²	128.4	43%	0.43	64%	0.635	S	S	.	*	H	α-helix	trans	-73.6	-29.8	176.7	-73.1	-178	-25.2	0	0	111.8	S1008 S1009 L1015	S1008-Q1011 PolarHBondContact O-N 2.84Å; S1008-Q1011 VanDerWaalsContact O-N 3.08Å; S1008-Q1011 WeakPolarHBondContact OG-CG 3.47Å; S1009-Q1011 VanDerWaalsContact C-N 3.34Å; S1009-Q1011 PolarHBondContact O-N 3.32Å; Q1011-L1015 WeakPolarHBondContact O-CB 3.28Å; Q1011-L1015 PolarHBondContact O-N 3.31Å
1012	I	46.8	Very low	41.8	Very low	83 Å²	83	127 Å²	127	43%	0.426	63%	0.632	S	S	.	*	H	α-helix	trans	-72.5	-38.4	174.8	-61.8	174.8	0	0	0	110.1	F1007 S1009 E1010 L1015 N1016	F1007-I1012 HydrophobicContact CB-CD1 4.48Å; S1009-I1012 PolarHBondContact O-N 2.88Å; E1010-I1012 VanDerWaalsContact C-N 3.34Å; I1012-L1015 PolarHBondContact O-N 3.48Å; I1012-N1016 PolarHBondContact O-N 3.05Å; I1012-N1016 PolarHBondContact O-ND2 3.42Å
1013	D	46	Very low	41.6	Very low	92 Å²	92	129.5 Å²	129.5	49%	0.492	64%	0.639	S	S	.	*	H	α-helix	trans	-70.8	-37.7	177.3	-72	-23.2	0	0	0	112.6	S1009 E1010 L1015 N1016 D1017	S1009-D1013 PolarHBondContact O-N 2.57Å; E1010-D1013 PolarHBondContact O-N 3.42Å; D1013-L1015 VanDerWaalsContact C-N 3.32Å; D1013-L1015 PolarHBondContact O-N 3.37Å; D1013-N1016 PolarHBondContact O-N 3.22Å; D1013-D1017 PolarHBondContact O-N 2.91Å
1014	Q	49.8	Very low	41.6	Very low	136 Å²	136	127.6 Å²	127.6	64%	0.636	64%	0.639	S	S	*	*	H	α-helix	trans	-66.2	-32.3	172.9	-74.4	-179.9	6.8	0	0	113.4	E1010 R1018	E1010-Q1014 WeakPolarHBondContact O-CG 3.45Å; E1010-Q1014 PolarHBondContact O-N 3.35Å; Q1014-R1018 PolarHBondContact O-N 2.87Å
1015	L	42.2	Very low	41.5	Very low	108 Å²	108	123.6 Å²	123.6	57%	0.565	64%	0.636	S	S	*	*	H	α-helix	trans	-70.8	-38.3	172.5	-96.1	154.8	0	0	0	111.5	Q1011 I1012 D1013 L1019	Q1011-L1015 WeakPolarHBondContact O-CB 3.28Å; Q1011-L1015 PolarHBondContact O-N 3.31Å; I1012-L1015 PolarHBondContact O-N 3.48Å; D1013-L1015 VanDerWaalsContact C-N 3.32Å; D1013-L1015 PolarHBondContact O-N 3.37Å; L1015-L1019 WeakPolarHBondContact O-CD1 3.32Å; L1015-L1019 WeakPolarHBondContact O-CG 3.24Å; L1015-L1019 PolarHBondContact O-N 2.88Å
1016	N	41.6	Very low	41.7	Very low	82 Å²	82	117.7 Å²	117.7	44%	0.439	61%	0.61	S	S	.	*	H	α-helix	trans	-66.5	-42	175.3	-79.2	-29.3	0	0	0	112.2	I1012 D1013 R1018 L1019 L1020	I1012-N1016 PolarHBondContact O-N 3.05Å; I1012-N1016 PolarHBondContact O-ND2 3.42Å; D1013-N1016 PolarHBondContact O-N 3.22Å; N1016-R1018 PolarHBondContact O-N 3.19Å; N1016-L1019 PolarHBondContact O-N 2.98Å; N1016-L1020 WeakPolarHBondContact O-CD1 3.37Å; N1016-L1020 PolarHBondContact O-N 2.91Å
