A0A3Q0KQA7_SCHMA Loading...

Putative neurobeachin AlphaSync Fragmented

AlphaFold DB , UniProt , Accession A0A3Q0KQA7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,892 aa.

						>A0A3Q0KQA7_SCHMA|A0A3Q0KQA7
MDDSVVTVAQILKAFRVHLGKLDFKCETKEVELSTSLSNHELSVTNDVVNFFLKVGDFVLLCENAECLNSVSLSKVLQELLSSHISANVVASLLYRIYQSSDIWPSFSAGFFSFLHTIPFASTPSSYFSFPDDAYSNVSLPPTDKWPSQTGWTFHCWIYRKRFTNNNKMHLYCFQTYDRLGFSAYFVNEVLFLSVSRSKGNVDEFPINFSFRLHEWFMLTIVHSFLRWGGSSILCYVNGTLVSNVDVTWHLNTCEVFRTCLIGQSNDTTNGDGFYGHMSNIMGFAEALTPEQISYIYSLGPKYQGQFRFEADICSESSNQTEIISDLNKLYNSLVFAYNPLSCDGRLCLNQTVNFHQSNQTSLHALMSGNVSAVINSSVSDTFIKLGGMQLLYPLFSRLDWPSEKSVAFENKLNVLEILALHPSFVNLQLSSPEIPTILVRFIFGLVRMSSTLRSQFVATKGLLIIANALNQSDMKHLTKSLLDEITNFTLYLLKTIKSTHDELNIHSNSTSNVNIYIILIRQMYGYLLSNSELWCKATLDVQEQLYQFLATDFMEAVSLGYIERIGTIIHCLYALKYYLALTNPRARSGYELCTPDHEIIGSVEKLIKLRTNLLIYLKRLFTRGGITDDEMRLILAFLTTVHEPENIHDVLYLLVSTLVEFPNTCGPVFVRTNGIHCVFKLLTSEDEHVRIYAIKLFGLYLIYGKTSVYGNAIESFALYSLLEERLNSTSSQFTSLMYNALFEVMTECISPKIRINPIIINKTVSIIKNPAVLKVIAHLIAQSEQTNEILSIKDTFIQHLFVFCSQNPYNKKTILQLSVWQDWLLHLVPLYPNNKANANFLVKILHLIRILLIYGICHEYGSWQVLVDTLALIHLHIYEERSACLKEKQETAKPNCTVDEKNSNLTHTDTSVLFSNKSSIGLKNSLGVDLTEYGSCQIKDDQPPSNSSSMGNNSNNNSNADNNKNVDNNANNSCSSSVCNSDQILDRTPSDSILSYENIELPPLSLSKTSPNRQPNSPSNHNHNTENKVITDTISLKKEDKSMKFQLPNFSWSYVHHLLLDDLLCSLENIVVQRDVHRKQSLASHSSSSLSTPPYGLRDNILKQQTKIGKESVQSQSSMQLKSPTLSLASTESSLSSTTVTSVATNPFIKTSHSNDQTYSTDNNLIANDNDDNKIFSQNEANMNVMDPRNESIFTTNILHIISYLSDMIIGACGGLLPLLAAASSSTSEIGSLESLPGMELNDGIGYLLRLTYLADFCILDKNINTKLIESERNLPSGSLARQLLRLYLTAAVRNCLESRLNRLLPPSYIVQTMKQLSSGNDVVGSSSDIEKNLEINEVLFIQSDDSSHAIQSLQIITGSTQTMNDIRVDKINHYHHSNGIDITSKEVRRHHFSFPLSIDSNNPCNIIEDSMENLTSKLLNLSRFQLVTDLEYYKIHRLGFLEQPWKLPDYYTTSSDLFRISDLKHDYDKKISHLSGTFQQLLYSIKPYFNYPKNYGDEAFQDTVINPVKNPEILLQNSDIKRLNHLIAKYTETTKSPDFLALATVYFLSVMMVSKYRDVLDPNPIWLPYANVDHVSSKDDFVQSHTKLTHVNKFKKEPEVHMNANDTRNNETVETKNDNDHNINSKEAVFGITRRDENDTDRNSLVSEDYELVDVPLDNNGNNTTITTKIELNNQKQNALTDLLDTCLGSTGLFLKDLFIEFMDYFSKTLIGTHGQELFPSVLPFLQHTSSVVELVMLLCSQEWQTSLQKYAGWAFIELVNEGRLLSHSIRDHLYRVAVEGDVILNQIHMSNIQQHTKFEEITAHTMANLREEEKLHKNIIDSARLRDAQLSNYLNNKSNRLAQFIMFNWMRSSVSISPTSSSSSFTVSRTVHPLLKDYFRLDTWEDDSRRHRRLIPNPHGTNYSSSAFYNDNMRRRSVCQNHSQQLEDLLKEAGVQHTRDFSINPESVDKNSVQYELPRDNTLMNSTMNESVDSSETINPVTLTWFQEDSLYPGRLCIDFKNTAYLSVPCILVSLGVTVHGTLSISKYELYFEHDTDHPNNRSIDQRVLAYIEHIYSRWSLSEIRAIFNRSFLHRKVALEIFVTSRGSVLFAFTDMNTVKLVVNALPEVGIGTRYGLPVSRASTLASPSKIFQLSNMTQRWQRRELSNFDYLMYLNTIAGRSYNDLNQYPIFPWVISNYTTKELDLSSPSNYRDLSKPIGAINPKRKAFFDERYKNWEDENQPPFHYGTHYSTAAFVLNYLLRIEPFTTVFLNLQGGKFDHPDRIFYSVAKTWENCQINTSDVKELIPEFFYFPEMFENLNDLGLGVTDDGINVDTVILPPWAKSPEEFVRINREALESELVSCQLHNWVDLIFGYKQRGPEAVHATNVFHYLTYDGSVDWDKITDSLLIKAVQDQIQSFGQTPGQLLTKPHPRRNSALHHNPEIFNLLNEEFCMSLKFQSHSPVVHLFSNTSSKALPFPSVFAITENRTIVVCKWNSLAADAVYRIARINPEVYSTDTIMNNQDPQIQHPKTSSNNTNKNNESSVLLTNSSNSSFMSSSSGVTNQSISSHLKENTSTKYGPDQVHGLPLKSETVLPLGRCLGHDFDENLRITSNQFVVTADSRAVILCGYYDRSFRIFGSNNGRLIQAVFGHSDIVTCLARSECHLSQYHYLASGSRDCTVMLWMFSVQRSRIVNSQGLPKPLFILNGHETSINCISLSAELGLVISGSMNGTCLLHSTRGELLRCLPSPCTTILNHQPSTSSSTAIVDNDVTAPMQPNLLTYHREGYLLGLFNLSQLSLYTLNGKLLRTTDLSILSNNTSCPYQINAVLFSNCGRYILIAGNDGVIWILRSYNLLPVHAFPKCDTSIGSLCLSHDQRFIFAGLKSGCLVVFYIDFNQWHHEFQQRYF
					

Structure and PAE viewers are unavailable as this is a multi-fragment structure.

Download 9 Fragment Structures AlphaSync Parameters PDBs Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.7	Very low	39.8	Very low	163 Å²	163	100.5 Å²	100.5	80%	0.803	57%	0.568	S	S	*	*				0	-12.4	0	-76.4	-73.8	-97.6	0	0	112.2	V8	M1-V8 HydrophobicContact SD-CG2 4.2Å
2	D	35	Very low	40.1	Very low	160 Å²	160	99.8 Å²	99.8	86%	0.856	56%	0.561	S	S	*	*			trans	-78.1	-18.1	177.6	-62.8	-28.2	0	0	0	114	S4	D2-S4 PolarHBondContact O-N 3.09Å
3	D	35	Very low	40.4	Very low	138 Å²	138	103.8 Å²	103.8	74%	0.738	57%	0.569	S	S	*	*	S	Bend	trans	-96.9	98.9	179.7	-70.9	-41.9	0	0	0	112.7	T7	D3-T7 PolarHBondContact O-OG1 3.21Å
4	S	41.5	Very low	40.8	Very low	67 Å²	67	100.9 Å²	100.9	47%	0.469	57%	0.565	S	S	.	*			trans	54.4	123.5	160.1	99.5	0	0	0	0	117.7	D2 V6 T7	D2-S4 PolarHBondContact O-N 3.09Å; S4-V6 PolarHBondContact O-N 3.48Å; S4-T7 PolarHBondContact O-N 3.27Å; S4-T7 PolarHBondContact O-OG1 2.95Å; S4-T7 PolarHBondContact OG-N 2.87Å; S4-T7 PolarHBondContact OG-OG1 2.86Å
5	V	39.9	Very low	40.8	Very low	130 Å²	130	100.3 Å²	100.3	79%	0.788	55%	0.554	S	S	*	*	H	α-helix	trans	-49.4	-25.7	168.8	176.4	0	0	0	0	112.2	A9	V5-A9 VanDerWaalsContact O-CB 3.31Å; V5-A9 WeakPolarHBondContact O-CB 3.23Å; V5-A9 PolarHBondContact O-N 2.84Å
6	V	41.2	Very low	40.6	Very low	89 Å²	89	105.9 Å²	105.9	54%	0.539	56%	0.564	S	S	.	*	H	α-helix	trans	-65.2	-41.9	177.9	-174.9	0	0	0	0	111.8	S4 A9 Q10	S4-V6 PolarHBondContact O-N 3.48Å; V6-A9 PolarHBondContact O-N 3.01Å; V6-Q10 HydrophobicContact CG1-CG 4.44Å; V6-Q10 WeakPolarHBondContact O-CB 3.29Å; V6-Q10 WeakPolarHBondContact O-CG 3.4Å; V6-Q10 PolarHBondContact O-N 3.42Å
7	T	41.9	Very low	41	Very low	59 Å²	59	105.5 Å²	105.5	36%	0.362	57%	0.566	S	S	.	*	H	α-helix	trans	-66.8	-43.8	-179.7	-6.1	0	0	0	0	110.9	D3 S4 Q10 I11	D3-T7 PolarHBondContact O-OG1 3.21Å; S4-T7 PolarHBondContact O-N 3.27Å; S4-T7 PolarHBondContact O-OG1 2.95Å; S4-T7 PolarHBondContact OG-N 2.87Å; S4-T7 PolarHBondContact OG-OG1 2.86Å; T7-Q10 PolarHBondContact O-N 3.22Å; T7-I11 WeakPolarHBondContact O-CB 3.39Å; T7-I11 WeakPolarHBondContact O-CD1 3.26Å; T7-I11 VanDerWaalsContact O-CG1 3.23Å; T7-I11 WeakPolarHBondContact O-CG1 3.45Å; T7-I11 PolarHBondContact O-N 2.99Å
8	V	40	Very low	40.9	Very low	59 Å²	59	107 Å²	107	36%	0.358	57%	0.569	S	S	.	*	H	α-helix	trans	-63.3	-43.4	175	179.2	0	0	0	0	110.7	M1 Q10 I11 L12	M1-V8 HydrophobicContact SD-CG2 4.2Å; V8-Q10 PolarHBondContact O-N 3.28Å; V8-I11 PolarHBondContact O-N 3.01Å; V8-L12 HydrophobicContact CG1-CD1 4.01Å; V8-L12 HydrophobicContact CG1-CG 4.49Å; V8-L12 WeakPolarHBondContact O-CB 3.35Å; V8-L12 VanDerWaalsContact O-CG 3.31Å; V8-L12 WeakPolarHBondContact O-CG 3.42Å; V8-L12 PolarHBondContact O-N 3.35Å
9	A	42.5	Very low	40.6	Very low	52 Å²	52	105.1 Å²	105.1	43%	0.43	56%	0.558	S	S	.	*	H	α-helix	trans	-64.1	-39.4	177.3	0	0	0	0	0	112.6	V5 V6 L12 K13	V5-A9 VanDerWaalsContact O-CB 3.31Å; V5-A9 WeakPolarHBondContact O-CB 3.23Å; V5-A9 PolarHBondContact O-N 2.84Å; V6-A9 PolarHBondContact O-N 3.01Å; A9-L12 PolarHBondContact O-N 3.02Å; A9-K13 VanDerWaalsContact O-CB 3.31Å; A9-K13 WeakPolarHBondContact O-CB 3.23Å; A9-K13 PolarHBondContact O-N 2.94Å
10	Q	45.2	Very low	40.5	Very low	126 Å²	126	103.2 Å²	103.2	59%	0.589	57%	0.566	S	S	*	*	H	α-helix	trans	-67.9	-41.2	176.1	-76.8	-177.7	-5.2	0	0	112.1	V6 T7 V8 K13 A14	V6-Q10 HydrophobicContact CG1-CG 4.44Å; V6-Q10 WeakPolarHBondContact O-CB 3.29Å; V6-Q10 WeakPolarHBondContact O-CG 3.4Å; V6-Q10 PolarHBondContact O-N 3.42Å; T7-Q10 PolarHBondContact O-N 3.22Å; V8-Q10 PolarHBondContact O-N 3.28Å; Q10-K13 PolarHBondContact O-N 3.38Å; Q10-A14 WeakPolarHBondContact O-CB 3.08Å; Q10-A14 PolarHBondContact O-N 3.01Å
11	I	43.8	Very low	40.5	Very low	62 Å²	62	106.3 Å²	106.3	32%	0.318	57%	0.574	S	S	.	*	H	α-helix	trans	-61.7	-46	174.7	-68.6	165.3	0	0	0	110.1	T7 V8 K13 A14 F15 F52	T7-I11 WeakPolarHBondContact O-CB 3.39Å; T7-I11 WeakPolarHBondContact O-CD1 3.26Å; T7-I11 VanDerWaalsContact O-CG1 3.23Å; T7-I11 WeakPolarHBondContact O-CG1 3.45Å; T7-I11 PolarHBondContact O-N 2.99Å; V8-I11 PolarHBondContact O-N 3.01Å; I11-K13 VanDerWaalsContact C-N 3.32Å; I11-K13 PolarHBondContact O-N 3.46Å; I11-A14 PolarHBondContact O-N 3.16Å; I11-F15 HydrophobicContact CG2-CD2 4.24Å; I11-F15 WeakPolarHBondContact O-CB 3.38Å; I11-F15 PolarHBondContact O-N 2.8Å; I11-F52 HydrophobicContact CD1-CE1 4.36Å; I11-F52 HydrophobicContact CD1-CZ 4.02Å; I11-F52 HydrophobicContact CG2-CE1 4.27Å
12	L	43.6	Very low	40.4	Very low	92 Å²	92	103.4 Å²	103.4	48%	0.482	56%	0.561	S	S	.	*	H	α-helix	trans	-62.5	-37.5	175.6	-73.2	170	0	0	0	112.4	V8 A9 F15 R16	V8-L12 HydrophobicContact CG1-CD1 4.01Å; V8-L12 HydrophobicContact CG1-CG 4.49Å; V8-L12 WeakPolarHBondContact O-CB 3.35Å; V8-L12 VanDerWaalsContact O-CG 3.31Å; V8-L12 WeakPolarHBondContact O-CG 3.42Å; V8-L12 PolarHBondContact O-N 3.35Å; A9-L12 PolarHBondContact O-N 3.02Å; L12-F15 PolarHBondContact O-N 3.48Å; L12-R16 PolarHBondContact O-N 2.98Å
13	K	44.5	Very low	40	Very low	153 Å²	153	103 Å²	103	67%	0.665	56%	0.559	S	S	*	*	H	α-helix	trans	-70	-40.3	177.6	-153.2	175.5	-172.5	-179.8	0	111.5	A9 Q10 I11 R16 V17	A9-K13 VanDerWaalsContact O-CB 3.31Å; A9-K13 WeakPolarHBondContact O-CB 3.23Å; A9-K13 PolarHBondContact O-N 2.94Å; Q10-K13 PolarHBondContact O-N 3.38Å; I11-K13 VanDerWaalsContact C-N 3.32Å; I11-K13 PolarHBondContact O-N 3.46Å; K13-R16 PolarHBondContact O-N 2.93Å; K13-V17 WeakPolarHBondContact O-CG2 3.46Å; K13-V17 PolarHBondContact O-N 3.38Å; K13-V17 VanDerWaalsContact O-N 3.1Å
14	A	45.2	Very low	39.6	Very low	62 Å²	62	105 Å²	105	51%	0.512	56%	0.561	S	S	.	*	H	α-helix	trans	-64.1	-41.1	172.8	0	0	0	0	0	111.4	Q10 I11 V17 H18	Q10-A14 WeakPolarHBondContact O-CB 3.08Å; Q10-A14 PolarHBondContact O-N 3.01Å; I11-A14 PolarHBondContact O-N 3.16Å; A14-V17 PolarHBondContact O-N 2.87Å; A14-H18 PolarHBondContact O-N 2.91Å
15	F	41.2	Very low	38.9	Very low	93 Å²	93	110.6 Å²	110.6	41%	0.408	58%	0.577	S	S	.	*	H	α-helix	trans	-61.4	-45	173.5	-110	-89.5	0	0	0	112.1	I11 L12 V17 H18 L19	I11-F15 HydrophobicContact CG2-CD2 4.24Å; I11-F15 WeakPolarHBondContact O-CB 3.38Å; I11-F15 PolarHBondContact O-N 2.8Å; L12-F15 PolarHBondContact O-N 3.48Å; F15-V17 VanDerWaalsContact C-N 3.32Å; F15-V17 PolarHBondContact O-N 3.45Å; F15-H18 PolarHBondContact O-N 2.66Å; F15-H18 VanDerWaalsContact O-N 3.16Å; F15-L19 HydrophobicContact CD1-CD1 4.28Å; F15-L19 WeakPolarHBondContact O-CB 3.38Å; F15-L19 PolarHBondContact O-N 2.99Å
16	R	38.1	Very low	38.1	Very low	189 Å²	189	110.1 Å²	110.1	71%	0.713	58%	0.578	S	S	*	*	H	α-helix	trans	-56.4	-43	173.1	-93.1	-173.5	-170.1	144.3	4.2	112.9	L12 K13 H18 L19 G20	L12-R16 PolarHBondContact O-N 2.98Å; K13-R16 PolarHBondContact O-N 2.93Å; R16-H18 VanDerWaalsContact C-N 3.32Å; R16-L19 PolarHBondContact O-N 3.21Å; R16-G20 PolarHBondContact O-N 2.89Å
17	V	46.6	Very low	37.3	Very low	99 Å²	99	114.5 Å²	114.5	60%	0.6	59%	0.593	S	S	*	*	H	α-helix	trans	-67	-35.4	178.9	172.5	0	0	0	0	111.3	K13 A14 F15	K13-V17 WeakPolarHBondContact O-CG2 3.46Å; K13-V17 PolarHBondContact O-N 3.38Å; K13-V17 VanDerWaalsContact O-N 3.1Å; A14-V17 PolarHBondContact O-N 2.87Å; F15-V17 VanDerWaalsContact C-N 3.32Å; F15-V17 PolarHBondContact O-N 3.45Å
18	H	39.8	Very low	36.5	Very low	133 Å²	133	118 Å²	118	62%	0.616	61%	0.614	S	S	*	*	H	α-helix	trans	-73.7	-38.8	176.3	-135.9	59.6	0	0	0	112.1	A14 F15 R16 K21	A14-H18 PolarHBondContact O-N 2.91Å; F15-H18 PolarHBondContact O-N 2.66Å; F15-H18 VanDerWaalsContact O-N 3.16Å; R16-H18 VanDerWaalsContact C-N 3.32Å; H18-K21 WeakPolarHBondContact O-CB 3.37Å; H18-K21 PolarHBondContact O-N 2.88Å
19	L	35.2	Very low	35.9	Very low	70 Å²	70	124.2 Å²	124.2	37%	0.366	64%	0.636	S	S	.	*	H	α-helix	trans	-66.7	-36.6	176	-85.5	157.7	0	0	0	113	F15 R16 K21 L22 L60	F15-L19 HydrophobicContact CD1-CD1 4.28Å; F15-L19 WeakPolarHBondContact O-CB 3.38Å; F15-L19 PolarHBondContact O-N 2.99Å; R16-L19 PolarHBondContact O-N 3.21Å; L19-K21 PolarHBondContact O-N 3.48Å; L19-L22 PolarHBondContact O-N 3.27Å; L19-L60 HydrophobicContact CD2-CD1 4.48Å
20	G	37.3	Very low	35	Very low	68 Å²	68	131.2 Å²	131.2	70%	0.701	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-9.7	173.7	0	0	0	0	0	114.6	R16	R16-G20 PolarHBondContact O-N 2.89Å
21	K	42.3	Very low	34	Very low	169 Å²	169	131.3 Å²	131.3	74%	0.735	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-9	172.5	-67.3	-175.1	174.5	-175.4	0	113.8	H18 L19	H18-K21 WeakPolarHBondContact O-CB 3.37Å; H18-K21 PolarHBondContact O-N 2.88Å; L19-K21 PolarHBondContact O-N 3.48Å
22	L	28.1	Very low	33	Very low	102 Å²	102	137 Å²	137	53%	0.534	69%	0.694	S	S	.	*			trans	-100.1	87.8	179.9	-78.1	151.2	0	0	0	108.5	L19 F24	L19-L22 PolarHBondContact O-N 3.27Å; L22-F24 VanDerWaalsContact C-N 3.32Å; L22-F24 HydrophobicContact CB-CD2 4.35Å; L22-F24 HydrophobicContact CB-CE2 4.45Å; L22-F24 PolarHBondContact O-N 3.09Å
23	D	27.1	Very low	32	Very low	152 Å²	152	141.1 Å²	141.1	81%	0.813	72%	0.716	S	S	*	*			trans	-62.9	87.7	171.7	-97.8	-18.2	0	0	0	110.1	K25	D23-K25 PolarHBondContact O-N 3.16Å
24	F	27.5	Very low	30.9	Very low	179 Å²	179	138.6 Å²	138.6	79%	0.785	72%	0.717	S	S	*	*			trans	-79.6	90.9	167.8	-91.9	-85	0	0	0	109.6	L22 C26	L22-F24 VanDerWaalsContact C-N 3.32Å; L22-F24 HydrophobicContact CB-CD2 4.35Å; L22-F24 HydrophobicContact CB-CE2 4.45Å; L22-F24 PolarHBondContact O-N 3.09Å; F24-C26 PolarHBondContact O-N 3.48Å
25	K	25.8	Very low	30	Very low	185 Å²	185	142.5 Å²	142.5	80%	0.804	74%	0.735	S	S	*	*			trans	-77.4	97.8	161.5	-77.1	-174.5	177.2	179.8	0	108.8	D23 E27	D23-K25 PolarHBondContact O-N 3.16Å; K25-E27 PolarHBondContact O-N 2.92Å; K25-E27 VanDerWaalsContact O-N 3.15Å
26	C	24.2	Very low	29.1	Very low	120 Å²	120	143.1 Å²	143.1	81%	0.811	75%	0.751	S	S	*	*			trans	-77	90.9	175.4	-161.8	0	0	0	0	109.4	F24	F24-C26 PolarHBondContact O-N 3.48Å
27	E	24.4	Very low	28.5	Very low	181 Å²	181	143.2 Å²	143.2	85%	0.846	76%	0.764	S	S	*	*			trans	-88.8	115.2	163.5	-79.7	-174.6	-180	0	0	109	K25 K29	K25-E27 PolarHBondContact O-N 2.92Å; K25-E27 VanDerWaalsContact O-N 3.15Å; E27-K29 PolarHBondContact O-N 2.95Å; E27-K29 VanDerWaalsContact O-N 3.09Å
28	T	25.2	Very low	27.4	Very low	131 Å²	131	143 Å²	143	80%	0.804	77%	0.767	S	S	*	*			trans	-60.3	101.2	-179.5	48.9	0	0	0	0	111.8
29	K	25.7	Very low	26.7	Very low	191 Å²	191	143.7 Å²	143.7	83%	0.83	78%	0.776	S	S	*	*			trans	-141.7	133.6	151.9	-75.4	-166.2	177	174.7	0	110	E27 V31	E27-K29 PolarHBondContact O-N 2.95Å; E27-K29 VanDerWaalsContact O-N 3.09Å; K29-V31 PolarHBondContact O-N 3.32Å
30	E	24.4	Very low	26.3	Very low	199 Å²	199	149.6 Å²	149.6	93%	0.93	80%	0.801	S	S	*	*			trans	-45.3	120.4	-174.5	-64.9	164.5	149.9	0	0	112.3
31	V	24.5	Very low	25.6	Very low	128 Å²	128	155.5 Å²	155.5	78%	0.776	81%	0.81	S	S	*	*			trans	-101	100.8	173.8	178.7	0	0	0	0	107.9	K29	K29-V31 PolarHBondContact O-N 3.32Å
32	E	22.2	Very low	24.9	Very low	180 Å²	180	154.6 Å²	154.6	84%	0.841	81%	0.813	S	S	*	*			trans	-70.2	123.9	160	-73.3	-174.3	152.1	0	0	108.7	S34	E32-S34 PolarHBondContact O-N 2.82Å
33	L	22.9	Very low	25	Very low	179 Å²	179	155.5 Å²	155.5	94%	0.937	83%	0.828	S	S	*	*			trans	-68.3	90.3	176.9	-87.3	105	0	0	0	110.4
34	S	22	Very low	25.2	Very low	100 Å²	100	153.2 Å²	153.2	70%	0.699	82%	0.819	S	S	*	*			trans	-107.5	116.9	160.3	63.9	0	0	0	0	110.7	E32 S36	E32-S34 PolarHBondContact O-N 2.82Å; S34-S36 PolarHBondContact O-N 2.9Å
35	T	24.8	Very low	25.5	Very low	144 Å²	144	151 Å²	151	88%	0.883	82%	0.82	S	S	*	*			trans	-30.9	103.5	168.4	49.6	0	0	0	0	116.1
36	S	23.2	Very low	26.4	Very low	106 Å²	106	145.4 Å²	145.4	74%	0.741	80%	0.799	S	S	*	*			trans	-164.7	72.9	154.5	64.3	0	0	0	0	112.3	S34	S34-S36 PolarHBondContact O-N 2.9Å
37	L	24.7	Very low	27.1	Very low	191 Å²	191	146.1 Å²	146.1	100%	1	80%	0.795	S	S	*	*			trans	-136.1	68.3	162.1	-81.8	166.5	0	0	0	108.5
38	S	24.6	Very low	27.6	Very low	94 Å²	94	142 Å²	142	66%	0.657	78%	0.782	S	S	*	*			trans	-113.4	136.2	157.3	56.9	0	0	0	0	106.6
39	N	24.3	Very low	28.1	Very low	149 Å²	149	139.2 Å²	139.2	80%	0.797	77%	0.765	S	S	*	*			trans	107	72.1	175.7	-50.2	-13.2	0	0	0	114.1
40	H	26.9	Very low	28.9	Very low	193 Å²	193	133.2 Å²	133.2	89%	0.894	74%	0.741	S	S	*	*			trans	-160	99.2	131.5	-108.3	-70.5	0	0	0	108.8
41	E	23.6	Very low	29.8	Very low	192 Å²	192	128.7 Å²	128.7	90%	0.897	72%	0.719	S	S	*	*			trans	-77.4	117.1	175.8	-68	174.6	152.8	0	0	109.8
42	L	26	Very low	30.5	Very low	151 Å²	151	126.1 Å²	126.1	79%	0.791	70%	0.697	S	S	*	*			trans	-125	111.4	158.3	-125.5	100.3	0	0	0	107.9	V44	L42-V44 PolarHBondContact O-N 3.27Å
43	S	31	Very low	31.4	Very low	121 Å²	121	121.2 Å²	121.2	85%	0.846	68%	0.677	S	S	*	*			trans	-88.5	97.3	-178.5	59.7	0	0	0	0	110.7
44	V	30.7	Very low	32.4	Very low	104 Å²	104	118.7 Å²	118.7	63%	0.63	66%	0.658	S	S	*	*	S	Bend	trans	-134.8	120.5	156.1	-178.1	0	0	0	0	106.7	L42 N46	L42-V44 PolarHBondContact O-N 3.27Å; V44-N46 WeakPolarHBondContact O-CA 3.34Å; V44-N46 PolarHBondContact O-N 2.87Å
45	T	35.6	Very low	33.5	Very low	131 Å²	131	116.5 Å²	116.5	80%	0.804	64%	0.64	S	S	*	*			trans	-20.7	98.7	-178.5	51.5	0	0	0	0	114.2	D47	T45-D47 PolarHBondContact O-N 3.47Å
46	N	44.1	Very low	34.3	Very low	69 Å²	69	110.7 Å²	110.7	37%	0.369	61%	0.609	S	S	.	*			trans	-97.1	11.8	-149.2	-134.8	-5.3	0	0	0	113.4	V44 V49 N50	V44-N46 WeakPolarHBondContact O-CA 3.34Å; V44-N46 PolarHBondContact O-N 2.87Å; N46-V49 WeakPolarHBondContact OD1-CB 3.18Å; N46-N50 VanDerWaalsContact O-CA 3.31Å; N46-N50 WeakPolarHBondContact O-CA 3.32Å; N46-N50 WeakPolarHBondContact O-CB 3.39Å; N46-N50 PolarHBondContact O-N 3.09Å; N46-N50 PolarHBondContact O-ND2 2.83Å; N46-N50 VanDerWaalsContact O-ND2 3.11Å
47	D	37.8	Very low	35.3	Very low	134 Å²	134	110 Å²	110	72%	0.717	60%	0.598	S	S	*	*	H	α-helix	trans	-76.5	-40.2	-176.6	-72.5	-25	0	0	0	112.5	T45 F51	T45-D47 PolarHBondContact O-N 3.47Å; D47-F51 WeakPolarHBondContact O-CB 3.48Å; D47-F51 PolarHBondContact O-N 3.49Å
48	V	34.8	Very low	36.3	Very low	95 Å²	95	102.6 Å²	102.6	58%	0.576	56%	0.557	S	S	*	*	H	α-helix	trans	-74.3	-40.9	176.9	179.6	0	0	0	0	110.1	F51 F52	V48-F51 PolarHBondContact O-N 2.77Å; V48-F52 HydrophobicContact CG1-CD2 3.59Å; V48-F52 HydrophobicContact CG1-CE2 3.48Å; V48-F52 VanDerWaalsContact CG1-CE2 3.48Å; V48-F52 WeakPolarHBondContact O-CB 3.27Å; V48-F52 WeakPolarHBondContact O-CD2 3.39Å; V48-F52 PolarHBondContact O-N 3.46Å
49	V	36.1	Very low	37.1	Very low	73 Å²	73	100 Å²	100	44%	0.442	54%	0.537	S	S	.	.	H	α-helix	trans	-69.7	-43	175.9	176.6	0	0	0	0	110.8	N46 F51 F52 L53	N46-V49 WeakPolarHBondContact OD1-CB 3.18Å; V49-F51 VanDerWaalsContact C-N 3.29Å; V49-F51 PolarHBondContact O-N 3.17Å; V49-F52 CarbonylContact O-C 3.5Å; V49-F52 PolarHBondContact O-N 3.45Å; V49-L53 HydrophobicContact CG1-CD1 3.78Å; V49-L53 HydrophobicContact CG1-CG 4.12Å; V49-L53 WeakPolarHBondContact O-CA 3.32Å; V49-L53 WeakPolarHBondContact O-CB 3.39Å; V49-L53 WeakPolarHBondContact O-CG 3.38Å; V49-L53 PolarHBondContact O-N 3.18Å
50	N	42.6	Very low	37.9	Very low	64 Å²	64	95.9 Å²	95.9	34%	0.342	52%	0.515	S	S	.	.	H	α-helix	trans	-66.1	-30.8	171.4	-74.8	-29.4	0	0	0	112.1	N46 K54	N46-N50 VanDerWaalsContact O-CA 3.31Å; N46-N50 WeakPolarHBondContact O-CA 3.32Å; N46-N50 WeakPolarHBondContact O-CB 3.39Å; N46-N50 PolarHBondContact O-N 3.09Å; N46-N50 PolarHBondContact O-ND2 2.83Å; N46-N50 VanDerWaalsContact O-ND2 3.11Å; N50-K54 WeakPolarHBondContact O-CB 3.43Å; N50-K54 WeakPolarHBondContact O-CG 3.45Å; N50-K54 PolarHBondContact O-N 3.44Å
51	F	43.4	Very low	38.7	Very low	104 Å²	104	88.3 Å²	88.3	46%	0.456	48%	0.481	S	S	.	.	H	α-helix	trans	-68.4	-46.5	172.3	178.1	-95.4	0	0	0	110.4	D47 V48 V49 L53 K54 V55	D47-F51 WeakPolarHBondContact O-CB 3.48Å; D47-F51 PolarHBondContact O-N 3.49Å; V48-F51 PolarHBondContact O-N 2.77Å; V49-F51 VanDerWaalsContact C-N 3.29Å; V49-F51 PolarHBondContact O-N 3.17Å; F51-L53 VanDerWaalsContact C-N 3.33Å; F51-L53 PolarHBondContact O-N 3.38Å; F51-K54 PolarHBondContact O-N 3.45Å; F51-V55 HydrophobicContact CD1-CG2 4.08Å; F51-V55 HydrophobicContact CD2-CG2 4.39Å; F51-V55 HydrophobicContact CE1-CG2 3.71Å; F51-V55 HydrophobicContact CE2-CG2 4.04Å; F51-V55 HydrophobicContact CG-CG2 4.41Å; F51-V55 HydrophobicContact CZ-CG2 3.69Å; F51-V55 VanDerWaalsContact O-CB 3.27Å; F51-V55 WeakPolarHBondContact O-CB 3.46Å; F51-V55 WeakPolarHBondContact O-CG2 3.48Å; F51-V55 PolarHBondContact O-N 3.31Å
52	F	38.3	Very low	39.6	Very low	74 Å²	74	79.9 Å²	79.9	33%	0.325	44%	0.443	S	S	.	.	H	α-helix	trans	-70.3	-26.8	175.6	-78.8	-65.1	0	0	0	113.3	I11 V48 V49 G56	I11-F52 HydrophobicContact CD1-CE1 4.36Å; I11-F52 HydrophobicContact CD1-CZ 4.02Å; I11-F52 HydrophobicContact CG2-CE1 4.27Å; V48-F52 HydrophobicContact CG1-CD2 3.59Å; V48-F52 HydrophobicContact CG1-CE2 3.48Å; V48-F52 VanDerWaalsContact CG1-CE2 3.48Å; V48-F52 WeakPolarHBondContact O-CB 3.27Å; V48-F52 WeakPolarHBondContact O-CD2 3.39Å; V48-F52 PolarHBondContact O-N 3.46Å; V49-F52 CarbonylContact O-C 3.5Å; V49-F52 PolarHBondContact O-N 3.45Å; F52-G56 WeakPolarHBondContact O-CA 3.46Å; F52-G56 PolarHBondContact O-N 2.95Å
53	L	42.2	Very low	40.3	Very low	77 Å²	77	77.8 Å²	77.8	40%	0.403	43%	0.429	S	S	.	.	H	α-helix	trans	-75	-40.4	169.5	-74.7	170.2	0	0	0	109.7	V49 F51 G56 D57	V49-L53 HydrophobicContact CG1-CD1 3.78Å; V49-L53 HydrophobicContact CG1-CG 4.12Å; V49-L53 WeakPolarHBondContact O-CA 3.32Å; V49-L53 WeakPolarHBondContact O-CB 3.39Å; V49-L53 WeakPolarHBondContact O-CG 3.38Å; V49-L53 PolarHBondContact O-N 3.18Å; F51-L53 VanDerWaalsContact C-N 3.33Å; F51-L53 PolarHBondContact O-N 3.38Å; L53-G56 CarbonylContact O-C 3.59Å; L53-G56 PolarHBondContact O-N 2.87Å; L53-D57 WeakPolarHBondContact O-CA 3.37Å; L53-D57 WeakPolarHBondContact O-CB 3.13Å; L53-D57 PolarHBondContact O-N 2.85Å
54	K	44.8	Very low	40.8	Very low	126 Å²	126	76.5 Å²	76.5	55%	0.548	41%	0.413	S	S	.	.	H	α-helix	trans	-69.1	-36.1	174	-78.5	176.2	-180	-176.6	0	112.4	N50 F51 F58	N50-K54 WeakPolarHBondContact O-CB 3.43Å; N50-K54 WeakPolarHBondContact O-CG 3.45Å; N50-K54 PolarHBondContact O-N 3.44Å; F51-K54 PolarHBondContact O-N 3.45Å; K54-F58 WeakPolarHBondContact O-CA 3.43Å; K54-F58 WeakPolarHBondContact O-CB 3.32Å; K54-F58 PolarHBondContact O-N 2.9Å
55	V	43.8	Very low	41.2	Very low	54 Å²	54	71.6 Å²	71.6	33%	0.327	38%	0.383	S	S	.	.	H	α-helix	trans	-73.4	-39.2	173	171.7	0	0	0	0	109.7	F51 F58 V59	F51-V55 HydrophobicContact CD1-CG2 4.08Å; F51-V55 HydrophobicContact CD2-CG2 4.39Å; F51-V55 HydrophobicContact CE1-CG2 3.71Å; F51-V55 HydrophobicContact CE2-CG2 4.04Å; F51-V55 HydrophobicContact CG-CG2 4.41Å; F51-V55 HydrophobicContact CZ-CG2 3.69Å; F51-V55 VanDerWaalsContact O-CB 3.27Å; F51-V55 WeakPolarHBondContact O-CB 3.46Å; F51-V55 WeakPolarHBondContact O-CG2 3.48Å; F51-V55 PolarHBondContact O-N 3.31Å; V55-F58 CarbonylContact O-C 3.54Å; V55-F58 PolarHBondContact O-N 3.1Å; V55-V59 HydrophobicContact CG1-CG2 4.35Å; V55-V59 WeakPolarHBondContact O-CB 3.4Å; V55-V59 WeakPolarHBondContact O-CG2 3.4Å; V55-V59 PolarHBondContact O-N 3.31Å
56	G	41.5	Very low	41.5	Very low	23 Å²	23	72.2 Å²	72.2	24%	0.237	38%	0.377	C	S	.	.	H	α-helix	trans	-63.4	-49.7	174.8	0	0	0	0	0	110.7	F52 L53 F58 V59 L60	F52-G56 WeakPolarHBondContact O-CA 3.46Å; F52-G56 PolarHBondContact O-N 2.95Å; L53-G56 CarbonylContact O-C 3.59Å; L53-G56 PolarHBondContact O-N 2.87Å; G56-F58 VanDerWaalsContact C-N 3.33Å; G56-F58 PolarHBondContact O-N 3.49Å; G56-V59 CarbonylContact O-C 3.37Å; G56-V59 PolarHBondContact O-N 3.01Å; G56-L60 WeakPolarHBondContact O-CA 3.07Å; G56-L60 WeakPolarHBondContact O-CB 3.33Å; G56-L60 PolarHBondContact O-N 2.88Å
57	D	45	Very low	41.3	Very low	92 Å²	92	74.6 Å²	74.6	49%	0.492	40%	0.398	S	S	.	.	H	α-helix	trans	-60.8	-39.6	170.4	-68.6	-19.6	0	0	0	110.3	L53 L60 L61	L53-D57 WeakPolarHBondContact O-CA 3.37Å; L53-D57 WeakPolarHBondContact O-CB 3.13Å; L53-D57 PolarHBondContact O-N 2.85Å; D57-L60 CarbonylContact O-C 3.42Å; D57-L61 VanDerWaalsContact O-CA 3.3Å; D57-L61 WeakPolarHBondContact O-CA 3.48Å; D57-L61 WeakPolarHBondContact O-CB 3.36Å; D57-L61 PolarHBondContact O-N 2.76Å
58	F	45.6	Very low	41.4	Very low	35 Å²	35	71 Å²	71	15%	0.154	38%	0.378	C	S	.	.	H	α-helix	trans	-66.7	-42.1	174.5	177	-90.5	0	0	0	111.3	K54 V55 G56 L61 C62 L77 L80 L93	K54-F58 WeakPolarHBondContact O-CA 3.43Å; K54-F58 WeakPolarHBondContact O-CB 3.32Å; K54-F58 PolarHBondContact O-N 2.9Å; V55-F58 CarbonylContact O-C 3.54Å; V55-F58 PolarHBondContact O-N 3.1Å; G56-F58 VanDerWaalsContact C-N 3.33Å; G56-F58 PolarHBondContact O-N 3.49Å; F58-L61 PolarHBondContact O-N 2.96Å; F58-C62 VanDerWaalsContact O-CB 3.23Å; F58-C62 WeakPolarHBondContact O-CB 3.41Å; F58-C62 PolarHBondContact O-N 2.99Å; F58-C62 PolarHBondContact O-SG 3.44Å; F58-L77 HydrophobicContact CD2-CD2 4.14Å; F58-L77 HydrophobicContact CE2-CD2 3.39Å; F58-L77 HydrophobicContact CZ-CD2 4.26Å; F58-L80 HydrophobicContact CD2-CD1 4.28Å; F58-L93 HydrophobicContact CE1-CD2 3.99Å; F58-L93 HydrophobicContact CZ-CD1 3.93Å; F58-L93 HydrophobicContact CZ-CD2 3.51Å; F58-L93 HydrophobicContact CZ-CG 3.96Å
59	V	41.3	Very low	42	Very low	39 Å²	39	70.8 Å²	70.8	24%	0.236	37%	0.374	C	S	.	.	H	α-helix	trans	-67.6	-44	176.4	169.2	0	0	0	0	110.1	V55 G56 C62 E63	V55-V59 HydrophobicContact CG1-CG2 4.35Å; V55-V59 WeakPolarHBondContact O-CB 3.4Å; V55-V59 WeakPolarHBondContact O-CG2 3.4Å; V55-V59 PolarHBondContact O-N 3.31Å; G56-V59 CarbonylContact O-C 3.37Å; G56-V59 PolarHBondContact O-N 3.01Å; V59-C62 CarbonylContact O-C 3.48Å; V59-C62 PolarHBondContact O-N 3.45Å; V59-E63 WeakPolarHBondContact O-CB 3.34Å; V59-E63 WeakPolarHBondContact O-CG 3.38Å; V59-E63 PolarHBondContact O-N 2.93Å
60	L	41.8	Very low	42.5	Very low	63 Å²	63	69.7 Å²	69.7	33%	0.33	37%	0.369	S	S	.	.	H	α-helix	trans	-69.3	-32.5	177.1	-163.6	99.6	0	0	0	111.1	L19 G56 D57 E63 N64	L19-L60 HydrophobicContact CD2-CD1 4.48Å; G56-L60 WeakPolarHBondContact O-CA 3.07Å; G56-L60 WeakPolarHBondContact O-CB 3.33Å; G56-L60 PolarHBondContact O-N 2.88Å; D57-L60 CarbonylContact O-C 3.42Å; L60-E63 PolarHBondContact O-N 2.94Å; L60-N64 WeakPolarHBondContact O-CA 3.47Å; L60-N64 WeakPolarHBondContact O-CB 3.46Å; L60-N64 PolarHBondContact O-N 2.89Å; L60-N64 PolarHBondContact O-ND2 3.29Å
61	L	43.3	Very low	42.8	Very low	34 Å²	34	70.2 Å²	70.2	18%	0.178	38%	0.375	C	S	.	.	H	α-helix	trans	-78.1	-30	174.4	-176.8	137.5	0	0	0	110.2	D57 F58 A65 L68 L73 V76	D57-L61 VanDerWaalsContact O-CA 3.3Å; D57-L61 WeakPolarHBondContact O-CA 3.48Å; D57-L61 WeakPolarHBondContact O-CB 3.36Å; D57-L61 PolarHBondContact O-N 2.76Å; F58-L61 PolarHBondContact O-N 2.96Å; L61-A65 WeakPolarHBondContact O-CA 3.5Å; L61-A65 WeakPolarHBondContact O-CB 3.18Å; L61-A65 PolarHBondContact O-N 3.39Å; L61-L68 HydrophobicContact CD1-CD1 3.94Å; L61-L68 HydrophobicContact CD2-CD1 4.38Å; L61-L68 HydrophobicContact CG-CD1 3.66Å; L61-L73 HydrophobicContact CD2-CD1 3.36Å; L61-L73 HydrophobicContact CD2-CG 4.21Å; L61-L73 HydrophobicContact CG-CD1 4.09Å; L61-V76 HydrophobicContact CD1-CB 4.45Å; L61-V76 HydrophobicContact CD1-CG1 3.71Å; L61-V76 HydrophobicContact CD2-CG1 4.3Å
62	C	43	Very low	43	Very low	14 Å²	14	67.9 Å²	67.9	10%	0.095	37%	0.371	C	S	.	.	H	α-helix	trans	-80.2	-20.2	168.9	-64.5	0	0	0	0	112.9	F58 V59 R96	F58-C62 VanDerWaalsContact O-CB 3.23Å; F58-C62 WeakPolarHBondContact O-CB 3.41Å; F58-C62 PolarHBondContact O-N 2.99Å; F58-C62 PolarHBondContact O-SG 3.44Å; V59-C62 CarbonylContact O-C 3.48Å; V59-C62 PolarHBondContact O-N 3.45Å; C62-R96 PolarHBondContact O-NH1 2.99Å
63	E	40.4	Very low	43.6	Very low	107 Å²	107	64.6 Å²	64.6	50%	0.5	36%	0.357	S	S	.	.	H	α-helix	trans	-86.8	-45.2	172.7	-81.3	-177.8	166.5	0	0	110.8	V59 L60 A65	V59-E63 WeakPolarHBondContact O-CB 3.34Å; V59-E63 WeakPolarHBondContact O-CG 3.38Å; V59-E63 PolarHBondContact O-N 2.93Å; L60-E63 PolarHBondContact O-N 2.94Å; E63-A65 PolarHBondContact O-N 3.43Å
64	N	41.6	Very low	44	Very low	94 Å²	94	62.2 Å²	62.2	50%	0.503	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-80.2	-0.5	171.8	-60.8	-19.4	0	0	0	112.5	L60 E66 C67	L60-N64 WeakPolarHBondContact O-CA 3.47Å; L60-N64 WeakPolarHBondContact O-CB 3.46Å; L60-N64 PolarHBondContact O-N 2.89Å; L60-N64 PolarHBondContact O-ND2 3.29Å; N64-E66 PolarHBondContact O-N 3.23Å; N64-C67 PolarHBondContact O-N 2.83Å
65	A	39.2	Very low	44.3	Very low	2 Å²	2	62.4 Å²	62.4	2%	0.017	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-55.9	-20.1	176.5	0	0	0	0	0	112.6	L61 E63 C67 L68 L73	L61-A65 WeakPolarHBondContact O-CA 3.5Å; L61-A65 WeakPolarHBondContact O-CB 3.18Å; L61-A65 PolarHBondContact O-N 3.39Å; E63-A65 PolarHBondContact O-N 3.43Å; A65-C67 PolarHBondContact O-N 3.1Å; A65-L68 PolarHBondContact O-N 3.03Å; A65-L68 VanDerWaalsContact O-N 3.09Å; A65-L73 HydrophobicContact CB-CD1 4.11Å
66	E	41.5	Very low	44.7	Very low	143 Å²	143	62.1 Å²	62.1	67%	0.668	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-46.6	-31	169.9	-70.4	-172.4	173.9	0	0	111.9	N64	N64-E66 PolarHBondContact O-N 3.23Å
67	C	39.2	Very low	45.3	Very low	120 Å²	120	61.1 Å²	61.1	81%	0.811	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-100.6	-10.2	-177.7	-66.4	0	0	0	0	116.1	N64 A65	N64-C67 PolarHBondContact O-N 2.83Å; A65-C67 PolarHBondContact O-N 3.1Å
68	L	40.1	Very low	45.7	Very low	59 Å²	59	61.2 Å²	61.2	31%	0.309	33%	0.333	S	S	.	.	S	Bend	trans	-93.5	130.8	-172.5	-73.9	165.5	0	0	0	112.2	L61 A65 L73 K405	L61-L68 HydrophobicContact CD1-CD1 3.94Å; L61-L68 HydrophobicContact CD2-CD1 4.38Å; L61-L68 HydrophobicContact CG-CD1 3.66Å; A65-L68 PolarHBondContact O-N 3.03Å; A65-L68 VanDerWaalsContact O-N 3.09Å; L68-L73 HydrophobicContact CB-CB 4.5Å; L68-L73 HydrophobicContact CB-CD1 4.02Å; L68-L73 HydrophobicContact CD1-CD1 3.8Å; L68-K405 WeakPolarHBondContact O-CE 3.13Å; L68-K405 PolarHBondContact O-NZ 3.37Å
69	N	46.6	Very low	46.1	Very low	90 Å²	90	67 Å²	67	48%	0.481	36%	0.36	S	S	.	.			trans	-58.4	141.3	173.9	-163.3	-3.6	0	0	0	110.4	V71 S72 L73	N69-V71 PolarHBondContact O-N 3.41Å; N69-V71 VanDerWaalsContact O-N 3.13Å; N69-S72 PolarHBondContact O-N 3.12Å; N69-L73 PolarHBondContact O-N 3.38Å
70	S	47.4	Very low	46.6	Very low	49 Å²	49	67.9 Å²	67.9	34%	0.343	36%	0.364	S	S	.	.	H	α-helix	trans	-58.9	-33.3	-173.5	65.4	0	0	0	0	111.4	S74 K405	S70-S74 WeakPolarHBondContact O-CB 3.2Å; S70-S74 PolarHBondContact O-N 3.11Å; S70-S74 PolarHBondContact O-OG 3.16Å; S70-K405 VanDerWaalsContact N-NZ 3.12Å
71	V	47.9	Very low	47.3	Very low	76 Å²	76	65.4 Å²	65.4	46%	0.461	35%	0.351	S	S	.	.	H	α-helix	trans	-64.1	-48.4	174.4	-177.6	0	0	0	0	111.1	N69 S74 K75	N69-V71 PolarHBondContact O-N 3.41Å; N69-V71 VanDerWaalsContact O-N 3.13Å; V71-S74 WeakPolarHBondContact CA-OG 3.44Å; V71-S74 PolarHBondContact O-N 2.99Å; V71-S74 PolarHBondContact O-OG 3.09Å; V71-K75 WeakPolarHBondContact O-CG 3.46Å; V71-K75 PolarHBondContact O-N 3.47Å
72	S	48.7	Very low	47.8	Very low	55 Å²	55	66.6 Å²	66.6	39%	0.385	36%	0.362	S	S	.	.	H	α-helix	trans	-64.5	-44	179	-51.5	0	0	0	0	111.3	N69 S74 K75 V76	N69-S72 PolarHBondContact O-N 3.12Å; S72-S74 VanDerWaalsContact C-N 3.33Å; S72-S74 PolarHBondContact O-N 3.4Å; S72-K75 PolarHBondContact O-N 2.94Å; S72-V76 WeakPolarHBondContact O-CG2 3.31Å; S72-V76 PolarHBondContact O-N 2.92Å
73	L	50.7	Low	48.3	Very low	4 Å²	4	68.2 Å²	68.2	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-62.6	-42.1	175.5	-160.9	94	0	0	0	111.2	L61 A65 L68 N69 K75 V76 L77 F107	L61-L73 HydrophobicContact CD2-CD1 3.36Å; L61-L73 HydrophobicContact CD2-CG 4.21Å; L61-L73 HydrophobicContact CG-CD1 4.09Å; A65-L73 HydrophobicContact CB-CD1 4.11Å; L68-L73 HydrophobicContact CB-CB 4.5Å; L68-L73 HydrophobicContact CB-CD1 4.02Å; L68-L73 HydrophobicContact CD1-CD1 3.8Å; N69-L73 PolarHBondContact O-N 3.38Å; L73-K75 VanDerWaalsContact C-N 3.32Å; L73-K75 PolarHBondContact O-N 3.26Å; L73-V76 PolarHBondContact O-N 3.46Å; L73-L77 HydrophobicContact CD2-CD1 3.87Å; L73-L77 HydrophobicContact CG-CD1 4.1Å; L73-L77 HydrophobicContact CG-CG 4.4Å; L73-L77 VanDerWaalsContact O-CB 3.25Å; L73-L77 WeakPolarHBondContact O-CB 3.47Å; L73-L77 VanDerWaalsContact O-CG 3.23Å; L73-L77 WeakPolarHBondContact O-CG 3.47Å; L73-L77 PolarHBondContact O-N 2.93Å; L73-F107 VanDerWaalsContact CD2-CA 3.49Å; L73-F107 HydrophobicContact CD2-CB 3.15Å
74	S	50	Low	49.1	Very low	28 Å²	28	67.9 Å²	67.9	20%	0.196	37%	0.371	C	S	.	.	H	α-helix	trans	-62.5	-37.8	176.4	73.7	0	0	0	0	112.1	S70 V71 S72 Q78	S70-S74 WeakPolarHBondContact O-CB 3.2Å; S70-S74 PolarHBondContact O-N 3.11Å; S70-S74 PolarHBondContact O-OG 3.16Å; V71-S74 WeakPolarHBondContact CA-OG 3.44Å; V71-S74 PolarHBondContact O-N 2.99Å; V71-S74 PolarHBondContact O-OG 3.09Å; S72-S74 VanDerWaalsContact C-N 3.33Å; S72-S74 PolarHBondContact O-N 3.4Å; S74-Q78 WeakPolarHBondContact O-CA 3.5Å; S74-Q78 WeakPolarHBondContact O-CB 3.47Å; S74-Q78 PolarHBondContact O-N 2.96Å
75	K	51.5	Low	50.3	Low	129 Å²	129	64.2 Å²	64.2	56%	0.561	35%	0.352	S	S	*	.	H	α-helix	trans	-67.1	-43.7	174.7	-76.1	-178.5	178.3	-177.8	0	112.1	V71 S72 L73 Q78 E79	V71-K75 WeakPolarHBondContact O-CG 3.46Å; V71-K75 PolarHBondContact O-N 3.47Å; S72-K75 PolarHBondContact O-N 2.94Å; L73-K75 VanDerWaalsContact C-N 3.32Å; L73-K75 PolarHBondContact O-N 3.26Å; K75-Q78 WeakPolarHBondContact O-CB 3.43Å; K75-Q78 PolarHBondContact O-N 3.34Å; K75-E79 PolarHBondContact O-N 3.29Å
76	V	52.2	Low	51.6	Low	48 Å²	48	66.4 Å²	66.4	29%	0.291	37%	0.366	S	S	.	.	H	α-helix	trans	-67	-44.6	177.5	175.3	0	0	0	0	110.9	L61 S72 L73 Q78 E79 L80	L61-V76 HydrophobicContact CD1-CB 4.45Å; L61-V76 HydrophobicContact CD1-CG1 3.71Å; L61-V76 HydrophobicContact CD2-CG1 4.3Å; S72-V76 WeakPolarHBondContact O-CG2 3.31Å; S72-V76 PolarHBondContact O-N 2.92Å; L73-V76 PolarHBondContact O-N 3.46Å; V76-Q78 PolarHBondContact O-N 3.18Å; V76-E79 PolarHBondContact O-N 2.75Å; V76-L80 HydrophobicContact CG1-CD1 3.72Å; V76-L80 HydrophobicContact CG1-CG 4.26Å; V76-L80 WeakPolarHBondContact O-CB 3.36Å; V76-L80 VanDerWaalsContact O-CG 3.3Å; V76-L80 WeakPolarHBondContact O-CG 3.36Å; V76-L80 PolarHBondContact O-N 2.78Å
77	L	54.8	Low	53.1	Low	2 Å²	2	60.5 Å²	60.5	1%	0.01	34%	0.343	C	S	.	.	H	α-helix	trans	-59.3	-40	172	-74	172.2	0	0	0	110.8	F58 L73 L80 L81	F58-L77 HydrophobicContact CD2-CD2 4.14Å; F58-L77 HydrophobicContact CE2-CD2 3.39Å; F58-L77 HydrophobicContact CZ-CD2 4.26Å; L73-L77 HydrophobicContact CD2-CD1 3.87Å; L73-L77 HydrophobicContact CG-CD1 4.1Å; L73-L77 HydrophobicContact CG-CG 4.4Å; L73-L77 VanDerWaalsContact O-CB 3.25Å; L73-L77 WeakPolarHBondContact O-CB 3.47Å; L73-L77 VanDerWaalsContact O-CG 3.23Å; L73-L77 WeakPolarHBondContact O-CG 3.47Å; L73-L77 PolarHBondContact O-N 2.93Å; L77-L80 PolarHBondContact O-N 3.36Å; L77-L81 HydrophobicContact CB-CD1 4.27Å; L77-L81 HydrophobicContact CD2-CD1 4.03Å; L77-L81 WeakPolarHBondContact O-CB 3.45Å; L77-L81 WeakPolarHBondContact O-CG 3.42Å; L77-L81 PolarHBondContact O-N 2.91Å
78	Q	52.6	Low	54.6	Low	95 Å²	95	59.4 Å²	59.4	44%	0.444	33%	0.328	S	S	.	.	H	α-helix	trans	-62.8	-46.4	176.8	177.7	177	8.3	0	0	111.8	S74 K75 V76 S82 F114	S74-Q78 WeakPolarHBondContact O-CA 3.5Å; S74-Q78 WeakPolarHBondContact O-CB 3.47Å; S74-Q78 PolarHBondContact O-N 2.96Å; K75-Q78 WeakPolarHBondContact O-CB 3.43Å; K75-Q78 PolarHBondContact O-N 3.34Å; V76-Q78 PolarHBondContact O-N 3.18Å; Q78-S82 WeakPolarHBondContact O-CA 3.14Å; Q78-S82 WeakPolarHBondContact O-CB 3.21Å; Q78-S82 PolarHBondContact O-N 3.35Å; Q78-S82 PolarHBondContact O-OG 2.93Å; Q78-F114 HydrophobicContact CB-CD2 3.64Å; Q78-F114 HydrophobicContact CB-CE2 3.72Å; Q78-F114 HydrophobicContact CG-CD2 3.93Å; Q78-F114 HydrophobicContact CG-CE2 3.75Å
79	E	53.7	Low	56	Low	155 Å²	155	58.7 Å²	58.7	72%	0.724	33%	0.326	S	S	*	.	H	α-helix	trans	-65.2	-42.2	175.7	-74.6	-174	174.3	0	0	112.4	K75 V76 S82	K75-E79 PolarHBondContact O-N 3.29Å; V76-E79 PolarHBondContact O-N 2.75Å; E79-S82 PolarHBondContact O-OG 3.34Å
80	L	52.8	Low	57.5	Low	59 Å²	59	54.4 Å²	54.4	31%	0.309	30%	0.303	S	S	.	.	H	α-helix	trans	-71.3	-45	-178.4	-72.1	173.2	0	0	0	112.8	F58 V76 L77 S83	F58-L80 HydrophobicContact CD2-CD1 4.28Å; V76-L80 HydrophobicContact CG1-CD1 3.72Å; V76-L80 HydrophobicContact CG1-CG 4.26Å; V76-L80 WeakPolarHBondContact O-CB 3.36Å; V76-L80 VanDerWaalsContact O-CG 3.3Å; V76-L80 WeakPolarHBondContact O-CG 3.36Å; V76-L80 PolarHBondContact O-N 2.78Å; L77-L80 PolarHBondContact O-N 3.36Å; L80-S83 PolarHBondContact O-OG 2.85Å
81	L	55.4	Low	58.9	Low	11 Å²	11	53.7 Å²	53.7	6%	0.058	30%	0.3	C	S	.	.	H	α-helix	trans	-91.6	-19.6	-171.9	-62.2	173.6	0	0	0	113.5	L77 S83 H84 I85 V89 L93 F114	L77-L81 HydrophobicContact CB-CD1 4.27Å; L77-L81 HydrophobicContact CD2-CD1 4.03Å; L77-L81 WeakPolarHBondContact O-CB 3.45Å; L77-L81 WeakPolarHBondContact O-CG 3.42Å; L77-L81 PolarHBondContact O-N 2.91Å; L81-S83 PolarHBondContact O-N 2.95Å; L81-S83 VanDerWaalsContact O-N 3.12Å; L81-H84 PolarHBondContact O-N 2.92Å; L81-I85 PolarHBondContact O-N 3.19Å; L81-V89 HydrophobicContact CD2-CG1 3.62Å; L81-L93 HydrophobicContact CD1-CD1 4.5Å; L81-F114 HydrophobicContact CB-CD1 4.37Å; L81-F114 HydrophobicContact CB-CE1 3.28Å; L81-F114 HydrophobicContact CB-CZ 3.56Å; L81-F114 HydrophobicContact CD1-CD1 3.9Å; L81-F114 HydrophobicContact CD1-CE1 3.55Å; L81-F114 HydrophobicContact CG-CE1 4.03Å
82	S	55.3	Low	60.1	Low	59 Å²	59	53.6 Å²	53.6	41%	0.413	30%	0.303	S	S	.	.	S	Bend	trans	-56.2	-28.8	178.2	54.7	0	0	0	0	113	Q78 E79	Q78-S82 WeakPolarHBondContact O-CA 3.14Å; Q78-S82 WeakPolarHBondContact O-CB 3.21Å; Q78-S82 PolarHBondContact O-N 3.35Å; Q78-S82 PolarHBondContact O-OG 2.93Å; E79-S82 PolarHBondContact O-OG 3.34Å
83	S	53.7	Low	61.3	Low	47 Å²	47	51.2 Å²	51.2	33%	0.329	29%	0.286	S	S	.	.	S	Bend	trans	-87.4	-34.1	-179.6	57.6	0	0	0	0	114.1	L80 L81	L80-S83 PolarHBondContact O-OG 2.85Å; L81-S83 PolarHBondContact O-N 2.95Å; L81-S83 VanDerWaalsContact O-N 3.12Å
84	H	56.1	Low	62.7	Low	100 Å²	100	51.4 Å²	51.4	46%	0.463	29%	0.287	S	S	.	.			trans	-148.2	58.6	-167.7	-64.8	-59.8	0	0	0	114.2	L81 S86 Y127	L81-H84 PolarHBondContact O-N 2.92Å; H84-S86 PolarHBondContact O-N 2.99Å; H84-Y127 PolarHBondContact CE1-OH 3.36Å
85	I	66.1	Low	64.1	Low	18 Å²	18	56.9 Å²	56.9	9%	0.092	31%	0.305	C	S	.	.			trans	-70.6	107.7	170.5	-158.9	155.5	0	0	0	110.5	L81 V90 L115 I118 S377	L81-I85 PolarHBondContact O-N 3.19Å; I85-V90 HydrophobicContact CD1-CG2 3.76Å; I85-V90 HydrophobicContact CG1-CG2 3.57Å; I85-L115 HydrophobicContact CD1-CD2 3.24Å; I85-I118 HydrophobicContact CD1-CD1 3.53Å; I85-S377 PolarHBondContact O-OG 3.27Å
86	S	67.9	Low	65.1	Low	47 Å²	47	54.6 Å²	54.6	33%	0.329	29%	0.292	S	S	.	.			trans	-104.2	151.1	174.9	71.1	0	0	0	0	110.7	H84 N88 V89 V90	H84-S86 PolarHBondContact O-N 2.99Å; S86-N88 PolarHBondContact O-N 2.85Å; S86-V89 PolarHBondContact O-N 2.85Å; S86-V89 VanDerWaalsContact O-N 3.08Å; S86-V89 VanDerWaalsContact OG-CG2 3.29Å; S86-V89 WeakPolarHBondContact OG-CG2 3.33Å; S86-V89 PolarHBondContact OG-N 3.37Å; S86-V90 PolarHBondContact O-N 2.82Å; S86-V90 VanDerWaalsContact O-N 3.09Å
87	A	72	Confident	66.4	Low	20 Å²	20	52.3 Å²	52.3	17%	0.165	28%	0.279	C	S	.	.	H	α-helix	trans	-54.3	-35.8	174.5	0	0	0	0	0	111.6	V90 A91 L386	A87-V90 PolarHBondContact O-N 3.27Å; A87-A91 WeakPolarHBondContact O-CB 3.29Å; A87-A91 PolarHBondContact O-N 3.38Å; A87-L386 HydrophobicContact CB-CD2 4.14Å; A87-L386 HydrophobicContact CB-CG 4.16Å
88	N	71	Confident	67.8	Low	96 Å²	96	55.1 Å²	55.1	51%	0.513	29%	0.29	S	S	.	.	H	α-helix	trans	-67.1	-37.6	178.8	-67	-10.5	0	0	0	113	S86 S92	S86-N88 PolarHBondContact O-N 2.85Å; N88-S92 WeakPolarHBondContact O-CB 3.34Å; N88-S92 PolarHBondContact O-N 3.26Å; N88-S92 PolarHBondContact O-OG 3.03Å
89	V	69.7	Low	69.1	Low	44 Å²	44	56.3 Å²	56.3	27%	0.267	30%	0.295	S	S	.	.	H	α-helix	trans	-70.3	-46	177.4	172.5	0	0	0	0	110.2	L81 S86 A91 S92 L93	L81-V89 HydrophobicContact CD2-CG1 3.62Å; S86-V89 PolarHBondContact O-N 2.85Å; S86-V89 VanDerWaalsContact O-N 3.08Å; S86-V89 VanDerWaalsContact OG-CG2 3.29Å; S86-V89 WeakPolarHBondContact OG-CG2 3.33Å; S86-V89 PolarHBondContact OG-N 3.37Å; V89-A91 VanDerWaalsContact C-N 3.32Å; V89-A91 PolarHBondContact O-N 2.98Å; V89-S92 PolarHBondContact O-N 3.43Å; V89-L93 HydrophobicContact CG1-CD1 4.15Å; V89-L93 PolarHBondContact O-N 2.9Å
90	V	76.9	Confident	70	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-59.8	-44.3	174.9	175	0	0	0	0	110.5	I85 S86 A87 S92 L93 L94 F111 F383 L386	I85-V90 HydrophobicContact CD1-CG2 3.76Å; I85-V90 HydrophobicContact CG1-CG2 3.57Å; S86-V90 PolarHBondContact O-N 2.82Å; S86-V90 VanDerWaalsContact O-N 3.09Å; A87-V90 PolarHBondContact O-N 3.27Å; V90-S92 VanDerWaalsContact C-N 3.33Å; V90-S92 PolarHBondContact O-N 3.23Å; V90-L93 PolarHBondContact O-N 3.41Å; V90-L94 HydrophobicContact CG1-CD1 3.82Å; V90-L94 HydrophobicContact CG1-CG 4.28Å; V90-L94 WeakPolarHBondContact O-CB 3.49Å; V90-L94 VanDerWaalsContact O-CG 3.29Å; V90-L94 WeakPolarHBondContact O-CG 3.47Å; V90-L94 PolarHBondContact O-N 3.35Å; V90-F111 HydrophobicContact CG1-CZ 4.3Å; V90-F383 HydrophobicContact CG1-CE2 4.22Å; V90-F383 HydrophobicContact CG1-CZ 4Å; V90-L386 HydrophobicContact CB-CD1 4Å; V90-L386 HydrophobicContact CG1-CD1 3.69Å
91	A	77.7	Confident	70.8	Confident	34 Å²	34	52.1 Å²	52.1	28%	0.281	29%	0.288	S	S	.	.	H	α-helix	trans	-59.9	-42.8	175.6	0	0	0	0	0	112	A87 V89 Y95 L386	A87-A91 WeakPolarHBondContact O-CB 3.29Å; A87-A91 PolarHBondContact O-N 3.38Å; V89-A91 VanDerWaalsContact C-N 3.32Å; V89-A91 PolarHBondContact O-N 2.98Å; A91-Y95 WeakPolarHBondContact O-CB 3.38Å; A91-Y95 PolarHBondContact O-N 3.35Å; A91-L386 HydrophobicContact CB-CD1 4.44Å; A91-L386 HydrophobicContact CB-CD2 3.67Å
92	S	72.3	Confident	71.7	Confident	74 Å²	74	56.7 Å²	56.7	52%	0.517	31%	0.313	S	S	.	.	H	α-helix	trans	-67.1	-40.4	-179.2	-60.3	0	0	0	0	111.8	N88 V89 V90 Y95 R96	N88-S92 WeakPolarHBondContact O-CB 3.34Å; N88-S92 PolarHBondContact O-N 3.26Å; N88-S92 PolarHBondContact O-OG 3.03Å; V89-S92 PolarHBondContact O-N 3.43Å; V90-S92 VanDerWaalsContact C-N 3.33Å; V90-S92 PolarHBondContact O-N 3.23Å; S92-Y95 PolarHBondContact O-N 2.91Å; S92-R96 PolarHBondContact O-N 2.97Å
93	L	74	Confident	72.7	Confident	5 Å²	5	56.7 Å²	56.7	3%	0.026	31%	0.307	C	S	.	.	H	α-helix	trans	-68.9	-45.2	176.3	-73.4	170.6	0	0	0	111.6	F58 L81 V89 V90 Y95 R96 I97 F107 F111	F58-L93 HydrophobicContact CE1-CD2 3.99Å; F58-L93 HydrophobicContact CZ-CD1 3.93Å; F58-L93 HydrophobicContact CZ-CD2 3.51Å; F58-L93 HydrophobicContact CZ-CG 3.96Å; L81-L93 HydrophobicContact CD1-CD1 4.5Å; V89-L93 HydrophobicContact CG1-CD1 4.15Å; V89-L93 PolarHBondContact O-N 2.9Å; V90-L93 PolarHBondContact O-N 3.41Å; L93-Y95 VanDerWaalsContact C-N 3.3Å; L93-Y95 PolarHBondContact O-N 3.45Å; L93-R96 PolarHBondContact O-N 2.95Å; L93-I97 WeakPolarHBondContact O-CG1 3.4Å; L93-I97 PolarHBondContact O-N 2.95Å; L93-F107 HydrophobicContact CB-CE2 4.44Å; L93-F107 HydrophobicContact CD2-CD2 4.26Å; L93-F107 HydrophobicContact CD2-CE2 3.8Å; L93-F107 HydrophobicContact CD2-CZ 4.27Å; L93-F111 HydrophobicContact CB-CE1 4.35Å; L93-F111 HydrophobicContact CB-CE2 4.06Å; L93-F111 HydrophobicContact CB-CZ 3.93Å; L93-F111 HydrophobicContact CD1-CD2 3.6Å; L93-F111 HydrophobicContact CD1-CE2 3.31Å; L93-F111 HydrophobicContact CD1-CZ 4.03Å; L93-F111 HydrophobicContact CG-CE2 4.34Å