1017	D	45.5	Very low	41.6	Very low	115 Å²	115	118.2 Å²	118.2	62%	0.615	61%	0.611	S	S	*	*	H	α-helix	trans	-68.1	-32.4	179	-85.3	-13.9	0	0	0	113.2	D1013 L1019	D1013-D1017 PolarHBondContact O-N 2.91Å; D1017-L1019 VanDerWaalsContact C-N 3.32Å
1018	R	44.2	Very low	41.5	Very low	217 Å²	217	117.7 Å²	117.7	82%	0.819	61%	0.612	S	S	*	*	H	α-helix	trans	-74.1	-21.5	174.2	-81.3	-168.1	169.1	-168.6	-0.4	113.7	Q1014 N1016	Q1014-R1018 PolarHBondContact O-N 2.87Å; N1016-R1018 PolarHBondContact O-N 3.19Å
1019	L	39.8	Very low	41.3	Very low	95 Å²	95	121.8 Å²	121.8	50%	0.497	62%	0.622	S	S	.	*	H	α-helix	trans	-84.2	-12.6	177.2	-79.6	162.6	0	0	0	113.3	L1015 N1016 D1017	L1015-L1019 WeakPolarHBondContact O-CD1 3.32Å; L1015-L1019 WeakPolarHBondContact O-CG 3.24Å; L1015-L1019 PolarHBondContact O-N 2.88Å; N1016-L1019 PolarHBondContact O-N 2.98Å; D1017-L1019 VanDerWaalsContact C-N 3.32Å
1020	L	38.4	Very low	41.2	Very low	140 Å²	140	120.7 Å²	120.7	73%	0.733	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-7.2	-179.5	-103.9	114.9	0	0	0	115.1	N1016	N1016-L1020 WeakPolarHBondContact O-CD1 3.37Å; N1016-L1020 PolarHBondContact O-N 2.91Å
1021	I	40.9	Very low	40.8	Very low	144 Å²	144	118.3 Å²	118.3	74%	0.738	61%	0.606	S	S	*	*	S	Bend	trans	-95.1	-9.4	-170.8	-63.7	176	0	0	0	113.8
1022	T	36	Very low	40.7	Very low	112 Å²	112	117.7 Å²	117.7	69%	0.687	61%	0.605	S	S	*	*			trans	-110.6	91.6	-177.7	54.4	0	0	0	0	112.6	Q1024	T1022-Q1024 PolarHBondContact O-N 3.39Å; T1022-Q1024 VanDerWaalsContact O-N 3.08Å
1023	H	29.5	Very low	40.5	Very low	187 Å²	187	118.8 Å²	118.8	87%	0.866	61%	0.611	S	S	*	*			trans	-58.8	101.5	156.4	-94.8	-87.5	0	0	0	109.4
1024	Q	34.6	Very low	40.2	Very low	184 Å²	184	117.8 Å²	117.8	86%	0.86	61%	0.611	S	S	*	*	S	Bend	trans	171.2	125.1	145	-95.4	165.6	3.3	0	0	111.6	T1022	T1022-Q1024 PolarHBondContact O-N 3.39Å; T1022-Q1024 VanDerWaalsContact O-N 3.08Å
1025	S	33	Very low	40.1	Very low	108 Å²	108	115.3 Å²	115.3	76%	0.755	60%	0.601	S	S	*	*	S	Bend	trans	21.3	115.5	162.9	56	0	0	0	0	120.6
1026	D	41.6	Very low	40.1	Very low	46 Å²	46	117 Å²	117	25%	0.246	61%	0.605	C	S	.	*			trans	89	80.7	162.7	-84.7	-46.7	0	0	0	120.1	K978 M1028 K1029 S1030	K978-D1026 WeakPolarHBondContact CD-OD2 3.4Å; K978-D1026 WeakPolarHBondContact CE-OD1 3.25Å; K978-D1026 WeakPolarHBondContact CE-OD2 2.73Å; K978-D1026 IonicContact NZ-OD1 2.58Å; K978-D1026 PolarHBondContact NZ-OD1 3.49Å; K978-D1026 IonicContact NZ-OD2 2.77Å; K978-D1026 PolarHBondContact NZ-OD2 3.29Å; D1026-M1028 VanDerWaalsContact C-N 3.27Å; D1026-M1028 PolarHBondContact O-N 3.22Å; D1026-K1029 HydrophobicContact CB-CB 4.17Å; D1026-K1029 HydrophobicContact CB-CD 4.49Å; D1026-K1029 PolarHBondContact O-N 3.44Å; D1026-S1030 PolarHBondContact O-N 3.3Å
1027	P	36.6	Very low	40.2	Very low	109 Å²	109	116.7 Å²	116.7	71%	0.708	61%	0.605	S	S	*	*	H	α-helix	trans	-63.2	-29.6	175.9	24.9	-32.4	0	0	0	113.2	S1030 L1031	P1027-S1030 PolarHBondContact O-N 3.05Å; P1027-L1031 WeakPolarHBondContact O-CB 3.42Å; P1027-L1031 PolarHBondContact O-N 3.4Å
1028	M	37.5	Very low	40	Very low	131 Å²	131	116.9 Å²	116.9	65%	0.645	61%	0.606	S	S	*	*	H	α-helix	trans	-69.3	-35.5	177.9	-88	-90.8	-82.4	0	0	113.3	D1026 I1032	D1026-M1028 VanDerWaalsContact C-N 3.27Å; D1026-M1028 PolarHBondContact O-N 3.22Å; M1028-I1032 WeakPolarHBondContact O-CB 3.21Å; M1028-I1032 WeakPolarHBondContact O-CD1 3.47Å; M1028-I1032 WeakPolarHBondContact O-CG1 3.45Å; M1028-I1032 PolarHBondContact O-N 3.27Å
1029	K	43.3	Very low	39.6	Very low	146 Å²	146	111.7 Å²	111.7	64%	0.635	59%	0.594	S	S	*	*	H	α-helix	trans	-72.6	-35.3	177	-89.5	-177.7	172.6	178.4	0	112	D1026 N1033	D1026-K1029 HydrophobicContact CB-CB 4.17Å; D1026-K1029 HydrophobicContact CB-CD 4.49Å; D1026-K1029 PolarHBondContact O-N 3.44Å; K1029-N1033 VanDerWaalsContact O-CB 3.3Å; K1029-N1033 WeakPolarHBondContact O-CB 3.3Å; K1029-N1033 PolarHBondContact O-N 3.4Å
1030	S	40.8	Very low	39.6	Very low	63 Å²	63	110.9 Å²	110.9	44%	0.441	60%	0.597	S	S	.	*	H	α-helix	trans	-69	-38.7	175.9	-148.5	0	0	0	0	111.3	D1026 P1027 N1033 C1034	D1026-S1030 PolarHBondContact O-N 3.3Å; P1027-S1030 PolarHBondContact O-N 3.05Å; S1030-N1033 PolarHBondContact O-N 3.5Å; S1030-C1034 WeakPolarHBondContact O-CB 3.38Å; S1030-C1034 PolarHBondContact O-N 3.43Å
1031	L	39.6	Very low	39.6	Very low	94 Å²	94	112.3 Å²	112.3	49%	0.492	60%	0.597	S	S	.	*	H	α-helix	trans	-67.2	-43.5	175.4	-146.7	103.3	0	0	0	112.1	P1027 C1034 I1035	P1027-L1031 WeakPolarHBondContact O-CB 3.42Å; P1027-L1031 PolarHBondContact O-N 3.4Å; L1031-C1034 PolarHBondContact O-N 3.08Å; L1031-I1035 HydrophobicContact CD2-CD1 3.91Å; L1031-I1035 HydrophobicContact CG-CD1 4.33Å; L1031-I1035 WeakPolarHBondContact O-CB 3.46Å; L1031-I1035 WeakPolarHBondContact O-CD1 3.41Å; L1031-I1035 WeakPolarHBondContact O-CG1 3.47Å; L1031-I1035 PolarHBondContact O-N 3.04Å
1032	I	47.5	Very low	39.3	Very low	80 Å²	80	109.4 Å²	109.4	41%	0.41	59%	0.594	S	S	.	*	H	α-helix	trans	-66.3	-39.4	176.8	-69.2	166.2	0	0	0	110.9	M1028 I1035 F1036	M1028-I1032 WeakPolarHBondContact O-CB 3.21Å; M1028-I1032 WeakPolarHBondContact O-CD1 3.47Å; M1028-I1032 WeakPolarHBondContact O-CG1 3.45Å; M1028-I1032 PolarHBondContact O-N 3.27Å; I1032-I1035 PolarHBondContact O-N 3.47Å; I1032-F1036 HydrophobicContact CG2-CD2 3.9Å; I1032-F1036 HydrophobicContact CG2-CE2 4.27Å; I1032-F1036 WeakPolarHBondContact O-CB 3.4Å; I1032-F1036 PolarHBondContact O-N 3.2Å