94	L	81.1	Confident	73.9	Confident	9 Å²	9	54.5 Å²	54.5	5%	0.047	29%	0.292	C	S	.	.	H	α-helix	trans	-60.8	-41.8	173.5	-73.6	175.1	0	0	0	111	V90 R96 I97 Y98 F111 F112 F383	V90-L94 HydrophobicContact CG1-CD1 3.82Å; V90-L94 HydrophobicContact CG1-CG 4.28Å; V90-L94 WeakPolarHBondContact O-CB 3.49Å; V90-L94 VanDerWaalsContact O-CG 3.29Å; V90-L94 WeakPolarHBondContact O-CG 3.47Å; V90-L94 PolarHBondContact O-N 3.35Å; L94-R96 VanDerWaalsContact C-N 3.3Å; L94-R96 PolarHBondContact O-N 3.13Å; L94-I97 CarbonylContact O-C 3.56Å; L94-I97 WeakPolarHBondContact O-CB 3.14Å; L94-I97 PolarHBondContact O-N 3.4Å; L94-Y98 HydrophobicContact CB-CD2 4.34Å; L94-Y98 HydrophobicContact CB-CE2 4.43Å; L94-Y98 WeakPolarHBondContact O-CB 3.36Å; L94-Y98 WeakPolarHBondContact O-CD2 3.45Å; L94-Y98 PolarHBondContact O-N 3.4Å; L94-F111 HydrophobicContact CD2-CE1 4.13Å; L94-F111 HydrophobicContact CG-CE1 4.41Å; L94-F112 HydrophobicContact CD2-CE1 4.23Å; L94-F112 HydrophobicContact CD2-CZ 4.01Å; L94-F383 HydrophobicContact CD1-CE1 3.93Å; L94-F383 HydrophobicContact CD1-CZ 4.32Å
95	Y	79.1	Confident	74.6	Confident	142 Å²	142	50.2 Å²	50.2	56%	0.557	27%	0.273	S	S	*	.	H	α-helix	trans	-59.2	-42.6	176	-178.6	-105.4	0	0	0	111.4	A91 S92 L93 Y98 Q99	A91-Y95 WeakPolarHBondContact O-CB 3.38Å; A91-Y95 PolarHBondContact O-N 3.35Å; S92-Y95 PolarHBondContact O-N 2.91Å; L93-Y95 VanDerWaalsContact C-N 3.3Å; L93-Y95 PolarHBondContact O-N 3.45Å; Y95-Y98 CarbonylContact O-C 3.43Å; Y95-Y98 PolarHBondContact O-N 3.16Å; Y95-Y98 VanDerWaalsContact O-N 3.13Å; Y95-Q99 HydrophobicContact CD1-CG 4.15Å; Y95-Q99 HydrophobicContact CD2-CG 4.5Å; Y95-Q99 HydrophobicContact CE1-CG 3.85Å; Y95-Q99 HydrophobicContact CE2-CG 4.21Å; Y95-Q99 HydrophobicContact CG-CG 4.49Å; Y95-Q99 VanDerWaalsContact CZ-CD 3.46Å; Y95-Q99 WeakPolarHBondContact O-CB 3.36Å; Y95-Q99 WeakPolarHBondContact O-CG 3.4Å; Y95-Q99 PolarHBondContact O-N 3.48Å; Y95-Q99 PolarHBondContact OH-NE2 3.37Å
96	R	73.4	Confident	74.7	Confident	81 Å²	81	49.9 Å²	49.9	31%	0.306	27%	0.272	S	S	.	.	H	α-helix	trans	-65	-39.8	175.6	-171.4	179.1	-75.9	-153.8	0.3	112.3	C62 S92 L93 L94 Y98 Q99 S100 F107	C62-R96 PolarHBondContact O-NH1 2.99Å; S92-R96 PolarHBondContact O-N 2.97Å; L93-R96 PolarHBondContact O-N 2.95Å; L94-R96 VanDerWaalsContact C-N 3.3Å; L94-R96 PolarHBondContact O-N 3.13Å; R96-Y98 VanDerWaalsContact C-N 3.28Å; R96-Y98 PolarHBondContact O-N 3.31Å; R96-Q99 PolarHBondContact O-N 3.26Å; R96-S100 PolarHBondContact O-N 3.25Å; R96-F107 HydrophobicContact CB-CZ 4.12Å; R96-F107 HydrophobicContact CG-CE1 4.1Å; R96-F107 HydrophobicContact CG-CZ 4.02Å
97	I	79.8	Confident	74.7	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-38.3	171.6	-65.1	166.7	0	0	0	110.5	L93 L94 S100 W104 P105 F107 F111 F112 L395 R398	L93-I97 WeakPolarHBondContact O-CG1 3.4Å; L93-I97 PolarHBondContact O-N 2.95Å; L94-I97 CarbonylContact O-C 3.56Å; L94-I97 WeakPolarHBondContact O-CB 3.14Å; L94-I97 PolarHBondContact O-N 3.4Å; I97-S100 PolarHBondContact O-OG 3.48Å; I97-S100 VanDerWaalsContact O-OG 3.08Å; I97-W104 HydrophobicContact CG2-CE3 4.1Å; I97-W104 HydrophobicContact CG2-CH2 4.4Å; I97-W104 HydrophobicContact CG2-CZ3 3.63Å; I97-P105 HydrophobicContact CG1-CG 4.39Å; I97-F107 HydrophobicContact CD1-CE2 4.02Å; I97-F107 HydrophobicContact CG1-CE2 3.85Å; I97-F107 HydrophobicContact CG1-CZ 3.9Å; I97-F111 HydrophobicContact CD1-CD1 3.99Å; I97-F111 HydrophobicContact CD1-CE1 4.31Å; I97-F112 HydrophobicContact CD1-CE2 3.94Å; I97-F112 HydrophobicContact CD1-CZ 4.13Å; I97-L395 HydrophobicContact CG2-CD2 3.84Å; I97-R398 PolarHBondContact O-NH1 3.08Å
98	Y	83.9	Confident	74.8	Confident	61 Å²	61	47 Å²	47	24%	0.239	25%	0.25	C	S	.	.	H	α-helix	trans	-73	-31.5	-179.8	-82.3	-57	0	0	0	113.8	L94 Y95 R96 L391 P394 L395 R398	L94-Y98 HydrophobicContact CB-CD2 4.34Å; L94-Y98 HydrophobicContact CB-CE2 4.43Å; L94-Y98 WeakPolarHBondContact O-CB 3.36Å; L94-Y98 WeakPolarHBondContact O-CD2 3.45Å; L94-Y98 PolarHBondContact O-N 3.4Å; Y95-Y98 CarbonylContact O-C 3.43Å; Y95-Y98 PolarHBondContact O-N 3.16Å; Y95-Y98 VanDerWaalsContact O-N 3.13Å; R96-Y98 VanDerWaalsContact C-N 3.28Å; R96-Y98 PolarHBondContact O-N 3.31Å; Y98-L391 PolarHBondContact OH-O 3.31Å; Y98-P394 HydrophobicContact CE1-CB 3.9Å; Y98-L395 HydrophobicContact CE1-CD2 3.73Å; Y98-L395 HydrophobicContact CE1-CG 4.42Å; Y98-L395 HydrophobicContact CE2-CD2 4.36Å; Y98-L395 WeakPolarHBondContact OH-CG 3.4Å; Y98-R398 PolarHBondContact O-NH1 3.42Å; Y98-R398 VanDerWaalsContact O-NH1 3.15Å; Y98-R398 PolarHBondContact O-NH2 3.32Å
99	Q	80.1	Confident	74.9	Confident	119 Å²	119	43.1 Å²	43.1	56%	0.556	23%	0.231	S	C	*	.	H	α-helix	trans	-78.9	-22.9	178	-79.2	-163.1	-34.3	0	0	114.7	Y95 R96 S101	Y95-Q99 HydrophobicContact CD1-CG 4.15Å; Y95-Q99 HydrophobicContact CD2-CG 4.5Å; Y95-Q99 HydrophobicContact CE1-CG 3.85Å; Y95-Q99 HydrophobicContact CE2-CG 4.21Å; Y95-Q99 HydrophobicContact CG-CG 4.49Å; Y95-Q99 VanDerWaalsContact CZ-CD 3.46Å; Y95-Q99 WeakPolarHBondContact O-CB 3.36Å; Y95-Q99 WeakPolarHBondContact O-CG 3.4Å; Y95-Q99 PolarHBondContact O-N 3.48Å; Y95-Q99 PolarHBondContact OH-NE2 3.37Å; R96-Q99 PolarHBondContact O-N 3.26Å; Q99-S101 PolarHBondContact O-N 3.11Å
100	S	70.9	Confident	74.6	Confident	30 Å²	30	41.3 Å²	41.3	21%	0.21	22%	0.222	C	C	.	.			trans	-63.9	129.7	178.9	66.2	0	0	0	0	110	R96 I97 I103 P105 W401	R96-S100 PolarHBondContact O-N 3.25Å; I97-S100 PolarHBondContact O-OG 3.48Å; I97-S100 VanDerWaalsContact O-OG 3.08Å; S100-I103 VanDerWaalsContact CB-O 3.29Å; S100-I103 WeakPolarHBondContact CB-O 3.28Å; S100-I103 PolarHBondContact OG-O 2.93Å; S100-P105 WeakPolarHBondContact OG-CD 3.24Å; S100-W401 VanDerWaalsContact O-CH2 3.23Å; S100-W401 WeakPolarHBondContact O-CH2 3.37Å; S100-W401 WeakPolarHBondContact O-CZ3 3.29Å
101	S	69.8	Low	74.5	Confident	97 Å²	97	41.4 Å²	41.4	68%	0.678	22%	0.222	S	C	*	.	S	Bend	trans	-89.2	115.8	175.7	52.9	0	0	0	0	109.1	Q99 I103	Q99-S101 PolarHBondContact O-N 3.11Å; S101-I103 PolarHBondContact O-N 3.11Å
102	D	74.3	Confident	74.7	Confident	107 Å²	107	39.9 Å²	39.9	57%	0.572	21%	0.209	S	C	*	.	S	Bend	trans	60	8.7	168.8	-54.7	-32.3	0	0	0	117.5	W401 P402	D102-W401 VanDerWaalsContact CA-CE2 3.47Å; D102-W401 WeakPolarHBondContact OD1-CZ2 3.32Å; D102-P402 WeakPolarHBondContact O-CD 3.49Å
103	I	77.9	Confident	74.8	Confident	58 Å²	58	39 Å²	39	30%	0.297	20%	0.203	S	C	.	.	S	Bend	trans	-136.3	134.6	179.1	-57	176.8	0	0	0	109.1	S100 S101 P105 P402 E404 V407	S100-I103 VanDerWaalsContact CB-O 3.29Å; S100-I103 WeakPolarHBondContact CB-O 3.28Å; S100-I103 PolarHBondContact OG-O 2.93Å; S101-I103 PolarHBondContact O-N 3.11Å; I103-P105 WeakPolarHBondContact O-CD 3.29Å; I103-P402 WeakPolarHBondContact CA-O 3.34Å; I103-P402 HydrophobicContact CG1-CG 4.48Å; I103-P402 WeakPolarHBondContact CG2-O 3.31Å; I103-E404 VanDerWaalsContact CG2-CA 3.5Å; I103-E404 HydrophobicContact CG2-CB 3.8Å; I103-E404 HydrophobicContact CG2-CG 4.46Å; I103-V407 HydrophobicContact CD1-CG2 4.47Å
104	W	78.5	Confident	74.6	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.008	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-74.3	123.5	169.4	-81.8	97.8	0	0	0	110.3	I97 S106 F112 L395 R398 W401 P402 E404 I435 L439	I97-W104 HydrophobicContact CG2-CE3 4.1Å; I97-W104 HydrophobicContact CG2-CH2 4.4Å; I97-W104 HydrophobicContact CG2-CZ3 3.63Å; W104-S106 PolarHBondContact O-N 2.82Å; W104-F112 HydrophobicContact CZ3-CE2 4.17Å; W104-L395 HydrophobicContact CH2-CB 4.15Å; W104-L395 HydrophobicContact CH2-CD2 4.06Å; W104-L395 HydrophobicContact CZ3-CD2 4.49Å; W104-R398 HydrophobicContact CZ2-CB 4.14Å; W104-R398 PolarHBondContact NE1-O 3.47Å; W104-W401 VanDerWaalsContact CD1-CB 3.45Å; W104-W401 HydrophobicContact CG-CB 4.46Å; W104-P402 PolarHBondContact N-O 2.67Å; W104-E404 WeakPolarHBondContact O-CB 3.48Å; W104-E404 PolarHBondContact O-N 3.48Å; W104-I435 HydrophobicContact CB-CD1 3.99Å; W104-I435 HydrophobicContact CD2-CD1 3.69Å; W104-I435 HydrophobicContact CD2-CG2 4.44Å; W104-I435 HydrophobicContact CE3-CD1 4.48Å; W104-I435 HydrophobicContact CG-CD1 3.41Å; W104-I435 VanDerWaalsContact CG-CD1 3.41Å; W104-I435 HydrophobicContact CH2-CG2 4.05Å; W104-I435 HydrophobicContact CZ2-CG2 3.68Å; W104-L439 HydrophobicContact CH2-CD1 4.26Å; W104-L439 HydrophobicContact CZ2-CD1 4.48Å
105	P	71.1	Confident	74.3	Confident	10 Å²	10	38.8 Å²	38.8	7%	0.065	20%	0.202	C	C	.	.			trans	-57.3	140.1	174.1	-22.8	33.4	0	0	0	110.5	I97 S100 I103 F107 S108	I97-P105 HydrophobicContact CG1-CG 4.39Å; S100-P105 WeakPolarHBondContact OG-CD 3.24Å; I103-P105 WeakPolarHBondContact O-CD 3.29Å; P105-F107 HydrophobicContact CB-CD1 3.57Å; P105-F107 HydrophobicContact CB-CE1 3.26Å; P105-F107 HydrophobicContact CB-CG 4.41Å; P105-F107 HydrophobicContact CB-CZ 3.9Å; P105-F107 HydrophobicContact CG-CE1 4.01Å; P105-F107 HydrophobicContact CG-CZ 4.26Å; P105-F107 PolarHBondContact O-N 2.91Å; P105-S108 VanDerWaalsContact O-CB 3.27Å; P105-S108 WeakPolarHBondContact O-CB 3.35Å; P105-S108 PolarHBondContact O-N 3.21Å; P105-S108 PolarHBondContact O-OG 2.84Å
106	S	66.3	Low	74.3	Confident	11 Å²	11	34 Å²	34	8%	0.077	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-27.7	-177.8	51.5	0	0	0	0	114.6	W104 E404	W104-S106 PolarHBondContact O-N 2.82Å; S106-E404 WeakPolarHBondContact CB-OE2 3.47Å; S106-E404 PolarHBondContact N-OE2 3.38Å; S106-E404 PolarHBondContact OG-OE2 3.04Å; S106-E404 VanDerWaalsContact OG-OE2 3.05Å
107	F	68	Low	74.1	Confident	5 Å²	5	33.1 Å²	33.1	2%	0.022	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-17	179.2	70.9	-95.6	0	0	0	115	L73 L93 R96 I97 P105 A109 G110 F111	L73-F107 VanDerWaalsContact CD2-CA 3.49Å; L73-F107 HydrophobicContact CD2-CB 3.15Å; L93-F107 HydrophobicContact CB-CE2 4.44Å; L93-F107 HydrophobicContact CD2-CD2 4.26Å; L93-F107 HydrophobicContact CD2-CE2 3.8Å; L93-F107 HydrophobicContact CD2-CZ 4.27Å; R96-F107 HydrophobicContact CB-CZ 4.12Å; R96-F107 HydrophobicContact CG-CE1 4.1Å; R96-F107 HydrophobicContact CG-CZ 4.02Å; I97-F107 HydrophobicContact CD1-CE2 4.02Å; I97-F107 HydrophobicContact CG1-CE2 3.85Å; I97-F107 HydrophobicContact CG1-CZ 3.9Å; P105-F107 HydrophobicContact CB-CD1 3.57Å; P105-F107 HydrophobicContact CB-CE1 3.26Å; P105-F107 HydrophobicContact CB-CG 4.41Å; P105-F107 HydrophobicContact CB-CZ 3.9Å; P105-F107 HydrophobicContact CG-CE1 4.01Å; P105-F107 HydrophobicContact CG-CZ 4.26Å; P105-F107 PolarHBondContact O-N 2.91Å; F107-A109 PolarHBondContact O-N 3.41Å; F107-G110 PolarHBondContact O-N 3.46Å; F107-F111 HydrophobicContact CD2-CB 4.21Å; F107-F111 WeakPolarHBondContact O-CB 3.32Å; F107-F111 PolarHBondContact O-N 3.26Å
108	S	75.3	Confident	73.5	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.014	19%	0.194	C	C	.	.	H	α-helix	trans	-58.4	-50.2	-168.1	55.4	0	0	0	0	114	P105 G110 F111 F112	P105-S108 VanDerWaalsContact O-CB 3.27Å; P105-S108 WeakPolarHBondContact O-CB 3.35Å; P105-S108 PolarHBondContact O-N 3.21Å; P105-S108 PolarHBondContact O-OG 2.84Å; S108-G110 VanDerWaalsContact C-N 3.35Å; S108-G110 PolarHBondContact O-N 2.97Å; S108-F111 WeakPolarHBondContact O-CB 3.36Å; S108-F111 PolarHBondContact O-N 3.47Å; S108-F112 VanDerWaalsContact O-CD2 3.23Å; S108-F112 WeakPolarHBondContact O-CD2 3.5Å; S108-F112 PolarHBondContact O-N 2.68Å; S108-F112 VanDerWaalsContact O-N 3.07Å
109	A	72.1	Confident	72.6	Confident	13 Å²	13	32.3 Å²	32.3	11%	0.107	19%	0.188	C	C	.	.	H	α-helix	trans	-61	-43.4	178.6	0	0	0	0	0	112	F107 F111 S113 P433 I438	F107-A109 PolarHBondContact O-N 3.41Å; A109-F111 VanDerWaalsContact C-N 3.34Å; A109-S113 VanDerWaalsContact O-CB 3.29Å; A109-S113 WeakPolarHBondContact O-CB 3.47Å; A109-S113 PolarHBondContact O-N 3.22Å; A109-S113 VanDerWaalsContact O-N 3.08Å; A109-P433 HydrophobicContact CB-CB 3.63Å; A109-P433 HydrophobicContact CB-CG 4.48Å; A109-I438 HydrophobicContact CB-CD1 3.81Å
110	G	65.3	Low	71.6	Confident	7 Å²	7	32.5 Å²	32.5	7%	0.072	19%	0.188	C	C	.	.	H	α-helix	trans	-64.9	-38.5	176.1	0	0	0	0	0	112.3	F107 S108 F114	F107-G110 PolarHBondContact O-N 3.46Å; S108-G110 VanDerWaalsContact C-N 3.35Å; S108-G110 PolarHBondContact O-N 2.97Å; G110-F114 WeakPolarHBondContact O-CB 3.48Å; G110-F114 PolarHBondContact O-N 3.2Å
111	F	74.4	Confident	71	Confident	1 Å²	1	33 Å²	33	0%	0.004	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-52.8	177.3	171.5	-113.9	0	0	0	112.3	V90 L93 L94 I97 F107 S108 A109 F114 L115	V90-F111 HydrophobicContact CG1-CZ 4.3Å; L93-F111 HydrophobicContact CB-CE1 4.35Å; L93-F111 HydrophobicContact CB-CE2 4.06Å; L93-F111 HydrophobicContact CB-CZ 3.93Å; L93-F111 HydrophobicContact CD1-CD2 3.6Å; L93-F111 HydrophobicContact CD1-CE2 3.31Å; L93-F111 HydrophobicContact CD1-CZ 4.03Å; L93-F111 HydrophobicContact CG-CE2 4.34Å; L94-F111 HydrophobicContact CD2-CE1 4.13Å; L94-F111 HydrophobicContact CG-CE1 4.41Å; I97-F111 HydrophobicContact CD1-CD1 3.99Å; I97-F111 HydrophobicContact CD1-CE1 4.31Å; F107-F111 HydrophobicContact CD2-CB 4.21Å; F107-F111 WeakPolarHBondContact O-CB 3.32Å; F107-F111 PolarHBondContact O-N 3.26Å; S108-F111 WeakPolarHBondContact O-CB 3.36Å; S108-F111 PolarHBondContact O-N 3.47Å; A109-F111 VanDerWaalsContact C-N 3.34Å; F111-F114 PolarHBondContact O-N 2.98Å; F111-L115 HydrophobicContact CD1-CD1 4.21Å; F111-L115 HydrophobicContact CD2-CD1 4.4Å; F111-L115 HydrophobicContact CD2-CG 4.22Å; F111-L115 HydrophobicContact CE1-CD1 3.63Å; F111-L115 HydrophobicContact CE1-CG 4.45Å; F111-L115 HydrophobicContact CE2-CD1 3.83Å; F111-L115 HydrophobicContact CE2-CD2 4.02Å; F111-L115 HydrophobicContact CE2-CG 3.89Å; F111-L115 HydrophobicContact CZ-CD1 3.44Å; F111-L115 VanDerWaalsContact CZ-CD1 3.44Å; F111-L115 HydrophobicContact CZ-CD2 4.35Å; F111-L115 HydrophobicContact CZ-CG 4.05Å; F111-L115 WeakPolarHBondContact O-CG 3.5Å; F111-L115 PolarHBondContact O-N 3.2Å
112	F	81.4	Confident	70.5	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.009	19%	0.192	C	C	.	.	H	α-helix	trans	-67.3	-38.4	179.6	-71.4	-66.7	0	0	0	112.8	L94 I97 W104 S108 F114 L115 H116 L392 L395 I438 L439 F442	L94-F112 HydrophobicContact CD2-CE1 4.23Å; L94-F112 HydrophobicContact CD2-CZ 4.01Å; I97-F112 HydrophobicContact CD1-CE2 3.94Å; I97-F112 HydrophobicContact CD1-CZ 4.13Å; W104-F112 HydrophobicContact CZ3-CE2 4.17Å; S108-F112 VanDerWaalsContact O-CD2 3.23Å; S108-F112 WeakPolarHBondContact O-CD2 3.5Å; S108-F112 PolarHBondContact O-N 2.68Å; S108-F112 VanDerWaalsContact O-N 3.07Å; F112-F114 VanDerWaalsContact C-N 3.33Å; F112-F114 PolarHBondContact O-N 3.48Å; F112-L115 HydrophobicContact CD1-CD1 4.33Å; F112-L115 PolarHBondContact O-N 3.18Å; F112-H116 PolarHBondContact O-N 3.41Å; F112-L392 HydrophobicContact CE1-CD2 4.17Å; F112-L395 HydrophobicContact CE1-CD1 4.03Å; F112-L395 HydrophobicContact CE2-CD1 4.2Å; F112-L395 HydrophobicContact CZ-CD1 3.43Å; F112-L395 VanDerWaalsContact CZ-CD1 3.43Å; F112-I438 HydrophobicContact CB-CG2 3.61Å; F112-L439 HydrophobicContact CD1-CD2 4.16Å; F112-L439 HydrophobicContact CD2-CD2 3.8Å; F112-L439 HydrophobicContact CE1-CD2 4.16Å; F112-L439 HydrophobicContact CE2-CD2 3.8Å; F112-L439 HydrophobicContact CG-CD2 4Å; F112-L439 HydrophobicContact CZ-CD2 4Å; F112-F442 AromaticContact CD1-CD1 3.75Å; F112-F442 HydrophobicContact CD1-CD1 3.75Å; F112-F442 AromaticContact CD1-CE1 3.98Å; F112-F442 HydrophobicContact CD1-CE1 3.98Å; F112-F442 HydrophobicContact CD1-CG 4.29Å; F112-F442 HydrophobicContact CE1-CD1 4.31Å; F112-F442 HydrophobicContact CE1-CE1 4.28Å
113	S	74.4	Confident	70.2	Confident	57 Å²	57	30 Å²	30	40%	0.399	18%	0.179	S	C	.	.	H	α-helix	trans	-59.6	-46.2	173.3	-175.1	0	0	0	0	111	A109 H116 T117	A109-S113 VanDerWaalsContact O-CB 3.29Å; A109-S113 WeakPolarHBondContact O-CB 3.47Å; A109-S113 PolarHBondContact O-N 3.22Å; A109-S113 VanDerWaalsContact O-N 3.08Å; S113-H116 WeakPolarHBondContact O-CB 3.25Å; S113-H116 PolarHBondContact O-N 3.29Å; S113-T117 WeakPolarHBondContact O-CG2 3.46Å; S113-T117 PolarHBondContact O-N 3.39Å; S113-T117 VanDerWaalsContact O-N 3.15Å
114	F	70.4	Confident	70	Confident	8 Å²	8	27.2 Å²	27.2	4%	0.035	17%	0.165	C	C	.	.	H	α-helix	trans	-60.9	-50.2	175.7	169.3	-111.3	0	0	0	111.7	Q78 L81 G110 F111 F112 H116 T117 I118	Q78-F114 HydrophobicContact CB-CD2 3.64Å; Q78-F114 HydrophobicContact CB-CE2 3.72Å; Q78-F114 HydrophobicContact CG-CD2 3.93Å; Q78-F114 HydrophobicContact CG-CE2 3.75Å; L81-F114 HydrophobicContact CB-CD1 4.37Å; L81-F114 HydrophobicContact CB-CE1 3.28Å; L81-F114 HydrophobicContact CB-CZ 3.56Å; L81-F114 HydrophobicContact CD1-CD1 3.9Å; L81-F114 HydrophobicContact CD1-CE1 3.55Å; L81-F114 HydrophobicContact CG-CE1 4.03Å; G110-F114 WeakPolarHBondContact O-CB 3.48Å; G110-F114 PolarHBondContact O-N 3.2Å; F111-F114 PolarHBondContact O-N 2.98Å; F112-F114 VanDerWaalsContact C-N 3.33Å; F112-F114 PolarHBondContact O-N 3.48Å; F114-H116 PolarHBondContact O-N 2.9Å; F114-H116 VanDerWaalsContact O-N 3.15Å; F114-T117 WeakPolarHBondContact O-CA 3.29Å; F114-T117 PolarHBondContact O-N 2.64Å; F114-T117 PolarHBondContact O-OG1 3.49Å; F114-I118 HydrophobicContact CD1-CD1 3.84Å; F114-I118 HydrophobicContact CD1-CG1 4.22Å; F114-I118 HydrophobicContact CD2-CG1 4.05Å; F114-I118 HydrophobicContact CE1-CD1 3.21Å; F114-I118 HydrophobicContact CE1-CG1 3.67Å; F114-I118 HydrophobicContact CE2-CD1 4Å; F114-I118 HydrophobicContact CE2-CG1 3.44Å; F114-I118 VanDerWaalsContact CE2-CG1 3.44Å; F114-I118 HydrophobicContact CG-CD1 4.47Å; F114-I118 HydrophobicContact CG-CG1 4.4Å; F114-I118 HydrophobicContact CZ-CD1 3.33Å; F114-I118 HydrophobicContact CZ-CG1 3.26Å; F114-I118 WeakPolarHBondContact O-CG1 3.3Å; F114-I118 PolarHBondContact O-N 3.45Å
115	L	75	Confident	69.8	Low	0 Å²	0	29 Å²	29	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-54.9	-34.4	177	-72.6	-175.4	0	0	0	113	I85 F111 F112 I118 P119 V379 F383 F442	I85-L115 HydrophobicContact CD1-CD2 3.24Å; F111-L115 HydrophobicContact CD1-CD1 4.21Å; F111-L115 HydrophobicContact CD2-CD1 4.4Å; F111-L115 HydrophobicContact CD2-CG 4.22Å; F111-L115 HydrophobicContact CE1-CD1 3.63Å; F111-L115 HydrophobicContact CE1-CG 4.45Å; F111-L115 HydrophobicContact CE2-CD1 3.83Å; F111-L115 HydrophobicContact CE2-CD2 4.02Å; F111-L115 HydrophobicContact CE2-CG 3.89Å; F111-L115 HydrophobicContact CZ-CD1 3.44Å; F111-L115 VanDerWaalsContact CZ-CD1 3.44Å; F111-L115 HydrophobicContact CZ-CD2 4.35Å; F111-L115 HydrophobicContact CZ-CG 4.05Å; F111-L115 WeakPolarHBondContact O-CG 3.5Å; F111-L115 PolarHBondContact O-N 3.2Å; F112-L115 HydrophobicContact CD1-CD1 4.33Å; F112-L115 PolarHBondContact O-N 3.18Å; L115-I118 HydrophobicContact CD2-CD1 3.9Å; L115-P119 WeakPolarHBondContact O-CD 3.42Å; L115-V379 HydrophobicContact CD2-CG1 4.39Å; L115-F383 HydrophobicContact CD1-CE2 4.04Å; L115-F383 HydrophobicContact CD1-CZ 4.03Å; L115-F442 HydrophobicContact CB-CD2 4.1Å; L115-F442 HydrophobicContact CB-CE2 3.49Å; L115-F442 VanDerWaalsContact CB-CE2 3.49Å; L115-F442 HydrophobicContact CB-CZ 3.99Å; L115-F442 HydrophobicContact CD1-CE1 4.41Å; L115-F442 HydrophobicContact CD1-CE2 4.2Å; L115-F442 HydrophobicContact CD1-CZ 3.82Å
116	H	78	Confident	70.3	Confident	43 Å²	43	28.6 Å²	28.6	20%	0.199	18%	0.175	C	C	.	.	H	α-helix	trans	-70.1	-33.2	175.2	-174.8	74.2	0	0	0	112.6	F112 S113 F114 P119 F120 R441 F442	F112-H116 PolarHBondContact O-N 3.41Å; S113-H116 WeakPolarHBondContact O-CB 3.25Å; S113-H116 PolarHBondContact O-N 3.29Å; F114-H116 PolarHBondContact O-N 2.9Å; F114-H116 VanDerWaalsContact O-N 3.15Å; H116-P119 VanDerWaalsContact O-CD 3.28Å; H116-P119 WeakPolarHBondContact O-CD 3.26Å; H116-F120 WeakPolarHBondContact O-CD2 3.4Å; H116-F120 WeakPolarHBondContact O-CE2 3.28Å; H116-R441 PolarHBondContact CE1-O 2.85Å; H116-R441 VanDerWaalsContact CE1-O 3.26Å; H116-R441 PolarHBondContact ND1-O 3.26Å; H116-F442 HydrophobicContact CB-CD2 4.04Å
117	T	69.6	Low	71.3	Confident	61 Å²	61	28.4 Å²	28.4	37%	0.374	17%	0.173	S	C	.	.	H	α-helix	trans	-80.4	-32.3	-179.7	60.7	0	0	0	0	114.6	S113 F114 P119 F120	S113-T117 WeakPolarHBondContact O-CG2 3.46Å; S113-T117 PolarHBondContact O-N 3.39Å; S113-T117 VanDerWaalsContact O-N 3.15Å; F114-T117 WeakPolarHBondContact O-CA 3.29Å; F114-T117 PolarHBondContact O-N 2.64Å; F114-T117 PolarHBondContact O-OG1 3.49Å; T117-P119 VanDerWaalsContact C-N 3.33Å; T117-F120 PolarHBondContact O-N 2.9Å; T117-F120 VanDerWaalsContact O-N 3.08Å
118	I	68	Low	72.4	Confident	27 Å²	27	28.2 Å²	28.2	14%	0.138	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-47.9	-47.7	-178	-65.8	166.2	0	0	0	113.2	I85 F114 L115 F120 A121 V379	I85-I118 HydrophobicContact CD1-CD1 3.53Å; F114-I118 HydrophobicContact CD1-CD1 3.84Å; F114-I118 HydrophobicContact CD1-CG1 4.22Å; F114-I118 HydrophobicContact CD2-CG1 4.05Å; F114-I118 HydrophobicContact CE1-CD1 3.21Å; F114-I118 HydrophobicContact CE1-CG1 3.67Å; F114-I118 HydrophobicContact CE2-CD1 4Å; F114-I118 HydrophobicContact CE2-CG1 3.44Å; F114-I118 VanDerWaalsContact CE2-CG1 3.44Å; F114-I118 HydrophobicContact CG-CD1 4.47Å; F114-I118 HydrophobicContact CG-CG1 4.4Å; F114-I118 HydrophobicContact CZ-CD1 3.33Å; F114-I118 HydrophobicContact CZ-CG1 3.26Å; F114-I118 WeakPolarHBondContact O-CG1 3.3Å; F114-I118 PolarHBondContact O-N 3.45Å; L115-I118 HydrophobicContact CD2-CD1 3.9Å; I118-F120 PolarHBondContact O-N 3.2Å; I118-A121 WeakPolarHBondContact O-CB 3.5Å; I118-A121 PolarHBondContact O-N 3.39Å; I118-V379 HydrophobicContact CB-CG2 3.95Å; I118-V379 HydrophobicContact CD1-CG2 3.99Å; I118-V379 HydrophobicContact CG2-CG2 3.85Å
119	P	64.1	Low	73	Confident	18 Å²	18	29.1 Å²	29.1	12%	0.117	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-72.1	-16.5	-171.2	-15.9	32.1	0	0	0	113.2	L115 H116 T117 A121 K302 V379 M449	L115-P119 WeakPolarHBondContact O-CD 3.42Å; H116-P119 VanDerWaalsContact O-CD 3.28Å; H116-P119 WeakPolarHBondContact O-CD 3.26Å; T117-P119 VanDerWaalsContact C-N 3.33Å; P119-A121 VanDerWaalsContact C-N 3.32Å; P119-K302 PolarHBondContact O-NZ 2.95Å; P119-V379 HydrophobicContact CG-CB 4.28Å; P119-V379 HydrophobicContact CG-CG2 4.01Å; P119-M449 HydrophobicContact CB-CE 3.06Å; P119-M449 HydrophobicContact CB-SD 3.07Å; P119-M449 WeakPolarHBondContact CB-SD 3.44Å; P119-M449 HydrophobicContact CG-CE 4.06Å; P119-M449 HydrophobicContact CG-SD 3.44Å; P119-M449 WeakPolarHBondContact CG-SD 3.25Å
120	F	59	Low	73.7	Confident	124 Å²	124	28.5 Å²	28.5	54%	0.544	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-83.3	-9.6	172.6	-57.5	-74	0	0	0	112.4	H116 T117 I118	H116-F120 WeakPolarHBondContact O-CD2 3.4Å; H116-F120 WeakPolarHBondContact O-CE2 3.28Å; T117-F120 PolarHBondContact O-N 2.9Å; T117-F120 VanDerWaalsContact O-N 3.08Å; I118-F120 PolarHBondContact O-N 3.2Å
121	A	58	Low	74.4	Confident	41 Å²	41	29.6 Å²	29.6	34%	0.339	18%	0.179	S	C	.	.	S	Bend	trans	-67.9	138.8	173.1	0	0	0	0	0	111.1	I118 P119 T123 K302	I118-A121 WeakPolarHBondContact O-CB 3.5Å; I118-A121 PolarHBondContact O-N 3.39Å; P119-A121 VanDerWaalsContact C-N 3.32Å; A121-T123 PolarHBondContact O-N 2.95Å; A121-K302 WeakPolarHBondContact O-CE 3.25Å; A121-K302 PolarHBondContact O-NZ 3.08Å; A121-K302 VanDerWaalsContact O-NZ 3.11Å
122	S	59.5	Low	74.5	Confident	92 Å²	92	33.6 Å²	33.6	64%	0.643	20%	0.2	S	C	*	.			trans	-82.1	45.9	-179.1	56.5	0	0	0	0	112.2	P301	S122-P301 WeakPolarHBondContact O-CG 3.05Å
123	T	68.5	Low	74.2	Confident	47 Å²	47	35.7 Å²	35.7	29%	0.288	21%	0.212	S	C	.	.			trans	-97.1	143.1	175.4	53.2	0	0	0	0	110.3	A121 K302	A121-T123 PolarHBondContact O-N 2.95Å; T123-K302 WeakPolarHBondContact O-CE 3.23Å; T123-K302 WeakPolarHBondContact O-CG 3.47Å
124	P	73.8	Confident	74.1	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.006	20%	0.204	C	C	.	.			trans	-65.2	143.9	173.5	25.5	-30.3	0	0	0	110.3	S126 Y127 W216 P301	P124-S126 PolarHBondContact O-N 2.62Å; P124-Y127 HydrophobicContact CG-CD1 4.34Å; P124-W216 HydrophobicContact CG-CD2 3.85Å; P124-W216 HydrophobicContact CG-CE3 3.95Å; P124-W216 HydrophobicContact CG-CH2 3.44Å; P124-W216 VanDerWaalsContact CG-CH2 3.44Å; P124-W216 HydrophobicContact CG-CZ2 3.33Å; P124-W216 HydrophobicContact CG-CZ3 3.77Å; P124-P301 WeakPolarHBondContact CA-O 3.45Å; P124-P301 HydrophobicContact CB-CB 4.17Å; P124-P301 VanDerWaalsContact CB-O 3.3Å; P124-P301 WeakPolarHBondContact CB-O 3.45Å
125	S	74.1	Confident	74.4	Confident	40 Å²	40	40.4 Å²	40.4	28%	0.28	23%	0.227	S	C	.	.	S	Bend	trans	-65.8	-22.4	176.1	52.2	0	0	0	0	112.9	Q304 N376	S125-Q304 VanDerWaalsContact OG-CG 3.3Å; S125-Q304 WeakPolarHBondContact OG-CG 3.31Å; S125-N376 WeakPolarHBondContact O-CA 3.41Å; S125-N376 WeakPolarHBondContact O-CB 3.36Å; S125-N376 PolarHBondContact O-N 3.5Å
126	S	82.1	Confident	74.9	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	140.5	-174.3	37.4	0	0	0	0	110.3	P124 S279 Q304 V374	P124-S126 PolarHBondContact O-N 2.62Å; S126-S279 PolarHBondContact O-OG 3.06Å; S126-Q304 PolarHBondContact OG-OE1 3.31Å; S126-V374 WeakPolarHBondContact CA-O 3.15Å
127	Y	87.5	Confident	75.4	Confident	8 Å²	8	39 Å²	39	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	154	177	56.5	-95	0	0	0	111.9	H84 P124 W216 H277 M278 V374	H84-Y127 PolarHBondContact CE1-OH 3.36Å; P124-Y127 HydrophobicContact CG-CD1 4.34Å; Y127-W216 HydrophobicContact CD1-CH2 4.23Å; Y127-W216 HydrophobicContact CD1-CZ2 4.04Å; Y127-W216 AromaticContact CG-CH2 4Å; Y127-W216 HydrophobicContact CG-CH2 4Å; Y127-W216 HydrophobicContact CG-CZ2 4.21Å; Y127-H277 HydrophobicContact CD2-CB 3.51Å; Y127-H277 AromaticContact CD2-CG 3.51Å; Y127-H277 AromaticContact CD2-ND1 3.74Å; Y127-H277 HydrophobicContact CE2-CB 4Å; Y127-H277 AromaticContact CE2-CD2 3.62Å; Y127-H277 AromaticContact CE2-CE1 3.67Å; Y127-H277 AromaticContact CE2-CG 3.46Å; Y127-H277 VanDerWaalsContact CE2-CG 3.46Å; Y127-H277 AromaticContact CE2-ND1 3.52Å; Y127-H277 AromaticContact CE2-NE2 3.77Å; Y127-H277 HydrophobicContact CG-CB 4.02Å; Y127-M278 CarbonylContact C-O 3.56Å; Y127-M278 WeakPolarHBondContact CA-O 3.35Å; Y127-M278 WeakPolarHBondContact CB-O 3.28Å; Y127-V374 HydrophobicContact CD2-CB 4.04Å; Y127-V374 HydrophobicContact CD2-CG2 4.42Å; Y127-V374 HydrophobicContact CE1-CB 4.45Å; Y127-V374 HydrophobicContact CE1-CG1 4.26Å; Y127-V374 HydrophobicContact CE2-CB 3.68Å; Y127-V374 HydrophobicContact CE2-CG1 4.04Å; Y127-V374 HydrophobicContact CE2-CG2 3.92Å; Y127-V374 PolarHBondContact N-O 2.83Å; Y127-V374 PolarHBondContact O-N 2.92Å
128	F	89.2	Confident	76.4	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	123.9	164.6	-60.6	-69.8	0	0	0	109.2	F130 H277 M278 I281 P340 M367 V371 A373	F128-F130 HydrophobicContact CB-CD2 4.33Å; F128-F130 HydrophobicContact CB-CE2 3.64Å; F128-F130 HydrophobicContact CB-CZ 4.2Å; F128-H277 CarbonylContact O-C 3.57Å; F128-H277 VanDerWaalsContact O-CA 3.23Å; F128-H277 WeakPolarHBondContact O-CA 3.2Å; F128-M278 PolarHBondContact N-O 3Å; F128-M278 PolarHBondContact O-N 3.16Å; F128-I281 HydrophobicContact CD2-CD1 3.74Å; F128-I281 HydrophobicContact CD2-CG1 4.16Å; F128-I281 HydrophobicContact CE2-CD1 3.91Å; F128-I281 HydrophobicContact CE2-CG1 4.16Å; F128-P340 HydrophobicContact CD1-CB 4.27Å; F128-P340 HydrophobicContact CD1-CG 4.38Å; F128-P340 HydrophobicContact CD2-CG 3.83Å; F128-P340 HydrophobicContact CE1-CB 4.01Å; F128-P340 HydrophobicContact CE1-CG 4.23Å; F128-P340 HydrophobicContact CE2-CB 4.33Å; F128-P340 HydrophobicContact CE2-CG 3.66Å; F128-P340 HydrophobicContact CG-CG 4.2Å; F128-P340 HydrophobicContact CZ-CB 4.04Å; F128-P340 HydrophobicContact CZ-CG 3.87Å; F128-M367 HydrophobicContact CD1-SD 3.82Å; F128-M367 HydrophobicContact CE1-SD 3.92Å; F128-V371 HydrophobicContact CB-CG1 4.49Å; F128-A373 HydrophobicContact CD1-CB 4.34Å; F128-A373 HydrophobicContact CE1-CB 4.3Å
129	S	88	Confident	77.5	Confident	22 Å²	22	36.1 Å²	36.1	15%	0.154	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	116.4	173.3	-178	0	0	0	0	109.6	P131 H277 V371 S372	S129-P131 WeakPolarHBondContact O-CD 3.36Å; S129-H277 PolarHBondContact OG-CE1 3.08Å; S129-H277 VanDerWaalsContact OG-CE1 3.24Å; S129-H277 PolarHBondContact OG-ND1 3.07Å; S129-V371 WeakPolarHBondContact O-CA 3.41Å; S129-S372 PolarHBondContact N-O 3.44Å; S129-S372 PolarHBondContact O-N 3.49Å
130	F	86.9	Confident	78.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	111	173.6	-62.8	-99.3	0	0	0	108.5	F128 V138 I262 F274 Y275 G276 M278 V371	F128-F130 HydrophobicContact CB-CD2 4.33Å; F128-F130 HydrophobicContact CB-CE2 3.64Å; F128-F130 HydrophobicContact CB-CZ 4.2Å; F130-V138 HydrophobicContact CE1-CG2 3.93Å; F130-V138 HydrophobicContact CZ-CG2 3.74Å; F130-I262 HydrophobicContact CZ-CG2 4.32Å; F130-F274 HydrophobicContact CB-CD1 3.8Å; F130-F274 WeakPolarHBondContact CB-O 3.16Å; F130-F274 HydrophobicContact CD1-CD1 4.49Å; F130-F274 AromaticContact CD2-CD1 3.78Å; F130-F274 HydrophobicContact CD2-CD1 3.78Å; F130-F274 HydrophobicContact CD2-CE1 4.11Å; F130-F274 HydrophobicContact CE2-CD1 4.5Å; F130-F274 AromaticContact CG-CD1 3.78Å; F130-F274 HydrophobicContact CG-CD1 3.78Å; F130-Y275 WeakPolarHBondContact O-CD2 3.47Å; F130-G276 PolarHBondContact N-O 2.88Å; F130-G276 PolarHBondContact O-N 2.82Å; F130-M278 HydrophobicContact CD2-CE 4.42Å; F130-M278 HydrophobicContact CD2-CG 4.16Å; F130-M278 HydrophobicContact CE2-CB 3.92Å; F130-M278 HydrophobicContact CE2-CE 4.05Å; F130-M278 HydrophobicContact CE2-CG 3.63Å; F130-M278 HydrophobicContact CE2-SD 3.88Å; F130-M278 HydrophobicContact CZ-CE 4.24Å; F130-M278 HydrophobicContact CZ-CG 4.46Å; F130-M278 HydrophobicContact CZ-SD 4.13Å; F130-V371 HydrophobicContact CD1-CG1 4.39Å; F130-V371 HydrophobicContact CD1-CG2 3.69Å; F130-V371 HydrophobicContact CE1-CG1 4.29Å; F130-V371 HydrophobicContact CE1-CG2 4.02Å; F130-V371 HydrophobicContact CG-CG2 4.42Å
131	P	80.7	Confident	79.9	Confident	29 Å²	29	31.1 Å²	31.1	19%	0.188	19%	0.185	C	C	.	.			trans	-73.1	169.7	176.7	31.1	-32.9	0	0	0	111.1	S129 D133 S136 N370	S129-P131 WeakPolarHBondContact O-CD 3.36Å; P131-D133 HydrophobicContact CG-CB 4.31Å; P131-D133 PolarHBondContact O-N 3.05Å; P131-S136 WeakPolarHBondContact CG-OG 3.35Å; P131-N370 HydrophobicContact CG-CB 3.6Å
132	D	76.9	Confident	81	Confident	85 Å²	85	32.9 Å²	32.9	46%	0.455	19%	0.193	S	C	.	.	S	Bend	trans	-75	72.6	173.2	-172.2	-3.5	0	0	0	109.2	F163 Y275	D132-F163 WeakPolarHBondContact OD1-CE2 2.86Å; D132-Y275 HydrophobicContact CB-CD2 3.82Å; D132-Y275 HydrophobicContact CB-CE2 3.93Å; D132-Y275 HydrophobicContact CB-CG 4.24Å
133	D	74	Confident	81.7	Confident	47 Å²	47	29.1 Å²	29.1	25%	0.251	17%	0.166	S	C	.	.			trans	-140.5	130.1	-179.6	169.5	30.7	0	0	0	110	P131 Y135 S136	P131-D133 HydrophobicContact CG-CB 4.31Å; P131-D133 PolarHBondContact O-N 3.05Å; D133-Y135 PolarHBondContact O-N 2.97Å; D133-Y135 VanDerWaalsContact O-N 3.11Å; D133-Y135 PolarHBondContact OD1-N 3.45Å; D133-S136 WeakPolarHBondContact CB-OG 3.28Å; D133-S136 PolarHBondContact O-N 3.31Å; D133-S136 PolarHBondContact OD2-OG 3.2Å
134	A	72.3	Confident	81.8	Confident	28 Å²	28	30.4 Å²	30.4	23%	0.231	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-24.4	-176.7	0	0	0	0	0	113.7	Q264	A134-Q264 PolarHBondContact O-NE2 3.06Å
135	Y	78.1	Confident	81.5	Confident	135 Å²	135	34.7 Å²	34.7	53%	0.529	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	6.3	-174.8	-58.1	-78.3	0	0	0	114.5	D133 N137 T268	D133-Y135 PolarHBondContact O-N 2.97Å; D133-Y135 VanDerWaalsContact O-N 3.11Å; D133-Y135 PolarHBondContact OD1-N 3.45Å; Y135-N137 PolarHBondContact O-N 3.42Å; Y135-T268 HydrophobicContact CE1-CG2 4.38Å
136	S	84.9	Confident	81.6	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.177	C	C	.	.			trans	-82.2	112.3	-178	-78.7	0	0	0	0	111	P131 D133 S368 N370	P131-S136 WeakPolarHBondContact CG-OG 3.35Å; D133-S136 WeakPolarHBondContact CB-OG 3.28Å; D133-S136 PolarHBondContact O-N 3.31Å; D133-S136 PolarHBondContact OD2-OG 3.2Å; S136-S368 WeakPolarHBondContact CA-O 3.46Å; S136-N370 PolarHBondContact OG-N 3.13Å
137	N	88.7	Confident	81.2	Confident	13 Å²	13	33.4 Å²	33.4	7%	0.07	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	164.3	-177.3	72.1	52.8	0	0	0	112.4	Y135 S139 I262 Q264 S368	Y135-N137 PolarHBondContact O-N 3.42Å; N137-S139 PolarHBondContact OD1-N 3.02Å; N137-I262 CarbonylContact C-O 3.49Å; N137-I262 VanDerWaalsContact CA-O 3.27Å; N137-I262 WeakPolarHBondContact CA-O 3.41Å; N137-I262 WeakPolarHBondContact CB-O 3.49Å; N137-Q264 HydrophobicContact CB-CB 3.78Å; N137-Q264 PolarHBondContact ND2-OE1 3.22Å; N137-S368 PolarHBondContact N-O 3.11Å; N137-S368 PolarHBondContact O-N 3.47Å; N137-S368 WeakPolarHBondContact OD1-CB 3.34Å; N137-S368 PolarHBondContact OD1-OG 2.96Å
138	V	90.8	Very high	80.4	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	108.9	161.7	-179.2	0	0	0	0	107.1	F130 L140 I262 A365 M367 V371	F130-V138 HydrophobicContact CE1-CG2 3.93Å; F130-V138 HydrophobicContact CZ-CG2 3.74Å; V138-L140 HydrophobicContact CG1-CD1 4.25Å; V138-I262 HydrophobicContact CB-CB 4.26Å; V138-I262 PolarHBondContact N-O 2.81Å; V138-I262 PolarHBondContact O-N 3.14Å; V138-A365 HydrophobicContact CG1-CB 3.78Å; V138-M367 HydrophobicContact CG2-CG 4.26Å; V138-V371 HydrophobicContact CG2-CG1 4.08Å
139	S	89.8	Confident	79.6	Confident	28 Å²	28	37.4 Å²	37.4	20%	0.196	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	122.3	-178.4	60.5	0	0	0	0	110.6	N137 A365 L366	N137-S139 PolarHBondContact OD1-N 3.02Å; S139-A365 CarbonylContact O-C 3.32Å; S139-A365 WeakPolarHBondContact O-CA 3.48Å; S139-A365 VanDerWaalsContact O-CB 3.31Å; S139-A365 WeakPolarHBondContact O-CB 3.17Å; S139-L366 PolarHBondContact N-O 3.16Å; S139-L366 PolarHBondContact O-N 3.41Å; S139-L366 WeakPolarHBondContact OG-CB 3.43Å; S139-L366 PolarHBondContact OG-O 3.12Å
140	L	89	Confident	79.1	Confident	14 Å²	14	41.5 Å²	41.5	7%	0.073	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	147.8	175	-81.5	64	0	0	0	109	V138 F174 C260 I262 F336 Y338 A365	V138-L140 HydrophobicContact CG1-CD1 4.25Å; L140-F174 HydrophobicContact CD2-CE1 4.45Å; L140-C260 HydrophobicContact CB-CB 3.65Å; L140-C260 PolarHBondContact N-O 3.28Å; L140-I262 HydrophobicContact CD1-CD1 3.61Å; L140-I262 HydrophobicContact CD1-CG1 3.92Å; L140-I262 HydrophobicContact CD2-CD1 4.42Å; L140-F336 HydrophobicContact CD2-CD1 4.29Å; L140-F336 HydrophobicContact CD2-CD2 4.41Å; L140-F336 HydrophobicContact CD2-CE1 4.01Å; L140-F336 HydrophobicContact CD2-CE2 4.14Å; L140-F336 HydrophobicContact CD2-CG 4.48Å; L140-F336 HydrophobicContact CD2-CZ 3.92Å; L140-Y338 HydrophobicContact CD1-CE2 3.98Å; L140-Y338 HydrophobicContact CD2-CE2 3.77Å; L140-Y338 HydrophobicContact CG-CE2 3.61Å; L140-A365 HydrophobicContact CD1-CB 4.08Å; L140-A365 HydrophobicContact CG-CB 4.27Å
141	P	85	Confident	79.1	Confident	23 Å²	23	41.5 Å²	41.5	15%	0.149	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-64.4	152.3	175.3	24	-27.7	0	0	0	110.4	T143 L363 H364	P141-T143 PolarHBondContact O-N 3.09Å; P141-L363 HydrophobicContact CG-CD2 4.2Å; P141-H364 WeakPolarHBondContact CD-O 3.36Å
142	P	81.3	Confident	79.5	Confident	79 Å²	79	40.2 Å²	40.2	51%	0.513	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-54.7	132.6	175	-26.8	35.2	0	0	0	111.8	V256 F257	P142-V256 HydrophobicContact CB-CG1 4.1Å; P142-F257 VanDerWaalsContact CA-O 3.25Å; P142-F257 WeakPolarHBondContact CA-O 3.38Å
143	T	74.7	Confident	80.3	Confident	13 Å²	13	36.2 Å²	36.2	8%	0.08	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-123.3	133.5	-175.7	40.7	0	0	0	0	110.6	P141 W146 F257 L363	P141-T143 PolarHBondContact O-N 3.09Å; T143-W146 WeakPolarHBondContact CB-O 3.49Å; T143-W146 PolarHBondContact OG1-O 3.01Å; T143-F257 PolarHBondContact N-O 2.91Å; T143-F257 PolarHBondContact O-N 3.37Å; T143-L363 HydrophobicContact CG2-CD2 3.85Å
144	D	70.6	Confident	81.2	Confident	73 Å²	73	34 Å²	34	39%	0.39	18%	0.184	S	C	.	.	S	Bend	trans	-98.6	-21.6	180	59.8	-21.5	0	0	0	112.8	V256	D144-V256 HydrophobicContact CB-CG2 4.01Å
145	K	67	Low	82.3	Confident	91 Å²	91	32.7 Å²	32.7	40%	0.396	17%	0.173	S	C	.	.	S	Bend	trans	-110.2	-7.9	-173.8	-65.9	178.2	-170.5	172	0	115.3	F355 S358	K145-F355 HydrophobicContact CB-CE1 3.82Å; K145-F355 HydrophobicContact CB-CZ 3.71Å; K145-F355 HydrophobicContact CD-CE1 3.92Å; K145-F355 HydrophobicContact CD-CZ 4.25Å; K145-F355 HydrophobicContact CG-CE1 4.48Å; K145-S358 PolarHBondContact NZ-OG 2.92Å
146	W	77.3	Confident	83	Confident	4 Å²	4	26.2 Å²	26.2	2%	0.015	15%	0.148	C	C	.	.	S	Bend	trans	-143.1	137.3	177.5	-174.1	92.7	0	0	0	109.5	T143 W152 F154 F174 F284 V335 F336	T143-W146 WeakPolarHBondContact CB-O 3.49Å; T143-W146 PolarHBondContact OG1-O 3.01Å; W146-W152 HydrophobicContact CZ2-CE3 4.32Å; W146-F154 HydrophobicContact CH2-CD2 4.4Å; W146-F174 HydrophobicContact CH2-CD2 4.49Å; W146-F174 AromaticContact CH2-CE2 3.98Å; W146-F174 HydrophobicContact CH2-CE2 3.98Å; W146-F174 HydrophobicContact CH2-CZ 4.19Å; W146-F174 HydrophobicContact CZ3-CD2 4.39Å; W146-F174 HydrophobicContact CZ3-CE1 4.35Å; W146-F174 HydrophobicContact CZ3-CE2 4.13Å; W146-F174 HydrophobicContact CZ3-CZ 4.13Å; W146-F284 PolarHBondContact NE1-O 3.05Å; W146-V335 HydrophobicContact CB-CG1 3.88Å; W146-V335 HydrophobicContact CB-CG2 4.27Å; W146-V335 HydrophobicContact CG-CB 4.35Å; W146-V335 HydrophobicContact CG-CG1 4.15Å; W146-V335 HydrophobicContact CG-CG2 4.03Å; W146-F336 AromaticContact CD2-CE1 3.97Å; W146-F336 HydrophobicContact CD2-CE1 3.97Å; W146-F336 AromaticContact CE3-CE1 3.64Å; W146-F336 HydrophobicContact CE3-CE1 3.64Å; W146-F336 HydrophobicContact CE3-CZ 4.42Å; W146-F336 AromaticContact CH2-CE1 3.66Å; W146-F336 HydrophobicContact CH2-CE1 3.66Å; W146-F336 AromaticContact CH2-CZ 3.63Å; W146-F336 HydrophobicContact CH2-CZ 3.63Å; W146-F336 AromaticContact CZ2-CE1 3.97Å; W146-F336 HydrophobicContact CZ2-CE1 3.97Å; W146-F336 HydrophobicContact CZ2-CZ 4.09Å; W146-F336 AromaticContact CZ3-CE1 3.48Å; W146-F336 HydrophobicContact CZ3-CE1 3.48Å; W146-F336 VanDerWaalsContact CZ3-CE1 3.48Å; W146-F336 AromaticContact CZ3-CZ 3.82Å; W146-F336 HydrophobicContact CZ3-CZ 3.82Å
147	P	73.7	Confident	83.4	Confident	10 Å²	10	27.2 Å²	27.2	7%	0.065	15%	0.151	C	C	.	.	S	Bend	cis	-68.3	140.6	-3.7	26.3	-34	0	0	0	113.7	W152 W249 F257	P147-W152 HydrophobicContact CB-CB 4.41Å; P147-W152 VanDerWaalsContact CB-CD1 3.45Å; P147-W152 HydrophobicContact CB-CD2 3.87Å; P147-W152 HydrophobicContact CB-CG 3.66Å; P147-W249 HydrophobicContact CB-CH2 3.88Å; P147-W249 HydrophobicContact CB-CZ2 4.48Å; P147-W249 HydrophobicContact CG-CH2 4Å; P147-F257 HydrophobicContact CG-CD1 4.49Å; P147-F257 HydrophobicContact CG-CD2 4.33Å; P147-F257 HydrophobicContact CG-CE1 3.95Å; P147-F257 HydrophobicContact CG-CE2 3.77Å; P147-F257 HydrophobicContact CG-CZ 3.55Å
148	S	70.3	Confident	83.5	Confident	20 Å²	20	26.6 Å²	26.6	14%	0.14	15%	0.148	C	C	.	.			trans	-97.9	157	-174	71	0	0	0	0	112.9	T150 G151	S148-T150 PolarHBondContact O-N 3.16Å; S148-T150 PolarHBondContact OG-OG1 3.1Å; S148-G151 PolarHBondContact O-N 3.45Å; S148-G151 PolarHBondContact OG-O 2.91Å; S148-G151 VanDerWaalsContact OG-O 3.08Å
149	Q	72.8	Confident	83.4	Confident	72 Å²	72	28.6 Å²	28.6	34%	0.336	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-23.1	174.9	-169.3	174.8	20.1	0	0	112.6	G151 F225 W249 T253	Q149-G151 PolarHBondContact O-N 2.87Å; Q149-F225 HydrophobicContact CG-CD2 4.38Å; Q149-F225 HydrophobicContact CG-CE2 4.27Å; Q149-F225 HydrophobicContact CG-CZ 4.44Å; Q149-F225 WeakPolarHBondContact O-CB 3.41Å; Q149-F225 WeakPolarHBondContact O-CD1 3.33Å; Q149-F225 WeakPolarHBondContact O-CG 3.49Å; Q149-W249 HydrophobicContact CG-CG 4.46Å; Q149-T253 HydrophobicContact CB-CG2 4.04Å
150	T	77.1	Confident	83.1	Confident	108 Å²	108	27.9 Å²	27.9	66%	0.663	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-6.2	-178.6	50.8	0	0	0	0	114	S148	S148-T150 PolarHBondContact O-N 3.16Å; S148-T150 PolarHBondContact OG-OG1 3.1Å
151	G	85.6	Confident	82.7	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.155	C	C	.	.			trans	109.9	146.9	-175.2	0	0	0	0	0	111.2	S148 Q149 H223 A285	S148-G151 PolarHBondContact O-N 3.45Å; S148-G151 PolarHBondContact OG-O 2.91Å; S148-G151 VanDerWaalsContact OG-O 3.08Å; Q149-G151 PolarHBondContact O-N 2.87Å; G151-H223 CarbonylContact C-O 3.45Å; G151-H223 WeakPolarHBondContact CA-O 3.24Å; G151-A285 CarbonylContact O-C 3.5Å
152	W	90.1	Very high	82	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.008	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	161.6	-175.7	52.6	-94.1	0	0	0	109.8	W146 P147 F154 F182 I221 H223 W249 F284 E286	W146-W152 HydrophobicContact CZ2-CE3 4.32Å; P147-W152 HydrophobicContact CB-CB 4.41Å; P147-W152 VanDerWaalsContact CB-CD1 3.45Å; P147-W152 HydrophobicContact CB-CD2 3.87Å; P147-W152 HydrophobicContact CB-CG 3.66Å; W152-F154 HydrophobicContact CZ3-CB 4.16Å; W152-F182 HydrophobicContact CZ2-CD1 4.4Å; W152-F182 HydrophobicContact CZ2-CG 4.34Å; W152-I221 HydrophobicContact CH2-CG2 4.25Å; W152-I221 HydrophobicContact CZ3-CG2 4.18Å; W152-H223 AromaticContact CD1-CG 3.96Å; W152-H223 AromaticContact CD1-ND1 3.53Å; W152-H223 HydrophobicContact CD2-CB 3.69Å; W152-H223 AromaticContact CE2-CG 3.89Å; W152-H223 HydrophobicContact CE3-CB 4.34Å; W152-H223 HydrophobicContact CG-CB 4.01Å; W152-H223 HydrophobicContact CH2-CB 4.28Å; W152-H223 HydrophobicContact CZ2-CB 3.63Å; W152-H223 PolarHBondContact N-O 3.45Å; W152-H223 VanDerWaalsContact NE1-CB 3.32Å; W152-H223 AromaticContact NE1-CG 3.45Å; W152-H223 AromaticContact NE1-ND1 3.32Å; W152-H223 PolarHBondContact NE1-ND1 3.39Å; W152-H223 PolarHBondContact O-N 2.93Å; W152-W249 AromaticContact CE2-CZ3 3.79Å; W152-W249 HydrophobicContact CZ2-CH2 4.4Å; W152-W249 AromaticContact CZ2-CZ3 3.94Å; W152-W249 HydrophobicContact CZ2-CZ3 3.94Å; W152-W249 AromaticContact NE1-CH2 3.19Å; W152-W249 AromaticContact NE1-CZ3 3.04Å; W152-F284 WeakPolarHBondContact CA-O 3.22Å; W152-F284 WeakPolarHBondContact CB-O 3.29Å; W152-E286 CarbonylContact C-O 3.55Å; W152-E286 WeakPolarHBondContact CA-O 3.46Å
153	T	93.2	Very high	81.3	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	130.8	176.6	-53.5	0	0	0	0	110.6	T220 I221 V222 G283 F284 E286 L288	T153-T220 HydrophobicContact CG2-CG2 3.31Å; T153-I221 CarbonylContact C-O 3.55Å; T153-I221 WeakPolarHBondContact CA-O 2.9Å; T153-V222 HydrophobicContact CG2-CG2 3.72Å; T153-G283 CarbonylContact O-C 3.52Å; T153-G283 WeakPolarHBondContact O-CA 3.34Å; T153-F284 HydrophobicContact CG2-CD2 4.14Å; T153-F284 PolarHBondContact N-O 2.87Å; T153-F284 PolarHBondContact O-N 3.44Å; T153-E286 PolarHBondContact N-O 2.86Å; T153-E286 PolarHBondContact OG1-O 3.01Å; T153-L288 HydrophobicContact CG2-CB 4.32Å; T153-L288 HydrophobicContact CG2-CD1 3.9Å; T153-L288 HydrophobicContact CG2-CG 3.95Å; T153-L288 PolarHBondContact OG1-N 3.38Å
154	F	93.5	Very high	80.7	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	131.1	166.6	175.7	-96.3	0	0	0	108.9	W146 W152 C156 L171 Y172 F174 T220 I221 I262 I281	W146-F154 HydrophobicContact CH2-CD2 4.4Å; W152-F154 HydrophobicContact CZ3-CB 4.16Å; F154-C156 HydrophobicContact CE1-CB 4.49Å; F154-C156 HydrophobicContact CZ-CB 4.46Å; F154-L171 HydrophobicContact CE1-CD2 4.23Å; F154-Y172 AromaticContact CD1-CD1 3.98Å; F154-Y172 HydrophobicContact CD1-CD1 3.98Å; F154-Y172 AromaticContact CD1-CE1 3.81Å; F154-Y172 HydrophobicContact CD1-CE1 3.81Å; F154-Y172 AromaticContact CE1-CD1 3.75Å; F154-Y172 HydrophobicContact CE1-CD1 3.75Å; F154-Y172 HydrophobicContact CE1-CE1 4.03Å; F154-Y172 HydrophobicContact CG-CD1 4.45Å; F154-Y172 HydrophobicContact CG-CE1 4.29Å; F154-Y172 HydrophobicContact CZ-CD1 4.04Å; F154-F174 HydrophobicContact CD2-CE2 4.35Å; F154-F174 HydrophobicContact CD2-CZ 4.38Å; F154-F174 HydrophobicContact CE2-CZ 4.36Å; F154-T220 CarbonylContact O-C 3.54Å; F154-T220 WeakPolarHBondContact O-CA 3.14Å; F154-I221 PolarHBondContact N-O 3.36Å; F154-I221 PolarHBondContact O-N 2.98Å; F154-I262 HydrophobicContact CE2-CD1 4.21Å; F154-I281 HydrophobicContact CE2-CG2 3.74Å; F154-I281 HydrophobicContact CZ-CG2 4.1Å