1033	N	43	Very low	39.1	Very low	105 Å²	105	111 Å²	111	56%	0.561	61%	0.61	S	S	*	*	H	α-helix	trans	-66.8	-39.8	173.7	-82.7	-10.1	0	0	0	111.7	K1029 S1030 F1036 T1037	K1029-N1033 VanDerWaalsContact O-CB 3.3Å; K1029-N1033 WeakPolarHBondContact O-CB 3.3Å; K1029-N1033 PolarHBondContact O-N 3.4Å; S1030-N1033 PolarHBondContact O-N 3.5Å; N1033-F1036 PolarHBondContact O-N 3.28Å; N1033-T1037 VanDerWaalsContact O-CB 3.25Å; N1033-T1037 WeakPolarHBondContact O-CB 3.42Å; N1033-T1037 PolarHBondContact O-N 2.77Å; N1033-T1037 PolarHBondContact O-OG1 3.24Å
1034	C	39.5	Very low	39.6	Very low	72 Å²	72	107.2 Å²	107.2	49%	0.486	60%	0.597	S	S	.	*	H	α-helix	trans	-62.4	-42	172.9	-90.2	0	0	0	0	111.9	S1030 L1031 T1037 L1038	S1030-C1034 WeakPolarHBondContact O-CB 3.38Å; S1030-C1034 PolarHBondContact O-N 3.43Å; L1031-C1034 PolarHBondContact O-N 3.08Å; C1034-T1037 PolarHBondContact O-N 3.03Å; C1034-L1038 VanDerWaalsContact O-CB 3.32Å; C1034-L1038 WeakPolarHBondContact O-CB 3.46Å; C1034-L1038 WeakPolarHBondContact O-CD1 3.17Å; C1034-L1038 VanDerWaalsContact O-CG 3.24Å; C1034-L1038 WeakPolarHBondContact O-CG 3.38Å; C1034-L1038 PolarHBondContact O-N 3.23Å
1035	I	45.9	Very low	39.9	Very low	84 Å²	84	103.1 Å²	103.1	43%	0.431	58%	0.583	S	S	.	*	H	α-helix	trans	-67.9	-39.1	177.9	-68.2	164.6	0	0	0	111.2	L1031 I1032 L1038 N1039	L1031-I1035 HydrophobicContact CD2-CD1 3.91Å; L1031-I1035 HydrophobicContact CG-CD1 4.33Å; L1031-I1035 WeakPolarHBondContact O-CB 3.46Å; L1031-I1035 WeakPolarHBondContact O-CD1 3.41Å; L1031-I1035 WeakPolarHBondContact O-CG1 3.47Å; L1031-I1035 PolarHBondContact O-N 3.04Å; I1032-I1035 PolarHBondContact O-N 3.47Å; I1035-L1038 PolarHBondContact O-N 2.93Å; I1035-N1039 WeakPolarHBondContact O-CB 3.1Å; I1035-N1039 PolarHBondContact O-N 3.35Å
1036	F	43	Very low	40.2	Very low	144 Å²	144	102.8 Å²	102.8	63%	0.632	57%	0.574	S	S	*	*	H	α-helix	trans	-69	-35.9	173.7	-100.6	-85.9	0	0	0	112.7	I1032 N1033 L1038 S1040	I1032-F1036 HydrophobicContact CG2-CD2 3.9Å; I1032-F1036 HydrophobicContact CG2-CE2 4.27Å; I1032-F1036 WeakPolarHBondContact O-CB 3.4Å; I1032-F1036 PolarHBondContact O-N 3.2Å; N1033-F1036 PolarHBondContact O-N 3.28Å; F1036-L1038 VanDerWaalsContact C-N 3.33Å; F1036-S1040 WeakPolarHBondContact O-CB 3.42Å; F1036-S1040 PolarHBondContact O-N 2.98Å