155	H	94	Very high	80.4	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	132.6	-176.4	170.2	80.1	0	0	0	111.3	M218 L219 T220 M282 F284	H155-M218 VanDerWaalsContact CE1-CE 3.45Å; H155-M218 WeakPolarHBondContact CE1-CE 3.23Å; H155-L219 WeakPolarHBondContact CA-O 3.39Å; H155-T220 HydrophobicContact CB-CG2 4.29Å; H155-T220 PolarHBondContact ND1-OG1 3.4Å; H155-M282 HydrophobicContact CB-CB 4.43Å; H155-M282 WeakPolarHBondContact CD2-CE 3.48Å; H155-M282 PolarHBondContact N-O 2.84Å; H155-M282 PolarHBondContact O-N 3.31Å; H155-F284 HydrophobicContact CB-CE2 4.05Å
156	C	94	Very high	80.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	163.5	167.4	63.8	0	0	0	0	112.1	F154 I158 L219 N280 I281	F154-C156 HydrophobicContact CE1-CB 4.49Å; F154-C156 HydrophobicContact CZ-CB 4.46Å; C156-I158 WeakPolarHBondContact SG-CG2 3.32Å; C156-L219 PolarHBondContact N-O 3.39Å; C156-L219 PolarHBondContact O-N 3.05Å; C156-L219 VanDerWaalsContact O-O 3.09Å; C156-N280 WeakPolarHBondContact CA-O 3.39Å; C156-I281 HydrophobicContact CB-CG1 4.47Å
157	W	93.3	Very high	80	Confident	20 Å²	20	46.8 Å²	46.8	8%	0.076	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	133.2	163.3	-70.4	79.7	0	0	0	109.5	W216 F217 M218 M278 S279 Y297 P301	W157-W216 HydrophobicContact CB-CE3 3.99Å; W157-W216 HydrophobicContact CB-CZ3 4.16Å; W157-W216 HydrophobicContact CE3-CB 4.45Å; W157-F217 CarbonylContact C-O 3.56Å; W157-F217 WeakPolarHBondContact CA-O 3.33Å; W157-M218 HydrophobicContact CD2-CB 3.89Å; W157-M218 HydrophobicContact CE3-CB 3.9Å; W157-M218 HydrophobicContact CH2-CB 3.82Å; W157-M218 HydrophobicContact CZ2-CB 3.78Å; W157-M218 HydrophobicContact CZ2-CG 4.32Å; W157-M218 HydrophobicContact CZ2-SD 4.06Å; W157-M218 HydrophobicContact CZ3-CB 3.88Å; W157-M278 CarbonylContact O-C 3.53Å; W157-M278 WeakPolarHBondContact O-CA 3.37Å; W157-S279 PolarHBondContact O-N 3.33Å; W157-Y297 AromaticContact CH2-CD2 3.76Å; W157-Y297 HydrophobicContact CH2-CD2 3.76Å; W157-Y297 AromaticContact CH2-CE2 3.7Å; W157-Y297 HydrophobicContact CH2-CE2 3.7Å; W157-Y297 HydrophobicContact CZ2-CD2 4.13Å; W157-Y297 HydrophobicContact CZ3-CE2 4.39Å; W157-P301 HydrophobicContact CD2-CB 3.84Å; W157-P301 HydrophobicContact CE3-CB 3.9Å; W157-P301 HydrophobicContact CG-CB 4.43Å; W157-P301 HydrophobicContact CH2-CB 4.15Å; W157-P301 HydrophobicContact CH2-CG 4.28Å; W157-P301 HydrophobicContact CZ2-CB 4.1Å; W157-P301 HydrophobicContact CZ3-CB 4.05Å; W157-P301 HydrophobicContact CZ3-CG 4.31Å
158	I	91.5	Very high	80.5	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	145.4	-177.8	62.9	170.1	0	0	0	111.3	C156 L171 F186 F211 W216 F217 L219 H277 M278	C156-I158 WeakPolarHBondContact SG-CG2 3.32Å; I158-L171 HydrophobicContact CG2-CD1 3.81Å; I158-F186 HydrophobicContact CD1-CE2 4.27Å; I158-F186 HydrophobicContact CD1-CZ 3.59Å; I158-F211 HydrophobicContact CD1-CD1 3.95Å; I158-F211 HydrophobicContact CD1-CE1 3.99Å; I158-W216 WeakPolarHBondContact O-CA 3.42Å; I158-F217 HydrophobicContact CG1-CB 4.06Å; I158-F217 PolarHBondContact N-O 2.9Å; I158-F217 PolarHBondContact O-N 3.13Å; I158-L219 HydrophobicContact CD1-CB 4.36Å; I158-L219 HydrophobicContact CD1-CD2 4.18Å; I158-L219 HydrophobicContact CG1-CB 4.49Å; I158-H277 CarbonylContact C-O 3.53Å; I158-H277 WeakPolarHBondContact CA-O 3.34Å; I158-M278 HydrophobicContact CG2-CG 4.39Å
159	Y	87.7	Confident	81.2	Confident	43 Å²	43	49 Å²	49	17%	0.169	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	117.9	172	177.5	-86.7	0	0	0	108.5	K161 H214 W216 G276 H277	Y159-K161 HydrophobicContact CD1-CG 4.25Å; Y159-K161 HydrophobicContact CE1-CG 3.91Å; Y159-H214 VanDerWaalsContact CE2-CA 3.49Å; Y159-H214 HydrophobicContact CE2-CB 4.33Å; Y159-H214 VanDerWaalsContact CE2-O 3.25Å; Y159-H214 WeakPolarHBondContact CE2-O 2.85Å; Y159-H214 VanDerWaalsContact CZ-CA 3.44Å; Y159-H214 WeakPolarHBondContact OH-CA 3.12Å; Y159-H214 WeakPolarHBondContact OH-CB 3.49Å; Y159-H214 PolarHBondContact OH-CD2 3.12Å; Y159-W216 AromaticContact CD2-CD1 3.63Å; Y159-W216 HydrophobicContact CD2-CD2 4.09Å; Y159-W216 AromaticContact CD2-CE2 3.85Å; Y159-W216 AromaticContact CD2-CG 3.96Å; Y159-W216 HydrophobicContact CD2-CG 3.96Å; Y159-W216 AromaticContact CD2-NE1 3.54Å; Y159-W216 HydrophobicContact CG-CD2 4.29Å; Y159-W216 AromaticContact CG-CE2 3.98Å; Y159-W216 HydrophobicContact CG-CZ2 4.24Å; Y159-G276 CarbonylContact O-C 3.57Å; Y159-G276 WeakPolarHBondContact O-CA 3.03Å; Y159-H277 HydrophobicContact CD1-CB 4.48Å; Y159-H277 AromaticContact CD1-CD2 3.59Å; Y159-H277 PolarHBondContact N-O 3.48Å; Y159-H277 PolarHBondContact O-N 3.26Å
160	R	84	Confident	81.8	Confident	13 Å²	13	46.4 Å²	46.4	5%	0.049	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	134.9	-174.1	-64.1	-176.8	64.8	-152.4	-2.4	110.9	M169 F186 N188 F211 L213 H214	R160-M169 HydrophobicContact CG-CE 4.32Å; R160-M169 VanDerWaalsContact NE-CE 3.35Å; R160-F186 VanDerWaalsContact CZ-CD1 3.42Å; R160-F186 VanDerWaalsContact CZ-CG 3.5Å; R160-F186 VanDerWaalsContact NH1-CD1 3.33Å; R160-N188 PolarHBondContact NH1-O 2.76Å; R160-N188 PolarHBondContact NH2-O 3.29Å; R160-F211 PolarHBondContact NH1-O 3.36Å; R160-L213 HydrophobicContact CB-CD2 4.14Å; R160-H214 PolarHBondContact O-N 3.17Å
161	K	80	Confident	82.4	Confident	46 Å²	46	41.3 Å²	41.3	20%	0.2	20%	0.197	C	C	.	.			trans	-103	161.9	170	-69.8	-176.1	179.7	177.8	0	110.2	Y159 F163 Y275 H277	Y159-K161 HydrophobicContact CD1-CG 4.25Å; Y159-K161 HydrophobicContact CE1-CG 3.91Å; K161-F163 PolarHBondContact O-N 2.96Å; K161-Y275 HydrophobicContact CB-CD1 3.49Å; K161-Y275 VanDerWaalsContact CB-CD1 3.49Å; K161-Y275 HydrophobicContact CB-CE1 3.23Å; K161-Y275 HydrophobicContact CB-CE2 4.4Å; K161-Y275 HydrophobicContact CB-CG 4.18Å; K161-Y275 HydrophobicContact CD-CE1 4.12Å; K161-Y275 HydrophobicContact CD-CE2 4.05Å; K161-Y275 HydrophobicContact CG-CE1 4.31Å; K161-Y275 PolarHBondContact N-O 3.24Å; K161-H277 WeakPolarHBondContact CE-NE2 3.47Å; K161-H277 PolarHBondContact NZ-CE1 3.01Å; K161-H277 PolarHBondContact NZ-NE2 3.09Å
162	R	70.7	Confident	82.7	Confident	195 Å²	195	41.5 Å²	41.5	74%	0.736	20%	0.198	S	C	*	.			trans	-71	113.3	179.9	-171	173.7	-173.9	162.3	1.7	109.6	L213 Y275	R162-L213 HydrophobicContact CB-CD1 4.06Å; R162-L213 HydrophobicContact CG-CD1 4.18Å; R162-Y275 WeakPolarHBondContact O-CD1 3.45Å; R162-Y275 VanDerWaalsContact O-CE1 3.23Å; R162-Y275 WeakPolarHBondContact O-CE1 3.47Å
163	F	67.2	Low	82.7	Confident	34 Å²	34	41.5 Å²	41.5	15%	0.149	20%	0.198	C	C	.	.			trans	-85.8	142.6	173.3	-163.4	-123.7	0	0	0	109.7	D132 K161 N165 N167 Y275	D132-F163 WeakPolarHBondContact OD1-CE2 2.86Å; K161-F163 PolarHBondContact O-N 2.96Å; F163-N165 HydrophobicContact CD1-CB 4.11Å; F163-N165 WeakPolarHBondContact CD1-O 3.26Å; F163-N165 HydrophobicContact CE1-CB 3.68Å; F163-N165 HydrophobicContact CZ-CB 4.41Å; F163-N167 HydrophobicContact CE1-CB 4.5Å; F163-Y275 HydrophobicContact CD2-CD1 4.26Å; F163-Y275 HydrophobicContact CD2-CG 4.26Å
164	T	61.7	Low	82.5	Confident	110 Å²	110	41.6 Å²	41.6	68%	0.675	20%	0.198	S	C	*	.	S	Bend	trans	-79.4	-30.9	-176.1	50.4	0	0	0	0	112.6
165	N	63.9	Low	82.2	Confident	95 Å²	95	42.7 Å²	42.7	51%	0.508	20%	0.203	S	C	.	.	S	Bend	trans	-94.9	142.4	-179.4	-73.5	-26.1	0	0	0	111.8	F163 N167	F163-N165 HydrophobicContact CD1-CB 4.11Å; F163-N165 WeakPolarHBondContact CD1-O 3.26Å; F163-N165 HydrophobicContact CE1-CB 3.68Å; F163-N165 HydrophobicContact CZ-CB 4.41Å; N165-N167 HydrophobicContact CB-CB 4.46Å; N165-N167 PolarHBondContact O-N 3.41Å
166	N	63	Low	81.8	Confident	141 Å²	141	42.9 Å²	42.9	75%	0.754	21%	0.205	S	C	*	.			trans	-78	27	175.3	-73.2	-12.8	0	0	0	113.4
167	N	72.9	Confident	81.2	Confident	72 Å²	72	51.3 Å²	51.3	39%	0.385	24%	0.238	S	C	.	.	S	Bend	trans	-83.8	167.1	-176.4	-84	19.3	0	0	0	112.8	F163 N165 M169 D272	F163-N167 HydrophobicContact CE1-CB 4.5Å; N165-N167 HydrophobicContact CB-CB 4.46Å; N165-N167 PolarHBondContact O-N 3.41Å; N167-M169 PolarHBondContact O-N 3.26Å; N167-D272 WeakPolarHBondContact CB-OD1 3.38Å; N167-D272 PolarHBondContact ND2-OD1 2.95Å
168	K	83.3	Confident	80.7	Confident	72 Å²	72	54.9 Å²	54.9	31%	0.313	26%	0.258	S	S	.	.			trans	-66.8	118.9	174.7	-68.8	-174	174.4	-169.7	0	109.5	Y185 V187 E204 D272	K168-Y185 HydrophobicContact CB-CD2 3.77Å; K168-Y185 HydrophobicContact CB-CE2 4.38Å; K168-Y185 HydrophobicContact CB-CG 4.18Å; K168-Y185 HydrophobicContact CD-CD2 3.76Å; K168-Y185 HydrophobicContact CD-CE1 4.3Å; K168-Y185 HydrophobicContact CD-CE2 3.54Å; K168-Y185 HydrophobicContact CD-CG 4.26Å; K168-Y185 HydrophobicContact CG-CD2 3.65Å; K168-Y185 HydrophobicContact CG-CE2 3.74Å; K168-Y185 HydrophobicContact CG-CG 4.4Å; K168-Y185 PolarHBondContact NZ-OH 3.4Å; K168-V187 HydrophobicContact CG-CG2 4.19Å; K168-E204 IonicContact NZ-OE1 2.65Å; K168-E204 PolarHBondContact NZ-OE1 2.94Å; K168-E204 IonicContact NZ-OE2 3.6Å; K168-D272 WeakPolarHBondContact O-CA 3.16Å; K168-D272 WeakPolarHBondContact O-CB 3.42Å
169	M	84.9	Confident	80.2	Confident	4 Å²	4	60 Å²	60	2%	0.02	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	100.1	179.5	-174.4	-176.8	76.8	0	0	110	R160 N167 L171 Y185 F186 G273 F274 Y275	R160-M169 HydrophobicContact CG-CE 4.32Å; R160-M169 VanDerWaalsContact NE-CE 3.35Å; N167-M169 PolarHBondContact O-N 3.26Å; M169-L171 PolarHBondContact O-N 3.12Å; M169-Y185 CarbonylContact O-C 3.53Å; M169-Y185 WeakPolarHBondContact O-CA 3.48Å; M169-Y185 WeakPolarHBondContact O-CB 3.18Å; M169-F186 HydrophobicContact CB-CB 4.3Å; M169-F186 HydrophobicContact CE-CB 4Å; M169-F186 HydrophobicContact CE-CD2 3.54Å; M169-F186 HydrophobicContact CE-CE2 4.33Å; M169-F186 HydrophobicContact CE-CG 3.99Å; M169-F186 PolarHBondContact N-O 2.91Å; M169-F186 PolarHBondContact O-N 3.41Å; M169-G273 WeakPolarHBondContact CG-O 3.44Å; M169-F274 HydrophobicContact CE-CD2 3.54Å; M169-F274 HydrophobicContact CE-CE2 3.54Å; M169-F274 HydrophobicContact CG-CB 4.43Å; M169-F274 HydrophobicContact CG-CD2 4.15Å; M169-F274 HydrophobicContact SD-CD2 4.08Å; M169-Y275 PolarHBondContact SD-N 3.01Å
170	H	87.1	Confident	80	Confident	19 Å²	19	59.1 Å²	59.1	9%	0.088	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	116.3	-171.8	-80.3	-96.6	0	0	0	113.5	A184 Y185 G263 D272 F274	H170-A184 CarbonylContact C-O 3.56Å; H170-Y185 AromaticContact CE1-CD1 3.85Å; H170-G263 CarbonylContact O-C 3.48Å; H170-G263 VanDerWaalsContact O-C 3.25Å; H170-G263 WeakPolarHBondContact O-CA 3.37Å; H170-D272 PolarHBondContact N-O 3.07Å; H170-F274 WeakPolarHBondContact O-CB 3.46Å
171	L	89.6	Confident	80	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	-49.6	170.9	-178	77.9	0	0	0	111.1	F154 I158 M169 A184 F186 L219 I262 G263 F274 M278	F154-L171 HydrophobicContact CE1-CD2 4.23Å; I158-L171 HydrophobicContact CG2-CD1 3.81Å; M169-L171 PolarHBondContact O-N 3.12Å; L171-A184 HydrophobicContact CB-CB 4.21Å; L171-A184 WeakPolarHBondContact CB-O 3.48Å; L171-A184 HydrophobicContact CD2-CB 4.24Å; L171-A184 PolarHBondContact N-O 3.07Å; L171-F186 HydrophobicContact CB-CE2 4.33Å; L171-F186 HydrophobicContact CD1-CE2 4.24Å; L171-L219 HydrophobicContact CD2-CD2 3.42Å; L171-L219 VanDerWaalsContact CD2-CD2 3.42Å; L171-I262 WeakPolarHBondContact O-CG2 3.37Å; L171-G263 PolarHBondContact O-N 3.29Å; L171-F274 HydrophobicContact CD1-CD2 4.29Å; L171-F274 HydrophobicContact CD1-CE2 3.96Å; L171-F274 HydrophobicContact CD1-CZ 4.47Å; L171-M278 HydrophobicContact CD1-CE 3.43Å; L171-M278 VanDerWaalsContact CD1-CE 3.43Å; L171-M278 HydrophobicContact CD1-SD 4.01Å; L171-M278 HydrophobicContact CG-CE 4.28Å
172	Y	91.2	Very high	80.3	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.016	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	161.5	173.2	67.3	-105	0	0	0	111.3	F154 F174 F182 S183 A184 I221 L261	F154-Y172 AromaticContact CD1-CD1 3.98Å; F154-Y172 HydrophobicContact CD1-CD1 3.98Å; F154-Y172 AromaticContact CD1-CE1 3.81Å; F154-Y172 HydrophobicContact CD1-CE1 3.81Å; F154-Y172 AromaticContact CE1-CD1 3.75Å; F154-Y172 HydrophobicContact CE1-CD1 3.75Å; F154-Y172 HydrophobicContact CE1-CE1 4.03Å; F154-Y172 HydrophobicContact CG-CD1 4.45Å; F154-Y172 HydrophobicContact CG-CE1 4.29Å; F154-Y172 HydrophobicContact CZ-CD1 4.04Å; Y172-F174 HydrophobicContact CD1-CE2 4.25Å; Y172-F174 AromaticContact CD2-CD2 3.28Å; Y172-F174 HydrophobicContact CD2-CD2 3.28Å; Y172-F174 AromaticContact CD2-CE2 3.19Å; Y172-F174 HydrophobicContact CD2-CE2 3.19Å; Y172-F174 HydrophobicContact CD2-CG 4.17Å; Y172-F174 HydrophobicContact CD2-CZ 4.01Å; Y172-F174 AromaticContact CE2-CD2 3.57Å; Y172-F174 HydrophobicContact CE2-CD2 3.57Å; Y172-F174 AromaticContact CE2-CE2 3.66Å; Y172-F174 HydrophobicContact CE2-CE2 3.66Å; Y172-F174 HydrophobicContact CG-CD2 4.12Å; Y172-F174 AromaticContact CG-CE2 3.55Å; Y172-F174 HydrophobicContact CG-CE2 3.55Å; Y172-F174 HydrophobicContact CG-CZ 4.02Å; Y172-F182 HydrophobicContact CE2-CB 4.38Å; Y172-S183 VanDerWaalsContact O-CA 3.25Å; Y172-S183 WeakPolarHBondContact O-CA 3.32Å; Y172-S183 WeakPolarHBondContact O-CB 3.32Å; Y172-A184 HydrophobicContact CD1-CB 3.87Å; Y172-A184 HydrophobicContact CE1-CB 3.43Å; Y172-A184 VanDerWaalsContact CE1-CB 3.43Å; Y172-A184 HydrophobicContact CE2-CB 4.19Å; Y172-A184 HydrophobicContact CG-CB 4.41Å; Y172-A184 PolarHBondContact N-O 3.43Å; Y172-A184 PolarHBondContact O-N 3.3Å; Y172-I221 HydrophobicContact CE1-CD1 3.76Å; Y172-L261 CarbonylContact C-O 3.49Å; Y172-L261 WeakPolarHBondContact CA-O 3.18Å
173	C	89.9	Confident	81.1	Confident	2 Å²	2	48 Å²	48	1%	0.014	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	111.3	175	-177	0	0	0	0	109.8	Q175 L261 Q264	C173-Q175 VanDerWaalsContact SG-CD 3.53Å; C173-L261 PolarHBondContact N-O 3.39Å; C173-L261 PolarHBondContact O-N 3.45Å; C173-Q264 WeakPolarHBondContact CB-O 3.3Å
174	F	89	Confident	82.3	Confident	3 Å²	3	46.4 Å²	46.4	1%	0.013	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	109.6	176.3	-55.5	-55.3	0	0	0	108.8	L140 W146 F154 Y172 G181 F182 F257 T259 C260 I262	L140-F174 HydrophobicContact CD2-CE1 4.45Å; W146-F174 HydrophobicContact CH2-CD2 4.49Å; W146-F174 AromaticContact CH2-CE2 3.98Å; W146-F174 HydrophobicContact CH2-CE2 3.98Å; W146-F174 HydrophobicContact CH2-CZ 4.19Å; W146-F174 HydrophobicContact CZ3-CD2 4.39Å; W146-F174 HydrophobicContact CZ3-CE1 4.35Å; W146-F174 HydrophobicContact CZ3-CE2 4.13Å; W146-F174 HydrophobicContact CZ3-CZ 4.13Å; F154-F174 HydrophobicContact CD2-CE2 4.35Å; F154-F174 HydrophobicContact CD2-CZ 4.38Å; F154-F174 HydrophobicContact CE2-CZ 4.36Å; Y172-F174 HydrophobicContact CD1-CE2 4.25Å; Y172-F174 AromaticContact CD2-CD2 3.28Å; Y172-F174 HydrophobicContact CD2-CD2 3.28Å; Y172-F174 AromaticContact CD2-CE2 3.19Å; Y172-F174 HydrophobicContact CD2-CE2 3.19Å; Y172-F174 HydrophobicContact CD2-CG 4.17Å; Y172-F174 HydrophobicContact CD2-CZ 4.01Å; Y172-F174 AromaticContact CE2-CD2 3.57Å; Y172-F174 HydrophobicContact CE2-CD2 3.57Å; Y172-F174 AromaticContact CE2-CE2 3.66Å; Y172-F174 HydrophobicContact CE2-CE2 3.66Å; Y172-F174 HydrophobicContact CG-CD2 4.12Å; Y172-F174 AromaticContact CG-CE2 3.55Å; Y172-F174 HydrophobicContact CG-CE2 3.55Å; Y172-F174 HydrophobicContact CG-CZ 4.02Å; F174-G181 CarbonylContact O-C 3.59Å; F174-G181 VanDerWaalsContact O-CA 3.29Å; F174-G181 WeakPolarHBondContact O-CA 3.28Å; F174-F182 PolarHBondContact N-O 3.36Å; F174-F182 PolarHBondContact O-N 3.05Å; F174-F257 HydrophobicContact CB-CD1 4.19Å; F174-T259 WeakPolarHBondContact CA-O 3.42Å; F174-C260 HydrophobicContact CD1-CB 3.72Å; F174-C260 HydrophobicContact CE1-CB 4.07Å; F174-I262 HydrophobicContact CE1-CG1 4.42Å; F174-I262 HydrophobicContact CZ-CG1 4.33Å
175	Q	87.6	Confident	83.7	Confident	22 Å²	22	41.3 Å²	41.3	10%	0.103	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	148.3	-176.2	-67.8	174.7	-11	0	0	112.6	C173 L180 F257 R258 T259 N266	C173-Q175 VanDerWaalsContact SG-CD 3.53Å; Q175-L180 CarbonylContact C-O 3.58Å; Q175-L180 VanDerWaalsContact CA-O 3.29Å; Q175-L180 WeakPolarHBondContact CA-O 3.5Å; Q175-F257 CarbonylContact O-C 3.56Å; Q175-R258 PolarHBondContact O-N 3.19Å; Q175-T259 WeakPolarHBondContact CB-OG1 3.49Å; Q175-T259 PolarHBondContact N-O 3.35Å; Q175-T259 PolarHBondContact O-N 2.94Å; Q175-T259 VanDerWaalsContact O-N 3.08Å; Q175-T259 PolarHBondContact O-OG1 3.26Å; Q175-T259 VanDerWaalsContact O-OG1 3.08Å; Q175-N266 PolarHBondContact OE1-ND2 2.96Å
176	T	86	Confident	84.9	Confident	5 Å²	5	36.8 Å²	36.8	3%	0.031	17%	0.172	C	C	.	.			trans	-79.3	176.9	169.6	69.9	0	0	0	0	110.9	D178 R179 L180 L251 E255 F257	T176-D178 PolarHBondContact O-N 3.42Å; T176-R179 PolarHBondContact O-N 3.02Å; T176-L180 PolarHBondContact N-O 3.05Å; T176-L180 PolarHBondContact OG1-O 3.31Å; T176-L251 HydrophobicContact CG2-CD2 3.66Å; T176-E255 HydrophobicContact CG2-CB 3.99Å; T176-F257 HydrophobicContact CG2-CD1 4.15Å; T176-F257 HydrophobicContact CG2-CE1 4.14Å; T176-F257 HydrophobicContact CG2-CG 4.36Å; T176-F257 HydrophobicContact CG2-CZ 4.33Å
177	Y	81	Confident	86	Confident	178 Å²	178	32.2 Å²	32.2	70%	0.698	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-36.8	177.5	-176.9	-98	0	0	0	112.8	R179	Y177-R179 PolarHBondContact O-N 3.3Å
178	D	81.9	Confident	86.4	Confident	95 Å²	95	34.1 Å²	34.1	51%	0.508	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	14.6	-179.5	-66.8	-34.1	0	0	0	113.5	T176 L180	T176-D178 PolarHBondContact O-N 3.42Å; D178-L180 HydrophobicContact CB-CD1 4.36Å; D178-L180 HydrophobicContact CB-CG 4.12Å; D178-L180 PolarHBondContact O-N 3.49Å
179	R	81.2	Confident	86.5	Confident	106 Å²	106	34.7 Å²	34.7	40%	0.4	16%	0.163	S	C	.	.	S	Bend	trans	61.6	23.9	-178.6	-54.9	-67.9	-170.4	125.1	-7.9	113.5	T176 Y177 S196 N266 D267	T176-R179 PolarHBondContact O-N 3.02Å; Y177-R179 PolarHBondContact O-N 3.3Å; R179-S196 PolarHBondContact O-OG 3.25Å; R179-N266 VanDerWaalsContact CD-ND2 3.31Å; R179-N266 WeakPolarHBondContact CD-ND2 3.47Å; R179-N266 VanDerWaalsContact CZ-CG 3.42Å; R179-N266 PolarHBondContact NE-ND2 3.13Å; R179-N266 PolarHBondContact NH1-ND2 2.85Å; R179-D267 IonicContact CZ-OD1 3.76Å; R179-D267 IonicContact NH1-OD1 2.76Å; R179-D267 PolarHBondContact NH1-OD1 3Å
180	L	83.9	Confident	86.7	Confident	26 Å²	26	36.7 Å²	36.7	14%	0.136	18%	0.175	C	C	.	.			trans	-88.3	138.1	173.3	-51	-178.8	0	0	0	109.2	Q175 T176 D178 S196 L251	Q175-L180 CarbonylContact C-O 3.58Å; Q175-L180 VanDerWaalsContact CA-O 3.29Å; Q175-L180 WeakPolarHBondContact CA-O 3.5Å; T176-L180 PolarHBondContact N-O 3.05Å; T176-L180 PolarHBondContact OG1-O 3.31Å; D178-L180 HydrophobicContact CB-CD1 4.36Å; D178-L180 HydrophobicContact CB-CG 4.12Å; D178-L180 PolarHBondContact O-N 3.49Å; L180-S196 WeakPolarHBondContact CA-O 3.43Å; L180-S196 WeakPolarHBondContact CA-OG 3.41Å; L180-L251 HydrophobicContact CB-CD2 3.72Å
181	G	83.7	Confident	86.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.1	-156.2	-178.8	0	0	0	0	0	115.2	F174 S196	F174-G181 CarbonylContact O-C 3.59Å; F174-G181 VanDerWaalsContact O-CA 3.29Å; F174-G181 WeakPolarHBondContact O-CA 3.28Å; G181-S196 PolarHBondContact N-O 3.14Å; G181-S196 PolarHBondContact N-OG 3.43Å; G181-S196 PolarHBondContact O-N 2.85Å; G181-S196 PolarHBondContact O-OG 2.88Å
182	F	85.8	Confident	87	Confident	8 Å²	8	37.9 Å²	37.9	4%	0.035	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	135.3	-172	-61.8	-93.9	0	0	0	110.2	W152 Y172 F174 S194 V195 I233 W249 L251	W152-F182 HydrophobicContact CZ2-CD1 4.4Å; W152-F182 HydrophobicContact CZ2-CG 4.34Å; Y172-F182 HydrophobicContact CE2-CB 4.38Å; F174-F182 PolarHBondContact N-O 3.36Å; F174-F182 PolarHBondContact O-N 3.05Å; F182-S194 WeakPolarHBondContact CA-O 3.47Å; F182-V195 HydrophobicContact CD1-CB 4.26Å; F182-V195 HydrophobicContact CD1-CG1 4.04Å; F182-V195 HydrophobicContact CD1-CG2 3.54Å; F182-V195 HydrophobicContact CE1-CB 4.04Å; F182-V195 HydrophobicContact CE1-CG1 3.43Å; F182-V195 VanDerWaalsContact CE1-CG1 3.43Å; F182-V195 HydrophobicContact CE1-CG2 3.48Å; F182-V195 VanDerWaalsContact CE1-CG2 3.48Å; F182-V195 HydrophobicContact CZ-CG1 3.77Å; F182-I233 HydrophobicContact CD1-CD1 4.17Å; F182-I233 HydrophobicContact CE1-CD1 3.92Å; F182-W249 AromaticContact CD2-CH2 3.86Å; F182-W249 HydrophobicContact CD2-CH2 3.86Å; F182-W249 AromaticContact CD2-CZ3 3.85Å; F182-W249 HydrophobicContact CD2-CZ3 3.85Å; F182-W249 HydrophobicContact CE1-CE3 4.23Å; F182-W249 AromaticContact CE1-CZ3 3.88Å; F182-W249 HydrophobicContact CE1-CZ3 3.88Å; F182-W249 HydrophobicContact CE2-CD2 4.42Å; F182-W249 AromaticContact CE2-CE3 3.67Å; F182-W249 HydrophobicContact CE2-CE3 3.67Å; F182-W249 AromaticContact CE2-CH2 3.15Å; F182-W249 HydrophobicContact CE2-CH2 3.15Å; F182-W249 AromaticContact CE2-CZ2 3.99Å; F182-W249 HydrophobicContact CE2-CZ2 3.99Å; F182-W249 AromaticContact CE2-CZ3 2.97Å; F182-W249 HydrophobicContact CE2-CZ3 2.97Å; F182-W249 HydrophobicContact CZ-CD2 4.23Å; F182-W249 AromaticContact CZ-CE3 3.3Å; F182-W249 HydrophobicContact CZ-CE3 3.3Å; F182-W249 AromaticContact CZ-CH2 3.73Å; F182-W249 HydrophobicContact CZ-CH2 3.73Å; F182-W249 AromaticContact CZ-CZ3 3Å; F182-W249 HydrophobicContact CZ-CZ3 3Å; F182-L251 HydrophobicContact CD2-CD1 4.29Å; F182-L251 HydrophobicContact CE2-CD1 3.48Å; F182-L251 VanDerWaalsContact CE2-CD1 3.48Å; F182-L251 HydrophobicContact CZ-CD1 4.27Å
183	S	89.1	Confident	87	Confident	13 Å²	13	37.9 Å²	37.9	9%	0.091	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	150.5	169.9	36.4	0	0	0	0	109.7	Y172 S194	Y172-S183 VanDerWaalsContact O-CA 3.25Å; Y172-S183 WeakPolarHBondContact O-CA 3.32Å; Y172-S183 WeakPolarHBondContact O-CB 3.32Å; S183-S194 PolarHBondContact N-O 3.37Å; S183-S194 PolarHBondContact O-N 2.93Å; S183-S194 PolarHBondContact O-OG 3.4Å; S183-S194 PolarHBondContact OG-OG 2.96Å
184	A	91.7	Very high	87	Confident	0 Å²	0	38 Å²	38	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.9	171.6	0	0	0	0	0	108.1	H170 L171 Y172 L191 F192 L193	H170-A184 CarbonylContact C-O 3.56Å; L171-A184 HydrophobicContact CB-CB 4.21Å; L171-A184 WeakPolarHBondContact CB-O 3.48Å; L171-A184 HydrophobicContact CD2-CB 4.24Å; L171-A184 PolarHBondContact N-O 3.07Å; Y172-A184 HydrophobicContact CD1-CB 3.87Å; Y172-A184 HydrophobicContact CE1-CB 3.43Å; Y172-A184 VanDerWaalsContact CE1-CB 3.43Å; Y172-A184 HydrophobicContact CE2-CB 4.19Å; Y172-A184 HydrophobicContact CG-CB 4.41Å; Y172-A184 PolarHBondContact N-O 3.43Å; Y172-A184 PolarHBondContact O-N 3.3Å; A184-L191 HydrophobicContact CB-CD1 4.13Å; A184-F192 CarbonylContact C-O 3.47Å; A184-F192 VanDerWaalsContact CA-O 3.28Å; A184-F192 WeakPolarHBondContact CA-O 3.24Å; A184-L193 HydrophobicContact CB-CD2 3.78Å
185	Y	90.4	Very high	86.9	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.008	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	152.3	179	62.3	-91.3	0	0	0	111.5	K168 M169 H170 V187 F192 S194 E204	K168-Y185 HydrophobicContact CB-CD2 3.77Å; K168-Y185 HydrophobicContact CB-CE2 4.38Å; K168-Y185 HydrophobicContact CB-CG 4.18Å; K168-Y185 HydrophobicContact CD-CD2 3.76Å; K168-Y185 HydrophobicContact CD-CE1 4.3Å; K168-Y185 HydrophobicContact CD-CE2 3.54Å; K168-Y185 HydrophobicContact CD-CG 4.26Å; K168-Y185 HydrophobicContact CG-CD2 3.65Å; K168-Y185 HydrophobicContact CG-CE2 3.74Å; K168-Y185 HydrophobicContact CG-CG 4.4Å; K168-Y185 PolarHBondContact NZ-OH 3.4Å; M169-Y185 CarbonylContact O-C 3.53Å; M169-Y185 WeakPolarHBondContact O-CA 3.48Å; M169-Y185 WeakPolarHBondContact O-CB 3.18Å; H170-Y185 AromaticContact CE1-CD1 3.85Å; Y185-V187 HydrophobicContact CD2-CG2 3.87Å; Y185-V187 HydrophobicContact CE2-CG2 3.69Å; Y185-F192 HydrophobicContact CD1-CB 4.48Å; Y185-F192 HydrophobicContact CD2-CB 4.07Å; Y185-F192 HydrophobicContact CE1-CB 4.02Å; Y185-F192 HydrophobicContact CE2-CB 3.53Å; Y185-F192 HydrophobicContact CE2-CD2 4.16Å; Y185-F192 AromaticContact CE2-CG 3.9Å; Y185-F192 HydrophobicContact CE2-CG 3.9Å; Y185-F192 HydrophobicContact CG-CB 4.49Å; Y185-F192 VanDerWaalsContact CZ-CB 3.48Å; Y185-F192 PolarHBondContact N-O 3.15Å; Y185-F192 PolarHBondContact O-N 2.87Å; Y185-S194 WeakPolarHBondContact CE1-OG 3.42Å; Y185-E204 WeakPolarHBondContact OH-CG 3.29Å; Y185-E204 PolarHBondContact OH-OE1 3.09Å; Y185-E204 VanDerWaalsContact OH-OE1 3.08Å; Y185-E204 PolarHBondContact OH-OE2 3.38Å
186	F	89	Confident	86.8	Confident	1 Å²	1	37.6 Å²	37.6	0%	0.004	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	142.3	175.6	-68	-86.9	0	0	0	111.4	I158 R160 M169 L171 V190 L191 F211 F274	I158-F186 HydrophobicContact CD1-CE2 4.27Å; I158-F186 HydrophobicContact CD1-CZ 3.59Å; R160-F186 VanDerWaalsContact CZ-CD1 3.42Å; R160-F186 VanDerWaalsContact CZ-CG 3.5Å; R160-F186 VanDerWaalsContact NH1-CD1 3.33Å; M169-F186 HydrophobicContact CB-CB 4.3Å; M169-F186 HydrophobicContact CE-CB 4Å; M169-F186 HydrophobicContact CE-CD2 3.54Å; M169-F186 HydrophobicContact CE-CE2 4.33Å; M169-F186 HydrophobicContact CE-CG 3.99Å; M169-F186 PolarHBondContact N-O 2.91Å; M169-F186 PolarHBondContact O-N 3.41Å; L171-F186 HydrophobicContact CB-CE2 4.33Å; L171-F186 HydrophobicContact CD1-CE2 4.24Å; F186-V190 WeakPolarHBondContact CA-O 3.32Å; F186-L191 HydrophobicContact CD1-CB 3.96Å; F186-L191 HydrophobicContact CD1-CD1 4.07Å; F186-L191 HydrophobicContact CD2-CD1 3.98Å; F186-L191 HydrophobicContact CE1-CB 3.61Å; F186-L191 HydrophobicContact CE1-CD1 3.85Å; F186-L191 HydrophobicContact CE1-CD2 4.5Å; F186-L191 HydrophobicContact CE1-CG 4.17Å; F186-L191 HydrophobicContact CE2-CD1 3.74Å; F186-L191 HydrophobicContact CG-CD1 4.14Å; F186-L191 HydrophobicContact CZ-CB 4.17Å; F186-L191 HydrophobicContact CZ-CD1 3.66Å; F186-L191 HydrophobicContact CZ-CD2 4.26Å; F186-L191 HydrophobicContact CZ-CG 4.24Å; F186-F211 HydrophobicContact CD1-CD2 4.42Å; F186-F211 HydrophobicContact CE1-CB 3.99Å; F186-F211 HydrophobicContact CE1-CD1 4.34Å; F186-F211 AromaticContact CE1-CD2 3.58Å; F186-F211 HydrophobicContact CE1-CD2 3.58Å; F186-F211 HydrophobicContact CE1-CE2 4.08Å; F186-F211 AromaticContact CE1-CG 3.71Å; F186-F211 HydrophobicContact CE1-CG 3.71Å; F186-F211 HydrophobicContact CZ-CD2 4.47Å; F186-F211 HydrophobicContact CZ-CG 4.39Å; F186-F274 HydrophobicContact CD2-CE2 4.48Å; F186-F274 HydrophobicContact CE2-CE2 4.23Å
187	V	86	Confident	86.4	Confident	44 Å²	44	41.9 Å²	41.9	27%	0.267	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	118.1	162.5	-178.9	0	0	0	0	106.5	K168 Y185 E189 V190 F192	K168-V187 HydrophobicContact CG-CG2 4.19Å; Y185-V187 HydrophobicContact CD2-CG2 3.87Å; Y185-V187 HydrophobicContact CE2-CG2 3.69Å; V187-E189 PolarHBondContact O-N 3.38Å; V187-V190 PolarHBondContact N-O 3.36Å; V187-V190 PolarHBondContact O-N 3.5Å; V187-V190 VanDerWaalsContact O-N 3.1Å; V187-F192 HydrophobicContact CB-CD2 4.14Å; V187-F192 HydrophobicContact CB-CE2 3.85Å; V187-F192 HydrophobicContact CG2-CD2 4.04Å; V187-F192 HydrophobicContact CG2-CE2 4.12Å
188	N	82.1	Confident	86.1	Confident	113 Å²	113	35.8 Å²	35.8	60%	0.604	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	-117.7	-170.7	-56.8	-31.9	0	0	0	111.4	R160	R160-N188 PolarHBondContact NH1-O 2.76Å; R160-N188 PolarHBondContact NH2-O 3.29Å
189	E	85.1	Confident	85.5	Confident	84 Å²	84	40.9 Å²	40.9	39%	0.393	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-5.3	-179	-61.1	-168.6	171.7	0	0	114.1	V187 S210 F211	V187-E189 PolarHBondContact O-N 3.38Å; E189-S210 WeakPolarHBondContact CB-OG 3.32Å; E189-S210 PolarHBondContact OE2-OG 3.24Å; E189-F211 PolarHBondContact O-N 3.2Å
190	V	89.1	Confident	85	Confident	45 Å²	45	39.3 Å²	39.3	27%	0.273	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	135.5	-170.8	-179.2	0	0	0	0	110.7	F186 V187 F192 P206	F186-V190 WeakPolarHBondContact CA-O 3.32Å; V187-V190 PolarHBondContact N-O 3.36Å; V187-V190 PolarHBondContact O-N 3.5Å; V187-V190 VanDerWaalsContact O-N 3.1Å; V190-F192 HydrophobicContact CB-CE2 4Å; V190-F192 HydrophobicContact CG1-CD2 4.24Å; V190-F192 HydrophobicContact CG1-CE2 3.81Å; V190-F192 HydrophobicContact CG1-CZ 4.32Å; V190-P206 HydrophobicContact CG1-CB 4Å
191	L	91.7	Very high	84.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	129.5	171.4	-176	58.4	0	0	0	109.6	A184 F186 I207 F211 L219	A184-L191 HydrophobicContact CB-CD1 4.13Å; F186-L191 HydrophobicContact CD1-CB 3.96Å; F186-L191 HydrophobicContact CD1-CD1 4.07Å; F186-L191 HydrophobicContact CD2-CD1 3.98Å; F186-L191 HydrophobicContact CE1-CB 3.61Å; F186-L191 HydrophobicContact CE1-CD1 3.85Å; F186-L191 HydrophobicContact CE1-CD2 4.5Å; F186-L191 HydrophobicContact CE1-CG 4.17Å; F186-L191 HydrophobicContact CE2-CD1 3.74Å; F186-L191 HydrophobicContact CG-CD1 4.14Å; F186-L191 HydrophobicContact CZ-CB 4.17Å; F186-L191 HydrophobicContact CZ-CD1 3.66Å; F186-L191 HydrophobicContact CZ-CD2 4.26Å; F186-L191 HydrophobicContact CZ-CG 4.24Å; L191-I207 HydrophobicContact CB-CB 4.36Å; L191-I207 HydrophobicContact CB-CD1 3.85Å; L191-I207 HydrophobicContact CD2-CD1 3.46Å; L191-I207 VanDerWaalsContact CD2-CD1 3.46Å; L191-I207 HydrophobicContact CG-CD1 3.6Å; L191-I207 WeakPolarHBondContact O-CB 2.96Å; L191-I207 PolarHBondContact O-N 3.15Å; L191-F211 HydrophobicContact CB-CD2 4.14Å; L191-F211 HydrophobicContact CB-CE2 3.61Å; L191-F211 HydrophobicContact CB-CZ 4.38Å; L191-F211 HydrophobicContact CD2-CE2 4.31Å; L191-F211 HydrophobicContact CD2-CZ 4.27Å; L191-L219 HydrophobicContact CD2-CD1 3.88Å; L191-L219 HydrophobicContact CD2-CD2 3.66Å; L191-L219 HydrophobicContact CD2-CG 4.44Å
192	F	91.8	Very high	84.7	Confident	45 Å²	45	46.4 Å²	46.4	20%	0.197	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	134.2	172.7	-73.5	-100.1	0	0	0	109.5	A184 Y185 V187 V190 E204 F205 P206	A184-F192 CarbonylContact C-O 3.47Å; A184-F192 VanDerWaalsContact CA-O 3.28Å; A184-F192 WeakPolarHBondContact CA-O 3.24Å; Y185-F192 HydrophobicContact CD1-CB 4.48Å; Y185-F192 HydrophobicContact CD2-CB 4.07Å; Y185-F192 HydrophobicContact CE1-CB 4.02Å; Y185-F192 HydrophobicContact CE2-CB 3.53Å; Y185-F192 HydrophobicContact CE2-CD2 4.16Å; Y185-F192 AromaticContact CE2-CG 3.9Å; Y185-F192 HydrophobicContact CE2-CG 3.9Å; Y185-F192 HydrophobicContact CG-CB 4.49Å; Y185-F192 VanDerWaalsContact CZ-CB 3.48Å; Y185-F192 PolarHBondContact N-O 3.15Å; Y185-F192 PolarHBondContact O-N 2.87Å; V187-F192 HydrophobicContact CB-CD2 4.14Å; V187-F192 HydrophobicContact CB-CE2 3.85Å; V187-F192 HydrophobicContact CG2-CD2 4.04Å; V187-F192 HydrophobicContact CG2-CE2 4.12Å; V190-F192 HydrophobicContact CB-CE2 4Å; V190-F192 HydrophobicContact CG1-CD2 4.24Å; V190-F192 HydrophobicContact CG1-CE2 3.81Å; V190-F192 HydrophobicContact CG1-CZ 4.32Å; F192-E204 HydrophobicContact CD1-CB 4.5Å; F192-F205 WeakPolarHBondContact CA-O 3.31Å; F192-P206 HydrophobicContact CD1-CB 4.06Å; F192-P206 HydrophobicContact CE1-CB 3.66Å; F192-P206 HydrophobicContact CE1-CG 4.26Å; F192-P206 HydrophobicContact CZ-CB 3.97Å
193	L	91.1	Very high	84.7	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.021	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	120.9	168.4	-58.5	177.9	0	0	0	107.7	A184 E204 F205 I207 I221 I233	A184-L193 HydrophobicContact CB-CD2 3.78Å; L193-E204 CarbonylContact O-C 3.53Å; L193-E204 WeakPolarHBondContact O-CA 3.35Å; L193-F205 PolarHBondContact N-O 2.85Å; L193-F205 WeakPolarHBondContact O-CD2 3.41Å; L193-F205 PolarHBondContact O-N 2.91Å; L193-I207 HydrophobicContact CD1-CD1 3.86Å; L193-I207 HydrophobicContact CD1-CG1 4.19Å; L193-I207 HydrophobicContact CD2-CD1 3.99Å; L193-I207 HydrophobicContact CG-CD1 3.67Å; L193-I207 HydrophobicContact CG-CG1 4.19Å; L193-I221 HydrophobicContact CD2-CD1 3.73Å; L193-I221 HydrophobicContact CD2-CG1 4.4Å; L193-I233 HydrophobicContact CD1-CG2 3.72Å
194	S	89.2	Confident	84.7	Confident	4 Å²	4	51.9 Å²	51.9	3%	0.028	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	134.6	177.3	53.4	0	0	0	0	111.8	F182 S183 Y185 D203	F182-S194 WeakPolarHBondContact CA-O 3.47Å; S183-S194 PolarHBondContact N-O 3.37Å; S183-S194 PolarHBondContact O-N 2.93Å; S183-S194 PolarHBondContact O-OG 3.4Å; S183-S194 PolarHBondContact OG-OG 2.96Å; Y185-S194 WeakPolarHBondContact CE1-OG 3.42Å; S194-D203 CarbonylContact C-O 3.55Å; S194-D203 WeakPolarHBondContact CA-O 3.13Å
195	V	87.3	Confident	84.6	Confident	5 Å²	5	54 Å²	54	3%	0.03	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	117	-178	-174.6	0	0	0	0	108.9	F182 R197 V202 D203 F205 I233 V247	F182-V195 HydrophobicContact CD1-CB 4.26Å; F182-V195 HydrophobicContact CD1-CG1 4.04Å; F182-V195 HydrophobicContact CD1-CG2 3.54Å; F182-V195 HydrophobicContact CE1-CB 4.04Å; F182-V195 HydrophobicContact CE1-CG1 3.43Å; F182-V195 VanDerWaalsContact CE1-CG1 3.43Å; F182-V195 HydrophobicContact CE1-CG2 3.48Å; F182-V195 VanDerWaalsContact CE1-CG2 3.48Å; F182-V195 HydrophobicContact CZ-CG1 3.77Å; V195-R197 HydrophobicContact CG1-CG 4.18Å; V195-V202 WeakPolarHBondContact O-CA 3Å; V195-D203 PolarHBondContact N-O 3.44Å; V195-D203 PolarHBondContact O-N 3.35Å; V195-F205 HydrophobicContact CB-CE2 4.48Å; V195-F205 HydrophobicContact CG2-CD2 4.44Å; V195-F205 HydrophobicContact CG2-CE2 4.06Å; V195-I233 HydrophobicContact CG2-CD1 4.14Å; V195-V247 HydrophobicContact CB-CG1 4.33Å; V195-V247 HydrophobicContact CG1-CG1 4.13Å; V195-V247 HydrophobicContact CG2-CG1 4.1Å
196	S	84.9	Confident	84.7	Confident	12 Å²	12	57.6 Å²	57.6	8%	0.084	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	107.6	176.9	57.9	0	0	0	0	110.6	R179 L180 G181	R179-S196 PolarHBondContact O-OG 3.25Å; L180-S196 WeakPolarHBondContact CA-O 3.43Å; L180-S196 WeakPolarHBondContact CA-OG 3.41Å; G181-S196 PolarHBondContact N-O 3.14Å; G181-S196 PolarHBondContact N-OG 3.43Å; G181-S196 PolarHBondContact O-N 2.85Å; G181-S196 PolarHBondContact O-OG 2.88Å
197	R	78.6	Confident	84.7	Confident	95 Å²	95	57.7 Å²	57.7	36%	0.358	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-33.3	-175	-64.8	-171.7	-92.2	-178.2	-3.7	113	V195 N201 D203 T248 H250	V195-R197 HydrophobicContact CG1-CG 4.18Å; R197-N201 PolarHBondContact N-O 3.42Å; R197-D203 IonicContact CZ-OD1 3.03Å; R197-D203 IonicContact CZ-OD2 3.7Å; R197-D203 IonicContact NE-OD2 2.66Å; R197-D203 PolarHBondContact NE-OD2 2.9Å; R197-D203 IonicContact NH2-OD1 2.66Å; R197-D203 PolarHBondContact NH2-OD1 3.46Å; R197-D203 IonicContact NH2-OD2 3.93Å; R197-D203 PolarHBondContact NH2-OD2 3.19Å; R197-T248 PolarHBondContact NH1-OG1 3.46Å; R197-H250 VanDerWaalsContact CD-CD2 3.4Å; R197-H250 WeakPolarHBondContact CD-CD2 3.37Å
198	S	73.5	Confident	84.7	Confident	50 Å²	50	62.3 Å²	62.3	35%	0.35	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	160.5	174	64.8	0	0	0	0	109.4	G200 N201	S198-G200 PolarHBondContact O-N 3.48Å; S198-N201 PolarHBondContact O-N 3.27Å; S198-N201 WeakPolarHBondContact OG-CB 3.12Å; S198-N201 PolarHBondContact OG-ND2 2.87Å
199	K	70.6	Confident	85.1	Confident	201 Å²	201	59.6 Å²	59.6	87%	0.874	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	107	178.7	-164.9	174.6	-176	174.7	0	110.6
200	G	70.6	Confident	85.2	Confident	74 Å²	74	58.5 Å²	58.5	76%	0.763	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.6	-15.1	-178.7	0	0	0	0	0	116.7	S198	S198-G200 PolarHBondContact O-N 3.48Å
201	N	78.3	Confident	85.1	Confident	105 Å²	105	56.3 Å²	56.3	56%	0.561	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	102.9	173.8	-73	-31	0	0	0	109.7	R197 S198	R197-N201 PolarHBondContact N-O 3.42Å; S198-N201 PolarHBondContact O-N 3.27Å; S198-N201 WeakPolarHBondContact OG-CB 3.12Å; S198-N201 PolarHBondContact OG-ND2 2.87Å
202	V	81.7	Confident	84.6	Confident	70 Å²	70	63.6 Å²	63.6	42%	0.424	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	121.9	176.8	-174.7	0	0	0	0	108.3	V195 E204	V195-V202 WeakPolarHBondContact O-CA 3Å; V202-E204 HydrophobicContact CG1-CG 4.18Å
203	D	86.3	Confident	84	Confident	47 Å²	47	64.2 Å²	64.2	25%	0.251	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	128.5	172.1	-54.4	-86.9	0	0	0	109.1	S194 V195 R197 F205	S194-D203 CarbonylContact C-O 3.55Å; S194-D203 WeakPolarHBondContact CA-O 3.13Å; V195-D203 PolarHBondContact N-O 3.44Å; V195-D203 PolarHBondContact O-N 3.35Å; R197-D203 IonicContact CZ-OD1 3.03Å; R197-D203 IonicContact CZ-OD2 3.7Å; R197-D203 IonicContact NE-OD2 2.66Å; R197-D203 PolarHBondContact NE-OD2 2.9Å; R197-D203 IonicContact NH2-OD1 2.66Å; R197-D203 PolarHBondContact NH2-OD1 3.46Å; R197-D203 IonicContact NH2-OD2 3.93Å; R197-D203 PolarHBondContact NH2-OD2 3.19Å; D203-F205 HydrophobicContact CB-CE1 4.43Å; D203-F205 HydrophobicContact CB-CE2 3.69Å; D203-F205 HydrophobicContact CB-CZ 3.57Å
204	E	89.3	Confident	83.3	Confident	88 Å²	88	69.1 Å²	69.1	41%	0.411	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	127.1	-177.1	-55.1	-176.1	164	0	0	109.4	K168 Y185 F192 L193 V202	K168-E204 IonicContact NZ-OE1 2.65Å; K168-E204 PolarHBondContact NZ-OE1 2.94Å; K168-E204 IonicContact NZ-OE2 3.6Å; Y185-E204 WeakPolarHBondContact OH-CG 3.29Å; Y185-E204 PolarHBondContact OH-OE1 3.09Å; Y185-E204 VanDerWaalsContact OH-OE1 3.08Å; Y185-E204 PolarHBondContact OH-OE2 3.38Å; F192-E204 HydrophobicContact CD1-CB 4.5Å; L193-E204 CarbonylContact O-C 3.53Å; L193-E204 WeakPolarHBondContact O-CA 3.35Å; V202-E204 HydrophobicContact CG1-CG 4.18Å
205	F	90.9	Very high	82.8	Confident	46 Å²	46	72.8 Å²	72.8	20%	0.202	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	114.8	-175.2	-53.3	-79.2	0	0	0	110.2	F192 L193 V195 D203 V245 V247	F192-F205 WeakPolarHBondContact CA-O 3.31Å; L193-F205 PolarHBondContact N-O 2.85Å; L193-F205 WeakPolarHBondContact O-CD2 3.41Å; L193-F205 PolarHBondContact O-N 2.91Å; V195-F205 HydrophobicContact CB-CE2 4.48Å; V195-F205 HydrophobicContact CG2-CD2 4.44Å; V195-F205 HydrophobicContact CG2-CE2 4.06Å; D203-F205 HydrophobicContact CB-CE1 4.43Å; D203-F205 HydrophobicContact CB-CE2 3.69Å; D203-F205 HydrophobicContact CB-CZ 3.57Å; F205-V245 HydrophobicContact CB-CG1 3.95Å; F205-V245 HydrophobicContact CB-CG2 4.14Å; F205-V245 HydrophobicContact CD1-CG1 3.32Å; F205-V245 HydrophobicContact CD2-CG1 3.99Å; F205-V245 HydrophobicContact CE1-CG1 3.68Å; F205-V245 HydrophobicContact CE2-CG1 4.31Å; F205-V245 HydrophobicContact CG-CG1 3.48Å; F205-V245 VanDerWaalsContact CG-CG1 3.48Å; F205-V245 HydrophobicContact CZ-CG1 4.16Å; F205-V247 HydrophobicContact CD2-CG2 4.16Å; F205-V247 HydrophobicContact CE1-CG2 4.4Å; F205-V247 HydrophobicContact CE2-CG1 4.32Å; F205-V247 HydrophobicContact CE2-CG2 3.57Å; F205-V247 HydrophobicContact CZ-CG2 3.7Å
206	P	91.8	Very high	82.8	Confident	76 Å²	76	74.4 Å²	74.4	49%	0.494	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	134	174.7	28.5	-31.6	0	0	0	110.8	V190 F192	V190-P206 HydrophobicContact CG1-CB 4Å; F192-P206 HydrophobicContact CD1-CB 4.06Å; F192-P206 HydrophobicContact CE1-CB 3.66Å; F192-P206 HydrophobicContact CE1-CG 4.26Å; F192-P206 HydrophobicContact CZ-CB 3.97Å
207	I	88.7	Confident	83.1	Confident	3 Å²	3	74.4 Å²	74.4	2%	0.015	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	131	170.7	-69.7	159.6	0	0	0	108.6	L191 L193 F209 C235	L191-I207 HydrophobicContact CB-CB 4.36Å; L191-I207 HydrophobicContact CB-CD1 3.85Å; L191-I207 HydrophobicContact CD2-CD1 3.46Å; L191-I207 VanDerWaalsContact CD2-CD1 3.46Å; L191-I207 HydrophobicContact CG-CD1 3.6Å; L191-I207 WeakPolarHBondContact O-CB 2.96Å; L191-I207 PolarHBondContact O-N 3.15Å; L193-I207 HydrophobicContact CD1-CD1 3.86Å; L193-I207 HydrophobicContact CD1-CG1 4.19Å; L193-I207 HydrophobicContact CD2-CD1 3.99Å; L193-I207 HydrophobicContact CG-CD1 3.67Å; L193-I207 HydrophobicContact CG-CG1 4.19Å; I207-F209 HydrophobicContact CG2-CB 4.06Å; I207-F209 PolarHBondContact O-N 3.28Å; I207-C235 HydrophobicContact CD1-CB 3.86Å; I207-C235 WeakPolarHBondContact CD1-SG 3.27Å; I207-C235 HydrophobicContact CG1-CB 4.01Å; I207-C235 HydrophobicContact CG2-CB 4.28Å
208	N	87.2	Confident	83.8	Confident	141 Å²	141	69.9 Å²	69.9	75%	0.754	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	54.9	-177.9	-165.3	20.6	0	0	0	112.9	V242	N208-V242 WeakPolarHBondContact O-CG1 3.26Å
209	F	89.4	Confident	84.9	Confident	57 Å²	57	67.5 Å²	67.5	25%	0.25	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	135.4	178.3	-166.3	-100.7	0	0	0	110.6	I207 F211 F217 V237 V242	I207-F209 HydrophobicContact CG2-CB 4.06Å; I207-F209 PolarHBondContact O-N 3.28Å; F209-F211 HydrophobicContact CB-CE2 4.05Å; F209-F211 HydrophobicContact CB-CZ 4.46Å; F209-F211 AromaticContact CD1-CD1 3.83Å; F209-F211 HydrophobicContact CD1-CD1 3.83Å; F209-F211 AromaticContact CD1-CD2 3.7Å; F209-F211 HydrophobicContact CD1-CD2 3.7Å; F209-F211 AromaticContact CD1-CE1 3.81Å; F209-F211 HydrophobicContact CD1-CE1 3.81Å; F209-F211 AromaticContact CD1-CE2 3.69Å; F209-F211 HydrophobicContact CD1-CE2 3.69Å; F209-F211 AromaticContact CD1-CG 3.79Å; F209-F211 HydrophobicContact CD1-CG 3.79Å; F209-F211 AromaticContact CD1-CZ 3.74Å; F209-F211 HydrophobicContact CD1-CZ 3.74Å; F209-F211 AromaticContact CE1-CD1 3.93Å; F209-F211 HydrophobicContact CE1-CD1 3.93Å; F209-F211 HydrophobicContact CE1-CE1 4.11Å; F209-F211 HydrophobicContact CE1-CG 4.16Å; F209-F211 HydrophobicContact CE1-CZ 4.49Å; F209-F211 HydrophobicContact CG-CE2 4.34Å; F209-F211 HydrophobicContact CG-CZ 4.46Å; F209-F217 AromaticContact CE1-CD1 3.83Å; F209-F217 HydrophobicContact CE1-CD1 3.83Å; F209-F217 AromaticContact CE1-CE1 3.68Å; F209-F217 HydrophobicContact CE1-CE1 3.68Å; F209-F217 HydrophobicContact CE1-CZ 4.23Å; F209-F217 HydrophobicContact CZ-CD1 4Å; F209-F217 AromaticContact CZ-CE1 3.68Å; F209-F217 HydrophobicContact CZ-CE1 3.68Å; F209-F217 HydrophobicContact CZ-CZ 4.49Å; F209-V237 HydrophobicContact CB-CG2 4.47Å; F209-V237 HydrophobicContact CD1-CG1 4.07Å; F209-V237 HydrophobicContact CD1-CG2 4.22Å; F209-V237 HydrophobicContact CE1-CG1 3.7Å; F209-V237 HydrophobicContact CE2-CG1 4.19Å; F209-V237 HydrophobicContact CG-CG1 4.47Å; F209-V237 HydrophobicContact CG-CG2 4.16Å; F209-V237 HydrophobicContact CZ-CG1 3.76Å; F209-V242 HydrophobicContact CB-CG1 3.72Å; F209-V242 HydrophobicContact CD2-CG1 4.08Å; F209-V242 HydrophobicContact CD2-CG2 4.19Å; F209-V242 HydrophobicContact CG-CG1 4.33Å
210	S	88.3	Confident	86.1	Confident	60 Å²	60	57.9 Å²	57.9	42%	0.42	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	108.4	172.3	-134.8	0	0	0	0	109.9	E189 R212	E189-S210 WeakPolarHBondContact CB-OG 3.32Å; E189-S210 PolarHBondContact OE2-OG 3.24Å; S210-R212 PolarHBondContact O-N 3.02Å
211	F	86.9	Confident	87.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.273	C	S	.	.			trans	-81.2	99.3	175.5	-67.2	-92.8	0	0	0	109.5	I158 R160 F186 E189 L191 F209 F217 L219 V237	I158-F211 HydrophobicContact CD1-CD1 3.95Å; I158-F211 HydrophobicContact CD1-CE1 3.99Å; R160-F211 PolarHBondContact NH1-O 3.36Å; F186-F211 HydrophobicContact CD1-CD2 4.42Å; F186-F211 HydrophobicContact CE1-CB 3.99Å; F186-F211 HydrophobicContact CE1-CD1 4.34Å; F186-F211 AromaticContact CE1-CD2 3.58Å; F186-F211 HydrophobicContact CE1-CD2 3.58Å; F186-F211 HydrophobicContact CE1-CE2 4.08Å; F186-F211 AromaticContact CE1-CG 3.71Å; F186-F211 HydrophobicContact CE1-CG 3.71Å; F186-F211 HydrophobicContact CZ-CD2 4.47Å; F186-F211 HydrophobicContact CZ-CG 4.39Å; E189-F211 PolarHBondContact O-N 3.2Å; L191-F211 HydrophobicContact CB-CD2 4.14Å; L191-F211 HydrophobicContact CB-CE2 3.61Å; L191-F211 HydrophobicContact CB-CZ 4.38Å; L191-F211 HydrophobicContact CD2-CE2 4.31Å; L191-F211 HydrophobicContact CD2-CZ 4.27Å; F209-F211 HydrophobicContact CB-CE2 4.05Å; F209-F211 HydrophobicContact CB-CZ 4.46Å; F209-F211 AromaticContact CD1-CD1 3.83Å; F209-F211 HydrophobicContact CD1-CD1 3.83Å; F209-F211 AromaticContact CD1-CD2 3.7Å; F209-F211 HydrophobicContact CD1-CD2 3.7Å; F209-F211 AromaticContact CD1-CE1 3.81Å; F209-F211 HydrophobicContact CD1-CE1 3.81Å; F209-F211 AromaticContact CD1-CE2 3.69Å; F209-F211 HydrophobicContact CD1-CE2 3.69Å; F209-F211 AromaticContact CD1-CG 3.79Å; F209-F211 HydrophobicContact CD1-CG 3.79Å; F209-F211 AromaticContact CD1-CZ 3.74Å; F209-F211 HydrophobicContact CD1-CZ 3.74Å; F209-F211 AromaticContact CE1-CD1 3.93Å; F209-F211 HydrophobicContact CE1-CD1 3.93Å; F209-F211 HydrophobicContact CE1-CE1 4.11Å; F209-F211 HydrophobicContact CE1-CG 4.16Å; F209-F211 HydrophobicContact CE1-CZ 4.49Å; F209-F211 HydrophobicContact CG-CE2 4.34Å; F209-F211 HydrophobicContact CG-CZ 4.46Å; F211-F217 HydrophobicContact CD1-CB 4.16Å; F211-F217 AromaticContact CD1-CD2 3.99Å; F211-F217 HydrophobicContact CD1-CD2 3.99Å; F211-F217 AromaticContact CD1-CG 3.99Å; F211-F217 HydrophobicContact CD1-CG 3.99Å; F211-F217 HydrophobicContact CE1-CB 4.25Å; F211-F217 HydrophobicContact CE1-CG 4.44Å; F211-L219 HydrophobicContact CE1-CD1 4.49Å; F211-L219 HydrophobicContact CZ-CD1 4.12Å; F211-V237 HydrophobicContact CE1-CG1 4.05Å; F211-V237 HydrophobicContact CE1-CG2 3.99Å; F211-V237 HydrophobicContact CZ-CG2 3.66Å
212	R	80.8	Confident	87.9	Confident	153 Å²	153	49.5 Å²	49.5	58%	0.577	25%	0.247	S	C	*	.			trans	-60.8	145.4	177.4	-66.7	-178.1	-178.6	170	1.8	111.1	S210 F217	S210-R212 PolarHBondContact O-N 3.02Å; R212-F217 HydrophobicContact CB-CE2 4.43Å; R212-F217 HydrophobicContact CB-CZ 4.31Å
213	L	79.7	Confident	88.3	Confident	58 Å²	58	46.2 Å²	46.2	30%	0.304	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	148.9	173.4	-57.4	176.6	0	0	0	109.6	R160 R162 E215	R160-L213 HydrophobicContact CB-CD2 4.14Å; R162-L213 HydrophobicContact CB-CD1 4.06Å; R162-L213 HydrophobicContact CG-CD1 4.18Å; L213-E215 VanDerWaalsContact C-N 3.28Å; L213-E215 PolarHBondContact O-N 3.49Å
214	H	75.1	Confident	88.4	Confident	106 Å²	106	45.2 Å²	45.2	49%	0.491	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	23.9	175.6	-50.3	84.4	0	0	0	116	Y159 R160	Y159-H214 VanDerWaalsContact CE2-CA 3.49Å; Y159-H214 HydrophobicContact CE2-CB 4.33Å; Y159-H214 VanDerWaalsContact CE2-O 3.25Å; Y159-H214 WeakPolarHBondContact CE2-O 2.85Å; Y159-H214 VanDerWaalsContact CZ-CA 3.44Å; Y159-H214 WeakPolarHBondContact OH-CA 3.12Å; Y159-H214 WeakPolarHBondContact OH-CB 3.49Å; Y159-H214 PolarHBondContact OH-CD2 3.12Å; R160-H214 PolarHBondContact O-N 3.17Å
215	E	80	Confident	88.1	Confident	82 Å²	82	44.5 Å²	44.5	38%	0.383	22%	0.219	S	C	.	.			trans	-124	148.6	171.8	-70.5	-179.9	174.9	0	0	110.4	L213 F217	L213-E215 VanDerWaalsContact C-N 3.28Å; L213-E215 PolarHBondContact O-N 3.49Å; E215-F217 HydrophobicContact CB-CD2 4.42Å; E215-F217 HydrophobicContact CB-CE2 3.63Å; E215-F217 HydrophobicContact CB-CZ 3.89Å; E215-F217 WeakPolarHBondContact OE2-CZ 3.5Å
216	W	87.3	Confident	87.4	Confident	39 Å²	39	46.7 Å²	46.7	15%	0.148	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	126.7	174.7	-78.5	97.1	0	0	0	110.2	P124 Y127 W157 I158 Y159 H277	P124-W216 HydrophobicContact CG-CD2 3.85Å; P124-W216 HydrophobicContact CG-CE3 3.95Å; P124-W216 HydrophobicContact CG-CH2 3.44Å; P124-W216 VanDerWaalsContact CG-CH2 3.44Å; P124-W216 HydrophobicContact CG-CZ2 3.33Å; P124-W216 HydrophobicContact CG-CZ3 3.77Å; Y127-W216 HydrophobicContact CD1-CH2 4.23Å; Y127-W216 HydrophobicContact CD1-CZ2 4.04Å; Y127-W216 AromaticContact CG-CH2 4Å; Y127-W216 HydrophobicContact CG-CH2 4Å; Y127-W216 HydrophobicContact CG-CZ2 4.21Å; W157-W216 HydrophobicContact CB-CE3 3.99Å; W157-W216 HydrophobicContact CB-CZ3 4.16Å; W157-W216 HydrophobicContact CE3-CB 4.45Å; I158-W216 WeakPolarHBondContact O-CA 3.42Å; Y159-W216 AromaticContact CD2-CD1 3.63Å; Y159-W216 HydrophobicContact CD2-CD2 4.09Å; Y159-W216 AromaticContact CD2-CE2 3.85Å; Y159-W216 AromaticContact CD2-CG 3.96Å; Y159-W216 HydrophobicContact CD2-CG 3.96Å; Y159-W216 AromaticContact CD2-NE1 3.54Å; Y159-W216 HydrophobicContact CG-CD2 4.29Å; Y159-W216 AromaticContact CG-CE2 3.98Å; Y159-W216 HydrophobicContact CG-CZ2 4.24Å; W216-H277 HydrophobicContact CH2-CB 3.53Å; W216-H277 HydrophobicContact CZ2-CB 3.95Å; W216-H277 HydrophobicContact CZ3-CB 4.41Å
217	F	91	Very high	86.5	Confident	11 Å²	11	52.7 Å²	52.7	5%	0.048	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	136.4	175	-65.6	-80.3	0	0	0	110.5	W157 I158 F209 F211 R212 E215 V237 N238	W157-F217 CarbonylContact C-O 3.56Å; W157-F217 WeakPolarHBondContact CA-O 3.33Å; I158-F217 HydrophobicContact CG1-CB 4.06Å; I158-F217 PolarHBondContact N-O 2.9Å; I158-F217 PolarHBondContact O-N 3.13Å; F209-F217 AromaticContact CE1-CD1 3.83Å; F209-F217 HydrophobicContact CE1-CD1 3.83Å; F209-F217 AromaticContact CE1-CE1 3.68Å; F209-F217 HydrophobicContact CE1-CE1 3.68Å; F209-F217 HydrophobicContact CE1-CZ 4.23Å; F209-F217 HydrophobicContact CZ-CD1 4Å; F209-F217 AromaticContact CZ-CE1 3.68Å; F209-F217 HydrophobicContact CZ-CE1 3.68Å; F209-F217 HydrophobicContact CZ-CZ 4.49Å; F211-F217 HydrophobicContact CD1-CB 4.16Å; F211-F217 AromaticContact CD1-CD2 3.99Å; F211-F217 HydrophobicContact CD1-CD2 3.99Å; F211-F217 AromaticContact CD1-CG 3.99Å; F211-F217 HydrophobicContact CD1-CG 3.99Å; F211-F217 HydrophobicContact CE1-CB 4.25Å; F211-F217 HydrophobicContact CE1-CG 4.44Å; R212-F217 HydrophobicContact CB-CE2 4.43Å; R212-F217 HydrophobicContact CB-CZ 4.31Å; E215-F217 HydrophobicContact CB-CD2 4.42Å; E215-F217 HydrophobicContact CB-CE2 3.63Å; E215-F217 HydrophobicContact CB-CZ 3.89Å; E215-F217 WeakPolarHBondContact OE2-CZ 3.5Å; F217-V237 HydrophobicContact CB-CG1 4.29Å; F217-V237 HydrophobicContact CD1-CG1 3.93Å; F217-V237 HydrophobicContact CG-CG1 4.47Å; F217-N238 WeakPolarHBondContact CA-OD1 3.48Å
218	M	93.4	Very high	85.8	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	119.6	165	174.2	172.1	157.6	0	0	108.3	H155 W157 T220 V237 N238 I293 I296 Y297	H155-M218 VanDerWaalsContact CE1-CE 3.45Å; H155-M218 WeakPolarHBondContact CE1-CE 3.23Å; W157-M218 HydrophobicContact CD2-CB 3.89Å; W157-M218 HydrophobicContact CE3-CB 3.9Å; W157-M218 HydrophobicContact CH2-CB 3.82Å; W157-M218 HydrophobicContact CZ2-CB 3.78Å; W157-M218 HydrophobicContact CZ2-CG 4.32Å; W157-M218 HydrophobicContact CZ2-SD 4.06Å; W157-M218 HydrophobicContact CZ3-CB 3.88Å; M218-T220 WeakPolarHBondContact CE-OG1 3.39Å; M218-V237 CarbonylContact O-C 3.58Å; M218-V237 VanDerWaalsContact O-CA 3.26Å; M218-V237 WeakPolarHBondContact O-CA 3.4Å; M218-N238 PolarHBondContact N-OD1 3.37Å; M218-N238 PolarHBondContact O-N 3.42Å; M218-I293 HydrophobicContact CE-CG2 3.85Å; M218-I293 WeakPolarHBondContact CE-O 3.37Å; M218-I296 HydrophobicContact CE-CB 3.86Å; M218-I296 HydrophobicContact CE-CG2 3.66Å; M218-I296 HydrophobicContact SD-CG2 4.23Å; M218-Y297 HydrophobicContact CB-CD2 4.04Å; M218-Y297 WeakPolarHBondContact SD-CA 3.44Å; M218-Y297 VanDerWaalsContact SD-CB 3.54Å; M218-Y297 HydrophobicContact SD-CD2 3.74Å; M218-Y297 HydrophobicContact SD-CG 4.13Å
219	L	94.9	Very high	84.8	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	123.7	176.5	178.5	66.3	0	0	0	109.3	H155 C156 I158 L171 L191 F211 I221 C235 V237	H155-L219 WeakPolarHBondContact CA-O 3.39Å; C156-L219 PolarHBondContact N-O 3.39Å; C156-L219 PolarHBondContact O-N 3.05Å; C156-L219 VanDerWaalsContact O-O 3.09Å; I158-L219 HydrophobicContact CD1-CB 4.36Å; I158-L219 HydrophobicContact CD1-CD2 4.18Å; I158-L219 HydrophobicContact CG1-CB 4.49Å; L171-L219 HydrophobicContact CD2-CD2 3.42Å; L171-L219 VanDerWaalsContact CD2-CD2 3.42Å; L191-L219 HydrophobicContact CD2-CD1 3.88Å; L191-L219 HydrophobicContact CD2-CD2 3.66Å; L191-L219 HydrophobicContact CD2-CG 4.44Å; F211-L219 HydrophobicContact CE1-CD1 4.49Å; F211-L219 HydrophobicContact CZ-CD1 4.12Å; L219-I221 HydrophobicContact CD1-CG1 4.25Å; L219-I221 HydrophobicContact CD2-CD1 4.16Å; L219-I221 HydrophobicContact CG-CD1 4.33Å; L219-I221 HydrophobicContact CG-CG1 4.33Å; L219-C235 VanDerWaalsContact CD1-SG 3.57Å; L219-V237 HydrophobicContact CD1-CG2 4.42Å
220	T	96	Very high	84.2	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	116.6	173.8	-52.8	0	0	0	0	109.3	T153 F154 H155 M218 V222 Y236 I293	T153-T220 HydrophobicContact CG2-CG2 3.31Å; F154-T220 CarbonylContact O-C 3.54Å; F154-T220 WeakPolarHBondContact O-CA 3.14Å; H155-T220 HydrophobicContact CB-CG2 4.29Å; H155-T220 PolarHBondContact ND1-OG1 3.4Å; M218-T220 WeakPolarHBondContact CE-OG1 3.39Å; T220-V222 HydrophobicContact CG2-CG2 3.97Å; T220-Y236 PolarHBondContact N-O 2.91Å; T220-Y236 PolarHBondContact O-N 3.26Å; T220-I293 HydrophobicContact CG2-CD1 4.07Å; T220-I293 HydrophobicContact CG2-CG1 4.15Å; T220-I293 HydrophobicContact CG2-CG2 4.47Å
221	I	94.2	Very high	84.1	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	116.6	177.5	-64.6	160.1	0	0	0	107.5	W152 T153 F154 Y172 L193 L219 I233 L234	W152-I221 HydrophobicContact CH2-CG2 4.25Å; W152-I221 HydrophobicContact CZ3-CG2 4.18Å; T153-I221 CarbonylContact C-O 3.55Å; T153-I221 WeakPolarHBondContact CA-O 2.9Å; F154-I221 PolarHBondContact N-O 3.36Å; F154-I221 PolarHBondContact O-N 2.98Å; Y172-I221 HydrophobicContact CE1-CD1 3.76Å; L193-I221 HydrophobicContact CD2-CD1 3.73Å; L193-I221 HydrophobicContact CD2-CG1 4.4Å; L219-I221 HydrophobicContact CD1-CG1 4.25Å; L219-I221 HydrophobicContact CD2-CD1 4.16Å; L219-I221 HydrophobicContact CG-CD1 4.33Å; L219-I221 HydrophobicContact CG-CG1 4.33Å; I221-I233 HydrophobicContact CG2-CG2 3.67Å; I221-L234 WeakPolarHBondContact CA-O 3.48Å
222	V	93.4	Very high	84.2	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	120.7	-176.9	-176.8	0	0	0	0	108.4	T153 T220 I233 L234 Y236 A287 I293	T153-V222 HydrophobicContact CG2-CG2 3.72Å; T220-V222 HydrophobicContact CG2-CG2 3.97Å; V222-I233 CarbonylContact O-C 3.26Å; V222-I233 WeakPolarHBondContact O-CA 3.5Å; V222-L234 HydrophobicContact CB-CB 4.21Å; V222-L234 PolarHBondContact N-O 2.94Å; V222-L234 PolarHBondContact O-N 2.89Å; V222-Y236 HydrophobicContact CG2-CD2 4.08Å; V222-Y236 HydrophobicContact CG2-CE2 4.01Å; V222-A287 HydrophobicContact CG1-CB 3.64Å; V222-I293 HydrophobicContact CG2-CD1 3.67Å
223	H	90.7	Very high	84.6	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	115.5	163.8	173	-109.1	0	0	0	108.5	G151 W152 S231 W249 A287	G151-H223 CarbonylContact C-O 3.45Å; G151-H223 WeakPolarHBondContact CA-O 3.24Å; W152-H223 AromaticContact CD1-CG 3.96Å; W152-H223 AromaticContact CD1-ND1 3.53Å; W152-H223 HydrophobicContact CD2-CB 3.69Å; W152-H223 AromaticContact CE2-CG 3.89Å; W152-H223 HydrophobicContact CE3-CB 4.34Å; W152-H223 HydrophobicContact CG-CB 4.01Å; W152-H223 HydrophobicContact CH2-CB 4.28Å; W152-H223 HydrophobicContact CZ2-CB 3.63Å; W152-H223 PolarHBondContact N-O 3.45Å; W152-H223 VanDerWaalsContact NE1-CB 3.32Å; W152-H223 AromaticContact NE1-CG 3.45Å; W152-H223 AromaticContact NE1-ND1 3.32Å; W152-H223 PolarHBondContact NE1-ND1 3.39Å; W152-H223 PolarHBondContact O-N 2.93Å; H223-S231 WeakPolarHBondContact NE2-CB 3.05Å; H223-W249 AromaticContact CD2-CE3 3.88Å; H223-W249 AromaticContact CE1-CD2 3.78Å; H223-W249 AromaticContact CE1-CE3 3.35Å; H223-W249 AromaticContact ND1-CE3 3.8Å; H223-W249 AromaticContact ND1-CZ3 3.99Å; H223-W249 AromaticContact NE2-CE3 3.38Å; H223-A287 WeakPolarHBondContact O-CB 3.48Å
224	S	88	Confident	85.2	Confident	26 Å²	26	49.1 Å²	49.1	18%	0.182	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	128.8	174.8	-173.9	0	0	0	0	109.4	L226 S231 S232	S224-L226 WeakPolarHBondContact OG-CD1 3.36Å; S224-S231 WeakPolarHBondContact O-CA 3.44Å; S224-S232 PolarHBondContact N-O 3.3Å; S224-S232 PolarHBondContact O-N 2.8Å
225	F	82.6	Confident	86.2	Confident	73 Å²	73	44.1 Å²	44.1	32%	0.32	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	115.1	177.8	175	-98.3	0	0	0	110	Q149	Q149-F225 HydrophobicContact CG-CD2 4.38Å; Q149-F225 HydrophobicContact CG-CE2 4.27Å; Q149-F225 HydrophobicContact CG-CZ 4.44Å; Q149-F225 WeakPolarHBondContact O-CB 3.41Å; Q149-F225 WeakPolarHBondContact O-CD1 3.33Å; Q149-F225 WeakPolarHBondContact O-CG 3.49Å
226	L	77.1	Confident	86.9	Confident	92 Å²	92	40.9 Å²	40.9	48%	0.482	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	118.5	173.6	-79.7	78.7	0	0	0	109.6	S224 W228 G229 G230	S224-L226 WeakPolarHBondContact OG-CD1 3.36Å; L226-W228 PolarHBondContact O-N 3.21Å; L226-G229 PolarHBondContact O-N 3.26Å; L226-G230 PolarHBondContact N-O 3.3Å; L226-G230 PolarHBondContact O-N 2.68Å
227	R	72.9	Confident	87.2	Confident	202 Å²	202	39 Å²	39	76%	0.762	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-32.7	-179.3	-174.7	177.5	-178.9	96	1	114.1
228	W	73.4	Confident	87.2	Confident	239 Å²	239	40.5 Å²	40.5	91%	0.905	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.7	-4.2	179.7	-52.3	107.9	0	0	0	113.8	L226	L226-W228 PolarHBondContact O-N 3.21Å
229	G	65.1	Low	87.1	Confident	62 Å²	62	41.1 Å²	41.1	64%	0.639	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.3	-1.3	-170	0	0	0	0	0	115	L226	L226-G229 PolarHBondContact O-N 3.26Å
230	G	77.7	Confident	86.9	Confident	43 Å²	43	45.3 Å²	45.3	44%	0.443	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	83.7	-179.4	-171.1	0	0	0	0	0	112.3	L226	L226-G230 PolarHBondContact N-O 3.3Å; L226-G230 PolarHBondContact O-N 2.68Å
231	S	85.4	Confident	86.8	Confident	10 Å²	10	49.4 Å²	49.4	7%	0.07	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	141.5	174.6	39.8	0	0	0	0	110.2	H223 S224 V247 T248 W249	H223-S231 WeakPolarHBondContact NE2-CB 3.05Å; S224-S231 WeakPolarHBondContact O-CA 3.44Å; S231-V247 CarbonylContact C-O 3.6Å; S231-V247 VanDerWaalsContact CB-O 3.23Å; S231-V247 WeakPolarHBondContact CB-O 3.3Å; S231-V247 CarbonylContact O-C 3.58Å; S231-V247 PolarHBondContact O-N 2.82Å; S231-V247 PolarHBondContact OG-O 2.92Å; S231-T248 WeakPolarHBondContact OG-CA 3.49Å; S231-W249 PolarHBondContact OG-N 3.46Å
232	S	88.6	Confident	86.8	Confident	16 Å²	16	51.1 Å²	51.1	11%	0.112	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	142.5	-178.4	64.4	0	0	0	0	110.3	S224 N244 V245	S224-S232 PolarHBondContact N-O 3.3Å; S224-S232 PolarHBondContact O-N 2.8Å; S232-N244 WeakPolarHBondContact CB-OD1 3.49Å; S232-V245 CarbonylContact C-O 3.5Å; S232-V245 VanDerWaalsContact CA-O 3.31Å; S232-V245 WeakPolarHBondContact CA-O 3.38Å
233	I	89.9	Confident	86.7	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	115.8	172.4	-55.2	174.5	0	0	0	108.1	F182 L193 V195 I221 V222 V245 V247	F182-I233 HydrophobicContact CD1-CD1 4.17Å; F182-I233 HydrophobicContact CE1-CD1 3.92Å; L193-I233 HydrophobicContact CD1-CG2 3.72Å; V195-I233 HydrophobicContact CG2-CD1 4.14Å; I221-I233 HydrophobicContact CG2-CG2 3.67Å; V222-I233 CarbonylContact O-C 3.26Å; V222-I233 WeakPolarHBondContact O-CA 3.5Å; I233-V245 PolarHBondContact N-O 3.01Å; I233-V245 PolarHBondContact O-N 3.47Å; I233-V247 HydrophobicContact CD1-CB 4.19Å; I233-V247 HydrophobicContact CD1-CG2 4.02Å; I233-V247 HydrophobicContact CG1-CB 4.41Å; I233-V247 HydrophobicContact CG1-CG2 4.33Å
234	L	93.2	Very high	86.8	Confident	24 Å²	24	56 Å²	56	13%	0.126	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	128.5	178.2	-59	160.7	0	0	0	108.5	I221 V222 Y236 L241 S243 N244	I221-L234 WeakPolarHBondContact CA-O 3.48Å; V222-L234 HydrophobicContact CB-CB 4.21Å; V222-L234 PolarHBondContact N-O 2.94Å; V222-L234 PolarHBondContact O-N 2.89Å; L234-Y236 HydrophobicContact CB-CD2 4.31Å; L234-Y236 HydrophobicContact CB-CE2 3.69Å; L234-Y236 HydrophobicContact CD1-CE2 4.4Å; L234-L241 HydrophobicContact CB-CD1 3.83Å; L234-L241 HydrophobicContact CD2-CD1 3.79Å; L234-L241 HydrophobicContact CD2-CD2 4.27Å; L234-L241 HydrophobicContact CG-CD1 4.42Å; L234-S243 WeakPolarHBondContact CA-O 3.3Å; L234-N244 HydrophobicContact CD2-CB 3.7Å; L234-N244 VanDerWaalsContact CD2-OD1 3.23Å; L234-N244 WeakPolarHBondContact CD2-OD1 3.32Å
235	C	94.7	Very high	86.8	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.007	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	119.4	174.1	-176.1	0	0	0	0	109.8	I207 L219 V242 S243	I207-C235 HydrophobicContact CD1-CB 3.86Å; I207-C235 WeakPolarHBondContact CD1-SG 3.27Å; I207-C235 HydrophobicContact CG1-CB 4.01Å; I207-C235 HydrophobicContact CG2-CB 4.28Å; L219-C235 VanDerWaalsContact CD1-SG 3.57Å; C235-V242 PolarHBondContact O-N 3.44Å; C235-S243 PolarHBondContact N-O 3.34Å; C235-S243 PolarHBondContact O-N 2.74Å
236	Y	95.8	Very high	86.9	Confident	13 Å²	13	58.5 Å²	58.5	5%	0.051	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	135.5	173.8	-64.3	-104.6	0	0	0	110.2	T220 V222 L234 T240 L241 P290 I293	T220-Y236 PolarHBondContact N-O 2.91Å; T220-Y236 PolarHBondContact O-N 3.26Å; V222-Y236 HydrophobicContact CG2-CD2 4.08Å; V222-Y236 HydrophobicContact CG2-CE2 4.01Å; L234-Y236 HydrophobicContact CB-CD2 4.31Å; L234-Y236 HydrophobicContact CB-CE2 3.69Å; L234-Y236 HydrophobicContact CD1-CE2 4.4Å; Y236-T240 CarbonylContact C-O 3.51Å; Y236-T240 WeakPolarHBondContact CA-O 3.46Å; Y236-L241 HydrophobicContact CD1-CB 3.88Å; Y236-L241 HydrophobicContact CD1-CD1 4.36Å; Y236-L241 HydrophobicContact CD2-CD1 4.08Å; Y236-L241 HydrophobicContact CE1-CB 3.59Å; Y236-L241 HydrophobicContact CE1-CD1 4.03Å; Y236-L241 HydrophobicContact CE1-CG 4.37Å; Y236-L241 HydrophobicContact CE2-CD1 3.75Å; Y236-L241 HydrophobicContact CG-CD1 4.37Å; Y236-P290 HydrophobicContact CE1-CB 4.04Å; Y236-I293 HydrophobicContact CD1-CD1 4.07Å; Y236-I293 HydrophobicContact CD1-CG2 4.04Å; Y236-I293 HydrophobicContact CD2-CD1 3.51Å; Y236-I293 HydrophobicContact CE1-CD1 4.08Å; Y236-I293 HydrophobicContact CE2-CD1 3.51Å; Y236-I293 HydrophobicContact CG-CD1 3.81Å; Y236-I293 HydrophobicContact CG-CG2 3.99Å
237	V	93.7	Very high	87	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	129.5	172.2	-173.2	0	0	0	0	108.5	F209 F211 F217 M218 L219 G239 T240 V242	F209-V237 HydrophobicContact CB-CG2 4.47Å; F209-V237 HydrophobicContact CD1-CG1 4.07Å; F209-V237 HydrophobicContact CD1-CG2 4.22Å; F209-V237 HydrophobicContact CE1-CG1 3.7Å; F209-V237 HydrophobicContact CE2-CG1 4.19Å; F209-V237 HydrophobicContact CG-CG1 4.47Å; F209-V237 HydrophobicContact CG-CG2 4.16Å; F209-V237 HydrophobicContact CZ-CG1 3.76Å; F211-V237 HydrophobicContact CE1-CG1 4.05Å; F211-V237 HydrophobicContact CE1-CG2 3.99Å; F211-V237 HydrophobicContact CZ-CG2 3.66Å; F217-V237 HydrophobicContact CB-CG1 4.29Å; F217-V237 HydrophobicContact CD1-CG1 3.93Å; F217-V237 HydrophobicContact CG-CG1 4.47Å; M218-V237 CarbonylContact O-C 3.58Å; M218-V237 VanDerWaalsContact O-CA 3.26Å; M218-V237 WeakPolarHBondContact O-CA 3.4Å; L219-V237 HydrophobicContact CD1-CG2 4.42Å; V237-G239 PolarHBondContact O-N 3.4Å; V237-T240 PolarHBondContact N-O 2.7Å; V237-T240 PolarHBondContact O-N 2.88Å; V237-T240 PolarHBondContact O-OG1 2.8Å; V237-V242 HydrophobicContact CB-CG2 3.79Å; V237-V242 HydrophobicContact CG2-CB 4.42Å; V237-V242 HydrophobicContact CG2-CG2 3.86Å
238	N	91.3	Very high	87.1	Confident	42 Å²	42	48.1 Å²	48.1	23%	0.225	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	42.3	179.5	-65.4	-13	0	0	0	113.3	F217 M218 T240 Y297	F217-N238 WeakPolarHBondContact CA-OD1 3.48Å; M218-N238 PolarHBondContact N-OD1 3.37Å; M218-N238 PolarHBondContact O-N 3.42Å; N238-T240 VanDerWaalsContact C-N 3.26Å; N238-T240 PolarHBondContact O-N 3.22Å; N238-Y297 HydrophobicContact CB-CD2 4.26Å; N238-Y297 HydrophobicContact CB-CE2 3.62Å; N238-Y297 WeakPolarHBondContact O-CD1 3.32Å; N238-Y297 WeakPolarHBondContact O-CE1 3.48Å
239	G	89.7	Confident	87	Confident	12 Å²	12	37.8 Å²	37.8	12%	0.124	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	-8.6	180	0	0	0	0	0	115.4	V237	V237-G239 PolarHBondContact O-N 3.4Å
240	T	92.2	Very high	86.9	Confident	88 Å²	88	40.5 Å²	40.5	54%	0.54	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	142.8	-175.7	62.9	0	0	0	0	112.1	Y236 V237 N238 V242	Y236-T240 CarbonylContact C-O 3.51Å; Y236-T240 WeakPolarHBondContact CA-O 3.46Å; V237-T240 PolarHBondContact N-O 2.7Å; V237-T240 PolarHBondContact O-N 2.88Å; V237-T240 PolarHBondContact O-OG1 2.8Å; N238-T240 VanDerWaalsContact C-N 3.26Å; N238-T240 PolarHBondContact O-N 3.22Å; T240-V242 PolarHBondContact O-N 2.9Å
241	L	94.3	Very high	86.2	Confident	86 Å²	86	39.2 Å²	39.2	45%	0.45	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	124.4	176.3	-179.1	67.8	0	0	0	109.7	L234 Y236 S243	L234-L241 HydrophobicContact CB-CD1 3.83Å; L234-L241 HydrophobicContact CD2-CD1 3.79Å; L234-L241 HydrophobicContact CD2-CD2 4.27Å; L234-L241 HydrophobicContact CG-CD1 4.42Å; Y236-L241 HydrophobicContact CD1-CB 3.88Å; Y236-L241 HydrophobicContact CD1-CD1 4.36Å; Y236-L241 HydrophobicContact CD2-CD1 4.08Å; Y236-L241 HydrophobicContact CE1-CB 3.59Å; Y236-L241 HydrophobicContact CE1-CD1 4.03Å; Y236-L241 HydrophobicContact CE1-CG 4.37Å; Y236-L241 HydrophobicContact CE2-CD1 3.75Å; Y236-L241 HydrophobicContact CG-CD1 4.37Å; L241-S243 WeakPolarHBondContact CD1-O 3.22Å
242	V	93.1	Very high	85.1	Confident	37 Å²	37	43.7 Å²	43.7	22%	0.224	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	-33.4	-179.3	-174	0	0	0	0	113.1	N208 F209 C235 V237 T240	N208-V242 WeakPolarHBondContact O-CG1 3.26Å; F209-V242 HydrophobicContact CB-CG1 3.72Å; F209-V242 HydrophobicContact CD2-CG1 4.08Å; F209-V242 HydrophobicContact CD2-CG2 4.19Å; F209-V242 HydrophobicContact CG-CG1 4.33Å; C235-V242 PolarHBondContact O-N 3.44Å; V237-V242 HydrophobicContact CB-CG2 3.79Å; V237-V242 HydrophobicContact CG2-CB 4.42Å; V237-V242 HydrophobicContact CG2-CG2 3.86Å; T240-V242 PolarHBondContact O-N 2.9Å
243	S	91.8	Very high	83.8	Confident	18 Å²	18	47.3 Å²	47.3	13%	0.126	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	142.9	177.8	-168.3	0	0	0	0	110.9	L234 C235 L241	L234-S243 WeakPolarHBondContact CA-O 3.3Å; C235-S243 PolarHBondContact N-O 3.34Å; C235-S243 PolarHBondContact O-N 2.74Å; L241-S243 WeakPolarHBondContact CD1-O 3.22Å
244	N	91.6	Very high	82.5	Confident	88 Å²	88	52.2 Å²	52.2	47%	0.471	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	121.3	170.6	-178.4	16.8	0	0	0	107.9	S232 L234	S232-N244 WeakPolarHBondContact CB-OD1 3.49Å; L234-N244 HydrophobicContact CD2-CB 3.7Å; L234-N244 VanDerWaalsContact CD2-OD1 3.23Å; L234-N244 WeakPolarHBondContact CD2-OD1 3.32Å
245	V	88	Confident	81.5	Confident	19 Å²	19	53.9 Å²	53.9	12%	0.115	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	116.5	-176.3	-174.5	0	0	0	0	108.8	F205 S232 I233 V247	F205-V245 HydrophobicContact CB-CG1 3.95Å; F205-V245 HydrophobicContact CB-CG2 4.14Å; F205-V245 HydrophobicContact CD1-CG1 3.32Å; F205-V245 HydrophobicContact CD2-CG1 3.99Å; F205-V245 HydrophobicContact CE1-CG1 3.68Å; F205-V245 HydrophobicContact CE2-CG1 4.31Å; F205-V245 HydrophobicContact CG-CG1 3.48Å; F205-V245 VanDerWaalsContact CG-CG1 3.48Å; F205-V245 HydrophobicContact CZ-CG1 4.16Å; S232-V245 CarbonylContact C-O 3.5Å; S232-V245 VanDerWaalsContact CA-O 3.31Å; S232-V245 WeakPolarHBondContact CA-O 3.38Å; I233-V245 PolarHBondContact N-O 3.01Å; I233-V245 PolarHBondContact O-N 3.47Å; V245-V247 HydrophobicContact CB-CG2 4.23Å; V245-V247 HydrophobicContact CG1-CG2 3.52Å; V245-V247 PolarHBondContact O-N 3.47Å
246	D	85.6	Confident	80.6	Confident	131 Å²	131	57.2 Å²	57.2	70%	0.701	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	114.4	174.5	-62.3	-34.7	0	0	0	109.6
247	V	78.9	Confident	79.9	Confident	7 Å²	7	57 Å²	57	4%	0.042	32%	0.321	C	S	.	.			trans	-136.2	124.1	-176.8	-174.9	0	0	0	0	109.4	V195 F205 S231 I233 V245 W249	V195-V247 HydrophobicContact CB-CG1 4.33Å; V195-V247 HydrophobicContact CG1-CG1 4.13Å; V195-V247 HydrophobicContact CG2-CG1 4.1Å; F205-V247 HydrophobicContact CD2-CG2 4.16Å; F205-V247 HydrophobicContact CE1-CG2 4.4Å; F205-V247 HydrophobicContact CE2-CG1 4.32Å; F205-V247 HydrophobicContact CE2-CG2 3.57Å; F205-V247 HydrophobicContact CZ-CG2 3.7Å; S231-V247 CarbonylContact C-O 3.6Å; S231-V247 VanDerWaalsContact CB-O 3.23Å; S231-V247 WeakPolarHBondContact CB-O 3.3Å; S231-V247 CarbonylContact O-C 3.58Å; S231-V247 PolarHBondContact O-N 2.82Å; S231-V247 PolarHBondContact OG-O 2.92Å; I233-V247 HydrophobicContact CD1-CB 4.19Å; I233-V247 HydrophobicContact CD1-CG2 4.02Å; I233-V247 HydrophobicContact CG1-CB 4.41Å; I233-V247 HydrophobicContact CG1-CG2 4.33Å; V245-V247 HydrophobicContact CB-CG2 4.23Å; V245-V247 HydrophobicContact CG1-CG2 3.52Å; V245-V247 PolarHBondContact O-N 3.47Å; V247-W249 PolarHBondContact O-N 3.48Å
248	T	75.2	Confident	79.2	Confident	69 Å²	69	64.8 Å²	64.8	42%	0.423	35%	0.351	S	S	.	.			trans	-74.3	122.7	178.3	51	0	0	0	0	112.2	R197 S231 H250	R197-T248 PolarHBondContact NH1-OG1 3.46Å; S231-T248 WeakPolarHBondContact OG-CA 3.49Å; T248-H250 WeakPolarHBondContact CB-NE2 3.34Å; T248-H250 PolarHBondContact O-CD2 2.94Å; T248-H250 PolarHBondContact O-N 3.03Å; T248-H250 PolarHBondContact OG1-CD2 2.96Å; T248-H250 PolarHBondContact OG1-NE2 3.36Å
249	W	71	Confident	78.9	Confident	23 Å²	23	64.3 Å²	64.3	9%	0.087	35%	0.349	C	S	.	.			trans	-77.7	113.3	177	-170.9	-85.7	0	0	0	111.4	P147 Q149 W152 F182 H223 S231 V247 L251	P147-W249 HydrophobicContact CB-CH2 3.88Å; P147-W249 HydrophobicContact CB-CZ2 4.48Å; P147-W249 HydrophobicContact CG-CH2 4Å; Q149-W249 HydrophobicContact CG-CG 4.46Å; W152-W249 AromaticContact CE2-CZ3 3.79Å; W152-W249 HydrophobicContact CZ2-CH2 4.4Å; W152-W249 AromaticContact CZ2-CZ3 3.94Å; W152-W249 HydrophobicContact CZ2-CZ3 3.94Å; W152-W249 AromaticContact NE1-CH2 3.19Å; W152-W249 AromaticContact NE1-CZ3 3.04Å; F182-W249 AromaticContact CD2-CH2 3.86Å; F182-W249 HydrophobicContact CD2-CH2 3.86Å; F182-W249 AromaticContact CD2-CZ3 3.85Å; F182-W249 HydrophobicContact CD2-CZ3 3.85Å; F182-W249 HydrophobicContact CE1-CE3 4.23Å; F182-W249 AromaticContact CE1-CZ3 3.88Å; F182-W249 HydrophobicContact CE1-CZ3 3.88Å; F182-W249 HydrophobicContact CE2-CD2 4.42Å; F182-W249 AromaticContact CE2-CE3 3.67Å; F182-W249 HydrophobicContact CE2-CE3 3.67Å; F182-W249 AromaticContact CE2-CH2 3.15Å; F182-W249 HydrophobicContact CE2-CH2 3.15Å; F182-W249 AromaticContact CE2-CZ2 3.99Å; F182-W249 HydrophobicContact CE2-CZ2 3.99Å; F182-W249 AromaticContact CE2-CZ3 2.97Å; F182-W249 HydrophobicContact CE2-CZ3 2.97Å; F182-W249 HydrophobicContact CZ-CD2 4.23Å; F182-W249 AromaticContact CZ-CE3 3.3Å; F182-W249 HydrophobicContact CZ-CE3 3.3Å; F182-W249 AromaticContact CZ-CH2 3.73Å; F182-W249 HydrophobicContact CZ-CH2 3.73Å; F182-W249 AromaticContact CZ-CZ3 3Å; F182-W249 HydrophobicContact CZ-CZ3 3Å; H223-W249 AromaticContact CD2-CE3 3.88Å; H223-W249 AromaticContact CE1-CD2 3.78Å; H223-W249 AromaticContact CE1-CE3 3.35Å; H223-W249 AromaticContact ND1-CE3 3.8Å; H223-W249 AromaticContact ND1-CZ3 3.99Å; H223-W249 AromaticContact NE2-CE3 3.38Å; S231-W249 PolarHBondContact OG-N 3.46Å; V247-W249 PolarHBondContact O-N 3.48Å; W249-L251 HydrophobicContact CH2-CD1 4.35Å; W249-L251 HydrophobicContact CZ2-CB 4.32Å; W249-L251 HydrophobicContact CZ2-CD1 3.99Å; W249-L251 PolarHBondContact NE1-O 3.15Å
250	H	63.6	Low	78.9	Confident	119 Å²	119	63.9 Å²	63.9	55%	0.551	35%	0.345	S	S	*	.			trans	-110.7	1.4	-176	-69.7	-71.4	0	0	0	115.2	R197 T248	R197-H250 VanDerWaalsContact CD-CD2 3.4Å; R197-H250 WeakPolarHBondContact CD-CD2 3.37Å; T248-H250 WeakPolarHBondContact CB-NE2 3.34Å; T248-H250 PolarHBondContact O-CD2 2.94Å; T248-H250 PolarHBondContact O-N 3.03Å; T248-H250 PolarHBondContact OG1-CD2 2.96Å; T248-H250 PolarHBondContact OG1-NE2 3.36Å
251	L	62.1	Low	78.8	Confident	16 Å²	16	61 Å²	61	8%	0.084	33%	0.326	C	S	.	.			trans	-79.2	130.9	179.9	-72.2	137.8	0	0	0	110.6	T176 L180 F182 W249 F257	T176-L251 HydrophobicContact CG2-CD2 3.66Å; L180-L251 HydrophobicContact CB-CD2 3.72Å; F182-L251 HydrophobicContact CD2-CD1 4.29Å; F182-L251 HydrophobicContact CE2-CD1 3.48Å; F182-L251 VanDerWaalsContact CE2-CD1 3.48Å; F182-L251 HydrophobicContact CZ-CD1 4.27Å; W249-L251 HydrophobicContact CH2-CD1 4.35Å; W249-L251 HydrophobicContact CZ2-CB 4.32Å; W249-L251 HydrophobicContact CZ2-CD1 3.99Å; W249-L251 PolarHBondContact NE1-O 3.15Å; L251-F257 HydrophobicContact CD1-CZ 4.06Å; L251-F257 HydrophobicContact CD2-CZ 4.35Å
252	N	62.3	Low	78.6	Confident	104 Å²	104	56.9 Å²	56.9	56%	0.556	30%	0.304	S	S	*	.			trans	-72.5	138.6	177.9	-161.7	-1.7	0	0	0	109.8	C254 E255	N252-C254 PolarHBondContact O-N 3.47Å; N252-E255 HydrophobicContact CB-CG 4.46Å; N252-E255 PolarHBondContact O-N 3.43Å; N252-E255 VanDerWaalsContact O-N 3.1Å
253	T	61.1	Low	78.5	Confident	92 Å²	92	55.1 Å²	55.1	56%	0.564	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-8.2	-174.5	46.5	0	0	0	0	114.8	Q149	Q149-T253 HydrophobicContact CB-CG2 4.04Å
254	C	62.8	Low	78.2	Confident	106 Å²	106	54.8 Å²	54.8	72%	0.716	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-4.4	-179.3	-59.1	0	0	0	0	113.9	N252	N252-C254 PolarHBondContact O-N 3.47Å
255	E	72.2	Confident	77.8	Confident	59 Å²	59	51 Å²	51	28%	0.276	27%	0.27	S	S	.	.			trans	-82.9	127.6	-178.7	-72.3	-179.4	-159.2	0	0	111.8	T176 N252	T176-E255 HydrophobicContact CG2-CB 3.99Å; N252-E255 HydrophobicContact CB-CG 4.46Å; N252-E255 PolarHBondContact O-N 3.43Å; N252-E255 VanDerWaalsContact O-N 3.1Å
256	V	76.7	Confident	77.3	Confident	71 Å²	71	51.5 Å²	51.5	43%	0.43	27%	0.272	S	S	.	.			trans	-83.2	127.8	177.9	-175.1	0	0	0	0	109.7	P142 D144 R258	P142-V256 HydrophobicContact CB-CG1 4.1Å; D144-V256 HydrophobicContact CB-CG2 4.01Å; V256-R258 PolarHBondContact O-N 3.29Å
257	F	80.2	Confident	76.6	Confident	8 Å²	8	49.8 Å²	49.8	4%	0.035	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-74	93.6	171	-74.3	-95.3	0	0	0	109.3	P142 T143 P147 F174 Q175 T176 L251	P142-F257 VanDerWaalsContact CA-O 3.25Å; P142-F257 WeakPolarHBondContact CA-O 3.38Å; T143-F257 PolarHBondContact N-O 2.91Å; T143-F257 PolarHBondContact O-N 3.37Å; P147-F257 HydrophobicContact CG-CD1 4.49Å; P147-F257 HydrophobicContact CG-CD2 4.33Å; P147-F257 HydrophobicContact CG-CE1 3.95Å; P147-F257 HydrophobicContact CG-CE2 3.77Å; P147-F257 HydrophobicContact CG-CZ 3.55Å; F174-F257 HydrophobicContact CB-CD1 4.19Å; Q175-F257 CarbonylContact O-C 3.56Å; T176-F257 HydrophobicContact CG2-CD1 4.15Å; T176-F257 HydrophobicContact CG2-CE1 4.14Å; T176-F257 HydrophobicContact CG2-CG 4.36Å; T176-F257 HydrophobicContact CG2-CZ 4.33Å; L251-F257 HydrophobicContact CD1-CZ 4.06Å; L251-F257 HydrophobicContact CD2-CZ 4.35Å
258	R	80.7	Confident	75.6	Confident	166 Å²	166	53 Å²	53	63%	0.626	28%	0.283	S	S	*	.			trans	-71.2	-37	-176.4	-173.3	179.6	176.8	109.5	1.4	112.5	Q175 V256	Q175-R258 PolarHBondContact O-N 3.19Å; V256-R258 PolarHBondContact O-N 3.29Å
259	T	85	Confident	74.8	Confident	32 Å²	32	55.6 Å²	55.6	20%	0.196	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	102.2	-176.6	46.3	0	0	0	0	109.1	F174 Q175 N266	F174-T259 WeakPolarHBondContact CA-O 3.42Å; Q175-T259 WeakPolarHBondContact CB-OG1 3.49Å; Q175-T259 PolarHBondContact N-O 3.35Å; Q175-T259 PolarHBondContact O-N 2.94Å; Q175-T259 VanDerWaalsContact O-N 3.08Å; Q175-T259 PolarHBondContact O-OG1 3.26Å; Q175-T259 VanDerWaalsContact O-OG1 3.08Å; T259-N266 PolarHBondContact OG1-ND2 3.5Å
260	C	88.6	Confident	74.1	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.02	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	95.2	175.4	-63.4	0	0	0	0	109.1	L140 F174	L140-C260 HydrophobicContact CB-CB 3.65Å; L140-C260 PolarHBondContact N-O 3.28Å; F174-C260 HydrophobicContact CD1-CB 3.72Å; F174-C260 HydrophobicContact CE1-CB 4.07Å
261	L	90.2	Very high	73.8	Confident	27 Å²	27	54.6 Å²	54.6	14%	0.141	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	135.6	-175.7	-59.7	175.3	0	0	0	109.9	Y172 C173	Y172-L261 CarbonylContact C-O 3.49Å; Y172-L261 WeakPolarHBondContact CA-O 3.18Å; C173-L261 PolarHBondContact N-O 3.39Å; C173-L261 PolarHBondContact O-N 3.45Å
262	I	91.1	Very high	74.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.8	170.4	-58.1	179.2	0	0	0	108.1	F130 N137 V138 L140 F154 L171 F174 M278 I281	F130-I262 HydrophobicContact CZ-CG2 4.32Å; N137-I262 CarbonylContact C-O 3.49Å; N137-I262 VanDerWaalsContact CA-O 3.27Å; N137-I262 WeakPolarHBondContact CA-O 3.41Å; N137-I262 WeakPolarHBondContact CB-O 3.49Å; V138-I262 HydrophobicContact CB-CB 4.26Å; V138-I262 PolarHBondContact N-O 2.81Å; V138-I262 PolarHBondContact O-N 3.14Å; L140-I262 HydrophobicContact CD1-CD1 3.61Å; L140-I262 HydrophobicContact CD1-CG1 3.92Å; L140-I262 HydrophobicContact CD2-CD1 4.42Å; F154-I262 HydrophobicContact CE2-CD1 4.21Å; L171-I262 WeakPolarHBondContact O-CG2 3.37Å; F174-I262 HydrophobicContact CE1-CG1 4.42Å; F174-I262 HydrophobicContact CZ-CG1 4.33Å; I262-M278 HydrophobicContact CG2-CE 4.07Å; I262-M278 HydrophobicContact CG2-SD 3.69Å; I262-I281 HydrophobicContact CD1-CD1 4.12Å; I262-I281 HydrophobicContact CD1-CG2 3.5Å; I262-I281 HydrophobicContact CG2-CD1 4.19Å
263	G	89	Confident	74.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.282	C	S	.	.	S	Bend	trans	84.2	6.7	-177.5	0	0	0	0	0	115.3	H170 L171 G273 F274	H170-G263 CarbonylContact O-C 3.48Å; H170-G263 VanDerWaalsContact O-C 3.25Å; H170-G263 WeakPolarHBondContact O-CA 3.37Å; L171-G263 PolarHBondContact O-N 3.29Å; G263-G273 CarbonylContact O-C 3.59Å; G263-G273 WeakPolarHBondContact O-CA 3.35Å; G263-F274 PolarHBondContact O-N 2.66Å
264	Q	86.4	Confident	76.1	Confident	11 Å²	11	45.4 Å²	45.4	5%	0.051	26%	0.255	C	S	.	.	S	Bend	trans	-152.1	155.8	179.3	-158.4	-171.5	11.4	0	0	112	A134 N137 C173	A134-Q264 PolarHBondContact O-NE2 3.06Å; N137-Q264 HydrophobicContact CB-CB 3.78Å; N137-Q264 PolarHBondContact ND2-OE1 3.22Å; C173-Q264 WeakPolarHBondContact CB-O 3.3Å
265	S	83	Confident	77.1	Confident	8 Å²	8	43 Å²	43	6%	0.056	23%	0.232	C	C	.	.			trans	-83	167.5	166.3	80.9	0	0	0	0	111.7	D267	S265-D267 VanDerWaalsContact C-N 3.29Å; S265-D267 PolarHBondContact OG-N 3.43Å; S265-D267 PolarHBondContact OG-O 3.11Å
266	N	76.7	Confident	77.8	Confident	30 Å²	30	40.2 Å²	40.2	16%	0.16	22%	0.219	C	C	.	.	S	Bend	trans	-80.5	-12.3	172.5	-162.4	8.7	0	0	0	112.7	Q175 R179 T259	Q175-N266 PolarHBondContact OE1-ND2 2.96Å; R179-N266 VanDerWaalsContact CD-ND2 3.31Å; R179-N266 WeakPolarHBondContact CD-ND2 3.47Å; R179-N266 VanDerWaalsContact CZ-CG 3.42Å; R179-N266 PolarHBondContact NE-ND2 3.13Å; R179-N266 PolarHBondContact NH1-ND2 2.85Å; T259-N266 PolarHBondContact OG1-ND2 3.5Å
267	D	71.1	Confident	78.4	Confident	94 Å²	94	37.3 Å²	37.3	50%	0.503	20%	0.2	S	C	.	.			trans	-101.9	90.2	-177.8	-65.9	-22.9	0	0	0	108.8	R179 S265 T269	R179-D267 IonicContact CZ-OD1 3.76Å; R179-D267 IonicContact NH1-OD1 2.76Å; R179-D267 PolarHBondContact NH1-OD1 3Å; S265-D267 VanDerWaalsContact C-N 3.29Å; S265-D267 PolarHBondContact OG-N 3.43Å; S265-D267 PolarHBondContact OG-O 3.11Å; D267-T269 PolarHBondContact O-N 3.31Å
268	T	59	Low	78.9	Confident	76 Å²	76	37 Å²	37	47%	0.466	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-1.3	-173.8	54.1	0	0	0	0	114.8	Y135	Y135-T268 HydrophobicContact CE1-CG2 4.38Å
269	T	58.5	Low	79.3	Confident	122 Å²	122	29 Å²	29	75%	0.748	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-23.4	-174	56.8	0	0	0	0	113.5	D267	D267-T269 PolarHBondContact O-N 3.31Å
270	N	56.1	Low	79.5	Confident	87 Å²	87	27.9 Å²	27.9	47%	0.465	16%	0.161	S	C	.	.	S	Bend	trans	-113	131.2	178.7	-61	-8	0	0	0	107.1	D272	N270-D272 HydrophobicContact CB-CB 4.47Å; N270-D272 VanDerWaalsContact CB-CG 3.46Å; N270-D272 WeakPolarHBondContact CB-OD1 3.45Å; N270-D272 VanDerWaalsContact CB-OD2 3.27Å; N270-D272 WeakPolarHBondContact CB-OD2 3.45Å; N270-D272 PolarHBondContact O-N 3.23Å
271	G	57.9	Low	79.6	Confident	34 Å²	34	27.8 Å²	27.8	35%	0.351	16%	0.16	S	C	.	.			trans	-67.2	57.7	-179	0	0	0	0	0	114	G273	G271-G273 VanDerWaalsContact C-N 3.3Å; G271-G273 PolarHBondContact O-N 3.2Å
272	D	68	Low	79.7	Confident	15 Å²	15	26.8 Å²	26.8	8%	0.08	16%	0.155	C	C	.	.			trans	-98.5	36.8	-165.3	-71.3	1.9	0	0	0	110.9	N167 K168 H170 N270	N167-D272 WeakPolarHBondContact CB-OD1 3.38Å; N167-D272 PolarHBondContact ND2-OD1 2.95Å; K168-D272 WeakPolarHBondContact O-CA 3.16Å; K168-D272 WeakPolarHBondContact O-CB 3.42Å; H170-D272 PolarHBondContact N-O 3.07Å; N270-D272 HydrophobicContact CB-CB 4.47Å; N270-D272 VanDerWaalsContact CB-CG 3.46Å; N270-D272 WeakPolarHBondContact CB-OD1 3.45Å; N270-D272 VanDerWaalsContact CB-OD2 3.27Å; N270-D272 WeakPolarHBondContact CB-OD2 3.45Å; N270-D272 PolarHBondContact O-N 3.23Å
273	G	78.1	Confident	79.6	Confident	3 Å²	3	26.8 Å²	26.8	3%	0.031	16%	0.155	C	C	.	.			trans	-76.3	151.3	177.2	0	0	0	0	0	112.1	M169 G263 G271	M169-G273 WeakPolarHBondContact CG-O 3.44Å; G263-G273 CarbonylContact O-C 3.59Å; G263-G273 WeakPolarHBondContact O-CA 3.35Å; G271-G273 VanDerWaalsContact C-N 3.3Å; G271-G273 PolarHBondContact O-N 3.2Å
274	F	85.9	Confident	79.7	Confident	1 Å²	1	26.8 Å²	26.8	0%	0.004	16%	0.155	C	C	.	.			trans	-70.5	129.1	173.9	-179	-100.3	0	0	0	111.1	F130 M169 H170 L171 F186 G263 M278	F130-F274 HydrophobicContact CB-CD1 3.8Å; F130-F274 WeakPolarHBondContact CB-O 3.16Å; F130-F274 HydrophobicContact CD1-CD1 4.49Å; F130-F274 AromaticContact CD2-CD1 3.78Å; F130-F274 HydrophobicContact CD2-CD1 3.78Å; F130-F274 HydrophobicContact CD2-CE1 4.11Å; F130-F274 HydrophobicContact CE2-CD1 4.5Å; F130-F274 AromaticContact CG-CD1 3.78Å; F130-F274 HydrophobicContact CG-CD1 3.78Å; M169-F274 HydrophobicContact CE-CD2 3.54Å; M169-F274 HydrophobicContact CE-CE2 3.54Å; M169-F274 HydrophobicContact CG-CB 4.43Å; M169-F274 HydrophobicContact CG-CD2 4.15Å; M169-F274 HydrophobicContact SD-CD2 4.08Å; H170-F274 WeakPolarHBondContact O-CB 3.46Å; L171-F274 HydrophobicContact CD1-CD2 4.29Å; L171-F274 HydrophobicContact CD1-CE2 3.96Å; L171-F274 HydrophobicContact CD1-CZ 4.47Å; F186-F274 HydrophobicContact CD2-CE2 4.48Å; F186-F274 HydrophobicContact CE2-CE2 4.23Å; G263-F274 PolarHBondContact O-N 2.66Å; F274-M278 HydrophobicContact CB-CE 4.15Å; F274-M278 HydrophobicContact CD1-CE 3.27Å; F274-M278 HydrophobicContact CD1-CG 4.43Å; F274-M278 HydrophobicContact CD2-CE 3.78Å; F274-M278 HydrophobicContact CE1-CE 3.42Å; F274-M278 VanDerWaalsContact CE1-CE 3.42Å; F274-M278 HydrophobicContact CE1-CG 3.8Å; F274-M278 HydrophobicContact CE1-SD 4.49Å; F274-M278 HydrophobicContact CE2-CE 3.93Å; F274-M278 HydrophobicContact CG-CE 3.46Å; F274-M278 VanDerWaalsContact CG-CE 3.46Å; F274-M278 HydrophobicContact CZ-CE 3.77Å; F274-M278 HydrophobicContact CZ-CG 4.22Å
275	Y	84.9	Confident	79.8	Confident	57 Å²	57	27.5 Å²	27.5	22%	0.224	16%	0.163	C	C	.	.			trans	-111.8	108.6	173.2	-177.5	-130.7	0	0	0	111.5	F130 D132 K161 R162 F163 M169	F130-Y275 WeakPolarHBondContact O-CD2 3.47Å; D132-Y275 HydrophobicContact CB-CD2 3.82Å; D132-Y275 HydrophobicContact CB-CE2 3.93Å; D132-Y275 HydrophobicContact CB-CG 4.24Å; K161-Y275 HydrophobicContact CB-CD1 3.49Å; K161-Y275 VanDerWaalsContact CB-CD1 3.49Å; K161-Y275 HydrophobicContact CB-CE1 3.23Å; K161-Y275 HydrophobicContact CB-CE2 4.4Å; K161-Y275 HydrophobicContact CB-CG 4.18Å; K161-Y275 HydrophobicContact CD-CE1 4.12Å; K161-Y275 HydrophobicContact CD-CE2 4.05Å; K161-Y275 HydrophobicContact CG-CE1 4.31Å; K161-Y275 PolarHBondContact N-O 3.24Å; R162-Y275 WeakPolarHBondContact O-CD1 3.45Å; R162-Y275 VanDerWaalsContact O-CE1 3.23Å; R162-Y275 WeakPolarHBondContact O-CE1 3.47Å; F163-Y275 HydrophobicContact CD2-CD1 4.26Å; F163-Y275 HydrophobicContact CD2-CG 4.26Å; M169-Y275 PolarHBondContact SD-N 3.01Å
276	G	87.4	Confident	80	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159.2	-157.6	-175.6	0	0	0	0	0	113.8	F130 Y159	F130-G276 PolarHBondContact N-O 2.88Å; F130-G276 PolarHBondContact O-N 2.82Å; Y159-G276 CarbonylContact O-C 3.57Å; Y159-G276 WeakPolarHBondContact O-CA 3.03Å
277	H	89.1	Confident	80.7	Confident	10 Å²	10	32.2 Å²	32.2	5%	0.046	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	143.1	177.7	-51.5	-41.8	0	0	0	110.6	Y127 F128 S129 I158 Y159 K161 W216	Y127-H277 HydrophobicContact CD2-CB 3.51Å; Y127-H277 AromaticContact CD2-CG 3.51Å; Y127-H277 AromaticContact CD2-ND1 3.74Å; Y127-H277 HydrophobicContact CE2-CB 4Å; Y127-H277 AromaticContact CE2-CD2 3.62Å; Y127-H277 AromaticContact CE2-CE1 3.67Å; Y127-H277 AromaticContact CE2-CG 3.46Å; Y127-H277 VanDerWaalsContact CE2-CG 3.46Å; Y127-H277 AromaticContact CE2-ND1 3.52Å; Y127-H277 AromaticContact CE2-NE2 3.77Å; Y127-H277 HydrophobicContact CG-CB 4.02Å; F128-H277 CarbonylContact O-C 3.57Å; F128-H277 VanDerWaalsContact O-CA 3.23Å; F128-H277 WeakPolarHBondContact O-CA 3.2Å; S129-H277 PolarHBondContact OG-CE1 3.08Å; S129-H277 VanDerWaalsContact OG-CE1 3.24Å; S129-H277 PolarHBondContact OG-ND1 3.07Å; I158-H277 CarbonylContact C-O 3.53Å; I158-H277 WeakPolarHBondContact CA-O 3.34Å; Y159-H277 HydrophobicContact CD1-CB 4.48Å; Y159-H277 AromaticContact CD1-CD2 3.59Å; Y159-H277 PolarHBondContact N-O 3.48Å; Y159-H277 PolarHBondContact O-N 3.26Å; K161-H277 WeakPolarHBondContact CE-NE2 3.47Å; K161-H277 PolarHBondContact NZ-CE1 3.01Å; K161-H277 PolarHBondContact NZ-NE2 3.09Å; W216-H277 HydrophobicContact CH2-CB 3.53Å; W216-H277 HydrophobicContact CZ2-CB 3.95Å; W216-H277 HydrophobicContact CZ3-CB 4.41Å