1037	T	44.5	Very low	40.2	Very low	74 Å²	74	106.2 Å²	106.2	45%	0.454	59%	0.593	S	S	.	*	H	α-helix	trans	-75	-25.9	177.9	-47.6	0	0	0	0	111.7	N1033 C1034 K1041	N1033-T1037 VanDerWaalsContact O-CB 3.25Å; N1033-T1037 WeakPolarHBondContact O-CB 3.42Å; N1033-T1037 PolarHBondContact O-N 2.77Å; N1033-T1037 PolarHBondContact O-OG1 3.24Å; C1034-T1037 PolarHBondContact O-N 3.03Å; T1037-K1041 WeakPolarHBondContact O-CB 3.38Å; T1037-K1041 VanDerWaalsContact O-CG 3.31Å; T1037-K1041 WeakPolarHBondContact O-CG 3.4Å
1038	L	39.8	Very low	40.4	Very low	119 Å²	119	106 Å²	106	62%	0.623	59%	0.586	S	S	*	*	H	α-helix	trans	-79.6	-39.4	171.8	-75.3	163.1	0	0	0	111.4	C1034 I1035 F1036 K1041 A1042	C1034-L1038 VanDerWaalsContact O-CB 3.32Å; C1034-L1038 WeakPolarHBondContact O-CB 3.46Å; C1034-L1038 WeakPolarHBondContact O-CD1 3.17Å; C1034-L1038 VanDerWaalsContact O-CG 3.24Å; C1034-L1038 WeakPolarHBondContact O-CG 3.38Å; C1034-L1038 PolarHBondContact O-N 3.23Å; I1035-L1038 PolarHBondContact O-N 2.93Å; F1036-L1038 VanDerWaalsContact C-N 3.33Å; L1038-K1041 PolarHBondContact O-N 3.45Å; L1038-A1042 WeakPolarHBondContact O-CB 2.85Å; L1038-A1042 PolarHBondContact O-N 3.42Å
1039	N	37.4	Very low	40.6	Very low	109 Å²	109	104.3 Å²	104.3	58%	0.583	58%	0.582	S	S	*	*	H	α-helix	trans	-69.7	-31.7	174.1	-82.1	-13.6	0	0	0	112.9	I1035 K1041 A1042 S1043	I1035-N1039 WeakPolarHBondContact O-CB 3.1Å; I1035-N1039 PolarHBondContact O-N 3.35Å; N1039-K1041 PolarHBondContact O-N 3.2Å; N1039-A1042 PolarHBondContact O-N 3.08Å; N1039-S1043 PolarHBondContact O-N 2.58Å
1040	S	39.5	Very low	40.4	Very low	78 Å²	78	101.4 Å²	101.4	55%	0.545	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.2	-4.2	174.4	93.4	0	0	0	0	113.8	F1036	F1036-S1040 WeakPolarHBondContact O-CB 3.42Å; F1036-S1040 PolarHBondContact O-N 2.98Å
1041	K	37.3	Very low	40.4	Very low	169 Å²	169	104.3 Å²	104.3	74%	0.735	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	-8.2	172.3	-79.5	-176.6	173.6	-168.6	0	112.3	T1037 L1038 N1039	T1037-K1041 WeakPolarHBondContact O-CB 3.38Å; T1037-K1041 VanDerWaalsContact O-CG 3.31Å; T1037-K1041 WeakPolarHBondContact O-CG 3.4Å; L1038-K1041 PolarHBondContact O-N 3.45Å; N1039-K1041 PolarHBondContact O-N 3.2Å
1042	A	35.3	Very low	40.4	Very low	83 Å²	83	105.2 Å²	105.2	69%	0.686	60%	0.597	S	S	*	*			trans	-109.5	2.7	179.5	0	0	0	0	0	113.6	L1038 N1039	L1038-A1042 WeakPolarHBondContact O-CB 2.85Å; L1038-A1042 PolarHBondContact O-N 3.42Å; N1039-A1042 PolarHBondContact O-N 3.08Å
1043	S	32.1	Very low	39.8	Very low	145 Å²	145	107.5 Å²	107.5	100%	1.014	61%	0.614	S	S	*	*			trans	-115.8	0	165.8	74.8	0	0	0	0	109.6	N1039	N1039-S1043 PolarHBondContact O-N 2.58Å

Retrieved 1,043 of 1,043 residues in 1386.5 ms (Link to these results)

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