278	M	90.7	Very high	81.6	Confident	0 Å²	0	28 Å²	28	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.6	169.5	-53.9	-172.5	-164.2	0	0	109.1	Y127 F128 F130 W157 I158 L171 I262 F274	Y127-M278 CarbonylContact C-O 3.56Å; Y127-M278 WeakPolarHBondContact CA-O 3.35Å; Y127-M278 WeakPolarHBondContact CB-O 3.28Å; F128-M278 PolarHBondContact N-O 3Å; F128-M278 PolarHBondContact O-N 3.16Å; F130-M278 HydrophobicContact CD2-CE 4.42Å; F130-M278 HydrophobicContact CD2-CG 4.16Å; F130-M278 HydrophobicContact CE2-CB 3.92Å; F130-M278 HydrophobicContact CE2-CE 4.05Å; F130-M278 HydrophobicContact CE2-CG 3.63Å; F130-M278 HydrophobicContact CE2-SD 3.88Å; F130-M278 HydrophobicContact CZ-CE 4.24Å; F130-M278 HydrophobicContact CZ-CG 4.46Å; F130-M278 HydrophobicContact CZ-SD 4.13Å; W157-M278 CarbonylContact O-C 3.53Å; W157-M278 WeakPolarHBondContact O-CA 3.37Å; I158-M278 HydrophobicContact CG2-CG 4.39Å; L171-M278 HydrophobicContact CD1-CE 3.43Å; L171-M278 VanDerWaalsContact CD1-CE 3.43Å; L171-M278 HydrophobicContact CD1-SD 4.01Å; L171-M278 HydrophobicContact CG-CE 4.28Å; I262-M278 HydrophobicContact CG2-CE 4.07Å; I262-M278 HydrophobicContact CG2-SD 3.69Å; F274-M278 HydrophobicContact CB-CE 4.15Å; F274-M278 HydrophobicContact CD1-CE 3.27Å; F274-M278 HydrophobicContact CD1-CG 4.43Å; F274-M278 HydrophobicContact CD2-CE 3.78Å; F274-M278 HydrophobicContact CE1-CE 3.42Å; F274-M278 VanDerWaalsContact CE1-CE 3.42Å; F274-M278 HydrophobicContact CE1-CG 3.8Å; F274-M278 HydrophobicContact CE1-SD 4.49Å; F274-M278 HydrophobicContact CE2-CE 3.93Å; F274-M278 HydrophobicContact CG-CE 3.46Å; F274-M278 VanDerWaalsContact CG-CE 3.46Å; F274-M278 HydrophobicContact CZ-CE 3.77Å; F274-M278 HydrophobicContact CZ-CG 4.22Å
279	S	89.1	Confident	83.2	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.162	C	C	.	.			trans	-83.4	-159.2	168.5	-162	0	0	0	0	109.7	S126 W157 I281 Q304	S126-S279 PolarHBondContact O-OG 3.06Å; W157-S279 PolarHBondContact O-N 3.33Å; S279-I281 VanDerWaalsContact O-CG1 3.29Å; S279-I281 WeakPolarHBondContact O-CG1 3.43Å; S279-I281 PolarHBondContact O-N 2.93Å; S279-Q304 PolarHBondContact OG-NE2 3.32Å
280	N	88.3	Confident	84.7	Confident	8 Å²	8	25 Å²	25	4%	0.043	15%	0.149	C	C	.	.			trans	-38	121.8	-176.2	-69.2	-27	0	0	0	113.4	C156 M282 Y303 Q304 N339 P340	C156-N280 WeakPolarHBondContact CA-O 3.39Å; N280-M282 HydrophobicContact CB-CE 4.09Å; N280-Y303 PolarHBondContact ND2-O 3.49Å; N280-Q304 VanDerWaalsContact CG-OE1 3.24Å; N280-Q304 WeakPolarHBondContact ND2-CA 3.4Å; N280-Q304 PolarHBondContact ND2-NE2 2.9Å; N280-Q304 PolarHBondContact ND2-OE1 3.28Å; N280-Q304 PolarHBondContact OD1-OE1 2.86Å; N280-N339 WeakPolarHBondContact OD1-CA 3.47Å; N280-N339 PolarHBondContact OD1-OD1 3.35Å; N280-P340 WeakPolarHBondContact OD1-CD 3.21Å
281	I	91.7	Very high	86.2	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	114.4	-179.1	-53.3	175	0	0	0	106.6	F128 F154 C156 I262 S279 F336 Y338	F128-I281 HydrophobicContact CD2-CD1 3.74Å; F128-I281 HydrophobicContact CD2-CG1 4.16Å; F128-I281 HydrophobicContact CE2-CD1 3.91Å; F128-I281 HydrophobicContact CE2-CG1 4.16Å; F154-I281 HydrophobicContact CE2-CG2 3.74Å; F154-I281 HydrophobicContact CZ-CG2 4.1Å; C156-I281 HydrophobicContact CB-CG1 4.47Å; I262-I281 HydrophobicContact CD1-CD1 4.12Å; I262-I281 HydrophobicContact CD1-CG2 3.5Å; I262-I281 HydrophobicContact CG2-CD1 4.19Å; S279-I281 VanDerWaalsContact O-CG1 3.29Å; S279-I281 WeakPolarHBondContact O-CG1 3.43Å; S279-I281 PolarHBondContact O-N 2.93Å; I281-F336 HydrophobicContact CG2-CE2 4.13Å; I281-Y338 PolarHBondContact N-O 3.27Å; I281-Y338 VanDerWaalsContact N-O 3.11Å; I281-Y338 PolarHBondContact O-N 2.84Å
282	M	91.5	Very high	87.8	Confident	7 Å²	7	26.3 Å²	26.3	3%	0.034	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	139.5	-175.6	-65.9	-177.6	-89.9	0	0	110.7	H155 N280 F284 F307 L334 F336 A337	H155-M282 HydrophobicContact CB-CB 4.43Å; H155-M282 WeakPolarHBondContact CD2-CE 3.48Å; H155-M282 PolarHBondContact N-O 2.84Å; H155-M282 PolarHBondContact O-N 3.31Å; N280-M282 HydrophobicContact CB-CE 4.09Å; M282-F284 HydrophobicContact CB-CE2 3.97Å; M282-F284 HydrophobicContact CB-CZ 4.31Å; M282-F284 HydrophobicContact SD-CZ 4.47Å; M282-F307 HydrophobicContact CE-CE2 4.47Å; M282-F307 HydrophobicContact CE-CZ 4.09Å; M282-F307 HydrophobicContact SD-CE2 3.78Å; M282-F307 HydrophobicContact SD-CZ 4Å; M282-L334 HydrophobicContact CB-CD2 4.04Å; M282-L334 HydrophobicContact CG-CD2 4.28Å; M282-L334 HydrophobicContact SD-CD2 4.31Å; M282-F336 WeakPolarHBondContact CA-O 3.34Å; M282-A337 HydrophobicContact CG-CB 4.19Å
283	G	90.2	Very high	88.8	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	129.1	172.4	0	0	0	0	0	110.2	T153 V335 F336	T153-G283 CarbonylContact O-C 3.52Å; T153-G283 WeakPolarHBondContact O-CA 3.34Å; G283-V335 PolarHBondContact O-N 3.11Å; G283-F336 PolarHBondContact N-O 3.44Å; G283-F336 PolarHBondContact O-N 2.92Å
284	F	90.5	Very high	89.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	141.3	177.9	-53.9	-96.3	0	0	0	110.6	W146 W152 T153 H155 M282 E286 L288 I296 F307 L330 S333 L334	W146-F284 PolarHBondContact NE1-O 3.05Å; W152-F284 WeakPolarHBondContact CA-O 3.22Å; W152-F284 WeakPolarHBondContact CB-O 3.29Å; T153-F284 HydrophobicContact CG2-CD2 4.14Å; T153-F284 PolarHBondContact N-O 2.87Å; T153-F284 PolarHBondContact O-N 3.44Å; H155-F284 HydrophobicContact CB-CE2 4.05Å; M282-F284 HydrophobicContact CB-CE2 3.97Å; M282-F284 HydrophobicContact CB-CZ 4.31Å; M282-F284 HydrophobicContact SD-CZ 4.47Å; F284-E286 PolarHBondContact O-N 2.73Å; F284-L288 HydrophobicContact CB-CD2 4.47Å; F284-L288 HydrophobicContact CD1-CD1 4.44Å; F284-L288 HydrophobicContact CD1-CD2 4.21Å; F284-L288 HydrophobicContact CD2-CD1 3.8Å; F284-L288 HydrophobicContact CD2-CG 4.29Å; F284-L288 HydrophobicContact CE1-CD1 4.37Å; F284-L288 HydrophobicContact CE2-CD1 3.74Å; F284-L288 HydrophobicContact CG-CD1 4.15Å; F284-L288 HydrophobicContact CG-CD2 4.22Å; F284-L288 HydrophobicContact CG-CG 4.27Å; F284-L288 HydrophobicContact CZ-CD1 4.02Å; F284-I296 HydrophobicContact CZ-CD1 4.33Å; F284-F307 HydrophobicContact CE1-CE2 4.18Å; F284-F307 AromaticContact CZ-CE2 3.91Å; F284-F307 HydrophobicContact CZ-CE2 3.91Å; F284-L330 HydrophobicContact CE1-CD2 4.38Å; F284-S333 CarbonylContact C-O 3.25Å; F284-S333 VanDerWaalsContact CA-O 3.27Å; F284-S333 WeakPolarHBondContact CA-O 3.23Å; F284-S333 VanDerWaalsContact CD1-OG 3.31Å; F284-S333 WeakPolarHBondContact CD1-OG 3.48Å; F284-L334 HydrophobicContact CD1-CD2 3.63Å; F284-L334 HydrophobicContact CD1-CG 3.87Å; F284-L334 HydrophobicContact CE1-CD2 3.27Å; F284-L334 HydrophobicContact CE1-CG 3.6Å; F284-L334 HydrophobicContact CE2-CD2 4.21Å; F284-L334 HydrophobicContact CG-CD2 4.28Å; F284-L334 HydrophobicContact CZ-CD2 3.6Å; F284-L334 HydrophobicContact CZ-CG 4.37Å
285	A	87.8	Confident	89.3	Confident	26 Å²	26	29.3 Å²	29.3	22%	0.215	16%	0.162	C	C	.	.	S	Bend	trans	-78	0.4	177.9	0	0	0	0	0	113.8	G151 S333 V335 F355	G151-A285 CarbonylContact O-C 3.5Å; A285-S333 PolarHBondContact N-O 3.35Å; A285-V335 HydrophobicContact CB-CG2 3.6Å; A285-F355 HydrophobicContact CB-CE2 4.48Å
286	E	87.7	Confident	89.5	Confident	104 Å²	104	26.8 Å²	26.8	49%	0.486	15%	0.153	S	C	.	.	S	Bend	trans	-128.4	159.1	-179.2	-63.3	-174.7	167.3	0	0	110.5	W152 T153 F284 L288	W152-E286 CarbonylContact C-O 3.55Å; W152-E286 WeakPolarHBondContact CA-O 3.46Å; T153-E286 PolarHBondContact N-O 2.86Å; T153-E286 PolarHBondContact OG1-O 3.01Å; F284-E286 PolarHBondContact O-N 2.73Å; E286-L288 PolarHBondContact O-N 3.07Å
287	A	90.3	Very high	89.6	Confident	33 Å²	33	31.4 Å²	31.4	27%	0.273	17%	0.171	S	C	.	.			trans	-77.7	110	169.3	0	0	0	0	0	109.2	V222 H223	V222-A287 HydrophobicContact CG1-CB 3.64Å; H223-A287 WeakPolarHBondContact O-CB 3.48Å
288	L	91.7	Very high	89.3	Confident	6 Å²	6	33 Å²	33	3%	0.031	18%	0.183	C	C	.	.			trans	-66.5	140.1	179.5	-66.7	-171.6	0	0	0	111	T153 F284 E286 I293 I296 L330	T153-L288 HydrophobicContact CG2-CB 4.32Å; T153-L288 HydrophobicContact CG2-CD1 3.9Å; T153-L288 HydrophobicContact CG2-CG 3.95Å; T153-L288 PolarHBondContact OG1-N 3.38Å; F284-L288 HydrophobicContact CB-CD2 4.47Å; F284-L288 HydrophobicContact CD1-CD1 4.44Å; F284-L288 HydrophobicContact CD1-CD2 4.21Å; F284-L288 HydrophobicContact CD2-CD1 3.8Å; F284-L288 HydrophobicContact CD2-CG 4.29Å; F284-L288 HydrophobicContact CE1-CD1 4.37Å; F284-L288 HydrophobicContact CE2-CD1 3.74Å; F284-L288 HydrophobicContact CG-CD1 4.15Å; F284-L288 HydrophobicContact CG-CD2 4.22Å; F284-L288 HydrophobicContact CG-CG 4.27Å; F284-L288 HydrophobicContact CZ-CD1 4.02Å; E286-L288 PolarHBondContact O-N 3.07Å; L288-I293 HydrophobicContact CB-CD1 4.13Å; L288-I293 HydrophobicContact CB-CG1 3.86Å; L288-I293 HydrophobicContact CD1-CG1 4.43Å; L288-I296 HydrophobicContact CD1-CD1 3.78Å; L288-L330 HydrophobicContact CD1-CD2 4.22Å; L288-L330 HydrophobicContact CD2-CD2 3.41Å; L288-L330 VanDerWaalsContact CD2-CD2 3.41Å; L288-L330 HydrophobicContact CG-CD2 4.45Å
289	T	90.8	Very high	88.9	Confident	59 Å²	59	34 Å²	34	36%	0.362	19%	0.188	S	C	.	.			trans	-72.2	153.7	175	61.9	0	0	0	0	110.8	E291 Q292 I293	T289-E291 PolarHBondContact O-N 2.89Å; T289-Q292 WeakPolarHBondContact O-CB 3.46Å; T289-Q292 PolarHBondContact O-N 3.21Å; T289-Q292 WeakPolarHBondContact OG1-CB 3.4Å; T289-Q292 VanDerWaalsContact OG1-CD 3.26Å; T289-Q292 WeakPolarHBondContact OG1-CG 3.37Å; T289-Q292 PolarHBondContact OG1-N 3.44Å; T289-Q292 PolarHBondContact OG1-OE1 2.87Å; T289-I293 WeakPolarHBondContact O-CG1 3.45Å; T289-I293 PolarHBondContact O-N 3.03Å
290	P	90.8	Very high	88.5	Confident	76 Å²	76	34.8 Å²	34.8	49%	0.494	20%	0.196	S	C	.	.	H	α-helix	trans	-56.7	-34.5	176.1	22	-33.5	0	0	0	112.7	Y236 I293 S294	Y236-P290 HydrophobicContact CE1-CB 4.04Å; P290-I293 PolarHBondContact O-N 3.35Å; P290-S294 WeakPolarHBondContact O-CB 3.28Å; P290-S294 PolarHBondContact O-N 3.25Å
291	E	88.3	Confident	88.2	Confident	131 Å²	131	35.1 Å²	35.1	61%	0.612	20%	0.199	S	C	*	.	H	α-helix	trans	-64.2	-48.2	177.4	-65.9	177.4	-172.6	0	0	111.5	T289 I293 S294 Y295	T289-E291 PolarHBondContact O-N 2.89Å; E291-I293 VanDerWaalsContact C-N 3.29Å; E291-I293 PolarHBondContact O-N 3.49Å; E291-S294 PolarHBondContact O-N 3.19Å; E291-S294 PolarHBondContact O-OG 2.99Å; E291-Y295 WeakPolarHBondContact O-CB 3.37Å; E291-Y295 PolarHBondContact O-N 3.1Å
292	Q	90	Very high	87.4	Confident	17 Å²	17	39.9 Å²	39.9	8%	0.079	22%	0.22	C	C	.	.	H	α-helix	trans	-58.6	-39.8	174.1	-76.9	168.3	-28.3	0	0	112.5	T289 Y295 I296 L330	T289-Q292 WeakPolarHBondContact O-CB 3.46Å; T289-Q292 PolarHBondContact O-N 3.21Å; T289-Q292 WeakPolarHBondContact OG1-CB 3.4Å; T289-Q292 VanDerWaalsContact OG1-CD 3.26Å; T289-Q292 WeakPolarHBondContact OG1-CG 3.37Å; T289-Q292 PolarHBondContact OG1-N 3.44Å; T289-Q292 PolarHBondContact OG1-OE1 2.87Å; Q292-Y295 WeakPolarHBondContact O-CB 3.44Å; Q292-Y295 PolarHBondContact O-N 2.95Å; Q292-I296 VanDerWaalsContact O-CG1 3.29Å; Q292-I296 WeakPolarHBondContact O-CG1 3.45Å; Q292-I296 PolarHBondContact O-N 2.93Å; Q292-L330 HydrophobicContact CB-CD2 4.04Å; Q292-L330 HydrophobicContact CG-CD1 4.34Å; Q292-L330 HydrophobicContact CG-CD2 3.95Å; Q292-L330 HydrophobicContact CG-CG 4.23Å
293	I	90.9	Very high	86.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-69	-42.1	178.6	-62.7	168.1	0	0	0	110.5	M218 T220 V222 Y236 L288 T289 P290 E291 Y295 I296 Y297	M218-I293 HydrophobicContact CE-CG2 3.85Å; M218-I293 WeakPolarHBondContact CE-O 3.37Å; T220-I293 HydrophobicContact CG2-CD1 4.07Å; T220-I293 HydrophobicContact CG2-CG1 4.15Å; T220-I293 HydrophobicContact CG2-CG2 4.47Å; V222-I293 HydrophobicContact CG2-CD1 3.67Å; Y236-I293 HydrophobicContact CD1-CD1 4.07Å; Y236-I293 HydrophobicContact CD1-CG2 4.04Å; Y236-I293 HydrophobicContact CD2-CD1 3.51Å; Y236-I293 HydrophobicContact CE1-CD1 4.08Å; Y236-I293 HydrophobicContact CE2-CD1 3.51Å; Y236-I293 HydrophobicContact CG-CD1 3.81Å; Y236-I293 HydrophobicContact CG-CG2 3.99Å; L288-I293 HydrophobicContact CB-CD1 4.13Å; L288-I293 HydrophobicContact CB-CG1 3.86Å; L288-I293 HydrophobicContact CD1-CG1 4.43Å; T289-I293 WeakPolarHBondContact O-CG1 3.45Å; T289-I293 PolarHBondContact O-N 3.03Å; P290-I293 PolarHBondContact O-N 3.35Å; E291-I293 VanDerWaalsContact C-N 3.29Å; E291-I293 PolarHBondContact O-N 3.49Å; I293-Y295 PolarHBondContact O-N 3.46Å; I293-I296 PolarHBondContact O-N 3.03Å; I293-Y297 PolarHBondContact O-N 2.88Å
294	S	87.8	Confident	86.3	Confident	62 Å²	62	42 Å²	42	43%	0.434	23%	0.229	S	C	.	.	H	α-helix	trans	-61.4	-37.6	174.4	84.3	0	0	0	0	111.6	P290 E291 Y297 S298	P290-S294 WeakPolarHBondContact O-CB 3.28Å; P290-S294 PolarHBondContact O-N 3.25Å; E291-S294 PolarHBondContact O-N 3.19Å; E291-S294 PolarHBondContact O-OG 2.99Å; S294-Y297 WeakPolarHBondContact O-CB 3.07Å; S294-Y297 PolarHBondContact O-N 3.25Å; S294-S298 PolarHBondContact O-N 3.49Å
295	Y	86.3	Confident	85.7	Confident	19 Å²	19	42.8 Å²	42.8	8%	0.075	24%	0.237	C	C	.	.	H	α-helix	trans	-64.6	-50.5	176	178.4	-106.3	0	0	0	111.5	E291 Q292 I293 Y297 S298 L299 I313 L327 L330	E291-Y295 WeakPolarHBondContact O-CB 3.37Å; E291-Y295 PolarHBondContact O-N 3.1Å; Q292-Y295 WeakPolarHBondContact O-CB 3.44Å; Q292-Y295 PolarHBondContact O-N 2.95Å; I293-Y295 PolarHBondContact O-N 3.46Å; Y295-Y297 PolarHBondContact O-N 3.45Å; Y295-S298 PolarHBondContact O-N 3.39Å; Y295-S298 PolarHBondContact O-OG 3.43Å; Y295-L299 HydrophobicContact CE1-CD1 4.09Å; Y295-L299 HydrophobicContact CE1-CD2 4.48Å; Y295-L299 HydrophobicContact CE1-CG 4.46Å; Y295-L299 PolarHBondContact O-N 3.38Å; Y295-I313 VanDerWaalsContact OH-CG2 3.28Å; Y295-I313 WeakPolarHBondContact OH-CG2 3.46Å; Y295-L327 HydrophobicContact CE1-CD1 3.93Å; Y295-L327 HydrophobicContact CE1-CD2 4.15Å; Y295-L327 HydrophobicContact CE1-CG 4.05Å; Y295-L330 HydrophobicContact CD1-CD1 4.32Å
296	I	88.5	Confident	85.4	Confident	5 Å²	5	43.2 Å²	43.2	3%	0.026	24%	0.235	C	C	.	.	H	α-helix	trans	-55.9	-38.6	175.7	-65.5	165.3	0	0	0	111.3	M218 F284 L288 Q292 I293 L299 F307 L330	M218-I296 HydrophobicContact CE-CB 3.86Å; M218-I296 HydrophobicContact CE-CG2 3.66Å; M218-I296 HydrophobicContact SD-CG2 4.23Å; F284-I296 HydrophobicContact CZ-CD1 4.33Å; L288-I296 HydrophobicContact CD1-CD1 3.78Å; Q292-I296 VanDerWaalsContact O-CG1 3.29Å; Q292-I296 WeakPolarHBondContact O-CG1 3.45Å; Q292-I296 PolarHBondContact O-N 2.93Å; I293-I296 PolarHBondContact O-N 3.03Å; I296-L299 PolarHBondContact O-N 3.47Å; I296-F307 HydrophobicContact CD1-CZ 4.2Å; I296-F307 HydrophobicContact CG1-CE1 3.9Å; I296-F307 HydrophobicContact CG1-CZ 3.92Å; I296-F307 HydrophobicContact CG2-CZ 4.37Å; I296-L330 HydrophobicContact CD1-CD2 4.49Å
297	Y	88.6	Confident	85	Confident	96 Å²	96	38.3 Å²	38.3	38%	0.376	21%	0.212	S	C	.	.	H	α-helix	trans	-64.8	-40.4	175.3	-178.5	-112.7	0	0	0	112.5	W157 M218 N238 I293 S294 Y295 L299 G300	W157-Y297 AromaticContact CH2-CD2 3.76Å; W157-Y297 HydrophobicContact CH2-CD2 3.76Å; W157-Y297 AromaticContact CH2-CE2 3.7Å; W157-Y297 HydrophobicContact CH2-CE2 3.7Å; W157-Y297 HydrophobicContact CZ2-CD2 4.13Å; W157-Y297 HydrophobicContact CZ3-CE2 4.39Å; M218-Y297 HydrophobicContact CB-CD2 4.04Å; M218-Y297 WeakPolarHBondContact SD-CA 3.44Å; M218-Y297 VanDerWaalsContact SD-CB 3.54Å; M218-Y297 HydrophobicContact SD-CD2 3.74Å; M218-Y297 HydrophobicContact SD-CG 4.13Å; N238-Y297 HydrophobicContact CB-CD2 4.26Å; N238-Y297 HydrophobicContact CB-CE2 3.62Å; N238-Y297 WeakPolarHBondContact O-CD1 3.32Å; N238-Y297 WeakPolarHBondContact O-CE1 3.48Å; I293-Y297 PolarHBondContact O-N 2.88Å; S294-Y297 WeakPolarHBondContact O-CB 3.07Å; S294-Y297 PolarHBondContact O-N 3.25Å; Y295-Y297 PolarHBondContact O-N 3.45Å; Y297-L299 VanDerWaalsContact C-N 3.26Å; Y297-L299 PolarHBondContact O-N 3.28Å; Y297-G300 WeakPolarHBondContact O-CA 3.36Å; Y297-G300 PolarHBondContact O-N 3.07Å
298	S	82.8	Confident	84.1	Confident	43 Å²	43	42.9 Å²	42.9	30%	0.301	22%	0.222	S	C	.	.	H	α-helix	trans	-64.8	-25.1	178.9	69.4	0	0	0	0	114.3	S294 Y295 G300 Q320	S294-S298 PolarHBondContact O-N 3.49Å; Y295-S298 PolarHBondContact O-N 3.39Å; Y295-S298 PolarHBondContact O-OG 3.43Å; S298-G300 PolarHBondContact O-N 3.42Å; S298-Q320 PolarHBondContact OG-NE2 3.11Å; S298-Q320 PolarHBondContact OG-OE1 2.88Å
299	L	82.5	Confident	82.9	Confident	21 Å²	21	48.3 Å²	48.3	11%	0.11	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-21.3	171.4	-59.4	173.1	0	0	0	112.6	Y295 I296 Y297 Y303 F307 I313	Y295-L299 HydrophobicContact CE1-CD1 4.09Å; Y295-L299 HydrophobicContact CE1-CD2 4.48Å; Y295-L299 HydrophobicContact CE1-CG 4.46Å; Y295-L299 PolarHBondContact O-N 3.38Å; I296-L299 PolarHBondContact O-N 3.47Å; Y297-L299 VanDerWaalsContact C-N 3.26Å; Y297-L299 PolarHBondContact O-N 3.28Å; L299-Y303 HydrophobicContact CB-CD2 4.21Å; L299-Y303 HydrophobicContact CB-CG 3.93Å; L299-Y303 HydrophobicContact CD1-CD1 3.99Å; L299-Y303 HydrophobicContact CD1-CD2 4.15Å; L299-Y303 HydrophobicContact CD1-CE1 4.08Å; L299-Y303 HydrophobicContact CD1-CE2 4.24Å; L299-Y303 HydrophobicContact CD1-CG 4.02Å; L299-F307 HydrophobicContact CD1-CD1 3.89Å; L299-F307 HydrophobicContact CD1-CE1 3.62Å; L299-I313 HydrophobicContact CD2-CB 4.48Å; L299-I313 HydrophobicContact CD2-CG2 3.76Å
300	G	81.6	Confident	81.2	Confident	17 Å²	17	51.8 Å²	51.8	18%	0.175	26%	0.258	C	S	.	.			trans	74.5	172.9	177.5	0	0	0	0	0	114.9	Y297 S298 K302 Y303	Y297-G300 WeakPolarHBondContact O-CA 3.36Å; Y297-G300 PolarHBondContact O-N 3.07Å; S298-G300 PolarHBondContact O-N 3.42Å; G300-K302 PolarHBondContact O-N 3.48Å; G300-Y303 WeakPolarHBondContact O-CB 3.48Å; G300-Y303 PolarHBondContact O-N 3.02Å
301	P	80.9	Confident	79.3	Confident	16 Å²	16	52.3 Å²	52.3	10%	0.104	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-15.7	-174.6	27	-34	0	0	0	113.8	S122 P124 W157 Y303 Q304	S122-P301 WeakPolarHBondContact O-CG 3.05Å; P124-P301 WeakPolarHBondContact CA-O 3.45Å; P124-P301 HydrophobicContact CB-CB 4.17Å; P124-P301 VanDerWaalsContact CB-O 3.3Å; P124-P301 WeakPolarHBondContact CB-O 3.45Å; W157-P301 HydrophobicContact CD2-CB 3.84Å; W157-P301 HydrophobicContact CE3-CB 3.9Å; W157-P301 HydrophobicContact CG-CB 4.43Å; W157-P301 HydrophobicContact CH2-CB 4.15Å; W157-P301 HydrophobicContact CH2-CG 4.28Å; W157-P301 HydrophobicContact CZ2-CB 4.1Å; W157-P301 HydrophobicContact CZ3-CB 4.05Å; W157-P301 HydrophobicContact CZ3-CG 4.31Å; P301-Y303 VanDerWaalsContact C-N 3.27Å; P301-Q304 PolarHBondContact O-NE2 3.25Å
302	K	75.7	Confident	77.6	Confident	99 Å²	99	50.3 Å²	50.3	43%	0.43	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-10.4	176.9	-69.2	179.6	-177	165.8	0	112.9	P119 A121 T123 G300 Q304	P119-K302 PolarHBondContact O-NZ 2.95Å; A121-K302 WeakPolarHBondContact O-CE 3.25Å; A121-K302 PolarHBondContact O-NZ 3.08Å; A121-K302 VanDerWaalsContact O-NZ 3.11Å; T123-K302 WeakPolarHBondContact O-CE 3.23Å; T123-K302 WeakPolarHBondContact O-CG 3.47Å; G300-K302 PolarHBondContact O-N 3.48Å; K302-Q304 WeakPolarHBondContact O-CG 3.49Å; K302-Q304 PolarHBondContact O-N 3.22Å
303	Y	81.1	Confident	75.8	Confident	23 Å²	23	50.9 Å²	50.9	9%	0.09	27%	0.265	C	S	.	.			trans	-67.8	121.9	176	-175	-103.1	0	0	0	110.7	N280 L299 G300 P301 G305 Q306 F307 D312	N280-Y303 PolarHBondContact ND2-O 3.49Å; L299-Y303 HydrophobicContact CB-CD2 4.21Å; L299-Y303 HydrophobicContact CB-CG 3.93Å; L299-Y303 HydrophobicContact CD1-CD1 3.99Å; L299-Y303 HydrophobicContact CD1-CD2 4.15Å; L299-Y303 HydrophobicContact CD1-CE1 4.08Å; L299-Y303 HydrophobicContact CD1-CE2 4.24Å; L299-Y303 HydrophobicContact CD1-CG 4.02Å; G300-Y303 WeakPolarHBondContact O-CB 3.48Å; G300-Y303 PolarHBondContact O-N 3.02Å; P301-Y303 VanDerWaalsContact C-N 3.27Å; Y303-G305 VanDerWaalsContact CE1-C 3.46Å; Y303-G305 VanDerWaalsContact CE1-O 3.26Å; Y303-G305 WeakPolarHBondContact CE1-O 3.45Å; Y303-G305 WeakPolarHBondContact OH-CA 3.49Å; Y303-Q306 PolarHBondContact OH-N 2.91Å; Y303-F307 HydrophobicContact CD1-CE1 4.02Å; Y303-F307 AromaticContact CE1-CD1 3.69Å; Y303-F307 HydrophobicContact CE1-CD1 3.69Å; Y303-F307 AromaticContact CE1-CE1 3.41Å; Y303-F307 HydrophobicContact CE1-CE1 3.41Å; Y303-F307 VanDerWaalsContact CE1-CE1 3.41Å; Y303-F307 HydrophobicContact CE1-CG 4.47Å; Y303-F307 AromaticContact CE1-CZ 4Å; Y303-F307 HydrophobicContact CE1-CZ 4Å; Y303-F307 AromaticContact CZ-CD1 3.95Å; Y303-F307 VanDerWaalsContact OH-CA 3.29Å; Y303-F307 WeakPolarHBondContact OH-CA 3.41Å; Y303-F307 PolarHBondContact OH-N 3.41Å; Y303-D312 HydrophobicContact CE2-CB 4.16Å
304	Q	77.4	Confident	73.6	Confident	30 Å²	30	56.9 Å²	56.9	14%	0.14	31%	0.305	C	S	.	.			trans	-120.6	5.5	-176.3	-64.3	-60.1	-46.6	0	0	113.5	S125 S126 S279 N280 P301 K302 N339 L341	S125-Q304 VanDerWaalsContact OG-CG 3.3Å; S125-Q304 WeakPolarHBondContact OG-CG 3.31Å; S126-Q304 PolarHBondContact OG-OE1 3.31Å; S279-Q304 PolarHBondContact OG-NE2 3.32Å; N280-Q304 VanDerWaalsContact CG-OE1 3.24Å; N280-Q304 WeakPolarHBondContact ND2-CA 3.4Å; N280-Q304 PolarHBondContact ND2-NE2 2.9Å; N280-Q304 PolarHBondContact ND2-OE1 3.28Å; N280-Q304 PolarHBondContact OD1-OE1 2.86Å; P301-Q304 PolarHBondContact O-NE2 3.25Å; K302-Q304 WeakPolarHBondContact O-CG 3.49Å; K302-Q304 PolarHBondContact O-N 3.22Å; Q304-N339 WeakPolarHBondContact CB-ND2 3.41Å; Q304-N339 PolarHBondContact O-ND2 3.24Å; Q304-N339 PolarHBondContact OE1-ND2 3.01Å; Q304-N339 VanDerWaalsContact OE1-ND2 3.13Å; Q304-N339 PolarHBondContact OE1-OD1 2.91Å; Q304-N339 VanDerWaalsContact OE1-OD1 3.06Å; Q304-L341 HydrophobicContact CB-CD1 4.1Å; Q304-L341 HydrophobicContact CG-CD1 4.02Å
305	G	78.6	Confident	71.4	Confident	16 Å²	16	56.9 Å²	56.9	17%	0.165	31%	0.306	C	S	.	.	S	Bend	trans	-87.3	-172.9	-178	0	0	0	0	0	114.1	Y303	Y303-G305 VanDerWaalsContact CE1-C 3.46Å; Y303-G305 VanDerWaalsContact CE1-O 3.26Å; Y303-G305 WeakPolarHBondContact CE1-O 3.45Å; Y303-G305 WeakPolarHBondContact OH-CA 3.49Å
306	Q	80.2	Confident	69.3	Low	35 Å²	35	63.9 Å²	63.9	16%	0.164	34%	0.339	C	S	.	.			trans	-120	22	-178.4	-64.7	156.1	36.5	0	0	112.8	Y303 R308 Y331 L334 A337 Q351	Y303-Q306 PolarHBondContact OH-N 2.91Å; Q306-R308 PolarHBondContact O-N 3.32Å; Q306-Y331 HydrophobicContact CB-CD2 4.05Å; Q306-Y331 HydrophobicContact CB-CE2 4.1Å; Q306-Y331 WeakPolarHBondContact O-CD2 3.33Å; Q306-L334 HydrophobicContact CB-CD1 4.18Å; Q306-A337 HydrophobicContact CG-CB 4.48Å; Q306-Q351 HydrophobicContact CG-CB 4.4Å; Q306-Q351 PolarHBondContact OE1-O 3.16Å; Q306-Q351 VanDerWaalsContact OE1-O 3.08Å
307	F	81.2	Confident	67	Low	1 Å²	1	66.7 Å²	66.7	0%	0.004	36%	0.359	C	S	.	.	S	Bend	trans	62.9	20.7	-177	-37.8	-72.8	0	0	0	114.3	M282 F284 I296 L299 Y303 L327 L330 L334	M282-F307 HydrophobicContact CE-CE2 4.47Å; M282-F307 HydrophobicContact CE-CZ 4.09Å; M282-F307 HydrophobicContact SD-CE2 3.78Å; M282-F307 HydrophobicContact SD-CZ 4Å; F284-F307 HydrophobicContact CE1-CE2 4.18Å; F284-F307 AromaticContact CZ-CE2 3.91Å; F284-F307 HydrophobicContact CZ-CE2 3.91Å; I296-F307 HydrophobicContact CD1-CZ 4.2Å; I296-F307 HydrophobicContact CG1-CE1 3.9Å; I296-F307 HydrophobicContact CG1-CZ 3.92Å; I296-F307 HydrophobicContact CG2-CZ 4.37Å; L299-F307 HydrophobicContact CD1-CD1 3.89Å; L299-F307 HydrophobicContact CD1-CE1 3.62Å; Y303-F307 HydrophobicContact CD1-CE1 4.02Å; Y303-F307 AromaticContact CE1-CD1 3.69Å; Y303-F307 HydrophobicContact CE1-CD1 3.69Å; Y303-F307 AromaticContact CE1-CE1 3.41Å; Y303-F307 HydrophobicContact CE1-CE1 3.41Å; Y303-F307 VanDerWaalsContact CE1-CE1 3.41Å; Y303-F307 HydrophobicContact CE1-CG 4.47Å; Y303-F307 AromaticContact CE1-CZ 4Å; Y303-F307 HydrophobicContact CE1-CZ 4Å; Y303-F307 AromaticContact CZ-CD1 3.95Å; Y303-F307 VanDerWaalsContact OH-CA 3.29Å; Y303-F307 WeakPolarHBondContact OH-CA 3.41Å; Y303-F307 PolarHBondContact OH-N 3.41Å; F307-L327 HydrophobicContact CB-CD2 4.24Å; F307-L330 HydrophobicContact CB-CB 4.26Å; F307-L330 HydrophobicContact CD2-CB 4.22Å; F307-L330 HydrophobicContact CG-CB 4.32Å; F307-L334 HydrophobicContact CD2-CD1 4.2Å; F307-L334 HydrophobicContact CE2-CD1 4.47Å
308	R	71.1	Confident	64.7	Low	129 Å²	129	67 Å²	67	49%	0.487	38%	0.375	S	S	.	.			trans	-90.8	-40.1	-177.2	-174.1	179	-178.4	172	0.6	114.1	Q306 Y331	Q306-R308 PolarHBondContact O-N 3.32Å; R308-Y331 HydrophobicContact CB-CD2 4.03Å; R308-Y331 HydrophobicContact CB-CE2 4.09Å; R308-Y331 HydrophobicContact CB-CG 4.31Å; R308-Y331 HydrophobicContact CG-CE1 4.37Å; R308-Y331 HydrophobicContact CG-CE2 4.43Å; R308-Y331 PolarHBondContact NH1-OH 3.43Å
309	F	65.5	Low	62.7	Low	119 Å²	119	71.7 Å²	71.7	52%	0.522	40%	0.397	S	S	.	.			trans	-111.4	123.8	-174.5	-59.9	-69.7	0	0	0	109.9	A311 D312	F309-A311 PolarHBondContact O-N 3.09Å; F309-D312 PolarHBondContact O-N 3.05Å
310	E	55.6	Low	61	Low	133 Å²	133	73.7 Å²	73.7	62%	0.621	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-59.6	-28	174.6	-68.2	-179.6	171.7	0	0	112.2	D312 I313	E310-D312 PolarHBondContact O-N 2.76Å; E310-I313 VanDerWaalsContact O-CB 3.26Å; E310-I313 WeakPolarHBondContact O-CB 2.8Å; E310-I313 PolarHBondContact O-N 3.19Å; E310-I313 VanDerWaalsContact O-N 3.11Å
311	A	51.6	Low	59.3	Low	86 Å²	86	77.7 Å²	77.7	71%	0.711	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-63.5	-25.9	178.4	0	0	0	0	0	113.8	F309 I313	F309-A311 PolarHBondContact O-N 3.09Å; A311-I313 PolarHBondContact O-N 3.46Å
312	D	52.3	Low	57.8	Low	89 Å²	89	86.1 Å²	86.1	48%	0.476	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-78	-1.9	178.8	-64.2	-23.7	0	0	0	112.5	Y303 F309 E310	Y303-D312 HydrophobicContact CE2-CB 4.16Å; F309-D312 PolarHBondContact O-N 3.05Å; E310-D312 PolarHBondContact O-N 2.76Å
313	I	52.1	Low	56.6	Low	29 Å²	29	85.8 Å²	85.8	15%	0.149	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-110.7	-9.5	-163.9	-55.5	-179.1	0	0	0	112.4	Y295 L299 E310 A311 S315 L327	Y295-I313 VanDerWaalsContact OH-CG2 3.28Å; Y295-I313 WeakPolarHBondContact OH-CG2 3.46Å; L299-I313 HydrophobicContact CD2-CB 4.48Å; L299-I313 HydrophobicContact CD2-CG2 3.76Å; E310-I313 VanDerWaalsContact O-CB 3.26Å; E310-I313 WeakPolarHBondContact O-CB 2.8Å; E310-I313 PolarHBondContact O-N 3.19Å; E310-I313 VanDerWaalsContact O-N 3.11Å; A311-I313 PolarHBondContact O-N 3.46Å; I313-S315 VanDerWaalsContact C-N 3.26Å; I313-S315 PolarHBondContact O-N 2.97Å; I313-L327 HydrophobicContact CD1-CD2 3.21Å
314	C	43.8	Very low	55.3	Low	126 Å²	126	87 Å²	87	85%	0.851	47%	0.474	S	S	*	.			trans	-66.9	76.1	-178.7	-85.7	0	0	0	0	113.4
315	S	42.9	Very low	54.3	Low	63 Å²	63	90.5 Å²	90.5	44%	0.441	50%	0.502	S	S	.	.			trans	-94.2	140.4	150.5	53.3	0	0	0	0	109.2	I313 S317	I313-S315 VanDerWaalsContact C-N 3.26Å; I313-S315 PolarHBondContact O-N 2.97Å; S315-S317 PolarHBondContact O-N 3.42Å
316	E	41.1	Very low	53.7	Low	165 Å²	165	91.4 Å²	91.4	77%	0.771	50%	0.503	S	S	*	.	S	Bend	trans	-53.1	14.6	-167	-64.1	177.9	161.8	0	0	118.3	R448	E316-R448 IonicContact OE1-NH2 2.61Å; E316-R448 PolarHBondContact OE1-NH2 3.18Å; E316-R448 IonicContact OE2-NH2 2.72Å
317	S	40.9	Very low	53.2	Low	65 Å²	65	90.4 Å²	90.4	46%	0.455	50%	0.499	S	S	.	.			trans	-97.9	91.1	178.4	57.8	0	0	0	0	112.2	S315 N319	S315-S317 PolarHBondContact O-N 3.42Å; S317-N319 PolarHBondContact O-N 3.43Å
318	S	38.9	Very low	53	Low	101 Å²	101	95.6 Å²	95.6	71%	0.706	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	10.6	-173.1	52.8	0	0	0	0	117.8
319	N	42.5	Very low	53.4	Low	143 Å²	143	94.9 Å²	94.9	77%	0.765	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.9	5	-170.3	-69.7	7.4	0	0	0	115.2	S317	S317-N319 PolarHBondContact O-N 3.43Å
320	Q	45.5	Very low	54.3	Low	63 Å²	63	89.3 Å²	89.3	29%	0.294	50%	0.503	S	S	.	.			trans	-98.8	-1.1	-174.9	-67.9	-173.6	-13.5	0	0	114.5	S298 E322 I323	S298-Q320 PolarHBondContact OG-NE2 3.11Å; S298-Q320 PolarHBondContact OG-OE1 2.88Å; Q320-E322 VanDerWaalsContact C-N 3.3Å; Q320-E322 PolarHBondContact O-N 3.35Å; Q320-I323 PolarHBondContact O-N 3.3Å
321	T	45.5	Very low	55.7	Low	101 Å²	101	83.8 Å²	83.8	62%	0.62	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-66.5	-26.8	-174.7	45.9	0	0	0	0	114.2	I323 I324	T321-I323 PolarHBondContact O-N 2.97Å; T321-I324 VanDerWaalsContact CA-CD1 3.49Å; T321-I324 HydrophobicContact CG2-CD1 3.86Å; T321-I324 VanDerWaalsContact O-CB 3.32Å; T321-I324 WeakPolarHBondContact O-CB 3.36Å; T321-I324 VanDerWaalsContact O-CG1 3.29Å; T321-I324 WeakPolarHBondContact O-CG1 3.42Å; T321-I324 PolarHBondContact O-N 3.01Å
322	E	49.7	Very low	57.2	Low	192 Å²	192	84.3 Å²	84.3	90%	0.897	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-69.6	-15.3	176.5	-72.4	-171.9	158.5	0	0	113.7	Q320 I324	Q320-E322 VanDerWaalsContact C-N 3.3Å; Q320-E322 PolarHBondContact O-N 3.35Å; E322-I324 VanDerWaalsContact C-N 3.34Å
323	I	52	Low	58.8	Low	93 Å²	93	80.3 Å²	80.3	48%	0.477	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-88.4	-2.9	-179.7	-50.8	176.9	0	0	0	111.5	Q320 T321 S325	Q320-I323 PolarHBondContact O-N 3.3Å; T321-I323 PolarHBondContact O-N 2.97Å; I323-S325 VanDerWaalsContact C-N 3.3Å; I323-S325 PolarHBondContact O-N 3.27Å; I323-S325 VanDerWaalsContact O-N 3.07Å
324	I	52.9	Low	60.4	Low	48 Å²	48	79 Å²	79	25%	0.246	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-71.3	-6.4	-163.3	-70.7	-179.5	0	0	0	115.9	T321 E322 D326 L327	T321-I324 VanDerWaalsContact CA-CD1 3.49Å; T321-I324 HydrophobicContact CG2-CD1 3.86Å; T321-I324 VanDerWaalsContact O-CB 3.32Å; T321-I324 WeakPolarHBondContact O-CB 3.36Å; T321-I324 VanDerWaalsContact O-CG1 3.29Å; T321-I324 WeakPolarHBondContact O-CG1 3.42Å; T321-I324 PolarHBondContact O-N 3.01Å; E322-I324 VanDerWaalsContact C-N 3.34Å; I324-D326 PolarHBondContact O-N 3.25Å; I324-L327 HydrophobicContact CB-CD1 4.21Å; I324-L327 HydrophobicContact CG1-CD1 4.04Å; I324-L327 HydrophobicContact CG2-CD1 4.1Å; I324-L327 PolarHBondContact O-N 2.51Å
325	S	56.2	Low	62.4	Low	103 Å²	103	73.1 Å²	73.1	72%	0.72	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-60.1	-16.3	178.6	65	0	0	0	0	114.3	I323	I323-S325 VanDerWaalsContact C-N 3.3Å; I323-S325 PolarHBondContact O-N 3.27Å; I323-S325 VanDerWaalsContact O-N 3.07Å
326	D	65.3	Low	64.5	Low	35 Å²	35	70.3 Å²	70.3	19%	0.187	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-98.5	-6.7	-173.2	-73.6	-20.3	0	0	0	116.1	I324 N328 K329 L330	I324-D326 PolarHBondContact O-N 3.25Å; D326-N328 PolarHBondContact O-N 3.32Å; D326-K329 WeakPolarHBondContact O-CB 3.38Å; D326-K329 PolarHBondContact O-N 3.05Å; D326-K329 VanDerWaalsContact O-N 3.11Å; D326-K329 WeakPolarHBondContact OD1-CE 3.29Å; D326-K329 IonicContact OD1-NZ 3.78Å; D326-K329 PolarHBondContact OD1-NZ 3.38Å; D326-L330 PolarHBondContact O-N 3.3Å; D326-L330 VanDerWaalsContact O-N 3.09Å
327	L	71.7	Confident	66.8	Low	15 Å²	15	62.7 Å²	62.7	8%	0.079	35%	0.345	C	S	.	.	H	α-helix	trans	-64.8	-41.4	-177.8	-91.7	97.7	0	0	0	113.7	Y295 F307 I313 I324 K329 L330 Y331	Y295-L327 HydrophobicContact CE1-CD1 3.93Å; Y295-L327 HydrophobicContact CE1-CD2 4.15Å; Y295-L327 HydrophobicContact CE1-CG 4.05Å; F307-L327 HydrophobicContact CB-CD2 4.24Å; I313-L327 HydrophobicContact CD1-CD2 3.21Å; I324-L327 HydrophobicContact CB-CD1 4.21Å; I324-L327 HydrophobicContact CG1-CD1 4.04Å; I324-L327 HydrophobicContact CG2-CD1 4.1Å; I324-L327 PolarHBondContact O-N 2.51Å; L327-K329 PolarHBondContact O-N 2.97Å; L327-L330 WeakPolarHBondContact O-CB 3.3Å; L327-L330 PolarHBondContact O-N 3.1Å; L327-L330 VanDerWaalsContact O-N 3.13Å; L327-Y331 PolarHBondContact O-N 3.19Å
328	N	76	Confident	69.2	Low	109 Å²	109	59.8 Å²	59.8	58%	0.583	32%	0.324	S	S	*	.	H	α-helix	trans	-62.5	-31.2	175.8	-80.1	-33.6	0	0	0	111.7	D326 N332	D326-N328 PolarHBondContact O-N 3.32Å; N328-N332 VanDerWaalsContact O-CB 3.24Å; N328-N332 WeakPolarHBondContact O-CB 3.34Å; N328-N332 PolarHBondContact O-N 3.12Å; N328-N332 PolarHBondContact O-ND2 3.11Å
329	K	80.4	Confident	71.5	Confident	114 Å²	114	55.1 Å²	55.1	50%	0.496	29%	0.291	S	S	.	.	H	α-helix	trans	-68.1	-44	173.9	-62	179.8	-172.3	155.8	0	111	D326 L327 Y331 N332 S333	D326-K329 WeakPolarHBondContact O-CB 3.38Å; D326-K329 PolarHBondContact O-N 3.05Å; D326-K329 VanDerWaalsContact O-N 3.11Å; D326-K329 WeakPolarHBondContact OD1-CE 3.29Å; D326-K329 IonicContact OD1-NZ 3.78Å; D326-K329 PolarHBondContact OD1-NZ 3.38Å; L327-K329 PolarHBondContact O-N 2.97Å; K329-Y331 PolarHBondContact O-N 3.19Å; K329-N332 PolarHBondContact O-N 3.47Å; K329-S333 WeakPolarHBondContact O-CB 3.36Å; K329-S333 PolarHBondContact O-N 3.46Å; K329-S333 PolarHBondContact O-OG 3.39Å
330	L	83.9	Confident	73.6	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-56.7	-51.5	174.6	-73.9	175.8	0	0	0	111.5	F284 L288 Q292 Y295 I296 F307 D326 L327 N332 S333 L334	F284-L330 HydrophobicContact CE1-CD2 4.38Å; L288-L330 HydrophobicContact CD1-CD2 4.22Å; L288-L330 HydrophobicContact CD2-CD2 3.41Å; L288-L330 VanDerWaalsContact CD2-CD2 3.41Å; L288-L330 HydrophobicContact CG-CD2 4.45Å; Q292-L330 HydrophobicContact CB-CD2 4.04Å; Q292-L330 HydrophobicContact CG-CD1 4.34Å; Q292-L330 HydrophobicContact CG-CD2 3.95Å; Q292-L330 HydrophobicContact CG-CG 4.23Å; Y295-L330 HydrophobicContact CD1-CD1 4.32Å; I296-L330 HydrophobicContact CD1-CD2 4.49Å; F307-L330 HydrophobicContact CB-CB 4.26Å; F307-L330 HydrophobicContact CD2-CB 4.22Å; F307-L330 HydrophobicContact CG-CB 4.32Å; D326-L330 PolarHBondContact O-N 3.3Å; D326-L330 VanDerWaalsContact O-N 3.09Å; L327-L330 WeakPolarHBondContact O-CB 3.3Å; L327-L330 PolarHBondContact O-N 3.1Å; L327-L330 VanDerWaalsContact O-N 3.13Å; L330-N332 PolarHBondContact O-N 3.24Å; L330-S333 PolarHBondContact O-N 3.37Å; L330-S333 PolarHBondContact O-OG 3.42Å; L330-L334 PolarHBondContact O-N 3.39Å
331	Y	84.6	Confident	75.4	Confident	17 Å²	17	49.2 Å²	49.2	7%	0.067	26%	0.261	C	S	.	.	H	α-helix	trans	-59	-45.4	177.8	177.3	-114.3	0	0	0	112.5	Q306 R308 L327 K329 S333 L334 V353	Q306-Y331 HydrophobicContact CB-CD2 4.05Å; Q306-Y331 HydrophobicContact CB-CE2 4.1Å; Q306-Y331 WeakPolarHBondContact O-CD2 3.33Å; R308-Y331 HydrophobicContact CB-CD2 4.03Å; R308-Y331 HydrophobicContact CB-CE2 4.09Å; R308-Y331 HydrophobicContact CB-CG 4.31Å; R308-Y331 HydrophobicContact CG-CE1 4.37Å; R308-Y331 HydrophobicContact CG-CE2 4.43Å; R308-Y331 PolarHBondContact NH1-OH 3.43Å; L327-Y331 PolarHBondContact O-N 3.19Å; K329-Y331 PolarHBondContact O-N 3.19Å; Y331-S333 VanDerWaalsContact C-N 3.28Å; Y331-S333 PolarHBondContact O-N 3.29Å; Y331-L334 HydrophobicContact CD2-CD1 4.37Å; Y331-L334 PolarHBondContact O-N 3.02Å; Y331-V353 VanDerWaalsContact OH-CG2 3.22Å; Y331-V353 WeakPolarHBondContact OH-CG2 3.28Å
332	N	82.9	Confident	77.2	Confident	97 Å²	97	46 Å²	46	52%	0.519	24%	0.243	S	C	.	.	H	α-helix	trans	-68.8	-26.7	-178.5	-70.3	-22.2	0	0	0	113.3	N328 K329 L330 N354	N328-N332 VanDerWaalsContact O-CB 3.24Å; N328-N332 WeakPolarHBondContact O-CB 3.34Å; N328-N332 PolarHBondContact O-N 3.12Å; N328-N332 PolarHBondContact O-ND2 3.11Å; K329-N332 PolarHBondContact O-N 3.47Å; L330-N332 PolarHBondContact O-N 3.24Å; N332-N354 PolarHBondContact OD1-ND2 3.38Å
333	S	85.3	Confident	78.9	Confident	6 Å²	6	38.5 Å²	38.5	4%	0.042	21%	0.211	C	C	.	.	H	α-helix	trans	-81.2	-11.4	178.5	67.6	0	0	0	0	113.8	F284 A285 K329 L330 Y331 V335	F284-S333 CarbonylContact C-O 3.25Å; F284-S333 VanDerWaalsContact CA-O 3.27Å; F284-S333 WeakPolarHBondContact CA-O 3.23Å; F284-S333 VanDerWaalsContact CD1-OG 3.31Å; F284-S333 WeakPolarHBondContact CD1-OG 3.48Å; A285-S333 PolarHBondContact N-O 3.35Å; K329-S333 WeakPolarHBondContact O-CB 3.36Å; K329-S333 PolarHBondContact O-N 3.46Å; K329-S333 PolarHBondContact O-OG 3.39Å; L330-S333 PolarHBondContact O-N 3.37Å; L330-S333 PolarHBondContact O-OG 3.42Å; Y331-S333 VanDerWaalsContact C-N 3.28Å; Y331-S333 PolarHBondContact O-N 3.29Å; S333-V335 PolarHBondContact O-N 3.23Å
334	L	87.1	Confident	80.4	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	124.3	178.5	-77.1	167.2	0	0	0	112.3	M282 F284 Q306 F307 L330 Y331 T352	M282-L334 HydrophobicContact CB-CD2 4.04Å; M282-L334 HydrophobicContact CG-CD2 4.28Å; M282-L334 HydrophobicContact SD-CD2 4.31Å; F284-L334 HydrophobicContact CD1-CD2 3.63Å; F284-L334 HydrophobicContact CD1-CG 3.87Å; F284-L334 HydrophobicContact CE1-CD2 3.27Å; F284-L334 HydrophobicContact CE1-CG 3.6Å; F284-L334 HydrophobicContact CE2-CD2 4.21Å; F284-L334 HydrophobicContact CG-CD2 4.28Å; F284-L334 HydrophobicContact CZ-CD2 3.6Å; F284-L334 HydrophobicContact CZ-CG 4.37Å; Q306-L334 HydrophobicContact CB-CD1 4.18Å; F307-L334 HydrophobicContact CD2-CD1 4.2Å; F307-L334 HydrophobicContact CE2-CD1 4.47Å; L330-L334 PolarHBondContact O-N 3.39Å; Y331-L334 HydrophobicContact CD2-CD1 4.37Å; Y331-L334 PolarHBondContact O-N 3.02Å; L334-T352 HydrophobicContact CB-CG2 3.67Å
335	V	84.8	Confident	81.9	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-43.4	173.8	-176.3	0	0	0	0	111.1	W146 G283 A285 S333 N350 T352 F355	W146-V335 HydrophobicContact CB-CG1 3.88Å; W146-V335 HydrophobicContact CB-CG2 4.27Å; W146-V335 HydrophobicContact CG-CB 4.35Å; W146-V335 HydrophobicContact CG-CG1 4.15Å; W146-V335 HydrophobicContact CG-CG2 4.03Å; G283-V335 PolarHBondContact O-N 3.11Å; A285-V335 HydrophobicContact CB-CG2 3.6Å; S333-V335 PolarHBondContact O-N 3.23Å; V335-N350 PolarHBondContact O-ND2 3.36Å; V335-T352 PolarHBondContact O-OG1 3.48Å; V335-F355 HydrophobicContact CB-CD2 4.14Å; V335-F355 HydrophobicContact CB-CE2 4.13Å; V335-F355 HydrophobicContact CG1-CD1 4.38Å; V335-F355 HydrophobicContact CG1-CD2 3.95Å; V335-F355 HydrophobicContact CG1-CE1 4.26Å; V335-F355 HydrophobicContact CG1-CE2 3.85Å; V335-F355 HydrophobicContact CG1-CG 4.22Å; V335-F355 HydrophobicContact CG1-CZ 3.99Å; V335-F355 HydrophobicContact CG2-CD2 3.96Å; V335-F355 HydrophobicContact CG2-CE2 3.58Å; V335-F355 HydrophobicContact CG2-CZ 4.3Å
336	F	87.2	Confident	83.3	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.018	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	147.2	172.6	60.1	-95.6	0	0	0	110.6	L140 W146 I281 M282 G283 Y338 N350	L140-F336 HydrophobicContact CD2-CD1 4.29Å; L140-F336 HydrophobicContact CD2-CD2 4.41Å; L140-F336 HydrophobicContact CD2-CE1 4.01Å; L140-F336 HydrophobicContact CD2-CE2 4.14Å; L140-F336 HydrophobicContact CD2-CG 4.48Å; L140-F336 HydrophobicContact CD2-CZ 3.92Å; W146-F336 AromaticContact CD2-CE1 3.97Å; W146-F336 HydrophobicContact CD2-CE1 3.97Å; W146-F336 AromaticContact CE3-CE1 3.64Å; W146-F336 HydrophobicContact CE3-CE1 3.64Å; W146-F336 HydrophobicContact CE3-CZ 4.42Å; W146-F336 AromaticContact CH2-CE1 3.66Å; W146-F336 HydrophobicContact CH2-CE1 3.66Å; W146-F336 AromaticContact CH2-CZ 3.63Å; W146-F336 HydrophobicContact CH2-CZ 3.63Å; W146-F336 AromaticContact CZ2-CE1 3.97Å; W146-F336 HydrophobicContact CZ2-CE1 3.97Å; W146-F336 HydrophobicContact CZ2-CZ 4.09Å; W146-F336 AromaticContact CZ3-CE1 3.48Å; W146-F336 HydrophobicContact CZ3-CE1 3.48Å; W146-F336 VanDerWaalsContact CZ3-CE1 3.48Å; W146-F336 AromaticContact CZ3-CZ 3.82Å; W146-F336 HydrophobicContact CZ3-CZ 3.82Å; I281-F336 HydrophobicContact CG2-CE2 4.13Å; M282-F336 WeakPolarHBondContact CA-O 3.34Å; G283-F336 PolarHBondContact N-O 3.44Å; G283-F336 PolarHBondContact O-N 2.92Å; F336-Y338 HydrophobicContact CB-CD2 4.45Å; F336-Y338 HydrophobicContact CB-CE2 3.76Å; F336-Y338 AromaticContact CD2-CD2 3.57Å; F336-Y338 HydrophobicContact CD2-CD2 3.57Å; F336-Y338 AromaticContact CD2-CE2 3.33Å; F336-Y338 HydrophobicContact CD2-CE2 3.33Å; F336-Y338 HydrophobicContact CE2-CD2 4.23Å; F336-Y338 HydrophobicContact CE2-CE2 4.08Å; F336-Y338 HydrophobicContact CG-CD2 4.31Å; F336-Y338 AromaticContact CG-CE2 3.67Å; F336-Y338 HydrophobicContact CG-CE2 3.67Å; F336-N350 VanDerWaalsContact CA-OD1 3.3Å; F336-N350 WeakPolarHBondContact CA-OD1 3.32Å
337	A	89.7	Confident	84.4	Confident	4 Å²	4	43.9 Å²	43.9	3%	0.033	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	103.9	172.4	0	0	0	0	0	107.9	M282 Q306 N350 Q351 T352	M282-A337 HydrophobicContact CG-CB 4.19Å; Q306-A337 HydrophobicContact CG-CB 4.48Å; A337-N350 PolarHBondContact N-OD1 3Å; A337-Q351 PolarHBondContact O-N 2.93Å; A337-T352 HydrophobicContact CB-CG2 3.94Å
338	Y	90.3	Very high	85.2	Confident	4 Å²	4	43.2 Å²	43.2	2%	0.016	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	108.1	177.3	-57.5	-63	0	0	0	109.4	L140 I281 F336 C348 N350 L363 A365	L140-Y338 HydrophobicContact CD1-CE2 3.98Å; L140-Y338 HydrophobicContact CD2-CE2 3.77Å; L140-Y338 HydrophobicContact CG-CE2 3.61Å; I281-Y338 PolarHBondContact N-O 3.27Å; I281-Y338 VanDerWaalsContact N-O 3.11Å; I281-Y338 PolarHBondContact O-N 2.84Å; F336-Y338 HydrophobicContact CB-CD2 4.45Å; F336-Y338 HydrophobicContact CB-CE2 3.76Å; F336-Y338 AromaticContact CD2-CD2 3.57Å; F336-Y338 HydrophobicContact CD2-CD2 3.57Å; F336-Y338 AromaticContact CD2-CE2 3.33Å; F336-Y338 HydrophobicContact CD2-CE2 3.33Å; F336-Y338 HydrophobicContact CE2-CD2 4.23Å; F336-Y338 HydrophobicContact CE2-CE2 4.08Å; F336-Y338 HydrophobicContact CG-CD2 4.31Å; F336-Y338 AromaticContact CG-CE2 3.67Å; F336-Y338 HydrophobicContact CG-CE2 3.67Å; Y338-C348 HydrophobicContact CD1-CB 4Å; Y338-N350 HydrophobicContact CD1-CB 4.43Å; Y338-N350 HydrophobicContact CE1-CB 3.79Å; Y338-L363 WeakPolarHBondContact CE1-O 3.43Å; Y338-L363 PolarHBondContact OH-O 3.22Å; Y338-A365 HydrophobicContact CD1-CB 3.96Å; Y338-A365 HydrophobicContact CD2-CB 4.34Å; Y338-A365 HydrophobicContact CE1-CB 3.54Å; Y338-A365 HydrophobicContact CE2-CB 3.97Å; Y338-A365 HydrophobicContact CG-CB 4.34Å
339	N	88.1	Confident	85.7	Confident	3 Å²	3	41 Å²	41	2%	0.016	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	130.5	174.8	-173.3	-32.2	0	0	0	109.2	N280 Q304 L341 S342	N280-N339 WeakPolarHBondContact OD1-CA 3.47Å; N280-N339 PolarHBondContact OD1-OD1 3.35Å; Q304-N339 WeakPolarHBondContact CB-ND2 3.41Å; Q304-N339 PolarHBondContact O-ND2 3.24Å; Q304-N339 PolarHBondContact OE1-ND2 3.01Å; Q304-N339 VanDerWaalsContact OE1-ND2 3.13Å; Q304-N339 PolarHBondContact OE1-OD1 2.91Å; Q304-N339 VanDerWaalsContact OE1-OD1 3.06Å; N339-L341 PolarHBondContact O-N 3.35Å; N339-L341 VanDerWaalsContact O-N 3.13Å; N339-L341 VanDerWaalsContact OD1-CB 3.28Å; N339-L341 WeakPolarHBondContact OD1-CB 3.42Å; N339-L341 PolarHBondContact OD1-N 3.48Å; N339-S342 PolarHBondContact O-N 3.41Å
340	P	86.2	Confident	85.9	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	-26.4	174.9	-14.1	20.2	0	0	0	113.8	F128 N280 S342 C343 A373	F128-P340 HydrophobicContact CD1-CB 4.27Å; F128-P340 HydrophobicContact CD1-CG 4.38Å; F128-P340 HydrophobicContact CD2-CG 3.83Å; F128-P340 HydrophobicContact CE1-CB 4.01Å; F128-P340 HydrophobicContact CE1-CG 4.23Å; F128-P340 HydrophobicContact CE2-CB 4.33Å; F128-P340 HydrophobicContact CE2-CG 3.66Å; F128-P340 HydrophobicContact CG-CG 4.2Å; F128-P340 HydrophobicContact CZ-CB 4.04Å; F128-P340 HydrophobicContact CZ-CG 3.87Å; N280-P340 WeakPolarHBondContact OD1-CD 3.21Å; P340-S342 PolarHBondContact O-N 2.71Å; P340-C343 PolarHBondContact O-SG 3.36Å; P340-C343 VanDerWaalsContact O-SG 3.41Å; P340-A373 HydrophobicContact CB-CB 3.97Å
341	L	83.1	Confident	85.8	Confident	82 Å²	82	38.4 Å²	38.4	43%	0.429	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	-19.4	173.7	-68.7	164.7	0	0	0	113.6	Q304 N339 I375	Q304-L341 HydrophobicContact CB-CD1 4.1Å; Q304-L341 HydrophobicContact CG-CD1 4.02Å; N339-L341 PolarHBondContact O-N 3.35Å; N339-L341 VanDerWaalsContact O-N 3.13Å; N339-L341 VanDerWaalsContact OD1-CB 3.28Å; N339-L341 WeakPolarHBondContact OD1-CB 3.42Å; N339-L341 PolarHBondContact OD1-N 3.48Å; L341-I375 HydrophobicContact CD2-CB 4.43Å; L341-I375 HydrophobicContact CD2-CD1 4.03Å; L341-I375 HydrophobicContact CD2-CG1 3.98Å; L341-I375 HydrophobicContact CD2-CG2 3.62Å
342	S	84.7	Confident	85.5	Confident	33 Å²	33	38.7 Å²	38.7	23%	0.231	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	46.5	-179.7	-64.1	0	0	0	0	111.6	N339 P340 L349 Q351	N339-S342 PolarHBondContact O-N 3.41Å; P340-S342 PolarHBondContact O-N 2.71Å; S342-L349 VanDerWaalsContact O-CB 3.3Å; S342-L349 WeakPolarHBondContact O-CB 3.42Å; S342-L349 WeakPolarHBondContact O-CG 3.39Å; S342-L349 PolarHBondContact O-N 3.26Å; S342-Q351 PolarHBondContact OG-NE2 3.07Å
343	C	85.2	Confident	84.5	Confident	34 Å²	34	38.8 Å²	38.8	23%	0.23	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	135.6	171.9	-60.9	0	0	0	0	110.5	P340 L347 M367 A373	P340-C343 PolarHBondContact O-SG 3.36Å; P340-C343 VanDerWaalsContact O-SG 3.41Å; C343-L347 CarbonylContact C-O 3.58Å; C343-L347 WeakPolarHBondContact CA-O 3.45Å; C343-M367 HydrophobicContact CB-CE 4.16Å; C343-A373 HydrophobicContact CB-CB 4.18Å
344	D	82.6	Confident	83.2	Confident	119 Å²	119	41.7 Å²	41.7	64%	0.636	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	100	167.8	-176	16.8	0	0	0	108.8	R346 L347	D344-R346 PolarHBondContact O-N 3.04Å; D344-L347 PolarHBondContact N-O 2.96Å; D344-L347 WeakPolarHBondContact O-CB 3.05Å; D344-L347 PolarHBondContact O-N 3.47Å
345	G	84.1	Confident	81.6	Confident	63 Å²	63	44.1 Å²	44.1	65%	0.649	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	-109.2	-169.6	0	0	0	0	0	111.6	M367	G345-M367 WeakPolarHBondContact O-CE 3.48Å
346	R	85.8	Confident	79.9	Confident	149 Å²	149	51.8 Å²	51.8	56%	0.562	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-8.8	177.1	-66.5	-170.2	-179.9	-168.1	-3.6	113.9	D344 L366 M367	D344-R346 PolarHBondContact O-N 3.04Å; R346-L366 HydrophobicContact CB-CD1 4.16Å; R346-M367 HydrophobicContact CB-CB 4.38Å; R346-M367 WeakPolarHBondContact O-CB 3.33Å; R346-M367 PolarHBondContact O-N 3.38Å
347	L	88.3	Confident	78.1	Confident	61 Å²	61	59 Å²	59	32%	0.319	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	120.1	-179.3	-174.4	70.2	0	0	0	109.7	C343 D344 L349 H364	C343-L347 CarbonylContact C-O 3.58Å; C343-L347 WeakPolarHBondContact CA-O 3.45Å; D344-L347 PolarHBondContact N-O 2.96Å; D344-L347 WeakPolarHBondContact O-CB 3.05Å; D344-L347 PolarHBondContact O-N 3.47Å; L347-L349 HydrophobicContact CD2-CD2 3.77Å; L347-L349 HydrophobicContact CG-CD2 4.17Å; L347-H364 HydrophobicContact CD1-CB 3.71Å; L347-H364 HydrophobicContact CG-CB 4.24Å
348	C	88.4	Confident	76.2	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.007	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	109	170.6	-62.3	0	0	0	0	109.3	Y338 H364 A365 M367	Y338-C348 HydrophobicContact CD1-CB 4Å; C348-H364 CarbonylContact O-C 3.58Å; C348-H364 WeakPolarHBondContact O-CA 3.49Å; C348-A365 HydrophobicContact CB-CB 3.98Å; C348-A365 PolarHBondContact N-O 2.9Å; C348-A365 PolarHBondContact O-N 2.72Å; C348-M367 WeakPolarHBondContact SG-CG 3.34Å
349	L	87.1	Confident	74.3	Confident	64 Å²	64	66.5 Å²	66.5	34%	0.335	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	136.5	178.3	-57.2	175	0	0	0	109.6	S342 L347	S342-L349 VanDerWaalsContact O-CB 3.3Å; S342-L349 WeakPolarHBondContact O-CB 3.42Å; S342-L349 WeakPolarHBondContact O-CG 3.39Å; S342-L349 PolarHBondContact O-N 3.26Å; L347-L349 HydrophobicContact CD2-CD2 3.77Å; L347-L349 HydrophobicContact CG-CD2 4.17Å
350	N	85.8	Confident	72.6	Confident	18 Å²	18	76.3 Å²	76.3	10%	0.096	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	121.3	171.6	-178.8	8.4	0	0	0	107.2	V335 F336 A337 Y338 T352 L363 H364	V335-N350 PolarHBondContact O-ND2 3.36Å; F336-N350 VanDerWaalsContact CA-OD1 3.3Å; F336-N350 WeakPolarHBondContact CA-OD1 3.32Å; A337-N350 PolarHBondContact N-OD1 3Å; Y338-N350 HydrophobicContact CD1-CB 4.43Å; Y338-N350 HydrophobicContact CE1-CB 3.79Å; N350-T352 PolarHBondContact ND2-OG1 3.39Å; N350-T352 WeakPolarHBondContact OD1-CG2 3.35Å; N350-T352 PolarHBondContact OD1-N 3.25Å; N350-T352 PolarHBondContact OD1-OG1 2.59Å; N350-T352 VanDerWaalsContact OD1-OG1 3.07Å; N350-L363 HydrophobicContact CB-CB 4.36Å; N350-L363 WeakPolarHBondContact CB-O 3.37Å; N350-L363 WeakPolarHBondContact ND2-CB 3.33Å; N350-H364 PolarHBondContact N-ND1 3.45Å
351	Q	80.8	Confident	71.2	Confident	42 Å²	42	81.1 Å²	81.1	20%	0.196	43%	0.434	C	S	.	.			trans	-87.5	-3.6	-174.3	-47.2	179.7	-40.9	0	0	114.3	Q306 A337 S342	Q306-Q351 HydrophobicContact CG-CB 4.4Å; Q306-Q351 PolarHBondContact OE1-O 3.16Å; Q306-Q351 VanDerWaalsContact OE1-O 3.08Å; A337-Q351 PolarHBondContact O-N 2.93Å; S342-Q351 PolarHBondContact OG-NE2 3.07Å
352	T	77.4	Confident	70.4	Confident	23 Å²	23	80.4 Å²	80.4	14%	0.141	44%	0.436	C	S	.	.			trans	-76.4	136.7	-178.2	62.9	0	0	0	0	112.2	L334 V335 A337 N350	L334-T352 HydrophobicContact CB-CG2 3.67Å; V335-T352 PolarHBondContact O-OG1 3.48Å; A337-T352 HydrophobicContact CB-CG2 3.94Å; N350-T352 PolarHBondContact ND2-OG1 3.39Å; N350-T352 WeakPolarHBondContact OD1-CG2 3.35Å; N350-T352 PolarHBondContact OD1-N 3.25Å; N350-T352 PolarHBondContact OD1-OG1 2.59Å; N350-T352 VanDerWaalsContact OD1-OG1 3.07Å
353	V	63.5	Low	69.9	Low	99 Å²	99	80.5 Å²	80.5	60%	0.6	43%	0.434	S	S	*	.	S	Bend	trans	-95	-29.9	-178.1	-167.3	0	0	0	0	112.5	Y331	Y331-V353 VanDerWaalsContact OH-CG2 3.22Å; Y331-V353 WeakPolarHBondContact OH-CG2 3.28Å
354	N	58.1	Low	70	Confident	68 Å²	68	82 Å²	82	36%	0.364	44%	0.437	S	S	.	.			trans	-92.9	-9.7	-158.9	-72.6	-7.8	0	0	0	115.9	N332 H356	N332-N354 PolarHBondContact OD1-ND2 3.38Å; N354-H356 VanDerWaalsContact C-N 3.34Å; N354-H356 PolarHBondContact O-N 3.15Å
355	F	51.8	Low	70.3	Confident	52 Å²	52	76.3 Å²	76.3	23%	0.228	41%	0.407	C	S	.	.	S	Bend	trans	-74	94.3	-179.4	-144.3	-97.3	0	0	0	109.3	K145 A285 V335 Q357 L363	K145-F355 HydrophobicContact CB-CE1 3.82Å; K145-F355 HydrophobicContact CB-CZ 3.71Å; K145-F355 HydrophobicContact CD-CE1 3.92Å; K145-F355 HydrophobicContact CD-CZ 4.25Å; K145-F355 HydrophobicContact CG-CE1 4.48Å; A285-F355 HydrophobicContact CB-CE2 4.48Å; V335-F355 HydrophobicContact CB-CD2 4.14Å; V335-F355 HydrophobicContact CB-CE2 4.13Å; V335-F355 HydrophobicContact CG1-CD1 4.38Å; V335-F355 HydrophobicContact CG1-CD2 3.95Å; V335-F355 HydrophobicContact CG1-CE1 4.26Å; V335-F355 HydrophobicContact CG1-CE2 3.85Å; V335-F355 HydrophobicContact CG1-CG 4.22Å; V335-F355 HydrophobicContact CG1-CZ 3.99Å; V335-F355 HydrophobicContact CG2-CD2 3.96Å; V335-F355 HydrophobicContact CG2-CE2 3.58Å; V335-F355 HydrophobicContact CG2-CZ 4.3Å; F355-Q357 PolarHBondContact O-N 3.21Å; F355-L363 HydrophobicContact CB-CD1 4.31Å; F355-L363 HydrophobicContact CD1-CD1 4.24Å
356	H	49.1	Very low	70.6	Confident	164 Å²	164	77.2 Å²	77.2	76%	0.759	40%	0.397	S	S	*	.			trans	-39.2	101.3	-179.6	-83.3	-82.9	0	0	0	110.9	N354 S358	N354-H356 VanDerWaalsContact C-N 3.34Å; N354-H356 PolarHBondContact O-N 3.15Å; H356-S358 PolarHBondContact O-N 3.31Å
357	Q	50.4	Low	70.8	Confident	155 Å²	155	70.4 Å²	70.4	72%	0.724	37%	0.371	S	S	*	.			trans	-67.2	80.2	175.6	-65.9	176.5	0.7	0	0	108.6	F355 N359	F355-Q357 PolarHBondContact O-N 3.21Å; Q357-N359 PolarHBondContact O-N 2.93Å
358	S	49.3	Very low	70.6	Confident	75 Å²	75	69 Å²	69	52%	0.524	37%	0.366	S	S	.	.			trans	-70	-19	169.1	50.8	0	0	0	0	111.4	K145 H356	K145-S358 PolarHBondContact NZ-OG 2.92Å; H356-S358 PolarHBondContact O-N 3.31Å
359	N	49.7	Very low	70.4	Confident	90 Å²	90	70 Å²	70	48%	0.481	38%	0.377	S	S	.	.	S	Bend	trans	-124.6	140.4	-179	-63.3	-24.5	0	0	0	110.5	Q357 T361	Q357-N359 PolarHBondContact O-N 2.93Å; N359-T361 PolarHBondContact O-N 2.98Å
360	Q	52.8	Low	70.1	Confident	210 Å²	210	72.3 Å²	72.3	98%	0.981	39%	0.389	S	S	*	.	S	Bend	trans	-62	9.1	-175.7	-78.7	176.1	-27.3	0	0	116.2
361	T	57.7	Low	70	Confident	101 Å²	101	71.9 Å²	71.9	62%	0.62	39%	0.388	S	S	*	.			trans	-94.1	123.3	-177.4	6.4	0	0	0	0	110.3	N359 L363	N359-T361 PolarHBondContact O-N 2.98Å; T361-L363 PolarHBondContact O-N 3.34Å
362	S	66.1	Low	70.2	Confident	68 Å²	68	72.6 Å²	72.6	48%	0.476	40%	0.397	S	S	.	.			trans	-66	130.9	172.6	49.1	0	0	0	0	110.1	H364	S362-H364 PolarHBondContact O-N 3.3Å
363	L	73.8	Confident	70.5	Confident	35 Å²	35	73 Å²	73	18%	0.183	40%	0.403	C	S	.	.			trans	-76	26.2	179.4	-76.1	162.2	0	0	0	113	P141 T143 Y338 N350 F355 T361	P141-L363 HydrophobicContact CG-CD2 4.2Å; T143-L363 HydrophobicContact CG2-CD2 3.85Å; Y338-L363 WeakPolarHBondContact CE1-O 3.43Å; Y338-L363 PolarHBondContact OH-O 3.22Å; N350-L363 HydrophobicContact CB-CB 4.36Å; N350-L363 WeakPolarHBondContact CB-O 3.37Å; N350-L363 WeakPolarHBondContact ND2-CB 3.33Å; F355-L363 HydrophobicContact CB-CD1 4.31Å; F355-L363 HydrophobicContact CD1-CD1 4.24Å; T361-L363 PolarHBondContact O-N 3.34Å
364	H	86.6	Confident	71.1	Confident	64 Å²	64	69.6 Å²	69.6	30%	0.296	38%	0.382	S	S	.	.			trans	-77.7	139.4	-179.3	-58.6	-31.5	0	0	0	110.6	P141 L347 C348 N350 S362	P141-H364 WeakPolarHBondContact CD-O 3.36Å; L347-H364 HydrophobicContact CD1-CB 3.71Å; L347-H364 HydrophobicContact CG-CB 4.24Å; C348-H364 CarbonylContact O-C 3.58Å; C348-H364 WeakPolarHBondContact O-CA 3.49Å; N350-H364 PolarHBondContact N-ND1 3.45Å; S362-H364 PolarHBondContact O-N 3.3Å
365	A	89.3	Confident	71.9	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	159.2	176.5	0	0	0	0	0	110.8	V138 S139 L140 Y338 C348	V138-A365 HydrophobicContact CG1-CB 3.78Å; S139-A365 CarbonylContact O-C 3.32Å; S139-A365 WeakPolarHBondContact O-CA 3.48Å; S139-A365 VanDerWaalsContact O-CB 3.31Å; S139-A365 WeakPolarHBondContact O-CB 3.17Å; L140-A365 HydrophobicContact CD1-CB 4.08Å; L140-A365 HydrophobicContact CG-CB 4.27Å; Y338-A365 HydrophobicContact CD1-CB 3.96Å; Y338-A365 HydrophobicContact CD2-CB 4.34Å; Y338-A365 HydrophobicContact CE1-CB 3.54Å; Y338-A365 HydrophobicContact CE2-CB 3.97Å; Y338-A365 HydrophobicContact CG-CB 4.34Å; C348-A365 HydrophobicContact CB-CB 3.98Å; C348-A365 PolarHBondContact N-O 2.9Å; C348-A365 PolarHBondContact O-N 2.72Å
366	L	90.4	Very high	72.7	Confident	83 Å²	83	70.2 Å²	70.2	44%	0.435	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	123	179.5	-179.3	77.4	0	0	0	110.1	S139 R346 S368	S139-L366 PolarHBondContact N-O 3.16Å; S139-L366 PolarHBondContact O-N 3.41Å; S139-L366 WeakPolarHBondContact OG-CB 3.43Å; S139-L366 PolarHBondContact OG-O 3.12Å; R346-L366 HydrophobicContact CB-CD1 4.16Å; L366-S368 PolarHBondContact O-N 2.89Å
367	M	89.8	Confident	73.6	Confident	6 Å²	6	63.6 Å²	63.6	3%	0.03	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	119.1	169.8	-60	-170.1	-71.5	0	0	109.7	F128 V138 C343 G345 R346 C348 V371 A373	F128-M367 HydrophobicContact CD1-SD 3.82Å; F128-M367 HydrophobicContact CE1-SD 3.92Å; V138-M367 HydrophobicContact CG2-CG 4.26Å; C343-M367 HydrophobicContact CB-CE 4.16Å; G345-M367 WeakPolarHBondContact O-CE 3.48Å; R346-M367 HydrophobicContact CB-CB 4.38Å; R346-M367 WeakPolarHBondContact O-CB 3.33Å; R346-M367 PolarHBondContact O-N 3.38Å; C348-M367 WeakPolarHBondContact SG-CG 3.34Å; M367-V371 HydrophobicContact CB-CB 4.26Å; M367-V371 HydrophobicContact CB-CG1 4.37Å; M367-V371 HydrophobicContact CG-CG1 4.23Å; M367-V371 HydrophobicContact SD-CG1 4.01Å; M367-A373 HydrophobicContact CE-CB 4.3Å; M367-A373 HydrophobicContact SD-CB 4.38Å
368	S	85.7	Confident	74.7	Confident	31 Å²	31	58.5 Å²	58.5	22%	0.217	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	157.6	176.8	-55.8	0	0	0	0	110.8	S136 N137 L366 V371	S136-S368 WeakPolarHBondContact CA-O 3.46Å; N137-S368 PolarHBondContact N-O 3.11Å; N137-S368 PolarHBondContact O-N 3.47Å; N137-S368 WeakPolarHBondContact OD1-CB 3.34Å; N137-S368 PolarHBondContact OD1-OG 2.96Å; L366-S368 PolarHBondContact O-N 2.89Å; S368-V371 WeakPolarHBondContact O-CG2 3.37Å
369	G	82.2	Confident	76.1	Confident	22 Å²	22	55.1 Å²	55.1	23%	0.227	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	-138.7	-173	0	0	0	0	0	112.2
370	N	80.8	Confident	77.6	Confident	112 Å²	112	51.1 Å²	51.1	60%	0.599	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	20.1	-179.6	-74.9	-18.5	0	0	0	112.8	P131 S136 S372	P131-N370 HydrophobicContact CG-CB 3.6Å; S136-N370 PolarHBondContact OG-N 3.13Å; N370-S372 PolarHBondContact O-N 3.32Å
371	V	85.6	Confident	79	Confident	10 Å²	10	44.6 Å²	44.6	6%	0.061	27%	0.268	C	S	.	.			trans	-61.6	130.4	172.3	-178.6	0	0	0	0	109.3	F128 S129 F130 V138 M367 S368	F128-V371 HydrophobicContact CB-CG1 4.49Å; S129-V371 WeakPolarHBondContact O-CA 3.41Å; F130-V371 HydrophobicContact CD1-CG1 4.39Å; F130-V371 HydrophobicContact CD1-CG2 3.69Å; F130-V371 HydrophobicContact CE1-CG1 4.29Å; F130-V371 HydrophobicContact CE1-CG2 4.02Å; F130-V371 HydrophobicContact CG-CG2 4.42Å; V138-V371 HydrophobicContact CG2-CG1 4.08Å; M367-V371 HydrophobicContact CB-CB 4.26Å; M367-V371 HydrophobicContact CB-CG1 4.37Å; M367-V371 HydrophobicContact CG-CG1 4.23Å; M367-V371 HydrophobicContact SD-CG1 4.01Å; S368-V371 WeakPolarHBondContact O-CG2 3.37Å
372	S	84	Confident	80.1	Confident	56 Å²	56	39.8 Å²	39.8	39%	0.392	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	139.2	178.4	50.2	0	0	0	0	110.9	S129 N370 V374	S129-S372 PolarHBondContact N-O 3.44Å; S129-S372 PolarHBondContact O-N 3.49Å; N370-S372 PolarHBondContact O-N 3.32Å; S372-V374 PolarHBondContact O-N 3.38Å
373	A	84.8	Confident	81	Confident	32 Å²	32	36.5 Å²	36.5	26%	0.264	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	110.1	166.6	0	0	0	0	0	108.4	F128 P340 C343 M367	F128-A373 HydrophobicContact CD1-CB 4.34Å; F128-A373 HydrophobicContact CE1-CB 4.3Å; P340-A373 HydrophobicContact CB-CB 3.97Å; C343-A373 HydrophobicContact CB-CB 4.18Å; M367-A373 HydrophobicContact CE-CB 4.3Å; M367-A373 HydrophobicContact SD-CB 4.38Å
374	V	76.1	Confident	81.6	Confident	27 Å²	27	37.4 Å²	37.4	16%	0.164	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	120.4	176.9	-177.2	0	0	0	0	108.2	S126 Y127 S372	S126-V374 WeakPolarHBondContact CA-O 3.15Å; Y127-V374 HydrophobicContact CD2-CB 4.04Å; Y127-V374 HydrophobicContact CD2-CG2 4.42Å; Y127-V374 HydrophobicContact CE1-CB 4.45Å; Y127-V374 HydrophobicContact CE1-CG1 4.26Å; Y127-V374 HydrophobicContact CE2-CB 3.68Å; Y127-V374 HydrophobicContact CE2-CG1 4.04Å; Y127-V374 HydrophobicContact CE2-CG2 3.92Å; Y127-V374 PolarHBondContact N-O 2.83Å; Y127-V374 PolarHBondContact O-N 2.92Å; S372-V374 PolarHBondContact O-N 3.38Å
375	I	73.3	Confident	81.4	Confident	100 Å²	100	41.6 Å²	41.6	51%	0.513	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	109.9	175.6	-57	166.7	0	0	0	107	L341 S377	L341-I375 HydrophobicContact CD2-CB 4.43Å; L341-I375 HydrophobicContact CD2-CD1 4.03Å; L341-I375 HydrophobicContact CD2-CG1 3.98Å; L341-I375 HydrophobicContact CD2-CG2 3.62Å; I375-S377 PolarHBondContact O-N 2.89Å
376	N	69.2	Low	81.2	Confident	33 Å²	33	44 Å²	44	18%	0.176	25%	0.25	C	C	.	.			trans	-79.6	112	173.9	-74.4	-5.4	0	0	0	108.2	S125 S378	S125-N376 WeakPolarHBondContact O-CA 3.41Å; S125-N376 WeakPolarHBondContact O-CB 3.36Å; S125-N376 PolarHBondContact O-N 3.5Å; N376-S378 PolarHBondContact O-N 3.49Å
377	S	69.2	Low	80.8	Confident	25 Å²	25	42.1 Å²	42.1	18%	0.175	25%	0.25	C	S	.	.			trans	-62.5	129.9	168.5	43.2	0	0	0	0	109.4	I85 I375 T382	I85-S377 PolarHBondContact O-OG 3.27Å; I375-S377 PolarHBondContact O-N 2.89Å; S377-T382 WeakPolarHBondContact OG-CG2 3.45Å
378	S	73.6	Confident	80.7	Confident	49 Å²	49	41.9 Å²	41.9	34%	0.343	25%	0.249	S	C	.	.			trans	-58.5	153.7	169.1	73.2	0	0	0	0	109.4	N376 S380 D381 T382	N376-S378 PolarHBondContact O-N 3.49Å; S378-S380 PolarHBondContact O-N 3.28Å; S378-D381 WeakPolarHBondContact CB-OD2 3.45Å; S378-D381 PolarHBondContact N-OD2 3.03Å; S378-D381 PolarHBondContact O-N 3.38Å; S378-D381 PolarHBondContact OG-N 3.05Å; S378-D381 PolarHBondContact OG-OD2 3.5Å; S378-T382 PolarHBondContact O-N 3.37Å
379	V	78	Confident	80.8	Confident	4 Å²	4	40.5 Å²	40.5	2%	0.024	24%	0.239	C	C	.	.	H	α-helix	trans	-53.1	-42.4	174.8	-179.8	0	0	0	0	109.4	L115 I118 P119 D381 T382 F383 F442 L446	L115-V379 HydrophobicContact CD2-CG1 4.39Å; I118-V379 HydrophobicContact CB-CG2 3.95Å; I118-V379 HydrophobicContact CD1-CG2 3.99Å; I118-V379 HydrophobicContact CG2-CG2 3.85Å; P119-V379 HydrophobicContact CG-CB 4.28Å; P119-V379 HydrophobicContact CG-CG2 4.01Å; V379-D381 PolarHBondContact O-N 3.2Å; V379-T382 PolarHBondContact O-N 3.35Å; V379-T382 PolarHBondContact O-OG1 3.27Å; V379-F383 HydrophobicContact CG1-CD2 3.87Å; V379-F383 HydrophobicContact CG1-CE2 3.82Å; V379-F383 WeakPolarHBondContact O-CD2 3.13Å; V379-F383 PolarHBondContact O-N 3.39Å; V379-F383 VanDerWaalsContact O-N 3.07Å; V379-F442 HydrophobicContact CG1-CE2 4.28Å; V379-F442 HydrophobicContact CG1-CZ 4.32Å; V379-L446 HydrophobicContact CG1-CD2 4.02Å
380	S	81.6	Confident	81.2	Confident	5 Å²	5	45.3 Å²	45.3	4%	0.035	26%	0.256	C	S	.	.	H	α-helix	trans	-57.7	-45.4	175.4	-55.9	0	0	0	0	113.4	S378 T382 F383 I384	S378-S380 PolarHBondContact O-N 3.28Å; S380-T382 VanDerWaalsContact C-N 3.33Å; S380-T382 PolarHBondContact O-N 3.4Å; S380-F383 PolarHBondContact O-N 2.88Å; S380-I384 VanDerWaalsContact O-CG1 3.28Å; S380-I384 WeakPolarHBondContact O-CG1 3.48Å; S380-I384 PolarHBondContact O-N 2.99Å
381	D	80.5	Confident	81.5	Confident	73 Å²	73	42.3 Å²	42.3	39%	0.39	24%	0.239	S	C	.	.	H	α-helix	trans	-66.1	-36	178.2	-61.1	-40.1	0	0	0	112.2	S378 V379 F383 I384 K385	S378-D381 WeakPolarHBondContact CB-OD2 3.45Å; S378-D381 PolarHBondContact N-OD2 3.03Å; S378-D381 PolarHBondContact O-N 3.38Å; S378-D381 PolarHBondContact OG-N 3.05Å; S378-D381 PolarHBondContact OG-OD2 3.5Å; V379-D381 PolarHBondContact O-N 3.2Å; D381-F383 VanDerWaalsContact C-N 3.33Å; D381-I384 PolarHBondContact O-N 2.95Å; D381-K385 WeakPolarHBondContact O-CB 3.32Å; D381-K385 VanDerWaalsContact O-CG 3.3Å; D381-K385 WeakPolarHBondContact O-CG 3.48Å; D381-K385 PolarHBondContact O-N 3.04Å
382	T	81.1	Confident	81.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.4	-44.1	174.3	63.9	0	0	0	0	111	S377 S378 V379 S380 K385 L386	S377-T382 WeakPolarHBondContact OG-CG2 3.45Å; S378-T382 PolarHBondContact O-N 3.37Å; V379-T382 PolarHBondContact O-N 3.35Å; V379-T382 PolarHBondContact O-OG1 3.27Å; S380-T382 VanDerWaalsContact C-N 3.33Å; S380-T382 PolarHBondContact O-N 3.4Å; T382-K385 PolarHBondContact O-N 3.38Å; T382-L386 WeakPolarHBondContact O-CB 3.34Å; T382-L386 VanDerWaalsContact O-CG 3.22Å; T382-L386 WeakPolarHBondContact O-CG 3.25Å; T382-L386 PolarHBondContact O-N 2.86Å
383	F	85.1	Confident	82	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-67.2	-41.8	176.5	-83.7	-83.2	0	0	0	112	V90 L94 L115 V379 S380 D381 K385 L386 G387 G388 L391 L392 F442 L446 L453	V90-F383 HydrophobicContact CG1-CE2 4.22Å; V90-F383 HydrophobicContact CG1-CZ 4Å; L94-F383 HydrophobicContact CD1-CE1 3.93Å; L94-F383 HydrophobicContact CD1-CZ 4.32Å; L115-F383 HydrophobicContact CD1-CE2 4.04Å; L115-F383 HydrophobicContact CD1-CZ 4.03Å; V379-F383 HydrophobicContact CG1-CD2 3.87Å; V379-F383 HydrophobicContact CG1-CE2 3.82Å; V379-F383 WeakPolarHBondContact O-CD2 3.13Å; V379-F383 PolarHBondContact O-N 3.39Å; V379-F383 VanDerWaalsContact O-N 3.07Å; S380-F383 PolarHBondContact O-N 2.88Å; D381-F383 VanDerWaalsContact C-N 3.33Å; F383-K385 VanDerWaalsContact C-N 3.3Å; F383-K385 PolarHBondContact O-N 2.85Å; F383-L386 PolarHBondContact O-N 3.2Å; F383-L386 VanDerWaalsContact O-N 3.16Å; F383-G387 PolarHBondContact O-N 3.49Å; F383-G387 VanDerWaalsContact O-N 3.15Å; F383-G388 WeakPolarHBondContact O-CA 3.17Å; F383-G388 PolarHBondContact O-N 3.5Å; F383-L391 HydrophobicContact CD1-CD1 4.41Å; F383-L392 HydrophobicContact CE1-CD1 4.35Å; F383-L392 HydrophobicContact CE1-CD2 3.7Å; F383-L392 HydrophobicContact CE1-CG 4.16Å; F383-L392 HydrophobicContact CZ-CD2 4.3Å; F383-F442 HydrophobicContact CD2-CZ 4.28Å; F383-F442 HydrophobicContact CE1-CE1 4.47Å; F383-F442 HydrophobicContact CE2-CE1 4.11Å; F383-F442 AromaticContact CE2-CZ 3.53Å; F383-F442 HydrophobicContact CE2-CZ 3.53Å; F383-F442 AromaticContact CZ-CE1 3.85Å; F383-F442 HydrophobicContact CZ-CE1 3.85Å; F383-F442 AromaticContact CZ-CZ 3.75Å; F383-F442 HydrophobicContact CZ-CZ 3.75Å; F383-L446 HydrophobicContact CD2-CD1 4.38Å; F383-L446 HydrophobicContact CG-CD1 4.47Å; F383-L453 HydrophobicContact CB-CD1 4.43Å
384	I	86	Confident	82.2	Confident	54 Å²	54	41.6 Å²	41.6	28%	0.277	23%	0.228	S	C	.	.	H	α-helix	trans	-56.7	-45.6	174.8	-66.9	165.8	0	0	0	110.6	S380 D381 L386 G387 T452 L453	S380-I384 VanDerWaalsContact O-CG1 3.28Å; S380-I384 WeakPolarHBondContact O-CG1 3.48Å; S380-I384 PolarHBondContact O-N 2.99Å; D381-I384 PolarHBondContact O-N 2.95Å; I384-L386 VanDerWaalsContact C-N 3.34Å; I384-L386 PolarHBondContact O-N 3.27Å; I384-G387 PolarHBondContact O-N 3.43Å; I384-T452 HydrophobicContact CD1-CG2 4.07Å; I384-T452 HydrophobicContact CG1-CG2 4.5Å; I384-L453 HydrophobicContact CD1-CD2 4.49Å; I384-L453 HydrophobicContact CD1-CG 4.24Å; I384-L453 HydrophobicContact CG1-CD2 3.59Å; I384-L453 HydrophobicContact CG1-CG 3.84Å
385	K	83.8	Confident	82.7	Confident	152 Å²	152	40.3 Å²	40.3	66%	0.661	22%	0.221	S	C	*	.	H	α-helix	trans	-64.7	-34.5	178	-73.3	175.2	-177	-179	0	113.4	D381 T382 F383	D381-K385 WeakPolarHBondContact O-CB 3.32Å; D381-K385 VanDerWaalsContact O-CG 3.3Å; D381-K385 WeakPolarHBondContact O-CG 3.48Å; D381-K385 PolarHBondContact O-N 3.04Å; T382-K385 PolarHBondContact O-N 3.38Å; F383-K385 VanDerWaalsContact C-N 3.3Å; F383-K385 PolarHBondContact O-N 2.85Å
386	L	84.5	Confident	83.5	Confident	51 Å²	51	35.8 Å²	35.8	27%	0.267	20%	0.197	S	C	.	.	H	α-helix	trans	-78.1	-18.7	-178.7	-70.1	171.6	0	0	0	113.5	A87 V90 A91 T382 F383 I384 L391	A87-L386 HydrophobicContact CB-CD2 4.14Å; A87-L386 HydrophobicContact CB-CG 4.16Å; V90-L386 HydrophobicContact CB-CD1 4Å; V90-L386 HydrophobicContact CG1-CD1 3.69Å; A91-L386 HydrophobicContact CB-CD1 4.44Å; A91-L386 HydrophobicContact CB-CD2 3.67Å; T382-L386 WeakPolarHBondContact O-CB 3.34Å; T382-L386 VanDerWaalsContact O-CG 3.22Å; T382-L386 WeakPolarHBondContact O-CG 3.25Å; T382-L386 PolarHBondContact O-N 2.86Å; F383-L386 PolarHBondContact O-N 3.2Å; F383-L386 VanDerWaalsContact O-N 3.16Å; I384-L386 VanDerWaalsContact C-N 3.34Å; I384-L386 PolarHBondContact O-N 3.27Å; L386-L391 VanDerWaalsContact C-CD1 3.47Å; L386-L391 HydrophobicContact CB-CD1 3.43Å; L386-L391 VanDerWaalsContact CB-CD1 3.43Å; L386-L391 WeakPolarHBondContact O-CD1 3.38Å
387	G	82.8	Confident	84.2	Confident	43 Å²	43	38.6 Å²	38.6	44%	0.443	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	138.6	0.5	-176.2	0	0	0	0	0	115.7	F383 I384	F383-G387 PolarHBondContact O-N 3.49Å; F383-G387 VanDerWaalsContact O-N 3.15Å; I384-G387 PolarHBondContact O-N 3.43Å
388	G	88	Confident	85	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	81.5	-156.8	175.3	0	0	0	0	0	114.3	F383 Q390 L391	F383-G388 WeakPolarHBondContact O-CA 3.17Å; F383-G388 PolarHBondContact O-N 3.5Å; G388-Q390 VanDerWaalsContact C-N 3.25Å; G388-Q390 PolarHBondContact O-N 3.12Å; G388-L391 PolarHBondContact O-N 2.96Å
389	M	87.9	Confident	85.5	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.01	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-64.4	-26.1	-175.7	-72.9	-57.6	-153	0	0	114.2	L391 L392 Y393 L446 V447 L453 F457	M389-L391 PolarHBondContact O-N 3.34Å; M389-L391 VanDerWaalsContact O-N 3.14Å; M389-L392 PolarHBondContact O-N 2.98Å; M389-L392 HydrophobicContact SD-CD1 4.35Å; M389-Y393 HydrophobicContact CB-CE1 4.48Å; M389-L446 HydrophobicContact CE-CB 3.4Å; M389-L446 VanDerWaalsContact CE-CB 3.4Å; M389-L446 HydrophobicContact CE-CD1 4.2Å; M389-L446 HydrophobicContact CE-CG 4.48Å; M389-L446 HydrophobicContact SD-CB 4.31Å; M389-L446 HydrophobicContact SD-CD1 4.02Å; M389-V447 HydrophobicContact CE-CG2 3.55Å; M389-L453 HydrophobicContact CE-CB 3.59Å; M389-L453 HydrophobicContact CE-CD1 4.24Å; M389-L453 HydrophobicContact CE-CG 4.41Å; M389-L453 HydrophobicContact CG-CB 3.99Å; M389-L453 HydrophobicContact CG-CD2 3.94Å; M389-L453 WeakPolarHBondContact CG-O 3.45Å; M389-L453 HydrophobicContact SD-CB 4.16Å; M389-L453 HydrophobicContact SD-CD1 4.41Å; M389-L453 HydrophobicContact SD-CD2 4.24Å; M389-F457 HydrophobicContact CG-CB 4.23Å
390	Q	89.2	Confident	85.7	Confident	123 Å²	123	40 Å²	40	58%	0.575	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-61.5	-24.5	-178.1	-67.3	178.4	-5.9	0	0	113	G388 L392 Y393 P394 T460	G388-Q390 VanDerWaalsContact C-N 3.25Å; G388-Q390 PolarHBondContact O-N 3.12Å; Q390-L392 PolarHBondContact O-N 3.49Å; Q390-Y393 HydrophobicContact CB-CD2 4.4Å; Q390-Y393 HydrophobicContact CB-CE2 4.45Å; Q390-Y393 HydrophobicContact CG-CD2 4.39Å; Q390-Y393 HydrophobicContact CG-CE2 4.05Å; Q390-Y393 PolarHBondContact O-N 3.29Å; Q390-P394 VanDerWaalsContact O-CD 3.31Å; Q390-P394 WeakPolarHBondContact O-CD 3.14Å; Q390-T460 HydrophobicContact CG-CG2 3.88Å
391	L	87.3	Confident	85.5	Confident	49 Å²	49	44.9 Å²	44.9	26%	0.257	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-64.7	-17.1	175.4	-68.4	171.7	0	0	0	114.1	Y98 F383 L386 G388 M389	Y98-L391 PolarHBondContact OH-O 3.31Å; F383-L391 HydrophobicContact CD1-CD1 4.41Å; L386-L391 VanDerWaalsContact C-CD1 3.47Å; L386-L391 HydrophobicContact CB-CD1 3.43Å; L386-L391 VanDerWaalsContact CB-CD1 3.43Å; L386-L391 WeakPolarHBondContact O-CD1 3.38Å; G388-L391 PolarHBondContact O-N 2.96Å; M389-L391 PolarHBondContact O-N 3.34Å; M389-L391 VanDerWaalsContact O-N 3.14Å
392	L	89.3	Confident	84.9	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-98.8	-20.2	-176.6	-63.2	175.2	0	0	0	112.2	F112 F383 M389 Q390 L395 F442 I443 L446	F112-L392 HydrophobicContact CE1-CD2 4.17Å; F383-L392 HydrophobicContact CE1-CD1 4.35Å; F383-L392 HydrophobicContact CE1-CD2 3.7Å; F383-L392 HydrophobicContact CE1-CG 4.16Å; F383-L392 HydrophobicContact CZ-CD2 4.3Å; M389-L392 PolarHBondContact O-N 2.98Å; M389-L392 HydrophobicContact SD-CD1 4.35Å; Q390-L392 PolarHBondContact O-N 3.49Å; L392-L395 HydrophobicContact CD2-CD1 3.87Å; L392-L395 VanDerWaalsContact O-CB 3.28Å; L392-L395 WeakPolarHBondContact O-CB 3.46Å; L392-L395 PolarHBondContact O-N 3.01Å; L392-F442 HydrophobicContact CD1-CD1 4.12Å; L392-F442 HydrophobicContact CD1-CE1 3.77Å; L392-F442 HydrophobicContact CD2-CE1 4.12Å; L392-I443 HydrophobicContact CB-CD1 4.28Å; L392-I443 HydrophobicContact CD1-CD1 4.48Å; L392-I443 HydrophobicContact CD1-CG1 3.84Å; L392-L446 HydrophobicContact CD1-CD1 3.71Å
393	Y	91	Very high	84	Confident	21 Å²	21	48.1 Å²	48.1	8%	0.082	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-62.9	-41.1	-176.4	-57.5	-23	0	0	0	114.1	M389 Q390 L395 F396 F457 T460 G462 I465	M389-Y393 HydrophobicContact CB-CE1 4.48Å; Q390-Y393 HydrophobicContact CB-CD2 4.4Å; Q390-Y393 HydrophobicContact CB-CE2 4.45Å; Q390-Y393 HydrophobicContact CG-CD2 4.39Å; Q390-Y393 HydrophobicContact CG-CE2 4.05Å; Q390-Y393 PolarHBondContact O-N 3.29Å; Y393-L395 PolarHBondContact O-N 3.42Å; Y393-L395 VanDerWaalsContact O-N 3.09Å; Y393-F396 PolarHBondContact O-N 3.21Å; Y393-F457 HydrophobicContact CE1-CD2 4.2Å; Y393-F457 HydrophobicContact CE1-CE2 4.24Å; Y393-F457 WeakPolarHBondContact OH-CD2 3.29Å; Y393-T460 PolarHBondContact OH-OG1 3.33Å; Y393-G462 VanDerWaalsContact OH-CA 3.31Å; Y393-G462 WeakPolarHBondContact OH-CA 3.45Å; Y393-I465 HydrophobicContact CD2-CD1 3.41Å; Y393-I465 VanDerWaalsContact CD2-CD1 3.41Å; Y393-I465 HydrophobicContact CE2-CD1 3.69Å; Y393-I465 HydrophobicContact CG-CD1 3.94Å; Y393-I465 HydrophobicContact CG-CG2 4.41Å
394	P	88.3	Confident	82.6	Confident	61 Å²	61	54 Å²	54	40%	0.396	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-65.8	-12.1	177.9	-20.2	33.3	0	0	0	114	Y98 Q390 F396 S397	Y98-P394 HydrophobicContact CE1-CB 3.9Å; Q390-P394 VanDerWaalsContact O-CD 3.31Å; Q390-P394 WeakPolarHBondContact O-CD 3.14Å; P394-F396 VanDerWaalsContact C-N 3.28Å; P394-S397 PolarHBondContact O-OG 2.88Å
395	L	88.2	Confident	80.9	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-70.5	-27.5	172.3	-59	175.7	0	0	0	112	I97 Y98 W104 F112 L392 Y393 S397 R398 L439	I97-L395 HydrophobicContact CG2-CD2 3.84Å; Y98-L395 HydrophobicContact CE1-CD2 3.73Å; Y98-L395 HydrophobicContact CE1-CG 4.42Å; Y98-L395 HydrophobicContact CE2-CD2 4.36Å; Y98-L395 WeakPolarHBondContact OH-CG 3.4Å; W104-L395 HydrophobicContact CH2-CB 4.15Å; W104-L395 HydrophobicContact CH2-CD2 4.06Å; W104-L395 HydrophobicContact CZ3-CD2 4.49Å; F112-L395 HydrophobicContact CE1-CD1 4.03Å; F112-L395 HydrophobicContact CE2-CD1 4.2Å; F112-L395 HydrophobicContact CZ-CD1 3.43Å; F112-L395 VanDerWaalsContact CZ-CD1 3.43Å; L392-L395 HydrophobicContact CD2-CD1 3.87Å; L392-L395 VanDerWaalsContact O-CB 3.28Å; L392-L395 WeakPolarHBondContact O-CB 3.46Å; L392-L395 PolarHBondContact O-N 3.01Å; Y393-L395 PolarHBondContact O-N 3.42Å; Y393-L395 VanDerWaalsContact O-N 3.09Å; L395-S397 VanDerWaalsContact C-N 3.32Å; L395-R398 WeakPolarHBondContact O-CB 3.43Å; L395-R398 PolarHBondContact O-N 3.47Å; L395-L439 HydrophobicContact CB-CD1 4.11Å; L395-L439 HydrophobicContact CD1-CD2 4Å
396	F	88.4	Confident	79	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.018	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-75.8	-19.5	179.2	-72.1	-94.1	0	0	0	113.2	Y393 P394 R398 L399 L439 V440 I443 I466 A469	Y393-F396 PolarHBondContact O-N 3.21Å; P394-F396 VanDerWaalsContact C-N 3.28Å; F396-R398 PolarHBondContact O-N 3.21Å; F396-L399 HydrophobicContact CD1-CD1 4.1Å; F396-L399 HydrophobicContact CD1-CD2 4.26Å; F396-L399 HydrophobicContact CD1-CG 4.5Å; F396-L399 VanDerWaalsContact O-CG 3.32Å; F396-L399 WeakPolarHBondContact O-CG 3.32Å; F396-L439 HydrophobicContact CE1-CB 4.34Å; F396-L439 HydrophobicContact CE2-CB 4.47Å; F396-L439 HydrophobicContact CZ-CB 3.88Å; F396-V440 HydrophobicContact CE1-CG2 3.98Å; F396-V440 HydrophobicContact CZ-CG2 4.26Å; F396-I443 HydrophobicContact CE2-CD1 3.3Å; F396-I443 HydrophobicContact CZ-CD1 3.47Å; F396-I443 VanDerWaalsContact CZ-CD1 3.47Å; F396-I466 HydrophobicContact CD1-CG1 4.26Å; F396-I466 HydrophobicContact CD1-CG2 4.24Å; F396-I466 HydrophobicContact CD2-CG1 4.32Å; F396-I466 HydrophobicContact CE1-CB 4.33Å; F396-I466 HydrophobicContact CE1-CD1 4.49Å; F396-I466 HydrophobicContact CE1-CG1 3.9Å; F396-I466 HydrophobicContact CE1-CG2 3.81Å; F396-I466 HydrophobicContact CE2-CD1 4.38Å; F396-I466 HydrophobicContact CE2-CG1 3.95Å; F396-I466 HydrophobicContact CG-CG1 4.48Å; F396-I466 HydrophobicContact CZ-CD1 4.02Å; F396-I466 HydrophobicContact CZ-CG1 3.74Å; F396-I466 HydrophobicContact CZ-CG2 4.38Å; F396-A469 HydrophobicContact CB-CB 3.48Å; F396-A469 VanDerWaalsContact CB-CB 3.48Å; F396-A469 HydrophobicContact CG-CB 4.39Å
397	S	84.6	Confident	77	Confident	93 Å²	93	54.9 Å²	54.9	65%	0.65	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-75.9	0.7	170.5	72.3	0	0	0	0	112.8	P394 L395	P394-S397 PolarHBondContact O-OG 2.88Å; L395-S397 VanDerWaalsContact C-N 3.32Å
398	R	85.5	Confident	75	Confident	43 Å²	43	56.3 Å²	56.3	16%	0.162	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-120.7	13.7	-174.6	-58	176.5	176.5	-151.5	-3.1	112.4	I97 Y98 W104 L395 F396 D400 W401	I97-R398 PolarHBondContact O-NH1 3.08Å; Y98-R398 PolarHBondContact O-NH1 3.42Å; Y98-R398 VanDerWaalsContact O-NH1 3.15Å; Y98-R398 PolarHBondContact O-NH2 3.32Å; W104-R398 HydrophobicContact CZ2-CB 4.14Å; W104-R398 PolarHBondContact NE1-O 3.47Å; L395-R398 WeakPolarHBondContact O-CB 3.43Å; L395-R398 PolarHBondContact O-N 3.47Å; F396-R398 PolarHBondContact O-N 3.21Å; R398-D400 VanDerWaalsContact C-N 3.26Å; R398-D400 PolarHBondContact O-N 2.96Å; R398-W401 HydrophobicContact CB-CD2 3.83Å; R398-W401 HydrophobicContact CB-CE3 3.98Å; R398-W401 HydrophobicContact CB-CG 4.3Å; R398-W401 HydrophobicContact CB-CZ2 4.45Å; R398-W401 HydrophobicContact CB-CZ3 4.38Å; R398-W401 HydrophobicContact CG-CD2 4.17Å; R398-W401 HydrophobicContact CG-CE3 4.21Å; R398-W401 HydrophobicContact CG-CH2 3.96Å; R398-W401 HydrophobicContact CG-CZ2 3.88Å; R398-W401 HydrophobicContact CG-CZ3 4.13Å; R398-W401 WeakPolarHBondContact O-CB 3.17Å; R398-W401 PolarHBondContact O-N 2.94Å
399	L	84.4	Confident	72.7	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.01	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-36.7	-173.9	-68	174.8	0	0	0	112.9	F396 W401 I435 P436 L439 L470 H477	F396-L399 HydrophobicContact CD1-CD1 4.1Å; F396-L399 HydrophobicContact CD1-CD2 4.26Å; F396-L399 HydrophobicContact CD1-CG 4.5Å; F396-L399 VanDerWaalsContact O-CG 3.32Å; F396-L399 WeakPolarHBondContact O-CG 3.32Å; L399-W401 VanDerWaalsContact C-N 3.26Å; L399-W401 PolarHBondContact O-N 3.37Å; L399-I435 HydrophobicContact CD2-CG2 4.44Å; L399-P436 HydrophobicContact CD2-CB 4.16Å; L399-P436 HydrophobicContact CD2-CG 4.01Å; L399-L439 HydrophobicContact CD2-CD1 3.99Å; L399-L470 HydrophobicContact CD1-CD2 3.96Å; L399-H477 PolarHBondContact O-CE1 3.03Å; L399-H477 PolarHBondContact O-NE2 3.17Å
400	D	82.2	Confident	70.5	Confident	61 Å²	61	70 Å²	70	33%	0.326	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-6.3	-174.8	-55.3	-52.4	0	0	0	114.1	R398 D474 H477	R398-D400 VanDerWaalsContact C-N 3.26Å; R398-D400 PolarHBondContact O-N 2.96Å; D400-D474 WeakPolarHBondContact OD1-CB 3.4Å; D400-D474 PolarHBondContact OD1-N 3.24Å; D400-H477 IonicContact OD1-CD2 2.75Å; D400-H477 PolarHBondContact OD1-CD2 3.32Å; D400-H477 VanDerWaalsContact OD1-CD2 3.28Å; D400-H477 IonicContact OD1-NE2 3.04Å; D400-H477 PolarHBondContact OD1-NE2 3.43Å
401	W	78.1	Confident	68.6	Low	109 Å²	109	70 Å²	70	41%	0.413	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-63.3	135.4	-180	-76.7	26.1	0	0	0	110.4	S100 D102 W104 R398 L399 S403	S100-W401 VanDerWaalsContact O-CH2 3.23Å; S100-W401 WeakPolarHBondContact O-CH2 3.37Å; S100-W401 WeakPolarHBondContact O-CZ3 3.29Å; D102-W401 VanDerWaalsContact CA-CE2 3.47Å; D102-W401 WeakPolarHBondContact OD1-CZ2 3.32Å; W104-W401 VanDerWaalsContact CD1-CB 3.45Å; W104-W401 HydrophobicContact CG-CB 4.46Å; R398-W401 HydrophobicContact CB-CD2 3.83Å; R398-W401 HydrophobicContact CB-CE3 3.98Å; R398-W401 HydrophobicContact CB-CG 4.3Å; R398-W401 HydrophobicContact CB-CZ2 4.45Å; R398-W401 HydrophobicContact CB-CZ3 4.38Å; R398-W401 HydrophobicContact CG-CD2 4.17Å; R398-W401 HydrophobicContact CG-CE3 4.21Å; R398-W401 HydrophobicContact CG-CH2 3.96Å; R398-W401 HydrophobicContact CG-CZ2 3.88Å; R398-W401 HydrophobicContact CG-CZ3 4.13Å; R398-W401 WeakPolarHBondContact O-CB 3.17Å; R398-W401 PolarHBondContact O-N 2.94Å; L399-W401 VanDerWaalsContact C-N 3.26Å; L399-W401 PolarHBondContact O-N 3.37Å; W401-S403 PolarHBondContact O-N 3.44Å
402	P	67.1	Low	66.4	Low	88 Å²	88	75 Å²	75	57%	0.571	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-64.1	127	178.7	26.3	-34.4	0	0	0	110.2	D102 I103 W104 E404 V407	D102-P402 WeakPolarHBondContact O-CD 3.49Å; I103-P402 WeakPolarHBondContact CA-O 3.34Å; I103-P402 HydrophobicContact CG1-CG 4.48Å; I103-P402 WeakPolarHBondContact CG2-O 3.31Å; W104-P402 PolarHBondContact N-O 2.67Å; P402-E404 PolarHBondContact O-N 3.35Å; P402-V407 HydrophobicContact CB-CG2 3.91Å; P402-V407 HydrophobicContact CG-CG2 4.05Å
403	S	63.3	Low	64.3	Low	51.5 Å²	51.5	80.9 Å²	80.9	36%	0.36	43%	0.429	S	S	.	.	B	Isolated β-bridge	trans	-69.1	125.3	169.9	-176.5	0	0	0	0	108.3	W401 K405 S406 V407	W401-S403 PolarHBondContact O-N 3.44Å; S403-K405 PolarHBondContact O-N 3.35Å; S403-K405 VanDerWaalsContact O-N 3.13Å; S403-S406 PolarHBondContact N-OG 2.92Å; S403-S406 PolarHBondContact O-N 3.12Å; S403-S406 PolarHBondContact O-OG 3.24Å; S403-V407 PolarHBondContact O-N 2.95Å
404	E	55.4	Low	62.4	Low	124 Å²	124	84.8 Å²	84.8	58%	0.579	45%	0.451	S	S	*	.	H	α-helix	trans	-51.1	44.4	177	-119.5	-179.7	177.3	0	0	111	I103 W104 S106 P402 S406 A408	I103-E404 VanDerWaalsContact CG2-CA 3.5Å; I103-E404 HydrophobicContact CG2-CB 3.8Å; I103-E404 HydrophobicContact CG2-CG 4.46Å; W104-E404 WeakPolarHBondContact O-CB 3.48Å; W104-E404 PolarHBondContact O-N 3.48Å; S106-E404 WeakPolarHBondContact CB-OE2 3.47Å; S106-E404 PolarHBondContact N-OE2 3.38Å; S106-E404 PolarHBondContact OG-OE2 3.04Å; S106-E404 VanDerWaalsContact OG-OE2 3.05Å; P402-E404 PolarHBondContact O-N 3.35Å; E404-S406 PolarHBondContact O-N 2.86Å; E404-A408 PolarHBondContact O-N 3.39Å; E404-A408 VanDerWaalsContact O-N 3.13Å
405	K	48.9	Very low	60.4	Low	118.5 Å²	118.5	85.3 Å²	85.3	52%	0.515	45%	0.453	S	S	.	.	H	α-helix	trans	-61.9	38.6	174.1	-68.7	-177.9	178.4	177.3	0	110.2	L68 S70 S403 V407 A408 F409	L68-K405 WeakPolarHBondContact O-CE 3.13Å; L68-K405 PolarHBondContact O-NZ 3.37Å; S70-K405 VanDerWaalsContact N-NZ 3.12Å; S403-K405 PolarHBondContact O-N 3.35Å; S403-K405 VanDerWaalsContact O-N 3.13Å; K405-V407 WeakPolarHBondContact O-CG2 3.27Å; K405-V407 PolarHBondContact O-N 3.35Å; K405-A408 PolarHBondContact O-N 3.31Å; K405-F409 HydrophobicContact CB-CD2 4.44Å; K405-F409 WeakPolarHBondContact O-CD2 3.46Å; K405-F409 PolarHBondContact O-N 2.87Å
406	S	44.8	Very low	58.4	Low	65 Å²	65	90.3 Å²	90.3	46%	0.455	48%	0.479	S	S	.	.	H	α-helix	trans	-57.8	32.5	-173.9	122.8	0	0	0	0	111.6	S403 E404 F409 E410	S403-S406 PolarHBondContact N-OG 2.92Å; S403-S406 PolarHBondContact O-N 3.12Å; S403-S406 PolarHBondContact O-OG 3.24Å; E404-S406 PolarHBondContact O-N 2.86Å; S406-F409 PolarHBondContact O-N 3.02Å; S406-E410 WeakPolarHBondContact O-CB 3.39Å; S406-E410 WeakPolarHBondContact O-CG 3.39Å; S406-E410 PolarHBondContact O-N 3.47Å
407	V	43	Very low	56.6	Low	93 Å²	93	96 Å²	96	56%	0.564	51%	0.506	S	S	*	.	H	α-helix	trans	-87.5	-21.6	173.7	176.9	0	0	0	0	111.1	I103 P402 S403 K405 F409 N411	I103-V407 HydrophobicContact CD1-CG2 4.47Å; P402-V407 HydrophobicContact CB-CG2 3.91Å; P402-V407 HydrophobicContact CG-CG2 4.05Å; S403-V407 PolarHBondContact O-N 2.95Å; K405-V407 WeakPolarHBondContact O-CG2 3.27Å; K405-V407 PolarHBondContact O-N 3.35Å; V407-F409 VanDerWaalsContact C-N 3.34Å; V407-F409 PolarHBondContact O-N 3.45Å; V407-N411 PolarHBondContact O-N 3.29Å
408	A	39.9	Very low	55.1	Low	72.5 Å²	72.5	97 Å²	97	60%	0.599	50%	0.503	S	S	*	.	H	α-helix	trans	-91.3	-16.1	-178	0	0	0	0	0	114.2	E404 K405	E404-A408 PolarHBondContact O-N 3.39Å; E404-A408 VanDerWaalsContact O-N 3.13Å; K405-A408 PolarHBondContact O-N 3.31Å
409	F	41	Very low	53.2	Low	122 Å²	122	98.2 Å²	98.2	54%	0.535	51%	0.512	S	S	.	.			trans	-109.9	32.8	176.8	-78.7	-75.9	0	0	0	112.9	K405 S406 V407 N411 K412 L430	K405-F409 HydrophobicContact CB-CD2 4.44Å; K405-F409 WeakPolarHBondContact O-CD2 3.46Å; K405-F409 PolarHBondContact O-N 2.87Å; S406-F409 PolarHBondContact O-N 3.02Å; V407-F409 VanDerWaalsContact C-N 3.34Å; V407-F409 PolarHBondContact O-N 3.45Å; F409-N411 VanDerWaalsContact C-N 3.31Å; F409-N411 PolarHBondContact O-N 3.35Å; F409-K412 CarbonylContact O-C 3.54Å; F409-K412 VanDerWaalsContact O-C 3.26Å; F409-K412 PolarHBondContact O-N 2.99Å; F409-K412 VanDerWaalsContact O-N 3.09Å; F409-L430 HydrophobicContact CD2-CD2 4.04Å; F409-L430 HydrophobicContact CE2-CD2 4.08Å
410	E	41.3	Very low	51.7	Low	166.5 Å²	166.5	101.4 Å²	101.4	78%	0.778	54%	0.539	S	S	*	.			trans	-67.8	-28.8	172.9	-73.4	-175.5	143.9	0	0	112.6	S406 K412 L413	S406-E410 WeakPolarHBondContact O-CB 3.39Å; S406-E410 WeakPolarHBondContact O-CG 3.39Å; S406-E410 PolarHBondContact O-N 3.47Å; E410-K412 PolarHBondContact O-N 3.14Å; E410-L413 PolarHBondContact O-N 2.92Å
411	N	47.8	Very low	50.2	Low	124.5 Å²	124.5	105.5 Å²	105.5	67%	0.666	56%	0.56	S	S	*	*			trans	-73.9	19.3	179.2	-72.7	-23.8	0	0	0	113.8	V407 F409 L413	V407-N411 PolarHBondContact O-N 3.29Å; F409-N411 VanDerWaalsContact C-N 3.31Å; F409-N411 PolarHBondContact O-N 3.35Å; N411-L413 VanDerWaalsContact C-N 3.31Å; N411-L413 PolarHBondContact O-N 3.39Å
412	K	43	Very low	48.6	Very low	154 Å²	154	105.1 Å²	105.1	67%	0.67	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	21.9	-179.9	-113.2	-179.7	-179.8	179.3	0	112.1	F409 E410 N414 V415	F409-K412 CarbonylContact O-C 3.54Å; F409-K412 VanDerWaalsContact O-C 3.26Å; F409-K412 PolarHBondContact O-N 2.99Å; F409-K412 VanDerWaalsContact O-N 3.09Å; E410-K412 PolarHBondContact O-N 3.14Å; K412-N414 PolarHBondContact O-N 3.14Å; K412-V415 HydrophobicContact CB-CG2 4.1Å; K412-V415 PolarHBondContact O-N 3.13Å
413	L	44.6	Very low	48	Very low	125.5 Å²	125.5	105.9 Å²	105.9	66%	0.657	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-38.2	173.4	-119.4	79	0	0	0	112.9	E410 N411 V415 L416 E417	E410-L413 PolarHBondContact O-N 2.92Å; N411-L413 VanDerWaalsContact C-N 3.31Å; N411-L413 PolarHBondContact O-N 3.39Å; L413-V415 PolarHBondContact O-N 2.99Å; L413-V415 VanDerWaalsContact O-N 3.12Å; L413-L416 PolarHBondContact O-N 3.12Å; L413-E417 PolarHBondContact O-N 3.15Å
414	N	49.8	Very low	47.2	Very low	103.5 Å²	103.5	106.8 Å²	106.8	55%	0.553	57%	0.574	S	S	*	*	H	α-helix	trans	-70.2	-26	-173.2	-66.3	3.4	0	0	0	114.7	K412 I418	K412-N414 PolarHBondContact O-N 3.14Å; N414-I418 VanDerWaalsContact O-CB 3.26Å; N414-I418 WeakPolarHBondContact O-CB 3.43Å; N414-I418 WeakPolarHBondContact O-CD1 3.48Å; N414-I418 WeakPolarHBondContact O-CG1 3.4Å; N414-I418 PolarHBondContact O-N 2.85Å
415	V	48.1	Very low	46.8	Very low	71 Å²	71	104.2 Å²	104.2	43%	0.43	56%	0.561	S	S	.	*	H	α-helix	trans	-78.2	-33.2	-178.5	-178.1	0	0	0	0	111.8	K412 L413 I418 L419	K412-V415 HydrophobicContact CB-CG2 4.1Å; K412-V415 PolarHBondContact O-N 3.13Å; L413-V415 PolarHBondContact O-N 2.99Å; L413-V415 VanDerWaalsContact O-N 3.12Å; V415-I418 PolarHBondContact O-N 3.11Å; V415-L419 HydrophobicContact CG1-CD1 4.06Å; V415-L419 HydrophobicContact CG1-CG 4.15Å; V415-L419 WeakPolarHBondContact O-CB 3.24Å; V415-L419 VanDerWaalsContact O-CG 3.31Å; V415-L419 WeakPolarHBondContact O-CG 3.29Å; V415-L419 PolarHBondContact O-N 3.24Å
416	L	44.3	Very low	46.7	Very low	105.5 Å²	105.5	103.4 Å²	103.4	55%	0.552	57%	0.565	S	S	*	*	H	α-helix	trans	-69.3	-39	178.3	-120.4	132.9	0	0	0	111.6	L413 I418 L419 A420 L430	L413-L416 PolarHBondContact O-N 3.12Å; L416-I418 VanDerWaalsContact C-N 3.35Å; L416-L419 PolarHBondContact O-N 3.32Å; L416-A420 WeakPolarHBondContact O-CB 3.29Å; L416-A420 PolarHBondContact O-N 3.35Å; L416-L430 HydrophobicContact CD1-CD2 4.42Å; L416-L430 HydrophobicContact CD2-CB 4.36Å; L416-L430 HydrophobicContact CD2-CD2 4.32Å; L416-L430 HydrophobicContact CG-CD2 4.28Å
417	E	52.5	Low	46.8	Very low	122.5 Å²	122.5	107.6 Å²	107.6	57%	0.572	58%	0.583	S	S	*	*	H	α-helix	trans	-65.6	-41.3	172.8	-70.6	-176.2	154.9	0	0	112	L413 L419 A420 L421	L413-E417 PolarHBondContact O-N 3.15Å; E417-L419 VanDerWaalsContact C-N 3.31Å; E417-L419 PolarHBondContact O-N 2.93Å; E417-A420 PolarHBondContact O-N 3.31Å; E417-L421 WeakPolarHBondContact O-CB 3.3Å; E417-L421 VanDerWaalsContact O-CG 3.25Å; E417-L421 WeakPolarHBondContact O-CG 3.32Å; E417-L421 PolarHBondContact O-N 3.15Å
418	I	51.6	Low	46.7	Very low	115 Å²	115	106.7 Å²	106.7	59%	0.59	57%	0.574	S	S	*	*	H	α-helix	trans	-65.4	-38.9	177.8	-69.3	167	0	0	0	111.5	N414 V415 L416 A420 L421	N414-I418 VanDerWaalsContact O-CB 3.26Å; N414-I418 WeakPolarHBondContact O-CB 3.43Å; N414-I418 WeakPolarHBondContact O-CD1 3.48Å; N414-I418 WeakPolarHBondContact O-CG1 3.4Å; N414-I418 PolarHBondContact O-N 2.85Å; V415-I418 PolarHBondContact O-N 3.11Å; L416-I418 VanDerWaalsContact C-N 3.35Å; I418-A420 VanDerWaalsContact C-N 3.34Å; I418-L421 PolarHBondContact O-N 3.26Å
419	L	46.4	Very low	46.7	Very low	68.5 Å²	68.5	111.4 Å²	111.4	36%	0.359	58%	0.584	S	S	.	*	H	α-helix	trans	-71.5	-38	175.9	-70.5	173	0	0	0	112	V415 L416 E417 L421 H422 F425	V415-L419 HydrophobicContact CG1-CD1 4.06Å; V415-L419 HydrophobicContact CG1-CG 4.15Å; V415-L419 WeakPolarHBondContact O-CB 3.24Å; V415-L419 VanDerWaalsContact O-CG 3.31Å; V415-L419 WeakPolarHBondContact O-CG 3.29Å; V415-L419 PolarHBondContact O-N 3.24Å; L416-L419 PolarHBondContact O-N 3.32Å; E417-L419 VanDerWaalsContact C-N 3.31Å; E417-L419 PolarHBondContact O-N 2.93Å; L419-L421 VanDerWaalsContact C-N 3.27Å; L419-L421 PolarHBondContact O-N 3.02Å; L419-H422 PolarHBondContact O-N 3.22Å; L419-H422 VanDerWaalsContact O-N 3.1Å; L419-F425 HydrophobicContact CB-CB 4.4Å; L419-F425 HydrophobicContact CD2-CB 4.46Å; L419-F425 HydrophobicContact CD2-CD1 4.16Å; L419-F425 HydrophobicContact CD2-CE1 4.37Å; L419-F425 HydrophobicContact CD2-CG 4.24Å; L419-F425 WeakPolarHBondContact O-CB 3.5Å
420	A	52.4	Low	46.7	Very low	69 Å²	69	110.6 Å²	110.6	57%	0.57	59%	0.585	S	S	*	*	H	α-helix	trans	-66.9	-23.7	177.1	0	0	0	0	0	113.6	L416 E417 I418 H422 V426	L416-A420 WeakPolarHBondContact O-CB 3.29Å; L416-A420 PolarHBondContact O-N 3.35Å; E417-A420 PolarHBondContact O-N 3.31Å; I418-A420 VanDerWaalsContact C-N 3.34Å; A420-H422 PolarHBondContact O-N 3.38Å; A420-V426 WeakPolarHBondContact O-CG2 3.41Å
421	L	51.2	Low	47	Very low	147 Å²	147	107.9 Å²	107.9	77%	0.77	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-15.5	178.5	-82.6	164.1	0	0	0	114.2	E417 I418 L419	E417-L421 WeakPolarHBondContact O-CB 3.3Å; E417-L421 VanDerWaalsContact O-CG 3.25Å; E417-L421 WeakPolarHBondContact O-CG 3.32Å; E417-L421 PolarHBondContact O-N 3.15Å; I418-L421 PolarHBondContact O-N 3.26Å; L419-L421 VanDerWaalsContact C-N 3.27Å; L419-L421 PolarHBondContact O-N 3.02Å
422	H	44.8	Very low	47.2	Very low	99.5 Å²	99.5	105.9 Å²	105.9	46%	0.461	58%	0.58	S	S	.	*	S	Bend	trans	-113.9	121.3	-178.7	-169.7	-88.9	0	0	0	111.8	L419 A420 S424 F425	L419-H422 PolarHBondContact O-N 3.22Å; L419-H422 VanDerWaalsContact O-N 3.1Å; A420-H422 PolarHBondContact O-N 3.38Å; H422-S424 PolarHBondContact CE1-OG 3.07Å; H422-S424 PolarHBondContact ND1-OG 3.2Å; H422-S424 PolarHBondContact O-N 3.03Å; H422-F425 HydrophobicContact CB-CD2 3.87Å; H422-F425 HydrophobicContact CB-CE2 4.15Å; H422-F425 AromaticContact CG-CE2 3.97Å; H422-F425 AromaticContact ND1-CD2 3.71Å; H422-F425 AromaticContact ND1-CE2 3.57Å; H422-F425 PolarHBondContact O-N 3.35Å
423	P	53.3	Low	47.9	Very low	105 Å²	105	101.6 Å²	101.6	68%	0.682	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-19.9	-167.4	21.5	-32.6	0	0	0	114.5	F425	P423-F425 VanDerWaalsContact C-N 3.27Å; P423-F425 PolarHBondContact O-N 3.46Å
424	S	46.9	Very low	49.3	Very low	71 Å²	71	98.3 Å²	98.3	50%	0.497	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-9.8	175.2	11.9	0	0	0	0	114.9	H422 R441	H422-S424 PolarHBondContact CE1-OG 3.07Å; H422-S424 PolarHBondContact ND1-OG 3.2Å; H422-S424 PolarHBondContact O-N 3.03Å; S424-R441 PolarHBondContact O-NH1 2.93Å
425	F	46.4	Very low	50.9	Low	69 Å²	69	95.1 Å²	95.1	30%	0.303	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-3.7	-179.6	-56.2	-88.2	0	0	0	113.9	L419 H422 P423 N427 L428	L419-F425 HydrophobicContact CB-CB 4.4Å; L419-F425 HydrophobicContact CD2-CB 4.46Å; L419-F425 HydrophobicContact CD2-CD1 4.16Å; L419-F425 HydrophobicContact CD2-CE1 4.37Å; L419-F425 HydrophobicContact CD2-CG 4.24Å; L419-F425 WeakPolarHBondContact O-CB 3.5Å; H422-F425 HydrophobicContact CB-CD2 3.87Å; H422-F425 HydrophobicContact CB-CE2 4.15Å; H422-F425 AromaticContact CG-CE2 3.97Å; H422-F425 AromaticContact ND1-CD2 3.71Å; H422-F425 AromaticContact ND1-CE2 3.57Å; H422-F425 PolarHBondContact O-N 3.35Å; P423-F425 VanDerWaalsContact C-N 3.27Å; P423-F425 PolarHBondContact O-N 3.46Å; F425-N427 PolarHBondContact O-N 3.32Å; F425-N427 VanDerWaalsContact O-N 3.11Å; F425-L428 HydrophobicContact CB-CD1 4.3Å; F425-L428 HydrophobicContact CD1-CD1 3.72Å; F425-L428 HydrophobicContact CE1-CD1 4.36Å; F425-L428 WeakPolarHBondContact O-CB 3.47Å; F425-L428 PolarHBondContact O-N 3.23Å
426	V	47.9	Very low	52.7	Low	101 Å²	101	91.8 Å²	91.8	61%	0.612	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-30.1	-179.9	174.4	0	0	0	0	112.9	A420	A420-V426 WeakPolarHBondContact O-CG2 3.41Å
427	N	45.5	Very low	54.8	Low	154 Å²	154	86.9 Å²	86.9	82%	0.824	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-1.2	-179.6	-67.4	-11.4	0	0	0	114.5	F425 Q429	F425-N427 PolarHBondContact O-N 3.32Å; F425-N427 VanDerWaalsContact O-N 3.11Å; N427-Q429 PolarHBondContact O-N 3.24Å; N427-Q429 VanDerWaalsContact O-N 3.1Å
428	L	41.2	Very low	56.4	Low	73.5 Å²	73.5	83.3 Å²	83.3	39%	0.385	47%	0.47	S	S	.	.			trans	-83.7	78.2	174.1	-83.2	160.9	0	0	0	110.2	F425 L430 R441	F425-L428 HydrophobicContact CB-CD1 4.3Å; F425-L428 HydrophobicContact CD1-CD1 3.72Å; F425-L428 HydrophobicContact CE1-CD1 4.36Å; F425-L428 WeakPolarHBondContact O-CB 3.47Å; F425-L428 PolarHBondContact O-N 3.23Å; L428-L430 PolarHBondContact O-N 3.36Å; L428-R441 VanDerWaalsContact CD1-NH1 3.27Å
429	Q	40.7	Very low	58.2	Low	172.5 Å²	172.5	78.4 Å²	78.4	81%	0.806	45%	0.446	S	S	*	.			trans	-64.6	100.7	164.2	-86	-179.5	-21.4	0	0	108.4	N427 S431	N427-Q429 PolarHBondContact O-N 3.24Å; N427-Q429 VanDerWaalsContact O-N 3.1Å; Q429-S431 PolarHBondContact O-N 3.28Å; Q429-S431 PolarHBondContact O-OG 3.07Å
430	L	41.9	Very low	60.3	Low	104 Å²	104	75.2 Å²	75.2	55%	0.545	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	65.6	176.8	-140.8	81.6	0	0	0	110.2	F409 L416 L428 S432	F409-L430 HydrophobicContact CD2-CD2 4.04Å; F409-L430 HydrophobicContact CE2-CD2 4.08Å; L416-L430 HydrophobicContact CD1-CD2 4.42Å; L416-L430 HydrophobicContact CD2-CB 4.36Å; L416-L430 HydrophobicContact CD2-CD2 4.32Å; L416-L430 HydrophobicContact CG-CD2 4.28Å; L428-L430 PolarHBondContact O-N 3.36Å; L430-S432 VanDerWaalsContact C-N 3.29Å; L430-S432 PolarHBondContact O-N 3.44Å
431	S	46	Very low	62.1	Low	110.5 Å²	110.5	75.1 Å²	75.1	77%	0.773	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	41.8	174.7	-51.5	0	0	0	0	109	Q429	Q429-S431 PolarHBondContact O-N 3.28Å; Q429-S431 PolarHBondContact O-OG 3.07Å
432	S	53	Low	63.9	Low	83 Å²	83	70.5 Å²	70.5	58%	0.58	39%	0.388	S	S	*	.			trans	-98.5	135.7	168.3	47.9	0	0	0	0	108.1	L430 E434	L430-S432 VanDerWaalsContact C-N 3.29Å; L430-S432 PolarHBondContact O-N 3.44Å; S432-E434 PolarHBondContact O-N 2.96Å
433	P	57.6	Low	66.2	Low	63 Å²	63	65.9 Å²	65.9	41%	0.409	37%	0.366	S	S	.	.			trans	-66.8	110.2	-179.4	26.3	-32.7	0	0	0	109.7	A109 I435	A109-P433 HydrophobicContact CB-CB 3.63Å; A109-P433 HydrophobicContact CB-CG 4.48Å; P433-I435 HydrophobicContact CB-CG1 4.34Å; P433-I435 PolarHBondContact O-N 3.42Å
434	E	73.5	Confident	68.1	Low	55.5 Å²	55.5	61 Å²	61	26%	0.259	33%	0.334	S	S	.	.			trans	-75	71.6	173.2	-64.1	-171.2	-177.9	0	0	110.7	S432 P436 T437 I438 T479 S481	S432-E434 PolarHBondContact O-N 2.96Å; E434-P436 VanDerWaalsContact C-CD 3.41Å; E434-P436 VanDerWaalsContact C-N 3.33Å; E434-T437 WeakPolarHBondContact O-CB 3.24Å; E434-T437 PolarHBondContact O-N 3.08Å; E434-T437 VanDerWaalsContact O-N 3.11Å; E434-T437 WeakPolarHBondContact OE2-CB 3.14Å; E434-T437 PolarHBondContact OE2-OG1 2.96Å; E434-I438 WeakPolarHBondContact O-CG1 3.37Å; E434-I438 PolarHBondContact O-N 3.41Å; E434-T479 VanDerWaalsContact CD-OG1 3.27Å; E434-T479 HydrophobicContact CG-CG2 4.07Å; E434-T479 WeakPolarHBondContact OE2-CB 3.24Å; E434-T479 PolarHBondContact OE2-OG1 3.26Å; E434-S481 PolarHBondContact OE1-OG 3.36Å; E434-S481 WeakPolarHBondContact OE2-CB 3.42Å; E434-S481 PolarHBondContact OE2-OG 2.94Å
435	I	82.5	Confident	70	Confident	37 Å²	37	58.7 Å²	58.7	19%	0.19	32%	0.321	C	S	.	.	H	α-helix	trans	-50.8	-44.1	-179.7	-59.7	174.7	0	0	0	112.6	W104 L399 P433 T437 I438 L439	W104-I435 HydrophobicContact CB-CD1 3.99Å; W104-I435 HydrophobicContact CD2-CD1 3.69Å; W104-I435 HydrophobicContact CD2-CG2 4.44Å; W104-I435 HydrophobicContact CE3-CD1 4.48Å; W104-I435 HydrophobicContact CG-CD1 3.41Å; W104-I435 VanDerWaalsContact CG-CD1 3.41Å; W104-I435 HydrophobicContact CH2-CG2 4.05Å; W104-I435 HydrophobicContact CZ2-CG2 3.68Å; L399-I435 HydrophobicContact CD2-CG2 4.44Å; P433-I435 HydrophobicContact CB-CG1 4.34Å; P433-I435 PolarHBondContact O-N 3.42Å; I435-T437 PolarHBondContact O-N 2.7Å; I435-I438 PolarHBondContact O-N 3.17Å; I435-L439 HydrophobicContact CG2-CD1 3.8Å; I435-L439 HydrophobicContact CG2-CG 4.16Å; I435-L439 WeakPolarHBondContact O-CB 3.2Å; I435-L439 VanDerWaalsContact O-CG 3.32Å; I435-L439 WeakPolarHBondContact O-CG 3.46Å; I435-L439 PolarHBondContact O-N 3.26Å
436	P	86.7	Confident	72.1	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.013	31%	0.308	C	S	.	.	H	α-helix	trans	-59	-47.4	176.5	-15.2	23.1	0	0	0	112.6	L399 E434 I438 L439 V440 L470 H477 L482	L399-P436 HydrophobicContact CD2-CB 4.16Å; L399-P436 HydrophobicContact CD2-CG 4.01Å; E434-P436 VanDerWaalsContact C-CD 3.41Å; E434-P436 VanDerWaalsContact C-N 3.33Å; P436-I438 VanDerWaalsContact C-N 3.32Å; P436-I438 PolarHBondContact O-N 2.99Å; P436-L439 PolarHBondContact O-N 2.96Å; P436-V440 WeakPolarHBondContact O-CB 3.39Å; P436-V440 VanDerWaalsContact O-CG2 3.3Å; P436-V440 WeakPolarHBondContact O-CG2 3.35Å; P436-V440 PolarHBondContact O-N 2.84Å; P436-L470 HydrophobicContact CB-CD2 4.13Å; P436-H477 HydrophobicContact CG-CB 3.68Å; P436-H477 VanDerWaalsContact CG-ND1 3.34Å; P436-H477 WeakPolarHBondContact CG-ND1 3.33Å; P436-L482 HydrophobicContact CB-CD1 4.26Å; P436-L482 HydrophobicContact CB-CD2 4.16Å
437	T	88.2	Confident	74.1	Confident	2 Å²	2	51 Å²	51	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-59.6	-43.3	179.1	-50.8	0	0	0	0	111.1	E434 I435 R441 T479 L482 E485	E434-T437 WeakPolarHBondContact O-CB 3.24Å; E434-T437 PolarHBondContact O-N 3.08Å; E434-T437 VanDerWaalsContact O-N 3.11Å; E434-T437 WeakPolarHBondContact OE2-CB 3.14Å; E434-T437 PolarHBondContact OE2-OG1 2.96Å; I435-T437 PolarHBondContact O-N 2.7Å; T437-R441 WeakPolarHBondContact O-CB 3.22Å; T437-R441 PolarHBondContact O-N 3.25Å; T437-T479 PolarHBondContact OG1-OG1 2.94Å; T437-L482 WeakPolarHBondContact OG1-CB 3.3Å; T437-L482 PolarHBondContact OG1-N 3.27Å; T437-E485 HydrophobicContact CG2-CG 3.96Å
438	I	85.6	Confident	76.1	Confident	47 Å²	47	47.7 Å²	47.7	24%	0.241	26%	0.256	C	S	.	.	H	α-helix	trans	-66	-45.5	178.7	-63.5	168.3	0	0	0	111	A109 F112 E434 I435 P436 F442	A109-I438 HydrophobicContact CB-CD1 3.81Å; F112-I438 HydrophobicContact CB-CG2 3.61Å; E434-I438 WeakPolarHBondContact O-CG1 3.37Å; E434-I438 PolarHBondContact O-N 3.41Å; I435-I438 PolarHBondContact O-N 3.17Å; P436-I438 VanDerWaalsContact C-N 3.32Å; P436-I438 PolarHBondContact O-N 2.99Å; I438-F442 VanDerWaalsContact O-CB 3.25Å; I438-F442 WeakPolarHBondContact O-CB 3.42Å; I438-F442 PolarHBondContact O-N 2.71Å
439	L	89.9	Confident	78.1	Confident	13 Å²	13	49.7 Å²	49.7	7%	0.068	26%	0.264	C	S	.	.	H	α-helix	trans	-65.6	-43.3	179.2	-70.9	175.8	0	0	0	112.1	W104 F112 L395 F396 L399 I435 P436 F442 I443	W104-L439 HydrophobicContact CH2-CD1 4.26Å; W104-L439 HydrophobicContact CZ2-CD1 4.48Å; F112-L439 HydrophobicContact CD1-CD2 4.16Å; F112-L439 HydrophobicContact CD2-CD2 3.8Å; F112-L439 HydrophobicContact CE1-CD2 4.16Å; F112-L439 HydrophobicContact CE2-CD2 3.8Å; F112-L439 HydrophobicContact CG-CD2 4Å; F112-L439 HydrophobicContact CZ-CD2 4Å; L395-L439 HydrophobicContact CB-CD1 4.11Å; L395-L439 HydrophobicContact CD1-CD2 4Å; F396-L439 HydrophobicContact CE1-CB 4.34Å; F396-L439 HydrophobicContact CE2-CB 4.47Å; F396-L439 HydrophobicContact CZ-CB 3.88Å; L399-L439 HydrophobicContact CD2-CD1 3.99Å; I435-L439 HydrophobicContact CG2-CD1 3.8Å; I435-L439 HydrophobicContact CG2-CG 4.16Å; I435-L439 WeakPolarHBondContact O-CB 3.2Å; I435-L439 VanDerWaalsContact O-CG 3.32Å; I435-L439 WeakPolarHBondContact O-CG 3.46Å; I435-L439 PolarHBondContact O-N 3.26Å; P436-L439 PolarHBondContact O-N 2.96Å; L439-F442 PolarHBondContact O-N 3.16Å; L439-I443 WeakPolarHBondContact O-CG1 3.25Å; L439-I443 PolarHBondContact O-N 3.34Å
440	V	91.5	Very high	80.1	Confident	1.5 Å²	1.5	42 Å²	42	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-65.7	-46.4	177.6	170.2	0	0	0	0	110.8	F396 P436 F442 I443 F444 I466 L482 E485 I486	F396-V440 HydrophobicContact CE1-CG2 3.98Å; F396-V440 HydrophobicContact CZ-CG2 4.26Å; P436-V440 WeakPolarHBondContact O-CB 3.39Å; P436-V440 VanDerWaalsContact O-CG2 3.3Å; P436-V440 WeakPolarHBondContact O-CG2 3.35Å; P436-V440 PolarHBondContact O-N 2.84Å; V440-F442 VanDerWaalsContact C-N 3.29Å; V440-F442 PolarHBondContact O-N 3.25Å; V440-I443 PolarHBondContact O-N 3.19Å; V440-F444 HydrophobicContact CG1-CD2 3.55Å; V440-F444 HydrophobicContact CG1-CE1 4.36Å; V440-F444 HydrophobicContact CG1-CE2 3.21Å; V440-F444 HydrophobicContact CG1-CG 4.27Å; V440-F444 HydrophobicContact CG1-CZ 3.68Å; V440-F444 WeakPolarHBondContact O-CB 3.43Å; V440-F444 VanDerWaalsContact O-CG 3.31Å; V440-F444 WeakPolarHBondContact O-CG 3.32Å; V440-F444 PolarHBondContact O-N 3.08Å; V440-I466 HydrophobicContact CG2-CG2 4.2Å; V440-L482 HydrophobicContact CB-CD1 4.02Å; V440-L482 HydrophobicContact CG1-CD1 4.28Å; V440-L482 HydrophobicContact CG2-CD1 3.87Å; V440-E485 HydrophobicContact CG1-CB 4.28Å; V440-I486 HydrophobicContact CG1-CG1 4.42Å
441	R	90.1	Very high	82	Confident	66.5 Å²	66.5	39.6 Å²	39.6	25%	0.251	22%	0.222	S	C	.	.	H	α-helix	trans	-57	-43.1	173.6	-177.7	178.6	-69.3	154.9	8.7	111.5	H116 S424 L428 T437 G445 E485	H116-R441 PolarHBondContact CE1-O 2.85Å; H116-R441 VanDerWaalsContact CE1-O 3.26Å; H116-R441 PolarHBondContact ND1-O 3.26Å; S424-R441 PolarHBondContact O-NH1 2.93Å; L428-R441 VanDerWaalsContact CD1-NH1 3.27Å; T437-R441 WeakPolarHBondContact O-CB 3.22Å; T437-R441 PolarHBondContact O-N 3.25Å; R441-G445 PolarHBondContact O-N 3.17Å; R441-E485 HydrophobicContact CB-CG 4.2Å; R441-E485 WeakPolarHBondContact CG-OE2 3.2Å; R441-E485 IonicContact CZ-OE1 2.94Å; R441-E485 IonicContact NE-OE1 3.95Å; R441-E485 PolarHBondContact NE-OE1 2.92Å; R441-E485 IonicContact NE-OE2 3.45Å; R441-E485 PolarHBondContact NE-OE2 3.16Å; R441-E485 IonicContact NH2-OE1 2.71Å; R441-E485 PolarHBondContact NH2-OE1 3.23Å
442	F	89.4	Confident	83.9	Confident	50.5 Å²	50.5	38.1 Å²	38.1	22%	0.221	21%	0.208	C	C	.	.	H	α-helix	trans	-64.6	-48.3	178.3	-179.8	-116.1	0	0	0	112.3	F112 L115 H116 V379 F383 L392 I438 L439 V440 G445 L446	F112-F442 AromaticContact CD1-CD1 3.75Å; F112-F442 HydrophobicContact CD1-CD1 3.75Å; F112-F442 AromaticContact CD1-CE1 3.98Å; F112-F442 HydrophobicContact CD1-CE1 3.98Å; F112-F442 HydrophobicContact CD1-CG 4.29Å; F112-F442 HydrophobicContact CE1-CD1 4.31Å; F112-F442 HydrophobicContact CE1-CE1 4.28Å; L115-F442 HydrophobicContact CB-CD2 4.1Å; L115-F442 HydrophobicContact CB-CE2 3.49Å; L115-F442 VanDerWaalsContact CB-CE2 3.49Å; L115-F442 HydrophobicContact CB-CZ 3.99Å; L115-F442 HydrophobicContact CD1-CE1 4.41Å; L115-F442 HydrophobicContact CD1-CE2 4.2Å; L115-F442 HydrophobicContact CD1-CZ 3.82Å; H116-F442 HydrophobicContact CB-CD2 4.04Å; V379-F442 HydrophobicContact CG1-CE2 4.28Å; V379-F442 HydrophobicContact CG1-CZ 4.32Å; F383-F442 HydrophobicContact CD2-CZ 4.28Å; F383-F442 HydrophobicContact CE1-CE1 4.47Å; F383-F442 HydrophobicContact CE2-CE1 4.11Å; F383-F442 AromaticContact CE2-CZ 3.53Å; F383-F442 HydrophobicContact CE2-CZ 3.53Å; F383-F442 AromaticContact CZ-CE1 3.85Å; F383-F442 HydrophobicContact CZ-CE1 3.85Å; F383-F442 AromaticContact CZ-CZ 3.75Å; F383-F442 HydrophobicContact CZ-CZ 3.75Å; L392-F442 HydrophobicContact CD1-CD1 4.12Å; L392-F442 HydrophobicContact CD1-CE1 3.77Å; L392-F442 HydrophobicContact CD2-CE1 4.12Å; I438-F442 VanDerWaalsContact O-CB 3.25Å; I438-F442 WeakPolarHBondContact O-CB 3.42Å; I438-F442 PolarHBondContact O-N 2.71Å; L439-F442 PolarHBondContact O-N 3.16Å; V440-F442 VanDerWaalsContact C-N 3.29Å; V440-F442 PolarHBondContact O-N 3.25Å; F442-G445 WeakPolarHBondContact O-CA 3.3Å; F442-G445 PolarHBondContact O-N 3.28Å; F442-G445 VanDerWaalsContact O-N 3.15Å; F442-L446 HydrophobicContact CD1-CD1 4.22Å; F442-L446 HydrophobicContact CD2-CG 4.46Å; F442-L446 HydrophobicContact CE1-CD1 3.65Å; F442-L446 HydrophobicContact CE1-CG 4.34Å; F442-L446 HydrophobicContact CE2-CD1 4.17Å; F442-L446 HydrophobicContact CE2-CD2 4.04Å; F442-L446 HydrophobicContact CE2-CG 4.23Å; F442-L446 HydrophobicContact CZ-CD1 3.73Å; F442-L446 HydrophobicContact CZ-CD2 4.23Å; F442-L446 HydrophobicContact CZ-CG 4.07Å; F442-L446 PolarHBondContact O-N 3.43Å
443	I	91.8	Very high	85.5	Confident	1.5 Å²	1.5	34.2 Å²	34.2	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-62.1	-47.7	177.6	-73	173.8	0	0	0	111.1	L392 F396 L439 V440 G445 L446 V447 F457 I466	L392-I443 HydrophobicContact CB-CD1 4.28Å; L392-I443 HydrophobicContact CD1-CD1 4.48Å; L392-I443 HydrophobicContact CD1-CG1 3.84Å; F396-I443 HydrophobicContact CE2-CD1 3.3Å; F396-I443 HydrophobicContact CZ-CD1 3.47Å; F396-I443 VanDerWaalsContact CZ-CD1 3.47Å; L439-I443 WeakPolarHBondContact O-CG1 3.25Å; L439-I443 PolarHBondContact O-N 3.34Å; V440-I443 PolarHBondContact O-N 3.19Å; I443-G445 PolarHBondContact O-N 3.11Å; I443-L446 PolarHBondContact O-N 3.04Å; I443-L446 VanDerWaalsContact O-N 3.11Å; I443-V447 HydrophobicContact CG2-CG2 4.31Å; I443-V447 VanDerWaalsContact O-CG2 3.29Å; I443-V447 WeakPolarHBondContact O-CG2 3.45Å; I443-V447 PolarHBondContact O-N 3.12Å; I443-F457 HydrophobicContact CG2-CD2 4.16Å; I443-F457 HydrophobicContact CG2-CE2 3.65Å; I443-F457 HydrophobicContact CG2-CZ 3.93Å; I443-I466 HydrophobicContact CD1-CD1 4.02Å; I443-I466 HydrophobicContact CG2-CD1 4.36Å
444	F	93.5	Very high	87.1	Confident	4 Å²	4	32 Å²	32	2%	0.018	16%	0.164	C	C	.	.	H	α-helix	trans	-62.8	-32.7	176.5	-68.5	-13.6	0	0	0	112	V440 V447 R448 F457 L463 I486 F489 M524	V440-F444 HydrophobicContact CG1-CD2 3.55Å; V440-F444 HydrophobicContact CG1-CE1 4.36Å; V440-F444 HydrophobicContact CG1-CE2 3.21Å; V440-F444 HydrophobicContact CG1-CG 4.27Å; V440-F444 HydrophobicContact CG1-CZ 3.68Å; V440-F444 WeakPolarHBondContact O-CB 3.43Å; V440-F444 VanDerWaalsContact O-CG 3.31Å; V440-F444 WeakPolarHBondContact O-CG 3.32Å; V440-F444 PolarHBondContact O-N 3.08Å; F444-V447 PolarHBondContact O-N 3.02Å; F444-R448 WeakPolarHBondContact O-CB 3.47Å; F444-R448 WeakPolarHBondContact O-CD 3.27Å; F444-R448 WeakPolarHBondContact O-CG 3.44Å; F444-R448 PolarHBondContact O-N 3.27Å; F444-F457 HydrophobicContact CE1-CE1 4.47Å; F444-F457 HydrophobicContact CE1-CZ 4.4Å; F444-L463 HydrophobicContact CE1-CD2 3.85Å; F444-L463 HydrophobicContact CZ-CD2 4.17Å; F444-I486 HydrophobicContact CE2-CG1 4.33Å; F444-F489 HydrophobicContact CB-CB 4.43Å; F444-F489 HydrophobicContact CB-CD1 4.44Å; F444-F489 HydrophobicContact CB-CD2 3.64Å; F444-F489 HydrophobicContact CB-CE2 3.96Å; F444-F489 HydrophobicContact CB-CG 3.97Å; F444-F489 HydrophobicContact CB-CZ 4.41Å; F444-F489 AromaticContact CD1-CD1 3.69Å; F444-F489 HydrophobicContact CD1-CD1 3.69Å; F444-F489 HydrophobicContact CD1-CD2 4.24Å; F444-F489 AromaticContact CD1-CE1 3.71Å; F444-F489 HydrophobicContact CD1-CE1 3.71Å; F444-F489 HydrophobicContact CD1-CE2 4.26Å; F444-F489 AromaticContact CD1-CG 3.85Å; F444-F489 HydrophobicContact CD1-CG 3.97Å; F444-F489 AromaticContact CD1-CZ 3.97Å; F444-F489 HydrophobicContact CD1-CZ 4.01Å; F444-F489 HydrophobicContact CD2-CB 3.41Å; F444-F489 VanDerWaalsContact CD2-CB 3.42Å; F444-F489 AromaticContact CD2-CD1 3.84Å; F444-F489 HydrophobicContact CD2-CD1 3.84Å; F444-F489 HydrophobicContact CD2-CD2 4.11Å; F444-F489 AromaticContact CD2-CG 3.52Å; F444-F489 HydrophobicContact CD2-CG 3.52Å; F444-F489 AromaticContact CE1-CD1 3.67Å; F444-F489 HydrophobicContact CE1-CD1 3.67Å; F444-F489 AromaticContact CE1-CE1 3.79Å; F444-F489 HydrophobicContact CE1-CE1 3.79Å; F444-F489 HydrophobicContact CE1-CG 4.31Å; F444-F489 HydrophobicContact CE1-CZ 4.4Å; F444-F489 HydrophobicContact CE2-CB 3.68Å; F444-F489 AromaticContact CE2-CD1 3.81Å; F444-F489 HydrophobicContact CE2-CD1 3.81Å; F444-F489 AromaticContact CE2-CG 3.89Å; F444-F489 HydrophobicContact CE2-CG 3.89Å; F444-F489 HydrophobicContact CG-CB 3.97Å; F444-F489 AromaticContact CG-CD1 3.78Å; F444-F489 HydrophobicContact CG-CD1 3.78Å; F444-F489 AromaticContact CG-CD2 3.76Å; F444-F489 HydrophobicContact CG-CD2 3.76Å; F444-F489 HydrophobicContact CG-CE1 4.17Å; F444-F489 HydrophobicContact CG-CE2 4.15Å; F444-F489 AromaticContact CG-CG 3.56Å; F444-F489 HydrophobicContact CG-CG 3.56Å; F444-F489 HydrophobicContact CG-CZ 4.35Å; F444-F489 HydrophobicContact CZ-CB 4.27Å; F444-F489 AromaticContact CZ-CD1 3.73Å; F444-F489 HydrophobicContact CZ-CD1 3.73Å; F444-F489 HydrophobicContact CZ-CE1 4.3Å; F444-F489 HydrophobicContact CZ-CG 4.27Å; F444-M524 HydrophobicContact CE1-SD 4.39Å; F444-M524 HydrophobicContact CE2-CE 4.44Å; F444-M524 HydrophobicContact CZ-CE 4.08Å; F444-M524 HydrophobicContact CZ-SD 3.98Å
445	G	88	Confident	87.8	Confident	21 Å²	21	31.8 Å²	31.8	22%	0.216	17%	0.168	C	C	.	.	H	α-helix	trans	-59.7	-51.4	167.8	0	0	0	0	0	112.7	R441 F442 I443 V447 R448 M449	R441-G445 PolarHBondContact O-N 3.17Å; F442-G445 WeakPolarHBondContact O-CA 3.3Å; F442-G445 PolarHBondContact O-N 3.28Å; F442-G445 VanDerWaalsContact O-N 3.15Å; I443-G445 PolarHBondContact O-N 3.11Å; G445-V447 VanDerWaalsContact C-N 3.3Å; G445-V447 PolarHBondContact O-N 3.42Å; G445-R448 WeakPolarHBondContact O-CB 3.25Å; G445-R448 PolarHBondContact O-N 3.31Å; G445-R448 VanDerWaalsContact O-N 3.14Å; G445-M449 WeakPolarHBondContact O-CB 3.49Å; G445-M449 VanDerWaalsContact O-CG 3.23Å; G445-M449 WeakPolarHBondContact O-CG 3.47Å; G445-M449 PolarHBondContact O-N 3.33Å
446	L	88.9	Confident	88.1	Confident	7 Å²	7	32.7 Å²	32.7	4%	0.037	17%	0.172	C	C	.	.	H	α-helix	trans	-61.5	-39.5	177.5	-69	178.1	0	0	0	112.7	V379 F383 M389 L392 F442 I443 R448 M449 S450 L453	V379-L446 HydrophobicContact CG1-CD2 4.02Å; F383-L446 HydrophobicContact CD2-CD1 4.38Å; F383-L446 HydrophobicContact CG-CD1 4.47Å; M389-L446 HydrophobicContact CE-CB 3.4Å; M389-L446 VanDerWaalsContact CE-CB 3.4Å; M389-L446 HydrophobicContact CE-CD1 4.2Å; M389-L446 HydrophobicContact CE-CG 4.48Å; M389-L446 HydrophobicContact SD-CB 4.31Å; M389-L446 HydrophobicContact SD-CD1 4.02Å; L392-L446 HydrophobicContact CD1-CD1 3.71Å; F442-L446 HydrophobicContact CD1-CD1 4.22Å; F442-L446 HydrophobicContact CD2-CG 4.46Å; F442-L446 HydrophobicContact CE1-CD1 3.65Å; F442-L446 HydrophobicContact CE1-CG 4.34Å; F442-L446 HydrophobicContact CE2-CD1 4.17Å; F442-L446 HydrophobicContact CE2-CD2 4.04Å; F442-L446 HydrophobicContact CE2-CG 4.23Å; F442-L446 HydrophobicContact CZ-CD1 3.73Å; F442-L446 HydrophobicContact CZ-CD2 4.23Å; F442-L446 HydrophobicContact CZ-CG 4.07Å; F442-L446 PolarHBondContact O-N 3.43Å; I443-L446 PolarHBondContact O-N 3.04Å; I443-L446 VanDerWaalsContact O-N 3.11Å; L446-R448 VanDerWaalsContact C-N 3.34Å; L446-M449 PolarHBondContact O-N 3.17Å; L446-S450 PolarHBondContact O-N 2.95Å; L446-L453 HydrophobicContact CB-CD1 4.13Å; L446-L453 HydrophobicContact CD2-CD1 4.24Å
447	V	89.9	Confident	88.4	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-67.3	-34.5	176.9	174	0	0	0	0	111.9	M389 I443 F444 G445 M449 R454 F457 F489 L520	M389-V447 HydrophobicContact CE-CG2 3.55Å; I443-V447 HydrophobicContact CG2-CG2 4.31Å; I443-V447 VanDerWaalsContact O-CG2 3.29Å; I443-V447 WeakPolarHBondContact O-CG2 3.45Å; I443-V447 PolarHBondContact O-N 3.12Å; F444-V447 PolarHBondContact O-N 3.02Å; G445-V447 VanDerWaalsContact C-N 3.3Å; G445-V447 PolarHBondContact O-N 3.42Å; V447-M449 VanDerWaalsContact C-N 3.33Å; V447-R454 HydrophobicContact CG1-CB 4.01Å; V447-R454 HydrophobicContact CG1-CG 3.83Å; V447-R454 PolarHBondContact O-NE 3.13Å; V447-R454 PolarHBondContact O-NH2 2.78Å; V447-F457 HydrophobicContact CG1-CD1 4.34Å; V447-F457 HydrophobicContact CG2-CB 3.97Å; V447-F457 HydrophobicContact CG2-CD1 3.65Å; V447-F457 HydrophobicContact CG2-CD2 4.45Å; V447-F457 HydrophobicContact CG2-CE1 4.19Å; V447-F457 HydrophobicContact CG2-CG 3.79Å; V447-F489 HydrophobicContact CB-CZ 4.34Å; V447-F489 HydrophobicContact CG1-CE2 4.3Å; V447-F489 HydrophobicContact CG1-CZ 3.78Å; V447-L520 HydrophobicContact CG1-CD1 4.29Å; V447-L520 HydrophobicContact CG1-CD2 4.07Å
448	R	88.4	Confident	88.5	Confident	85.5 Å²	85.5	33.5 Å²	33.5	32%	0.323	18%	0.177	S	C	.	.	H	α-helix	trans	-65.3	-45.6	170.5	-129.2	166	-179.6	157.6	-5	110.8	E316 F444 G445 L446 R454 N488 F489 Y492	E316-R448 IonicContact OE1-NH2 2.61Å; E316-R448 PolarHBondContact OE1-NH2 3.18Å; E316-R448 IonicContact OE2-NH2 2.72Å; F444-R448 WeakPolarHBondContact O-CB 3.47Å; F444-R448 WeakPolarHBondContact O-CD 3.27Å; F444-R448 WeakPolarHBondContact O-CG 3.44Å; F444-R448 PolarHBondContact O-N 3.27Å; G445-R448 WeakPolarHBondContact O-CB 3.25Å; G445-R448 PolarHBondContact O-N 3.31Å; G445-R448 VanDerWaalsContact O-N 3.14Å; L446-R448 VanDerWaalsContact C-N 3.34Å; R448-R454 PolarHBondContact O-NH2 2.98Å; R448-N488 PolarHBondContact NH2-O 3.27Å; R448-F489 HydrophobicContact CG-CE2 4.37Å; R448-Y492 HydrophobicContact CB-CE1 4.26Å; R448-Y492 HydrophobicContact CG-CD1 3.99Å; R448-Y492 HydrophobicContact CG-CE1 3.84Å; R448-Y492 HydrophobicContact CG-CE2 4.1Å; R448-Y492 HydrophobicContact CG-CG 4.46Å; R448-Y492 VanDerWaalsContact NE-CE2 3.32Å
449	M	82.4	Confident	88.7	Confident	115.5 Å²	115.5	35.2 Å²	35.2	57%	0.569	20%	0.198	S	C	*	.	H	α-helix	trans	-77.6	-30.9	-170.3	-119.7	128.2	72	0	0	115.9	P119 G445 L446 V447	P119-M449 HydrophobicContact CB-CE 3.06Å; P119-M449 HydrophobicContact CB-SD 3.07Å; P119-M449 WeakPolarHBondContact CB-SD 3.44Å; P119-M449 HydrophobicContact CG-CE 4.06Å; P119-M449 HydrophobicContact CG-SD 3.44Å; P119-M449 WeakPolarHBondContact CG-SD 3.25Å; G445-M449 WeakPolarHBondContact O-CB 3.49Å; G445-M449 VanDerWaalsContact O-CG 3.23Å; G445-M449 WeakPolarHBondContact O-CG 3.47Å; G445-M449 PolarHBondContact O-N 3.33Å; L446-M449 PolarHBondContact O-N 3.17Å; V447-M449 VanDerWaalsContact C-N 3.33Å
450	S	83.4	Confident	88.7	Confident	12 Å²	12	36.2 Å²	36.2	8%	0.084	21%	0.205	C	C	.	.			trans	-129.5	123.7	-174.6	173.2	0	0	0	0	112.3	L446 T452 L453 R454	L446-S450 PolarHBondContact O-N 2.95Å; S450-T452 VanDerWaalsContact C-N 3.28Å; S450-T452 PolarHBondContact O-N 3.02Å; S450-T452 PolarHBondContact OG-N 3.1Å; S450-L453 PolarHBondContact O-N 3.22Å; S450-L453 PolarHBondContact OG-N 3.4Å; S450-L453 VanDerWaalsContact OG-N 3.14Å; S450-R454 VanDerWaalsContact O-CB 3.28Å; S450-R454 WeakPolarHBondContact O-CB 3.28Å; S450-R454 PolarHBondContact O-N 2.97Å
451	S	82.6	Confident	88.6	Confident	53 Å²	53	41.3 Å²	41.3	37%	0.371	23%	0.227	S	C	.	.	H	α-helix	trans	-61.7	-39.4	172.2	124.1	0	0	0	0	111.9	R454 S455	S451-R454 WeakPolarHBondContact O-CB 3.36Å; S451-R454 PolarHBondContact O-N 3.37Å; S451-R454 PolarHBondContact OG-NH1 2.94Å; S451-S455 WeakPolarHBondContact O-CB 3.26Å; S451-S455 PolarHBondContact O-N 3.16Å; S451-S455 PolarHBondContact O-OG 2.9Å; S451-S455 VanDerWaalsContact O-OG 3.11Å
452	T	84.7	Confident	88.6	Confident	79 Å²	79	38.1 Å²	38.1	49%	0.485	22%	0.215	S	C	.	.	H	α-helix	trans	-63.2	-47.2	177.9	-43.5	0	0	0	0	111.7	I384 S450 R454 S455 Q456	I384-T452 HydrophobicContact CD1-CG2 4.07Å; I384-T452 HydrophobicContact CG1-CG2 4.5Å; S450-T452 VanDerWaalsContact C-N 3.28Å; S450-T452 PolarHBondContact O-N 3.02Å; S450-T452 PolarHBondContact OG-N 3.1Å; T452-R454 VanDerWaalsContact C-N 3.34Å; T452-S455 PolarHBondContact O-N 3.45Å; T452-Q456 WeakPolarHBondContact O-CB 3.14Å; T452-Q456 WeakPolarHBondContact O-CG 3.2Å; T452-Q456 PolarHBondContact O-N 3.4Å
453	L	87.4	Confident	88.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-68.8	-33.6	177.5	-69.3	176.5	0	0	0	112.2	F383 I384 M389 L446 S450 Q456 F457	F383-L453 HydrophobicContact CB-CD1 4.43Å; I384-L453 HydrophobicContact CD1-CD2 4.49Å; I384-L453 HydrophobicContact CD1-CG 4.24Å; I384-L453 HydrophobicContact CG1-CD2 3.59Å; I384-L453 HydrophobicContact CG1-CG 3.84Å; M389-L453 HydrophobicContact CE-CB 3.59Å; M389-L453 HydrophobicContact CE-CD1 4.24Å; M389-L453 HydrophobicContact CE-CG 4.41Å; M389-L453 HydrophobicContact CG-CB 3.99Å; M389-L453 HydrophobicContact CG-CD2 3.94Å; M389-L453 WeakPolarHBondContact CG-O 3.45Å; M389-L453 HydrophobicContact SD-CB 4.16Å; M389-L453 HydrophobicContact SD-CD1 4.41Å; M389-L453 HydrophobicContact SD-CD2 4.24Å; L446-L453 HydrophobicContact CB-CD1 4.13Å; L446-L453 HydrophobicContact CD2-CD1 4.24Å; S450-L453 PolarHBondContact O-N 3.22Å; S450-L453 PolarHBondContact OG-N 3.4Å; S450-L453 VanDerWaalsContact OG-N 3.14Å; L453-Q456 PolarHBondContact O-N 3.17Å; L453-F457 VanDerWaalsContact O-CB 3.28Å; L453-F457 WeakPolarHBondContact O-CB 3.35Å; L453-F457 PolarHBondContact O-N 2.89Å
454	R	91.5	Very high	88.9	Confident	18 Å²	18	38.9 Å²	38.9	7%	0.068	22%	0.221	C	C	.	.	H	α-helix	trans	-61.4	-48.4	171.8	-179.1	-177	-37.1	126.7	4.7	111.8	V447 R448 S450 S451 T452 Q456 F457 V458 I516 Y517 L520	V447-R454 HydrophobicContact CG1-CB 4.01Å; V447-R454 HydrophobicContact CG1-CG 3.83Å; V447-R454 PolarHBondContact O-NE 3.13Å; V447-R454 PolarHBondContact O-NH2 2.78Å; R448-R454 PolarHBondContact O-NH2 2.98Å; S450-R454 VanDerWaalsContact O-CB 3.28Å; S450-R454 WeakPolarHBondContact O-CB 3.28Å; S450-R454 PolarHBondContact O-N 2.97Å; S451-R454 WeakPolarHBondContact O-CB 3.36Å; S451-R454 PolarHBondContact O-N 3.37Å; S451-R454 PolarHBondContact OG-NH1 2.94Å; T452-R454 VanDerWaalsContact C-N 3.34Å; R454-Q456 VanDerWaalsContact C-N 3.32Å; R454-Q456 PolarHBondContact O-N 3.39Å; R454-F457 WeakPolarHBondContact O-CB 3.3Å; R454-F457 PolarHBondContact O-N 2.86Å; R454-V458 WeakPolarHBondContact O-CG2 3.22Å; R454-V458 PolarHBondContact O-N 3.31Å; R454-I516 HydrophobicContact CG-CG2 3.8Å; R454-Y517 VanDerWaalsContact CZ-OH 3.23Å; R454-Y517 PolarHBondContact NH1-OH 3.07Å; R454-L520 HydrophobicContact CG-CD1 3.91Å
455	S	87.2	Confident	88.8	Confident	50 Å²	50	42 Å²	42	35%	0.35	24%	0.237	S	C	.	.	H	α-helix	trans	-62.3	-40.8	175.6	-64	0	0	0	0	111.7	S451 T452 V458 A459	S451-S455 WeakPolarHBondContact O-CB 3.26Å; S451-S455 PolarHBondContact O-N 3.16Å; S451-S455 PolarHBondContact O-OG 2.9Å; S451-S455 VanDerWaalsContact O-OG 3.11Å; T452-S455 PolarHBondContact O-N 3.45Å; S455-V458 PolarHBondContact O-N 3.25Å; S455-A459 VanDerWaalsContact O-CB 3.23Å; S455-A459 WeakPolarHBondContact O-CB 3.27Å; S455-A459 PolarHBondContact O-N 3.22Å
456	Q	89.2	Confident	89	Confident	56.5 Å²	56.5	41.1 Å²	41.1	26%	0.264	23%	0.227	S	C	.	.	H	α-helix	trans	-63.7	-42	174	-119.8	-174.7	2.7	0	0	112.1	T452 L453 R454 V458 A459 T460	T452-Q456 WeakPolarHBondContact O-CB 3.14Å; T452-Q456 WeakPolarHBondContact O-CG 3.2Å; T452-Q456 PolarHBondContact O-N 3.4Å; L453-Q456 PolarHBondContact O-N 3.17Å; R454-Q456 VanDerWaalsContact C-N 3.32Å; R454-Q456 PolarHBondContact O-N 3.39Å; Q456-V458 VanDerWaalsContact C-N 3.34Å; Q456-V458 PolarHBondContact O-N 2.97Å; Q456-A459 PolarHBondContact O-N 3.15Å; Q456-T460 HydrophobicContact CG-CG2 4.25Å; Q456-T460 WeakPolarHBondContact O-CB 3.32Å; Q456-T460 VanDerWaalsContact O-CG2 3.31Å; Q456-T460 WeakPolarHBondContact O-CG2 3.23Å; Q456-T460 PolarHBondContact O-N 3.45Å; Q456-T460 PolarHBondContact O-OG1 3.07Å
457	F	92.9	Very high	89.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.1	-42.5	178.7	-174.9	-117.9	0	0	0	111.8	M389 Y393 I443 F444 V447 L453 R454 T460 K461 G462 L463 I466 L520	M389-F457 HydrophobicContact CG-CB 4.23Å; Y393-F457 HydrophobicContact CE1-CD2 4.2Å; Y393-F457 HydrophobicContact CE1-CE2 4.24Å; Y393-F457 WeakPolarHBondContact OH-CD2 3.29Å; I443-F457 HydrophobicContact CG2-CD2 4.16Å; I443-F457 HydrophobicContact CG2-CE2 3.65Å; I443-F457 HydrophobicContact CG2-CZ 3.93Å; F444-F457 HydrophobicContact CE1-CE1 4.47Å; F444-F457 HydrophobicContact CE1-CZ 4.4Å; V447-F457 HydrophobicContact CG1-CD1 4.34Å; V447-F457 HydrophobicContact CG2-CB 3.97Å; V447-F457 HydrophobicContact CG2-CD1 3.65Å; V447-F457 HydrophobicContact CG2-CD2 4.45Å; V447-F457 HydrophobicContact CG2-CE1 4.19Å; V447-F457 HydrophobicContact CG2-CG 3.79Å; L453-F457 VanDerWaalsContact O-CB 3.28Å; L453-F457 WeakPolarHBondContact O-CB 3.35Å; L453-F457 PolarHBondContact O-N 2.89Å; R454-F457 WeakPolarHBondContact O-CB 3.3Å; R454-F457 PolarHBondContact O-N 2.86Å; F457-T460 PolarHBondContact O-OG1 3.19Å; F457-K461 PolarHBondContact O-N 3.36Å; F457-G462 PolarHBondContact O-N 3.05Å; F457-L463 HydrophobicContact CE1-CB 4.43Å; F457-L463 HydrophobicContact CE1-CD1 4.04Å; F457-L463 HydrophobicContact CE1-CD2 3.8Å; F457-L463 HydrophobicContact CE1-CG 3.67Å; F457-L463 VanDerWaalsContact CE1-CG 3.49Å; F457-L463 HydrophobicContact CZ-CB 4.33Å; F457-L463 HydrophobicContact CZ-CD1 4.38Å; F457-L463 HydrophobicContact CZ-CD2 3.67Å; F457-L463 HydrophobicContact CZ-CG 3.7Å; F457-I466 HydrophobicContact CE2-CD1 3.88Å; F457-I466 HydrophobicContact CZ-CD1 3.95Å; F457-L520 HydrophobicContact CD1-CD1 3.81Å; F457-L520 HydrophobicContact CD1-CD2 3.84Å; F457-L520 HydrophobicContact CE1-CD1 3.89Å; F457-L520 HydrophobicContact CE1-CD2 4.06Å
458	V	90.6	Very high	89.2	Confident	21 Å²	21	44.7 Å²	44.7	13%	0.127	25%	0.247	C	C	.	.	H	α-helix	trans	-67.6	-48.3	174.5	172.3	0	0	0	0	111.5	R454 S455 Q456 T460 K461 I516 I519 L520	R454-V458 WeakPolarHBondContact O-CG2 3.22Å; R454-V458 PolarHBondContact O-N 3.31Å; S455-V458 PolarHBondContact O-N 3.25Å; Q456-V458 VanDerWaalsContact C-N 3.34Å; Q456-V458 PolarHBondContact O-N 2.97Å; V458-T460 VanDerWaalsContact C-N 3.28Å; V458-T460 PolarHBondContact O-N 3.37Å; V458-K461 PolarHBondContact O-N 2.91Å; V458-K461 VanDerWaalsContact O-N 3.1Å; V458-I516 HydrophobicContact CG2-CG2 4.08Å; V458-I519 HydrophobicContact CG1-CB 4.32Å; V458-I519 HydrophobicContact CG1-CG2 3.59Å; V458-L520 HydrophobicContact CG2-CB 4.41Å; V458-L520 HydrophobicContact CG2-CD1 3.96Å; V458-L520 HydrophobicContact CG2-CD2 3.5Å; V458-L520 HydrophobicContact CG2-CG 3.56Å
459	A	89.4	Confident	89.3	Confident	83.5 Å²	83.5	41.2 Å²	41.2	69%	0.69	24%	0.236	S	C	*	.	H	α-helix	trans	-62.7	-35	-177.9	0	0	0	0	0	112.8	S455 Q456 K461	S455-A459 VanDerWaalsContact O-CB 3.23Å; S455-A459 WeakPolarHBondContact O-CB 3.27Å; S455-A459 PolarHBondContact O-N 3.22Å; Q456-A459 PolarHBondContact O-N 3.15Å; A459-K461 VanDerWaalsContact C-N 3.3Å
460	T	89.6	Confident	89.7	Confident	34 Å²	34	35.7 Å²	35.7	21%	0.209	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	0.8	177.7	55.5	0	0	0	0	113.5	Q390 Y393 Q456 F457 V458 G462	Q390-T460 HydrophobicContact CG-CG2 3.88Å; Y393-T460 PolarHBondContact OH-OG1 3.33Å; Q456-T460 HydrophobicContact CG-CG2 4.25Å; Q456-T460 WeakPolarHBondContact O-CB 3.32Å; Q456-T460 VanDerWaalsContact O-CG2 3.31Å; Q456-T460 WeakPolarHBondContact O-CG2 3.23Å; Q456-T460 PolarHBondContact O-N 3.45Å; Q456-T460 PolarHBondContact O-OG1 3.07Å; F457-T460 PolarHBondContact O-OG1 3.19Å; V458-T460 VanDerWaalsContact C-N 3.28Å; V458-T460 PolarHBondContact O-N 3.37Å; T460-G462 PolarHBondContact O-N 3.27Å
461	K	89.9	Confident	89.9	Confident	108 Å²	108	36.1 Å²	36.1	47%	0.47	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	43.3	-171.4	-57.1	-177.1	-179.3	-179.9	0	112	F457 V458 A459 L463 L464 I465	F457-K461 PolarHBondContact O-N 3.36Å; V458-K461 PolarHBondContact O-N 2.91Å; V458-K461 VanDerWaalsContact O-N 3.1Å; A459-K461 VanDerWaalsContact C-N 3.3Å; K461-L463 PolarHBondContact O-N 3.02Å; K461-L463 VanDerWaalsContact O-N 3.12Å; K461-L464 HydrophobicContact CB-CB 4.13Å; K461-L464 HydrophobicContact CD-CD2 4.3Å; K461-L464 VanDerWaalsContact O-CB 3.3Å; K461-L464 WeakPolarHBondContact O-CB 3.3Å; K461-L464 PolarHBondContact O-N 3.16Å; K461-I465 PolarHBondContact O-N 3Å
462	G	91	Very high	90.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-54.2	-33.9	-175.9	0	0	0	0	0	113.4	Y393 F457 T460 L464 I465 I466	Y393-G462 VanDerWaalsContact OH-CA 3.31Å; Y393-G462 WeakPolarHBondContact OH-CA 3.45Å; F457-G462 PolarHBondContact O-N 3.05Å; T460-G462 PolarHBondContact O-N 3.27Å; G462-L464 VanDerWaalsContact C-N 3.32Å; G462-L464 PolarHBondContact O-N 3.04Å; G462-I465 PolarHBondContact O-N 2.96Å; G462-I466 WeakPolarHBondContact O-CG1 3.42Å; G462-I466 PolarHBondContact O-N 3.07Å
463	L	93	Very high	90.2	Very high	0.5 Å²	0.5	37.1 Å²	37.1	0%	0.003	20%	0.204	C	C	.	.	H	α-helix	trans	-59.4	-38.6	173.3	-93.2	167	0	0	0	114	F444 F457 K461 I465 I466 A467 L520 Q523 M524 Y527 L528	F444-L463 HydrophobicContact CE1-CD2 3.85Å; F444-L463 HydrophobicContact CZ-CD2 4.17Å; F457-L463 HydrophobicContact CE1-CB 4.43Å; F457-L463 HydrophobicContact CE1-CD1 4.04Å; F457-L463 HydrophobicContact CE1-CD2 3.8Å; F457-L463 HydrophobicContact CE1-CG 3.67Å; F457-L463 VanDerWaalsContact CE1-CG 3.49Å; F457-L463 HydrophobicContact CZ-CB 4.33Å; F457-L463 HydrophobicContact CZ-CD1 4.38Å; F457-L463 HydrophobicContact CZ-CD2 3.67Å; F457-L463 HydrophobicContact CZ-CG 3.7Å; K461-L463 PolarHBondContact O-N 3.02Å; K461-L463 VanDerWaalsContact O-N 3.12Å; L463-I465 VanDerWaalsContact C-N 3.32Å; L463-I466 PolarHBondContact O-N 3.44Å; L463-A467 VanDerWaalsContact O-CB 3.29Å; L463-A467 WeakPolarHBondContact O-CB 3.4Å; L463-A467 PolarHBondContact O-N 3.38Å; L463-L520 HydrophobicContact CD1-CD1 3.51Å; L463-L520 HydrophobicContact CD1-CD2 3.97Å; L463-L520 HydrophobicContact CD1-CG 4.17Å; L463-L520 HydrophobicContact CG-CD1 4.33Å; L463-Q523 HydrophobicContact CB-CB 4.37Å; L463-Q523 HydrophobicContact CD1-CB 3.76Å; L463-M524 HydrophobicContact CD1-CG 3.77Å; L463-M524 HydrophobicContact CD1-SD 3.64Å; L463-M524 VanDerWaalsContact CD1-SD 3.56Å; L463-M524 HydrophobicContact CD2-CG 4.44Å; L463-M524 HydrophobicContact CD2-SD 3.43Å; L463-M524 VanDerWaalsContact CD2-SD 3.53Å; L463-M524 WeakPolarHBondContact CD2-SD 3Å; L463-M524 HydrophobicContact CG-SD 4.13Å; L463-Y527 HydrophobicContact CB-CD2 4.26Å; L463-L528 HydrophobicContact CD2-CD1 3.7Å; L463-L528 VanDerWaalsContact CD2-CD1 3.44Å; L463-L528 HydrophobicContact CD2-CG 3.94Å
464	L	92.9	Very high	90	Very high	68 Å²	68	41.2 Å²	41.2	36%	0.356	23%	0.226	S	C	.	.	H	α-helix	trans	-67.6	-38.5	175.9	177.1	61	0	0	0	111.1	K461 G462 A467 N468 Y527	K461-L464 HydrophobicContact CB-CB 4.13Å; K461-L464 HydrophobicContact CD-CD2 4.3Å; K461-L464 VanDerWaalsContact O-CB 3.3Å; K461-L464 WeakPolarHBondContact O-CB 3.3Å; K461-L464 PolarHBondContact O-N 3.16Å; G462-L464 VanDerWaalsContact C-N 3.32Å; G462-L464 PolarHBondContact O-N 3.04Å; L464-A467 PolarHBondContact O-N 3.27Å; L464-N468 WeakPolarHBondContact O-CB 3.47Å; L464-N468 PolarHBondContact O-N 2.83Å; L464-Y527 HydrophobicContact CB-CD2 3.85Å; L464-Y527 HydrophobicContact CB-CE2 3.8Å; L464-Y527 HydrophobicContact CB-CG 4.26Å; L464-Y527 HydrophobicContact CD1-CD1 3.78Å; L464-Y527 HydrophobicContact CD1-CE1 3.89Å; L464-Y527 HydrophobicContact CD1-CG 4.11Å
465	I	91.8	Very high	89.5	Confident	67.5 Å²	67.5	46.7 Å²	46.7	35%	0.346	25%	0.254	S	S	.	.	H	α-helix	trans	-67.1	-43.5	178.9	-57.6	170.2	0	0	0	110.1	Y393 K461 G462 L463 N468 A469	Y393-I465 HydrophobicContact CD2-CD1 3.41Å; Y393-I465 VanDerWaalsContact CD2-CD1 3.41Å; Y393-I465 HydrophobicContact CE2-CD1 3.69Å; Y393-I465 HydrophobicContact CG-CD1 3.94Å; Y393-I465 HydrophobicContact CG-CG2 4.41Å; K461-I465 PolarHBondContact O-N 3Å; G462-I465 PolarHBondContact O-N 2.96Å; L463-I465 VanDerWaalsContact C-N 3.32Å; I465-N468 PolarHBondContact O-N 2.89Å; I465-A469 VanDerWaalsContact O-CB 3.31Å; I465-A469 WeakPolarHBondContact O-CB 3.43Å; I465-A469 PolarHBondContact O-N 3.36Å
466	I	92.2	Very high	89.2	Confident	2.5 Å²	2.5	49.8 Å²	49.8	1%	0.013	26%	0.262	C	S	.	.	H	α-helix	trans	-60.6	-48.9	173.8	-66.8	168.8	0	0	0	110.3	F396 V440 I443 F457 G462 L463 N468 A469 L470	F396-I466 HydrophobicContact CD1-CG1 4.26Å; F396-I466 HydrophobicContact CD1-CG2 4.24Å; F396-I466 HydrophobicContact CD2-CG1 4.32Å; F396-I466 HydrophobicContact CE1-CB 4.33Å; F396-I466 HydrophobicContact CE1-CD1 4.49Å; F396-I466 HydrophobicContact CE1-CG1 3.9Å; F396-I466 HydrophobicContact CE1-CG2 3.81Å; F396-I466 HydrophobicContact CE2-CD1 4.38Å; F396-I466 HydrophobicContact CE2-CG1 3.95Å; F396-I466 HydrophobicContact CG-CG1 4.48Å; F396-I466 HydrophobicContact CZ-CD1 4.02Å; F396-I466 HydrophobicContact CZ-CG1 3.74Å; F396-I466 HydrophobicContact CZ-CG2 4.38Å; V440-I466 HydrophobicContact CG2-CG2 4.2Å; I443-I466 HydrophobicContact CD1-CD1 4.02Å; I443-I466 HydrophobicContact CG2-CD1 4.36Å; F457-I466 HydrophobicContact CE2-CD1 3.88Å; F457-I466 HydrophobicContact CZ-CD1 3.95Å; G462-I466 WeakPolarHBondContact O-CG1 3.42Å; G462-I466 PolarHBondContact O-N 3.07Å; L463-I466 PolarHBondContact O-N 3.44Å; I466-N468 PolarHBondContact O-N 3.2Å; I466-A469 PolarHBondContact O-N 3.05Å; I466-L470 HydrophobicContact CG2-CD1 3.87Å; I466-L470 HydrophobicContact CG2-CG 4.34Å; I466-L470 WeakPolarHBondContact O-CB 3.49Å; I466-L470 VanDerWaalsContact O-CG 3.3Å; I466-L470 WeakPolarHBondContact O-CG 3.36Å; I466-L470 PolarHBondContact O-N 3.26Å
467	A	92	Very high	89	Confident	2.5 Å²	2.5	48 Å²	48	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-59.5	-45.8	178.9	0	0	0	0	0	112.6	L463 L464 A469 L470 N471 Y527 L528	L463-A467 VanDerWaalsContact O-CB 3.29Å; L463-A467 WeakPolarHBondContact O-CB 3.4Å; L463-A467 PolarHBondContact O-N 3.38Å; L464-A467 PolarHBondContact O-N 3.27Å; A467-A469 PolarHBondContact O-N 3.49Å; A467-L470 PolarHBondContact O-N 3.32Å; A467-N471 WeakPolarHBondContact O-CB 3.36Å; A467-N471 PolarHBondContact O-N 3.17Å; A467-N471 PolarHBondContact O-OD1 3.21Å; A467-Y527 VanDerWaalsContact CB-O 3.29Å; A467-Y527 WeakPolarHBondContact CB-O 3.36Å; A467-L528 HydrophobicContact CB-CD2 3.75Å; A467-L528 HydrophobicContact CB-CG 4.35Å
468	N	91.2	Very high	88.7	Confident	81.5 Å²	81.5	48.3 Å²	48.3	44%	0.436	26%	0.255	S	S	.	.	H	α-helix	trans	-63.9	-41.6	177.5	-179.8	80.9	0	0	0	112	L464 I465 I466 L470 N471 Q472	L464-N468 WeakPolarHBondContact O-CB 3.47Å; L464-N468 PolarHBondContact O-N 2.83Å; I465-N468 PolarHBondContact O-N 2.89Å; I466-N468 PolarHBondContact O-N 3.2Å; N468-L470 VanDerWaalsContact C-N 3.34Å; N468-N471 WeakPolarHBondContact O-CB 3.5Å; N468-N471 PolarHBondContact O-N 3.13Å; N468-Q472 PolarHBondContact ND2-NE2 3.01Å; N468-Q472 VanDerWaalsContact ND2-NE2 3.18Å; N468-Q472 WeakPolarHBondContact O-CG 3.36Å; N468-Q472 PolarHBondContact O-N 2.74Å; N468-Q472 VanDerWaalsContact O-N 3.11Å
469	A	89.7	Confident	88.6	Confident	11.5 Å²	11.5	48.6 Å²	48.6	10%	0.095	26%	0.257	C	S	.	.	H	α-helix	trans	-67.5	-38	178	0	0	0	0	0	112.3	F396 I465 I466 A467 N471 Q472 S473	F396-A469 HydrophobicContact CB-CB 3.48Å; F396-A469 VanDerWaalsContact CB-CB 3.48Å; F396-A469 HydrophobicContact CG-CB 4.39Å; I465-A469 VanDerWaalsContact O-CB 3.31Å; I465-A469 WeakPolarHBondContact O-CB 3.43Å; I465-A469 PolarHBondContact O-N 3.36Å; I466-A469 PolarHBondContact O-N 3.05Å; A467-A469 PolarHBondContact O-N 3.49Å; A469-N471 VanDerWaalsContact C-N 3.27Å; A469-N471 PolarHBondContact O-N 3.02Å; A469-Q472 PolarHBondContact O-N 3.44Å; A469-S473 WeakPolarHBondContact O-CB 3.38Å; A469-S473 PolarHBondContact O-N 3.34Å
470	L	90.6	Very high	88.6	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-65.1	-38.9	172.1	-68.5	172.2	0	0	0	111.7	L399 P436 I466 A467 N468 Q472 S473 L482 L528 L534	L399-L470 HydrophobicContact CD1-CD2 3.96Å; P436-L470 HydrophobicContact CB-CD2 4.13Å; I466-L470 HydrophobicContact CG2-CD1 3.87Å; I466-L470 HydrophobicContact CG2-CG 4.34Å; I466-L470 WeakPolarHBondContact O-CB 3.49Å; I466-L470 VanDerWaalsContact O-CG 3.3Å; I466-L470 WeakPolarHBondContact O-CG 3.36Å; I466-L470 PolarHBondContact O-N 3.26Å; A467-L470 PolarHBondContact O-N 3.32Å; N468-L470 VanDerWaalsContact C-N 3.34Å; L470-Q472 VanDerWaalsContact C-N 3.31Å; L470-Q472 PolarHBondContact O-N 2.84Å; L470-S473 WeakPolarHBondContact CA-OG 3.11Å; L470-S473 PolarHBondContact O-N 3.28Å; L470-S473 VanDerWaalsContact O-N 3.11Å; L470-S473 PolarHBondContact O-OG 3.2Å; L470-L482 HydrophobicContact CD1-CD2 4.31Å; L470-L482 HydrophobicContact CD2-CD2 4.06Å; L470-L528 HydrophobicContact CD1-CD2 4.2Å; L470-L534 HydrophobicContact CB-CD1 3.7Å
471	N	88.6	Confident	88.5	Confident	19.5 Å²	19.5	50.2 Å²	50.2	10%	0.104	25%	0.249	C	C	.	.	H	α-helix	trans	-62.2	-31.9	174.5	-126.9	34.9	0	0	0	112.3	A467 N468 A469 N531 E533 L534 K537	A467-N471 WeakPolarHBondContact O-CB 3.36Å; A467-N471 PolarHBondContact O-N 3.17Å; A467-N471 PolarHBondContact O-OD1 3.21Å; N468-N471 WeakPolarHBondContact O-CB 3.5Å; N468-N471 PolarHBondContact O-N 3.13Å; A469-N471 VanDerWaalsContact C-N 3.27Å; A469-N471 PolarHBondContact O-N 3.02Å; N471-N531 PolarHBondContact OD1-ND2 2.76Å; N471-N531 VanDerWaalsContact OD1-ND2 3.14Å; N471-E533 PolarHBondContact ND2-OE1 3.15Å; N471-E533 PolarHBondContact ND2-OE2 3.31Å; N471-L534 HydrophobicContact CB-CD1 4.2Å; N471-L534 VanDerWaalsContact OD1-CB 3.28Å; N471-L534 WeakPolarHBondContact OD1-CB 3.47Å; N471-L534 WeakPolarHBondContact OD1-CD1 2.95Å; N471-K537 PolarHBondContact O-NZ 2.91Å; N471-K537 PolarHBondContact OD1-NZ 3.27Å
472	Q	87.9	Confident	88.6	Confident	144 Å²	144	45 Å²	45	67%	0.673	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-14	178.7	-69.8	177.1	0.2	0	0	113.8	N468 A469 L470	N468-Q472 PolarHBondContact ND2-NE2 3.01Å; N468-Q472 VanDerWaalsContact ND2-NE2 3.18Å; N468-Q472 WeakPolarHBondContact O-CG 3.36Å; N468-Q472 PolarHBondContact O-N 2.74Å; N468-Q472 VanDerWaalsContact O-N 3.11Å; A469-Q472 PolarHBondContact O-N 3.44Å; L470-Q472 VanDerWaalsContact C-N 3.31Å; L470-Q472 PolarHBondContact O-N 2.84Å
473	S	86.6	Confident	88.7	Confident	9 Å²	9	45 Å²	45	6%	0.063	23%	0.227	C	C	.	.	S	Bend	trans	-86.8	162	-177.2	70.9	0	0	0	0	113.9	A469 L470	A469-S473 WeakPolarHBondContact O-CB 3.38Å; A469-S473 PolarHBondContact O-N 3.34Å; L470-S473 WeakPolarHBondContact CA-OG 3.11Å; L470-S473 PolarHBondContact O-N 3.28Å; L470-S473 VanDerWaalsContact O-N 3.11Å; L470-S473 PolarHBondContact O-OG 3.2Å
474	D	82.8	Confident	88.7	Confident	86 Å²	86	47.3 Å²	47.3	46%	0.46	24%	0.239	S	C	.	.			trans	-61.2	146.6	177.1	-82.6	-17.5	0	0	0	112.6	D400 K476 H477	D400-D474 WeakPolarHBondContact OD1-CB 3.4Å; D400-D474 PolarHBondContact OD1-N 3.24Å; D474-K476 HydrophobicContact CB-CD 3.76Å; D474-K476 HydrophobicContact CB-CG 3.8Å; D474-K476 PolarHBondContact O-N 2.92Å; D474-K476 WeakPolarHBondContact OD2-CE 3.47Å; D474-K476 IonicContact OD2-NZ 3.19Å; D474-K476 PolarHBondContact OD2-NZ 2.98Å; D474-H477 WeakPolarHBondContact O-CB 3.39Å; D474-H477 PolarHBondContact O-CD2 2.62Å; D474-H477 PolarHBondContact O-N 3.1Å
475	M	81	Confident	88.6	Confident	133.5 Å²	133.5	45.3 Å²	45.3	66%	0.658	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-51.1	-27.1	176.5	-0.7	-179.6	-4.2	0	0	114.5	H477 L478 K537	M475-H477 PolarHBondContact O-N 3Å; M475-H477 VanDerWaalsContact O-N 3.11Å; M475-L478 PolarHBondContact O-N 3.16Å; M475-L478 VanDerWaalsContact O-N 3.14Å; M475-K537 WeakPolarHBondContact CB-O 3.46Å; M475-K537 HydrophobicContact CG-CB 4.07Å
476	K	80.2	Confident	88.7	Confident	115.5 Å²	115.5	42.2 Å²	42.2	50%	0.502	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-58.3	-21	177.1	74.7	-160.3	179.7	-149.3	0	113.7	D474	D474-K476 HydrophobicContact CB-CD 3.76Å; D474-K476 HydrophobicContact CB-CG 3.8Å; D474-K476 PolarHBondContact O-N 2.92Å; D474-K476 WeakPolarHBondContact OD2-CE 3.47Å; D474-K476 IonicContact OD2-NZ 3.19Å; D474-K476 PolarHBondContact OD2-NZ 2.98Å
477	H	84.3	Confident	88.8	Confident	19.5 Å²	19.5	42.6 Å²	42.6	9%	0.09	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-87.3	-15.3	-177.5	-70.1	-53.6	0	0	0	114.1	L399 D400 P436 D474 M475 T479 L482	L399-H477 PolarHBondContact O-CE1 3.03Å; L399-H477 PolarHBondContact O-NE2 3.17Å; D400-H477 IonicContact OD1-CD2 2.75Å; D400-H477 PolarHBondContact OD1-CD2 3.32Å; D400-H477 VanDerWaalsContact OD1-CD2 3.28Å; D400-H477 IonicContact OD1-NE2 3.04Å; D400-H477 PolarHBondContact OD1-NE2 3.43Å; P436-H477 HydrophobicContact CG-CB 3.68Å; P436-H477 VanDerWaalsContact CG-ND1 3.34Å; P436-H477 WeakPolarHBondContact CG-ND1 3.33Å; D474-H477 WeakPolarHBondContact O-CB 3.39Å; D474-H477 PolarHBondContact O-CD2 2.62Å; D474-H477 PolarHBondContact O-N 3.1Å; M475-H477 PolarHBondContact O-N 3Å; M475-H477 VanDerWaalsContact O-N 3.11Å; H477-T479 VanDerWaalsContact C-N 3.28Å; H477-T479 PolarHBondContact O-N 3.03Å; H477-T479 VanDerWaalsContact O-N 3.12Å; H477-L482 WeakPolarHBondContact O-CD2 3.33Å
478	L	88	Confident	88.9	Confident	5 Å²	5	46.5 Å²	46.5	3%	0.026	24%	0.235	C	C	.	.			trans	-88.2	65.5	-178.4	-58	178.3	0	0	0	111.1	M475 L482 L534 W535 K537 A538	M475-L478 PolarHBondContact O-N 3.16Å; M475-L478 VanDerWaalsContact O-N 3.14Å; L478-L482 HydrophobicContact CD2-CD2 4.36Å; L478-L534 HydrophobicContact CD1-CD1 4.31Å; L478-L534 VanDerWaalsContact CD1-O 3.22Å; L478-L534 WeakPolarHBondContact CD1-O 3.37Å; L478-L534 HydrophobicContact CD2-CD1 3.8Å; L478-L534 HydrophobicContact CD2-CG 4.38Å; L478-W535 HydrophobicContact CD2-CZ3 4.46Å; L478-K537 HydrophobicContact CD1-CB 3.82Å; L478-A538 HydrophobicContact CB-CB 3.7Å; L478-A538 HydrophobicContact CD1-CB 4.01Å
479	T	87.9	Confident	89	Confident	28.5 Å²	28.5	43 Å²	43	18%	0.175	22%	0.216	C	C	.	.			trans	-83.8	162.6	-175.8	65.2	0	0	0	0	112.7	E434 T437 H477 S481 L482 L483	E434-T479 VanDerWaalsContact CD-OG1 3.27Å; E434-T479 HydrophobicContact CG-CG2 4.07Å; E434-T479 WeakPolarHBondContact OE2-CB 3.24Å; E434-T479 PolarHBondContact OE2-OG1 3.26Å; T437-T479 PolarHBondContact OG1-OG1 2.94Å; H477-T479 VanDerWaalsContact C-N 3.28Å; H477-T479 PolarHBondContact O-N 3.03Å; H477-T479 VanDerWaalsContact O-N 3.12Å; T479-S481 VanDerWaalsContact C-N 3.31Å; T479-S481 WeakPolarHBondContact CB-OG 3.47Å; T479-S481 PolarHBondContact O-N 3.09Å; T479-S481 PolarHBondContact OG1-OG 2.71Å; T479-L482 PolarHBondContact O-N 3.16Å; T479-L482 WeakPolarHBondContact OG1-CB 3.46Å; T479-L482 PolarHBondContact OG1-N 3.25Å; T479-L483 PolarHBondContact O-N 3.07Å
480	K	89.2	Confident	89.2	Confident	117.5 Å²	117.5	42.5 Å²	42.5	51%	0.511	21%	0.212	S	C	.	.	H	α-helix	trans	-58.4	-42.9	171.1	175.4	169.4	176.2	129.2	0	111.9	L482 L483 D484 V542 Q545	K480-L482 VanDerWaalsContact C-N 3.32Å; K480-L482 PolarHBondContact O-N 3.12Å; K480-L483 CarbonylContact O-C 3.54Å; K480-L483 WeakPolarHBondContact O-CB 3.4Å; K480-L483 PolarHBondContact O-N 3.36Å; K480-L483 VanDerWaalsContact O-N 3.13Å; K480-D484 VanDerWaalsContact O-CG 3.24Å; K480-D484 PolarHBondContact O-N 3.19Å; K480-V542 HydrophobicContact CB-CG2 4.1Å; K480-Q545 VanDerWaalsContact CG-OE1 3.27Å
481	S	87.9	Confident	89.3	Confident	33 Å²	33	45.3 Å²	45.3	23%	0.231	23%	0.227	C	C	.	.	H	α-helix	trans	-64.6	-33.4	179.2	-2.2	0	0	0	0	113.1	E434 T479 D484 E485	E434-S481 PolarHBondContact OE1-OG 3.36Å; E434-S481 WeakPolarHBondContact OE2-CB 3.42Å; E434-S481 PolarHBondContact OE2-OG 2.94Å; T479-S481 VanDerWaalsContact C-N 3.31Å; T479-S481 WeakPolarHBondContact CB-OG 3.47Å; T479-S481 PolarHBondContact O-N 3.09Å; T479-S481 PolarHBondContact OG1-OG 2.71Å; S481-D484 PolarHBondContact O-N 3.01Å; S481-E485 WeakPolarHBondContact O-CG 3.39Å; S481-E485 PolarHBondContact O-N 3.06Å; S481-E485 VanDerWaalsContact O-N 3.13Å
482	L	91.7	Very high	89.5	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-45.6	171.3	178.3	63.5	0	0	0	111.1	P436 T437 V440 L470 H477 L478 T479 K480 D484 E485 I486	P436-L482 HydrophobicContact CB-CD1 4.26Å; P436-L482 HydrophobicContact CB-CD2 4.16Å; T437-L482 WeakPolarHBondContact OG1-CB 3.3Å; T437-L482 PolarHBondContact OG1-N 3.27Å; V440-L482 HydrophobicContact CB-CD1 4.02Å; V440-L482 HydrophobicContact CG1-CD1 4.28Å; V440-L482 HydrophobicContact CG2-CD1 3.87Å; L470-L482 HydrophobicContact CD1-CD2 4.31Å; L470-L482 HydrophobicContact CD2-CD2 4.06Å; H477-L482 WeakPolarHBondContact O-CD2 3.33Å; L478-L482 HydrophobicContact CD2-CD2 4.36Å; T479-L482 PolarHBondContact O-N 3.16Å; T479-L482 WeakPolarHBondContact OG1-CB 3.46Å; T479-L482 PolarHBondContact OG1-N 3.25Å; K480-L482 VanDerWaalsContact C-N 3.32Å; K480-L482 PolarHBondContact O-N 3.12Å; L482-D484 VanDerWaalsContact C-N 3.32Å; L482-D484 PolarHBondContact O-N 2.98Å; L482-E485 PolarHBondContact O-N 3.07Å; L482-I486 HydrophobicContact CD1-CD1 4.35Å; L482-I486 HydrophobicContact CG-CD1 4.12Å; L482-I486 WeakPolarHBondContact O-CG1 3.43Å; L482-I486 PolarHBondContact O-N 3.41Å; L482-I486 VanDerWaalsContact O-N 3.13Å
483	L	92.8	Very high	89.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.5	-39.1	175	178.6	64	0	0	0	111.6	T479 K480 E485 I486 T487 W535 V542 Q545 L546	T479-L483 PolarHBondContact O-N 3.07Å; K480-L483 CarbonylContact O-C 3.54Å; K480-L483 WeakPolarHBondContact O-CB 3.4Å; K480-L483 PolarHBondContact O-N 3.36Å; K480-L483 VanDerWaalsContact O-N 3.13Å; L483-E485 VanDerWaalsContact C-N 3.32Å; L483-E485 PolarHBondContact O-N 2.95Å; L483-I486 PolarHBondContact O-N 3.06Å; L483-T487 HydrophobicContact CD1-CG2 3.98Å; L483-T487 HydrophobicContact CG-CG2 4.22Å; L483-T487 WeakPolarHBondContact O-CB 3.44Å; L483-T487 VanDerWaalsContact O-CG2 3.29Å; L483-T487 WeakPolarHBondContact O-CG2 3.35Å; L483-T487 PolarHBondContact O-N 2.84Å; L483-T487 PolarHBondContact O-OG1 3.2Å; L483-W535 HydrophobicContact CB-CH2 4.16Å; L483-W535 HydrophobicContact CB-CZ3 4.39Å; L483-W535 HydrophobicContact CD1-CH2 3.89Å; L483-W535 HydrophobicContact CD1-CZ2 4.07Å; L483-W535 HydrophobicContact CD1-CZ3 4.37Å; L483-V542 HydrophobicContact CB-CG1 4.19Å; L483-V542 HydrophobicContact CD2-CG1 3.83Å; L483-V542 WeakPolarHBondContact CD2-O 3.05Å; L483-Q545 HydrophobicContact CD2-CB 3.94Å; L483-Q545 HydrophobicContact CD2-CG 3.97Å; L483-L546 HydrophobicContact CD1-CB 4.25Å; L483-L546 HydrophobicContact CD1-CD1 3.9Å; L483-L546 HydrophobicContact CD2-CB 3.99Å
484	D	92.5	Very high	89.7	Confident	47 Å²	47	40 Å²	40	25%	0.251	20%	0.199	S	C	.	.	H	α-helix	trans	-60.7	-39.7	175.7	-67.5	-27.9	0	0	0	111.2	K480 S481 L482 T487 N488 Q545	K480-D484 VanDerWaalsContact O-CG 3.24Å; K480-D484 PolarHBondContact O-N 3.19Å; S481-D484 PolarHBondContact O-N 3.01Å; L482-D484 VanDerWaalsContact C-N 3.32Å; L482-D484 PolarHBondContact O-N 2.98Å; D484-T487 WeakPolarHBondContact CA-OG1 3.34Å; D484-T487 PolarHBondContact O-N 3.41Å; D484-T487 PolarHBondContact O-OG1 2.87Å; D484-T487 VanDerWaalsContact O-OG1 3.08Å; D484-N488 WeakPolarHBondContact O-CB 3.43Å; D484-N488 VanDerWaalsContact O-CG 3.31Å; D484-N488 PolarHBondContact O-N 3.33Å; D484-N488 PolarHBondContact O-ND2 3.09Å; D484-Q545 PolarHBondContact OD1-NE2 3.28Å
485	E	92.1	Very high	90	Very high	27.5 Å²	27.5	43.4 Å²	43.4	13%	0.129	21%	0.209	C	C	.	.	H	α-helix	trans	-66.5	-40.9	173.6	-71.4	-58.1	137.1	0	0	112.9	T437 V440 R441 S481 L482 L483 F489	T437-E485 HydrophobicContact CG2-CG 3.96Å; V440-E485 HydrophobicContact CG1-CB 4.28Å; R441-E485 HydrophobicContact CB-CG 4.2Å; R441-E485 WeakPolarHBondContact CG-OE2 3.2Å; R441-E485 IonicContact CZ-OE1 2.94Å; R441-E485 IonicContact NE-OE1 3.95Å; R441-E485 PolarHBondContact NE-OE1 2.92Å; R441-E485 IonicContact NE-OE2 3.45Å; R441-E485 PolarHBondContact NE-OE2 3.16Å; R441-E485 IonicContact NH2-OE1 2.71Å; R441-E485 PolarHBondContact NH2-OE1 3.23Å; S481-E485 WeakPolarHBondContact O-CG 3.39Å; S481-E485 PolarHBondContact O-N 3.06Å; S481-E485 VanDerWaalsContact O-N 3.13Å; L482-E485 PolarHBondContact O-N 3.07Å; L483-E485 VanDerWaalsContact C-N 3.32Å; L483-E485 PolarHBondContact O-N 2.95Å; E485-F489 VanDerWaalsContact O-CB 3.29Å; E485-F489 WeakPolarHBondContact O-CB 3.31Å; E485-F489 PolarHBondContact O-N 3.3Å
486	I	94.3	Very high	90.2	Very high	1 Å²	1	38 Å²	38	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-64.6	-43.9	178.3	-69.1	170.2	0	0	0	110.8	V440 F444 L482 L483 T490 M524 L528 L529 W535	V440-I486 HydrophobicContact CG1-CG1 4.42Å; F444-I486 HydrophobicContact CE2-CG1 4.33Å; L482-I486 HydrophobicContact CD1-CD1 4.35Å; L482-I486 HydrophobicContact CG-CD1 4.12Å; L482-I486 WeakPolarHBondContact O-CG1 3.43Å; L482-I486 PolarHBondContact O-N 3.41Å; L482-I486 VanDerWaalsContact O-N 3.13Å; L483-I486 PolarHBondContact O-N 3.06Å; I486-T490 WeakPolarHBondContact O-CB 3.41Å; I486-T490 PolarHBondContact O-N 3.28Å; I486-T490 PolarHBondContact O-OG1 3.27Å; I486-M524 HydrophobicContact CB-CE 4.4Å; I486-M524 HydrophobicContact CG2-CE 3.69Å; I486-M524 VanDerWaalsContact O-CE 3.23Å; I486-M524 WeakPolarHBondContact O-CE 3.43Å; I486-L528 HydrophobicContact CD1-CD1 4.25Å; I486-L528 HydrophobicContact CG1-CD1 4.18Å; I486-L528 HydrophobicContact CG2-CB 4.42Å; I486-L528 HydrophobicContact CG2-CD1 4.25Å; I486-L529 HydrophobicContact CG2-CD2 3.84Å; I486-L529 HydrophobicContact CG2-CG 4.49Å; I486-W535 HydrophobicContact CD1-CH2 4.1Å; I486-W535 HydrophobicContact CD1-CZ2 4.09Å
487	T	93.7	Very high	90.4	Very high	11 Å²	11	32.5 Å²	32.5	7%	0.067	16%	0.16	C	C	.	.	H	α-helix	trans	-70.5	-45.7	177.9	54.1	0	0	0	0	111.5	L483 D484 F489 T490 L491 F549	L483-T487 HydrophobicContact CD1-CG2 3.98Å; L483-T487 HydrophobicContact CG-CG2 4.22Å; L483-T487 WeakPolarHBondContact O-CB 3.44Å; L483-T487 VanDerWaalsContact O-CG2 3.29Å; L483-T487 WeakPolarHBondContact O-CG2 3.35Å; L483-T487 PolarHBondContact O-N 2.84Å; L483-T487 PolarHBondContact O-OG1 3.2Å; D484-T487 WeakPolarHBondContact CA-OG1 3.34Å; D484-T487 PolarHBondContact O-N 3.41Å; D484-T487 PolarHBondContact O-OG1 2.87Å; D484-T487 VanDerWaalsContact O-OG1 3.08Å; T487-F489 VanDerWaalsContact C-N 3.3Å; T487-F489 PolarHBondContact O-N 3.11Å; T487-T490 WeakPolarHBondContact O-CA 3.34Å; T487-T490 WeakPolarHBondContact O-CB 3.25Å; T487-T490 PolarHBondContact O-N 3.3Å; T487-T490 VanDerWaalsContact O-N 3.09Å; T487-L491 WeakPolarHBondContact O-CG 3.3Å; T487-L491 PolarHBondContact O-N 3.31Å; T487-F549 HydrophobicContact CG2-CB 4.26Å; T487-F549 HydrophobicContact CG2-CD1 3.65Å; T487-F549 HydrophobicContact CG2-CD2 3.84Å; T487-F549 HydrophobicContact CG2-CE1 3.87Å; T487-F549 HydrophobicContact CG2-CE2 4.04Å; T487-F549 HydrophobicContact CG2-CG 3.63Å; T487-F549 HydrophobicContact CG2-CZ 4.06Å
488	N	93.1	Very high	90.2	Very high	86 Å²	86	35.1 Å²	35.1	46%	0.46	17%	0.171	S	C	.	.	H	α-helix	trans	-60.9	-36.4	175.4	-77.1	-45.9	0	0	0	112.8	R448 D484 L491 Y492	R448-N488 PolarHBondContact NH2-O 3.27Å; D484-N488 WeakPolarHBondContact O-CB 3.43Å; D484-N488 VanDerWaalsContact O-CG 3.31Å; D484-N488 PolarHBondContact O-N 3.33Å; D484-N488 PolarHBondContact O-ND2 3.09Å; N488-L491 PolarHBondContact O-N 2.94Å; N488-Y492 WeakPolarHBondContact O-CB 3.46Å; N488-Y492 PolarHBondContact O-N 3.22Å; N488-Y492 VanDerWaalsContact O-N 3.09Å
489	F	94.1	Very high	89.7	Confident	6.5 Å²	6.5	37.8 Å²	37.8	3%	0.029	19%	0.19	C	C	.	.	H	α-helix	trans	-69.3	-41.6	172.9	-173.8	-115.3	0	0	0	111.8	F444 V447 R448 E485 T487 L491 Y492 L493 L520 M524	F444-F489 HydrophobicContact CB-CB 4.43Å; F444-F489 HydrophobicContact CB-CD1 4.44Å; F444-F489 HydrophobicContact CB-CD2 3.64Å; F444-F489 HydrophobicContact CB-CE2 3.96Å; F444-F489 HydrophobicContact CB-CG 3.97Å; F444-F489 HydrophobicContact CB-CZ 4.41Å; F444-F489 AromaticContact CD1-CD1 3.69Å; F444-F489 HydrophobicContact CD1-CD1 3.69Å; F444-F489 HydrophobicContact CD1-CD2 4.24Å; F444-F489 AromaticContact CD1-CE1 3.71Å; F444-F489 HydrophobicContact CD1-CE1 3.71Å; F444-F489 HydrophobicContact CD1-CE2 4.26Å; F444-F489 AromaticContact CD1-CG 3.85Å; F444-F489 HydrophobicContact CD1-CG 3.97Å; F444-F489 AromaticContact CD1-CZ 3.97Å; F444-F489 HydrophobicContact CD1-CZ 4.01Å; F444-F489 HydrophobicContact CD2-CB 3.41Å; F444-F489 VanDerWaalsContact CD2-CB 3.42Å; F444-F489 AromaticContact CD2-CD1 3.84Å; F444-F489 HydrophobicContact CD2-CD1 3.84Å; F444-F489 HydrophobicContact CD2-CD2 4.11Å; F444-F489 AromaticContact CD2-CG 3.52Å; F444-F489 HydrophobicContact CD2-CG 3.52Å; F444-F489 AromaticContact CE1-CD1 3.67Å; F444-F489 HydrophobicContact CE1-CD1 3.67Å; F444-F489 AromaticContact CE1-CE1 3.79Å; F444-F489 HydrophobicContact CE1-CE1 3.79Å; F444-F489 HydrophobicContact CE1-CG 4.31Å; F444-F489 HydrophobicContact CE1-CZ 4.4Å; F444-F489 HydrophobicContact CE2-CB 3.68Å; F444-F489 AromaticContact CE2-CD1 3.81Å; F444-F489 HydrophobicContact CE2-CD1 3.81Å; F444-F489 AromaticContact CE2-CG 3.89Å; F444-F489 HydrophobicContact CE2-CG 3.89Å; F444-F489 HydrophobicContact CG-CB 3.97Å; F444-F489 AromaticContact CG-CD1 3.78Å; F444-F489 HydrophobicContact CG-CD1 3.78Å; F444-F489 AromaticContact CG-CD2 3.76Å; F444-F489 HydrophobicContact CG-CD2 3.76Å; F444-F489 HydrophobicContact CG-CE1 4.17Å; F444-F489 HydrophobicContact CG-CE2 4.15Å; F444-F489 AromaticContact CG-CG 3.56Å; F444-F489 HydrophobicContact CG-CG 3.56Å; F444-F489 HydrophobicContact CG-CZ 4.35Å; F444-F489 HydrophobicContact CZ-CB 4.27Å; F444-F489 AromaticContact CZ-CD1 3.73Å; F444-F489 HydrophobicContact CZ-CD1 3.73Å; F444-F489 HydrophobicContact CZ-CE1 4.3Å; F444-F489 HydrophobicContact CZ-CG 4.27Å; V447-F489 HydrophobicContact CB-CZ 4.34Å; V447-F489 HydrophobicContact CG1-CE2 4.3Å; V447-F489 HydrophobicContact CG1-CZ 3.78Å; R448-F489 HydrophobicContact CG-CE2 4.37Å; E485-F489 VanDerWaalsContact O-CB 3.29Å; E485-F489 WeakPolarHBondContact O-CB 3.31Å; E485-F489 PolarHBondContact O-N 3.3Å; T487-F489 VanDerWaalsContact C-N 3.3Å; T487-F489 PolarHBondContact O-N 3.11Å; F489-L491 VanDerWaalsContact C-N 3.32Å; F489-L491 PolarHBondContact O-N 2.98Å; F489-Y492 HydrophobicContact CD2-CD1 4.15Å; F489-Y492 HydrophobicContact CE2-CD1 4.1Å; F489-Y492 HydrophobicContact CE2-CE1 4.39Å; F489-Y492 WeakPolarHBondContact O-CB 3.43Å; F489-Y492 PolarHBondContact O-N 2.89Å; F489-L493 HydrophobicContact CD1-CD1 4.03Å; F489-L493 HydrophobicContact CD1-CG 4.43Å; F489-L493 HydrophobicContact CE1-CD1 3.71Å; F489-L493 HydrophobicContact CE1-CD2 4.34Å; F489-L493 HydrophobicContact CE1-CG 4.16Å; F489-L493 HydrophobicContact CE2-CD2 4.35Å; F489-L493 HydrophobicContact CZ-CD1 4.2Å; F489-L493 HydrophobicContact CZ-CD2 3.97Å; F489-L493 HydrophobicContact CZ-CG 4.21Å; F489-L493 WeakPolarHBondContact O-CG 3.34Å; F489-L493 PolarHBondContact O-N 3.24Å; F489-L520 HydrophobicContact CE1-CD2 3.76Å; F489-L520 HydrophobicContact CE1-CG 4.43Å; F489-L520 HydrophobicContact CZ-CD2 3.68Å; F489-M524 HydrophobicContact CB-CE 4.47Å; F489-M524 HydrophobicContact CD1-CE 3.96Å; F489-M524 HydrophobicContact CD1-CG 4.34Å; F489-M524 HydrophobicContact CD1-SD 3.9Å; F489-M524 HydrophobicContact CE1-CG 4.45Å; F489-M524 HydrophobicContact CE1-SD 4.19Å
490	T	93.8	Very high	88.8	Confident	1.5 Å²	1.5	37.6 Å²	37.6	1%	0.009	19%	0.189	C	C	.	.	H	α-helix	trans	-59.7	-44	174.9	-57.3	0	0	0	0	111.9	I486 T487 L493 L494 M524 L529 F549 F554	I486-T490 WeakPolarHBondContact O-CB 3.41Å; I486-T490 PolarHBondContact O-N 3.28Å; I486-T490 PolarHBondContact O-OG1 3.27Å; T487-T490 WeakPolarHBondContact O-CA 3.34Å; T487-T490 WeakPolarHBondContact O-CB 3.25Å; T487-T490 PolarHBondContact O-N 3.3Å; T487-T490 VanDerWaalsContact O-N 3.09Å; T490-L493 PolarHBondContact O-N 2.9Å; T490-L494 HydrophobicContact CG2-CD1 4.29Å; T490-L494 PolarHBondContact O-N 3.13Å; T490-M524 WeakPolarHBondContact OG1-CE 3.31Å; T490-L529 HydrophobicContact CG2-CD1 4.11Å; T490-F549 HydrophobicContact CG2-CE1 4.28Å; T490-F549 HydrophobicContact CG2-CZ 3.96Å; T490-F554 HydrophobicContact CG2-CD2 3.76Å; T490-F554 HydrophobicContact CG2-CE2 3.68Å
491	L	93.2	Very high	87.5	Confident	60.5 Å²	60.5	35.9 Å²	35.9	32%	0.317	18%	0.183	S	C	.	.	H	α-helix	trans	-64.6	-39.8	175.5	-70.4	174.2	0	0	0	112.3	T487 N488 F489 L493 L494 K495 F549 D553	T487-L491 WeakPolarHBondContact O-CG 3.3Å; T487-L491 PolarHBondContact O-N 3.31Å; N488-L491 PolarHBondContact O-N 2.94Å; F489-L491 VanDerWaalsContact C-N 3.32Å; F489-L491 PolarHBondContact O-N 2.98Å; L491-L493 VanDerWaalsContact C-N 3.33Å; L491-L493 PolarHBondContact O-N 2.72Å; L491-L494 PolarHBondContact O-N 3.04Å; L491-K495 WeakPolarHBondContact O-CB 3.32Å; L491-K495 PolarHBondContact O-N 3.1Å; L491-F549 HydrophobicContact CD1-CE2 4.31Å; L491-F549 HydrophobicContact CD2-CE2 4Å; L491-F549 HydrophobicContact CD2-CZ 4.5Å; L491-F549 HydrophobicContact CG-CE2 3.97Å; L491-F549 HydrophobicContact CG-CZ 4.45Å; L491-D553 HydrophobicContact CD2-CB 3.87Å
492	Y	91.8	Very high	86	Confident	54 Å²	54	40.5 Å²	40.5	21%	0.212	20%	0.204	C	C	.	.	H	α-helix	trans	-59.1	-47.2	172.6	164.5	-95.6	0	0	0	111.3	R448 N488 F489 L494 K495 T496	R448-Y492 HydrophobicContact CB-CE1 4.26Å; R448-Y492 HydrophobicContact CG-CD1 3.99Å; R448-Y492 HydrophobicContact CG-CE1 3.84Å; R448-Y492 HydrophobicContact CG-CE2 4.1Å; R448-Y492 HydrophobicContact CG-CG 4.46Å; R448-Y492 VanDerWaalsContact NE-CE2 3.32Å; N488-Y492 WeakPolarHBondContact O-CB 3.46Å; N488-Y492 PolarHBondContact O-N 3.22Å; N488-Y492 VanDerWaalsContact O-N 3.09Å; F489-Y492 HydrophobicContact CD2-CD1 4.15Å; F489-Y492 HydrophobicContact CE2-CD1 4.1Å; F489-Y492 HydrophobicContact CE2-CE1 4.39Å; F489-Y492 WeakPolarHBondContact O-CB 3.43Å; F489-Y492 PolarHBondContact O-N 2.89Å; Y492-L494 PolarHBondContact O-N 2.62Å; Y492-K495 PolarHBondContact O-N 3.24Å; Y492-T496 WeakPolarHBondContact O-CB 3.11Å; Y492-T496 PolarHBondContact O-N 3.15Å; Y492-T496 PolarHBondContact O-OG1 3.38Å
493	L	90.6	Very high	84.2	Confident	0.5 Å²	0.5	47 Å²	47	0%	0.003	24%	0.235	C	C	.	.	H	α-helix	trans	-60.7	-46.1	177.4	-64.7	174.5	0	0	0	111.5	F489 T490 L491 K495 T496 I497 Y517 L520 I521 M524	F489-L493 HydrophobicContact CD1-CD1 4.03Å; F489-L493 HydrophobicContact CD1-CG 4.43Å; F489-L493 HydrophobicContact CE1-CD1 3.71Å; F489-L493 HydrophobicContact CE1-CD2 4.34Å; F489-L493 HydrophobicContact CE1-CG 4.16Å; F489-L493 HydrophobicContact CE2-CD2 4.35Å; F489-L493 HydrophobicContact CZ-CD1 4.2Å; F489-L493 HydrophobicContact CZ-CD2 3.97Å; F489-L493 HydrophobicContact CZ-CG 4.21Å; F489-L493 WeakPolarHBondContact O-CG 3.34Å; F489-L493 PolarHBondContact O-N 3.24Å; T490-L493 PolarHBondContact O-N 2.9Å; L491-L493 VanDerWaalsContact C-N 3.33Å; L491-L493 PolarHBondContact O-N 2.72Å; L493-K495 PolarHBondContact O-N 3.13Å; L493-T496 PolarHBondContact O-N 3.17Å; L493-I497 VanDerWaalsContact O-CG1 3.27Å; L493-I497 WeakPolarHBondContact O-CG1 3.34Å; L493-I497 PolarHBondContact O-N 3.06Å; L493-Y517 HydrophobicContact CD2-CD1 3.8Å; L493-Y517 HydrophobicContact CD2-CE1 4.42Å; L493-L520 HydrophobicContact CD1-CB 4.02Å; L493-L520 HydrophobicContact CD1-CD2 3.63Å; L493-L520 HydrophobicContact CD1-CG 3.84Å; L493-L520 HydrophobicContact CD2-CB 4.08Å; L493-L520 HydrophobicContact CD2-CD1 3.98Å; L493-L520 HydrophobicContact CD2-CD2 3.64Å; L493-L520 HydrophobicContact CG-CD2 4.26Å; L493-I521 HydrophobicContact CB-CD1 3.88Å; L493-I521 HydrophobicContact CB-CG1 3.67Å; L493-I521 HydrophobicContact CD1-CG1 3.92Å; L493-I521 HydrophobicContact CG-CG1 4.45Å; L493-M524 HydrophobicContact CD1-CG 4.06Å
494	L	88.8	Confident	82	Confident	7 Å²	7	49.1 Å²	49.1	4%	0.037	25%	0.246	C	C	.	.	H	α-helix	trans	-61	-45.2	178.3	-125.7	116.2	0	0	0	111.6	T490 L491 Y492 T496 I497 K498 I521 E556 A557 Y562	T490-L494 HydrophobicContact CG2-CD1 4.29Å; T490-L494 PolarHBondContact O-N 3.13Å; L491-L494 PolarHBondContact O-N 3.04Å; Y492-L494 PolarHBondContact O-N 2.62Å; L494-T496 VanDerWaalsContact C-N 3.35Å; L494-T496 PolarHBondContact O-N 3.32Å; L494-I497 PolarHBondContact O-N 3.19Å; L494-K498 WeakPolarHBondContact O-CG 3.37Å; L494-K498 PolarHBondContact O-N 3.21Å; L494-K498 VanDerWaalsContact O-N 3.11Å; L494-I521 HydrophobicContact CB-CD1 4.3Å; L494-I521 HydrophobicContact CD1-CD1 4.46Å; L494-I521 HydrophobicContact CD2-CD1 3.53Å; L494-I521 HydrophobicContact CG-CD1 3.7Å; L494-E556 HydrophobicContact CD2-CB 4.14Å; L494-E556 HydrophobicContact CD2-CG 4.39Å; L494-A557 HydrophobicContact CD1-CB 4.3Å; L494-A557 HydrophobicContact CD2-CB 3.76Å; L494-Y562 HydrophobicContact CD1-CD2 4.13Å; L494-Y562 HydrophobicContact CD1-CE2 3.93Å; L494-Y562 HydrophobicContact CD2-CD2 4.36Å
495	K	88.2	Confident	79.8	Confident	157 Å²	157	54.3 Å²	54.3	68%	0.683	27%	0.274	S	S	*	.	H	α-helix	trans	-61.5	-43.2	176.5	-174.4	178.9	178.9	-177.9	0	111.8	L491 Y492 L493 K498 S499	L491-K495 WeakPolarHBondContact O-CB 3.32Å; L491-K495 PolarHBondContact O-N 3.1Å; Y492-K495 PolarHBondContact O-N 3.24Å; L493-K495 PolarHBondContact O-N 3.13Å; K495-K498 PolarHBondContact O-N 2.85Å; K495-S499 PolarHBondContact O-N 2.95Å; K495-S499 VanDerWaalsContact O-N 3.12Å; K495-S499 PolarHBondContact O-OG 3.11Å; K495-S499 VanDerWaalsContact O-OG 3.13Å
496	T	85.5	Confident	77.7	Confident	20.5 Å²	20.5	59.2 Å²	59.2	13%	0.126	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-41.5	179.4	-57	0	0	0	0	111.7	Y492 L493 L494 K498 S499 T500 Y517	Y492-T496 WeakPolarHBondContact O-CB 3.11Å; Y492-T496 PolarHBondContact O-N 3.15Å; Y492-T496 PolarHBondContact O-OG1 3.38Å; L493-T496 PolarHBondContact O-N 3.17Å; L494-T496 VanDerWaalsContact C-N 3.35Å; L494-T496 PolarHBondContact O-N 3.32Å; T496-K498 VanDerWaalsContact C-N 3.35Å; T496-K498 PolarHBondContact O-N 2.91Å; T496-S499 WeakPolarHBondContact CA-OG 3.35Å; T496-S499 PolarHBondContact O-N 3.43Å; T496-S499 PolarHBondContact O-OG 3.16Å; T496-S499 VanDerWaalsContact O-OG 3.09Å; T496-T500 WeakPolarHBondContact O-CB 3.38Å; T496-T500 VanDerWaalsContact O-CG2 3.3Å; T496-T500 WeakPolarHBondContact O-CG2 3.46Å; T496-T500 PolarHBondContact O-N 3.11Å; T496-T500 VanDerWaalsContact O-N 3.13Å; T496-T500 PolarHBondContact O-OG1 3.32Å; T496-T500 VanDerWaalsContact O-OG1 3.1Å; T496-Y517 HydrophobicContact CG2-CD1 4.42Å; T496-Y517 HydrophobicContact CG2-CD2 4.07Å; T496-Y517 HydrophobicContact CG2-CE1 4.11Å; T496-Y517 HydrophobicContact CG2-CE2 3.66Å; T496-Y517 HydrophobicContact CG2-CG 4.38Å
497	I	83.9	Confident	75.3	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-64	-40.4	176.9	-67.5	164.3	0	0	0	111.1	L493 L494 T500 H501 V514 Y517 I518 I521 Y562	L493-I497 VanDerWaalsContact O-CG1 3.27Å; L493-I497 WeakPolarHBondContact O-CG1 3.34Å; L493-I497 PolarHBondContact O-N 3.06Å; L494-I497 PolarHBondContact O-N 3.19Å; I497-T500 WeakPolarHBondContact CA-OG1 3.43Å; I497-T500 PolarHBondContact O-N 3.32Å; I497-T500 PolarHBondContact O-OG1 3.16Å; I497-H501 WeakPolarHBondContact O-CB 3.33Å; I497-H501 PolarHBondContact O-CD2 2.96Å; I497-H501 VanDerWaalsContact O-CD2 3.28Å; I497-H501 PolarHBondContact O-N 3.26Å; I497-V514 HydrophobicContact CG2-CG1 4.39Å; I497-Y517 HydrophobicContact CG1-CG 4.44Å; I497-I518 HydrophobicContact CD1-CG1 4.03Å; I497-I518 HydrophobicContact CG1-CG1 4.5Å; I497-I518 HydrophobicContact CG2-CG1 4.46Å; I497-I521 HydrophobicContact CD1-CD1 3.4Å; I497-I521 VanDerWaalsContact CD1-CD1 3.44Å; I497-I521 HydrophobicContact CD1-CG1 4.08Å; I497-Y562 HydrophobicContact CG2-CE1 3.92Å; I497-Y562 HydrophobicContact CG2-CE2 3.87Å; I497-Y562 VanDerWaalsContact CG2-CZ 3.47Å; I497-Y562 VanDerWaalsContact CG2-OH 3.3Å; I497-Y562 WeakPolarHBondContact CG2-OH 3.27Å
498	K	80.3	Confident	73.1	Confident	74 Å²	74	68.7 Å²	68.7	32%	0.322	35%	0.353	S	S	.	.	H	α-helix	trans	-61.4	-51.7	175.3	-69.8	-179.3	-167.6	-173.9	0	112.4	L494 K495 T496 T500 H501 D502 E556	L494-K498 WeakPolarHBondContact O-CG 3.37Å; L494-K498 PolarHBondContact O-N 3.21Å; L494-K498 VanDerWaalsContact O-N 3.11Å; K495-K498 PolarHBondContact O-N 2.85Å; T496-K498 VanDerWaalsContact C-N 3.35Å; T496-K498 PolarHBondContact O-N 2.91Å; K498-T500 PolarHBondContact O-N 3.12Å; K498-H501 WeakPolarHBondContact O-CA 3.36Å; K498-H501 WeakPolarHBondContact O-CB 3.49Å; K498-H501 PolarHBondContact O-N 3.05Å; K498-D502 PolarHBondContact O-N 3.15Å; K498-E556 WeakPolarHBondContact CE-OE1 3.47Å; K498-E556 VanDerWaalsContact CE-OE2 3.22Å; K498-E556 WeakPolarHBondContact CE-OE2 3.29Å; K498-E556 IonicContact NZ-OE1 2.77Å; K498-E556 PolarHBondContact NZ-OE1 3.18Å; K498-E556 IonicContact NZ-OE2 3.3Å; K498-E556 PolarHBondContact NZ-OE2 3.15Å
499	S	78.1	Confident	70.9	Confident	60 Å²	60	70.3 Å²	70.3	42%	0.42	36%	0.362	S	S	.	.	H	α-helix	trans	-59.1	-35.2	-178.8	51.5	0	0	0	0	112.1	K495 T496 H501 E503	K495-S499 PolarHBondContact O-N 2.95Å; K495-S499 VanDerWaalsContact O-N 3.12Å; K495-S499 PolarHBondContact O-OG 3.11Å; K495-S499 VanDerWaalsContact O-OG 3.13Å; T496-S499 WeakPolarHBondContact CA-OG 3.35Å; T496-S499 PolarHBondContact O-N 3.43Å; T496-S499 PolarHBondContact O-OG 3.16Å; T496-S499 VanDerWaalsContact O-OG 3.09Å; S499-H501 VanDerWaalsContact C-N 3.31Å; S499-H501 PolarHBondContact O-N 3.46Å; S499-E503 WeakPolarHBondContact O-CG 3.44Å; S499-E503 PolarHBondContact O-N 3.25Å
500	T	69.5	Low	68.9	Low	24.5 Å²	24.5	71.9 Å²	71.9	15%	0.15	37%	0.373	C	S	.	.	H	α-helix	trans	-75.8	-21.6	174.8	49.8	0	0	0	0	114.1	T496 I497 K498 L504 V514	T496-T500 WeakPolarHBondContact O-CB 3.38Å; T496-T500 VanDerWaalsContact O-CG2 3.3Å; T496-T500 WeakPolarHBondContact O-CG2 3.46Å; T496-T500 PolarHBondContact O-N 3.11Å; T496-T500 VanDerWaalsContact O-N 3.13Å; T496-T500 PolarHBondContact O-OG1 3.32Å; T496-T500 VanDerWaalsContact O-OG1 3.1Å; I497-T500 WeakPolarHBondContact CA-OG1 3.43Å; I497-T500 PolarHBondContact O-N 3.32Å; I497-T500 PolarHBondContact O-OG1 3.16Å; K498-T500 PolarHBondContact O-N 3.12Å; T500-L504 WeakPolarHBondContact O-CB 3.25Å; T500-L504 WeakPolarHBondContact O-CD1 3.43Å; T500-L504 WeakPolarHBondContact O-CG 3.39Å; T500-L504 PolarHBondContact O-N 2.85Å; T500-V514 HydrophobicContact CG2-CG2 4.28Å; T500-V514 WeakPolarHBondContact OG1-CG2 3.37Å
501	H	62.5	Low	67.1	Low	83 Å²	83	75.2 Å²	75.2	38%	0.384	39%	0.393	S	S	.	.	H	α-helix	trans	-79.3	-36.2	174.7	-102.1	-67.4	0	0	0	112.9	I497 K498 S499 E503 L504 Y562	I497-H501 WeakPolarHBondContact O-CB 3.33Å; I497-H501 PolarHBondContact O-CD2 2.96Å; I497-H501 VanDerWaalsContact O-CD2 3.28Å; I497-H501 PolarHBondContact O-N 3.26Å; K498-H501 WeakPolarHBondContact O-CA 3.36Å; K498-H501 WeakPolarHBondContact O-CB 3.49Å; K498-H501 PolarHBondContact O-N 3.05Å; S499-H501 VanDerWaalsContact C-N 3.31Å; S499-H501 PolarHBondContact O-N 3.46Å; H501-E503 VanDerWaalsContact C-N 3.27Å; H501-E503 PolarHBondContact O-N 3.21Å; H501-L504 WeakPolarHBondContact O-CB 3.19Å; H501-L504 PolarHBondContact O-N 3.01Å; H501-L504 VanDerWaalsContact O-N 3.14Å; H501-Y562 PolarHBondContact CD2-OH 2.88Å; H501-Y562 VanDerWaalsContact CD2-OH 3.31Å; H501-Y562 PolarHBondContact NE2-OH 3.27Å
502	D	56.2	Low	65.6	Low	128 Å²	128	75.8 Å²	75.8	68%	0.684	40%	0.403	S	S	*	.	H	α-helix	trans	-64.1	-33.5	177	-67.1	-33	0	0	0	111.4	K498	K498-D502 PolarHBondContact O-N 3.15Å
503	E	52.3	Low	64.4	Low	137.5 Å²	137.5	75.7 Å²	75.7	64%	0.643	41%	0.406	S	S	*	.	H	α-helix	trans	-79.3	-22.4	175.3	-67.1	178.9	168.2	0	0	114	S499 H501 N505 I506	S499-E503 WeakPolarHBondContact O-CG 3.44Å; S499-E503 PolarHBondContact O-N 3.25Å; H501-E503 VanDerWaalsContact C-N 3.27Å; H501-E503 PolarHBondContact O-N 3.21Å; E503-N505 PolarHBondContact O-N 2.79Å; E503-N505 VanDerWaalsContact O-N 3.15Å; E503-I506 WeakPolarHBondContact O-CB 3.45Å; E503-I506 PolarHBondContact O-N 3.43Å
504	L	48.4	Very low	63.7	Low	45 Å²	45	75.9 Å²	75.9	24%	0.236	41%	0.407	C	S	.	.	H	α-helix	trans	-67.8	-9.9	-174.8	-103	164.6	0	0	0	114.3	T500 H501 I506 H507 S510 V514	T500-L504 WeakPolarHBondContact O-CB 3.25Å; T500-L504 WeakPolarHBondContact O-CD1 3.43Å; T500-L504 WeakPolarHBondContact O-CG 3.39Å; T500-L504 PolarHBondContact O-N 2.85Å; H501-L504 WeakPolarHBondContact O-CB 3.19Å; H501-L504 PolarHBondContact O-N 3.01Å; H501-L504 VanDerWaalsContact O-N 3.14Å; L504-I506 PolarHBondContact O-N 3.2Å; L504-I506 VanDerWaalsContact O-N 3.09Å; L504-H507 WeakPolarHBondContact CD2-O 3.06Å; L504-S510 WeakPolarHBondContact CD2-OG 3.45Å; L504-S510 WeakPolarHBondContact CG-OG 3.5Å; L504-V514 HydrophobicContact CD1-CB 4.36Å; L504-V514 HydrophobicContact CD1-CG1 4.49Å; L504-V514 HydrophobicContact CD1-CG2 3.72Å
505	N	46.3	Very low	63.3	Low	155.5 Å²	155.5	79.6 Å²	79.6	83%	0.832	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-8	169.9	-84.4	-34.1	0	0	0	113.6	E503	E503-N505 PolarHBondContact O-N 2.79Å; E503-N505 VanDerWaalsContact O-N 3.15Å
506	I	47.9	Very low	63.3	Low	130 Å²	130	73.5 Å²	73.5	67%	0.667	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	-38.5	-174.3	-52.6	-177	0	0	0	113.2	E503 L504	E503-I506 WeakPolarHBondContact O-CB 3.45Å; E503-I506 PolarHBondContact O-N 3.43Å; L504-I506 PolarHBondContact O-N 3.2Å; L504-I506 VanDerWaalsContact O-N 3.09Å
507	H	43.2	Very low	63.4	Low	118.5 Å²	118.5	73.6 Å²	73.6	55%	0.549	40%	0.4	S	S	.	.			trans	-142.2	133.2	-176.1	-68.1	-52.4	0	0	0	115.1	L504 N509	L504-H507 WeakPolarHBondContact CD2-O 3.06Å; H507-N509 PolarHBondContact O-N 3.03Å
508	S	47.1	Very low	63.6	Low	93.5 Å²	93.5	75.2 Å²	75.2	65%	0.654	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-5.3	-166.6	55.8	0	0	0	0	117.2	T511	S508-T511 PolarHBondContact O-OG1 3.44Å
509	N	47.2	Very low	64	Low	120 Å²	120	75.1 Å²	75.1	64%	0.642	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-0.6	-166.2	-73	7.8	0	0	0	115.1	H507 T511	H507-N509 PolarHBondContact O-N 3.03Å; N509-T511 VanDerWaalsContact C-N 3.34Å; N509-T511 PolarHBondContact O-N 3.11Å; N509-T511 VanDerWaalsContact O-N 3.11Å
510	S	52	Low	64.7	Low	39.5 Å²	39.5	72.2 Å²	72.2	28%	0.276	39%	0.39	S	S	.	.			trans	-74.6	-8.9	177.4	138.8	0	0	0	0	113.8	L504 S512 N513 V514	L504-S510 WeakPolarHBondContact CD2-OG 3.45Å; L504-S510 WeakPolarHBondContact CG-OG 3.5Å; S510-S512 VanDerWaalsContact C-N 3.3Å; S510-S512 PolarHBondContact O-N 3.11Å; S510-S512 VanDerWaalsContact O-N 3.14Å; S510-N513 PolarHBondContact O-N 3.13Å; S510-N513 VanDerWaalsContact O-N 3.14Å; S510-V514 WeakPolarHBondContact O-CG2 3.22Å; S510-V514 PolarHBondContact O-N 3.04Å
511	T	56.6	Low	65.8	Low	70 Å²	70	71.1 Å²	71.1	43%	0.429	38%	0.384	S	S	.	.	H	α-helix	trans	-56.7	-34.4	-171	9.6	0	0	0	0	114.4	S508 N509 N513 V514 N515	S508-T511 PolarHBondContact O-OG1 3.44Å; N509-T511 VanDerWaalsContact C-N 3.34Å; N509-T511 PolarHBondContact O-N 3.11Å; N509-T511 VanDerWaalsContact O-N 3.11Å; T511-N513 PolarHBondContact O-N 2.97Å; T511-V514 PolarHBondContact O-N 3.15Å; T511-N515 WeakPolarHBondContact O-CB 3.47Å; T511-N515 VanDerWaalsContact O-CG 3.26Å; T511-N515 PolarHBondContact O-N 3.38Å; T511-N515 VanDerWaalsContact O-N 3.12Å; T511-N515 PolarHBondContact O-ND2 3.02Å; T511-N515 VanDerWaalsContact O-ND2 3.09Å
512	S	61.7	Low	67.2	Low	74.5 Å²	74.5	73 Å²	73	52%	0.521	39%	0.387	S	S	.	.	H	α-helix	trans	-66.3	-43.3	-178.5	59	0	0	0	0	112.8	S510 N515 I516	S510-S512 VanDerWaalsContact C-N 3.3Å; S510-S512 PolarHBondContact O-N 3.11Å; S510-S512 VanDerWaalsContact O-N 3.14Å; S512-N515 PolarHBondContact O-N 3.34Å; S512-I516 WeakPolarHBondContact O-CG1 3.18Å; S512-I516 PolarHBondContact O-N 2.85Å
513	N	65.6	Low	68.9	Low	51 Å²	51	68 Å²	68	27%	0.273	36%	0.36	S	S	.	.	H	α-helix	trans	-71.1	-40.3	178.3	-80.6	-27.7	0	0	0	111.6	S510 T511 N515 I516 Y517	S510-N513 PolarHBondContact O-N 3.13Å; S510-N513 VanDerWaalsContact O-N 3.14Å; T511-N513 PolarHBondContact O-N 2.97Å; N513-N515 VanDerWaalsContact C-N 3.3Å; N513-N515 PolarHBondContact O-N 3.45Å; N513-I516 WeakPolarHBondContact O-CB 3.37Å; N513-I516 PolarHBondContact O-N 3.46Å; N513-I516 VanDerWaalsContact O-N 3.14Å; N513-Y517 WeakPolarHBondContact O-CD2 3.42Å; N513-Y517 PolarHBondContact O-N 2.97Å
514	V	75.4	Confident	70.9	Confident	4.5 Å²	4.5	61.4 Å²	61.4	3%	0.027	33%	0.329	C	S	.	.	H	α-helix	trans	-60.7	-42	175.7	-179.8	0	0	0	0	110.9	I497 T500 L504 S510 T511 I516 Y517 I518	I497-V514 HydrophobicContact CG2-CG1 4.39Å; T500-V514 HydrophobicContact CG2-CG2 4.28Å; T500-V514 WeakPolarHBondContact OG1-CG2 3.37Å; L504-V514 HydrophobicContact CD1-CB 4.36Å; L504-V514 HydrophobicContact CD1-CG1 4.49Å; L504-V514 HydrophobicContact CD1-CG2 3.72Å; S510-V514 WeakPolarHBondContact O-CG2 3.22Å; S510-V514 PolarHBondContact O-N 3.04Å; T511-V514 PolarHBondContact O-N 3.15Å; V514-I516 VanDerWaalsContact C-N 3.29Å; V514-I516 PolarHBondContact O-N 3.21Å; V514-Y517 PolarHBondContact O-N 3.2Å; V514-Y517 VanDerWaalsContact O-N 3.14Å; V514-I518 HydrophobicContact CG1-CD1 3.83Å; V514-I518 HydrophobicContact CG1-CG1 4.34Å; V514-I518 WeakPolarHBondContact O-CG1 3.28Å; V514-I518 PolarHBondContact O-N 3.12Å
515	N	82.1	Confident	73	Confident	85.5 Å²	85.5	60 Å²	60	46%	0.457	32%	0.32	S	S	.	.	H	α-helix	trans	-58.7	-38.3	174.9	-75.3	-22.9	0	0	0	112.7	T511 S512 N513 Y517 I518 I519	T511-N515 WeakPolarHBondContact O-CB 3.47Å; T511-N515 VanDerWaalsContact O-CG 3.26Å; T511-N515 PolarHBondContact O-N 3.38Å; T511-N515 VanDerWaalsContact O-N 3.12Å; T511-N515 PolarHBondContact O-ND2 3.02Å; T511-N515 VanDerWaalsContact O-ND2 3.09Å; S512-N515 PolarHBondContact O-N 3.34Å; N513-N515 VanDerWaalsContact C-N 3.3Å; N513-N515 PolarHBondContact O-N 3.45Å; N515-Y517 PolarHBondContact O-N 2.99Å; N515-I518 PolarHBondContact O-N 3.45Å; N515-I519 WeakPolarHBondContact O-CB 3.44Å; N515-I519 WeakPolarHBondContact O-CD1 3.29Å; N515-I519 WeakPolarHBondContact O-CG1 3.4Å; N515-I519 PolarHBondContact O-N 3.39Å
516	I	86.6	Confident	75.1	Confident	29.5 Å²	29.5	54.1 Å²	54.1	15%	0.151	30%	0.297	C	S	.	.	H	α-helix	trans	-63	-43.4	176.6	-67	168.2	0	0	0	110.8	R454 V458 S512 N513 V514 I519 L520	R454-I516 HydrophobicContact CG-CG2 3.8Å; V458-I516 HydrophobicContact CG2-CG2 4.08Å; S512-I516 WeakPolarHBondContact O-CG1 3.18Å; S512-I516 PolarHBondContact O-N 2.85Å; N513-I516 WeakPolarHBondContact O-CB 3.37Å; N513-I516 PolarHBondContact O-N 3.46Å; N513-I516 VanDerWaalsContact O-N 3.14Å; V514-I516 VanDerWaalsContact C-N 3.29Å; V514-I516 PolarHBondContact O-N 3.21Å; I516-I519 PolarHBondContact O-N 3.32Å; I516-L520 HydrophobicContact CG2-CD1 4.4Å; I516-L520 WeakPolarHBondContact O-CB 3.44Å; I516-L520 WeakPolarHBondContact O-CG 3.22Å; I516-L520 PolarHBondContact O-N 3.24Å
517	Y	88.4	Confident	77.2	Confident	22.5 Å²	22.5	51 Å²	51	9%	0.088	28%	0.277	C	S	.	.	H	α-helix	trans	-67.5	-39.2	176.9	-62.2	-62.4	0	0	0	112.5	R454 L493 T496 I497 N513 V514 N515 L520 I521	R454-Y517 VanDerWaalsContact CZ-OH 3.23Å; R454-Y517 PolarHBondContact NH1-OH 3.07Å; L493-Y517 HydrophobicContact CD2-CD1 3.8Å; L493-Y517 HydrophobicContact CD2-CE1 4.42Å; T496-Y517 HydrophobicContact CG2-CD1 4.42Å; T496-Y517 HydrophobicContact CG2-CD2 4.07Å; T496-Y517 HydrophobicContact CG2-CE1 4.11Å; T496-Y517 HydrophobicContact CG2-CE2 3.66Å; T496-Y517 HydrophobicContact CG2-CG 4.38Å; I497-Y517 HydrophobicContact CG1-CG 4.44Å; N513-Y517 WeakPolarHBondContact O-CD2 3.42Å; N513-Y517 PolarHBondContact O-N 2.97Å; V514-Y517 PolarHBondContact O-N 3.2Å; V514-Y517 VanDerWaalsContact O-N 3.14Å; N515-Y517 PolarHBondContact O-N 2.99Å; Y517-L520 WeakPolarHBondContact O-CB 3.49Å; Y517-L520 PolarHBondContact O-N 3.23Å; Y517-I521 PolarHBondContact O-N 3.43Å
518	I	87.8	Confident	79.6	Confident	32.5 Å²	32.5	45.4 Å²	45.4	17%	0.167	25%	0.251	C	S	.	.	H	α-helix	trans	-63.1	-44.3	174.7	-67.6	169.9	0	0	0	110.7	I497 V514 N515 L520 I521 R522 Y562	I497-I518 HydrophobicContact CD1-CG1 4.03Å; I497-I518 HydrophobicContact CG1-CG1 4.5Å; I497-I518 HydrophobicContact CG2-CG1 4.46Å; V514-I518 HydrophobicContact CG1-CD1 3.83Å; V514-I518 HydrophobicContact CG1-CG1 4.34Å; V514-I518 WeakPolarHBondContact O-CG1 3.28Å; V514-I518 PolarHBondContact O-N 3.12Å; N515-I518 PolarHBondContact O-N 3.45Å; I518-L520 VanDerWaalsContact C-N 3.29Å; I518-L520 PolarHBondContact O-N 3.3Å; I518-I521 PolarHBondContact O-N 3Å; I518-R522 WeakPolarHBondContact O-CG 3.35Å; I518-R522 PolarHBondContact O-N 3.22Å; I518-Y562 HydrophobicContact CD1-CD1 4.1Å; I518-Y562 HydrophobicContact CD1-CE1 3.99Å; I518-Y562 HydrophobicContact CG1-CD1 4.08Å; I518-Y562 HydrophobicContact CG1-CE1 4.32Å; I518-Y562 HydrophobicContact CG1-CG 4.47Å
519	I	89.7	Confident	81.8	Confident	72 Å²	72	41.1 Å²	41.1	37%	0.369	22%	0.221	S	C	.	.	H	α-helix	trans	-59.7	-42.8	174.9	-68.7	161.9	0	0	0	110.2	V458 N515 I516 I521 R522 Q523	V458-I519 HydrophobicContact CG1-CB 4.32Å; V458-I519 HydrophobicContact CG1-CG2 3.59Å; N515-I519 WeakPolarHBondContact O-CB 3.44Å; N515-I519 WeakPolarHBondContact O-CD1 3.29Å; N515-I519 WeakPolarHBondContact O-CG1 3.4Å; N515-I519 PolarHBondContact O-N 3.39Å; I516-I519 PolarHBondContact O-N 3.32Å; I519-I521 PolarHBondContact O-N 3.2Å; I519-R522 PolarHBondContact O-N 3.11Å; I519-Q523 HydrophobicContact CG2-CG 4.39Å; I519-Q523 WeakPolarHBondContact O-CB 3.46Å; I519-Q523 WeakPolarHBondContact O-CG 3.36Å; I519-Q523 PolarHBondContact O-N 3.28Å
520	L	92.1	Very high	83.8	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.8	-42.6	177	-120	119.9	0	0	0	112	V447 R454 F457 V458 L463 F489 L493 I516 Y517 I518 R522 Q523 M524	V447-L520 HydrophobicContact CG1-CD1 4.29Å; V447-L520 HydrophobicContact CG1-CD2 4.07Å; R454-L520 HydrophobicContact CG-CD1 3.91Å; F457-L520 HydrophobicContact CD1-CD1 3.81Å; F457-L520 HydrophobicContact CD1-CD2 3.84Å; F457-L520 HydrophobicContact CE1-CD1 3.89Å; F457-L520 HydrophobicContact CE1-CD2 4.06Å; V458-L520 HydrophobicContact CG2-CB 4.41Å; V458-L520 HydrophobicContact CG2-CD1 3.96Å; V458-L520 HydrophobicContact CG2-CD2 3.5Å; V458-L520 HydrophobicContact CG2-CG 3.56Å; L463-L520 HydrophobicContact CD1-CD1 3.51Å; L463-L520 HydrophobicContact CD1-CD2 3.97Å; L463-L520 HydrophobicContact CD1-CG 4.17Å; L463-L520 HydrophobicContact CG-CD1 4.33Å; F489-L520 HydrophobicContact CE1-CD2 3.76Å; F489-L520 HydrophobicContact CE1-CG 4.43Å; F489-L520 HydrophobicContact CZ-CD2 3.68Å; L493-L520 HydrophobicContact CD1-CB 4.02Å; L493-L520 HydrophobicContact CD1-CD2 3.63Å; L493-L520 HydrophobicContact CD1-CG 3.84Å; L493-L520 HydrophobicContact CD2-CB 4.08Å; L493-L520 HydrophobicContact CD2-CD1 3.98Å; L493-L520 HydrophobicContact CD2-CD2 3.64Å; L493-L520 HydrophobicContact CG-CD2 4.26Å; I516-L520 HydrophobicContact CG2-CD1 4.4Å; I516-L520 WeakPolarHBondContact O-CB 3.44Å; I516-L520 WeakPolarHBondContact O-CG 3.22Å; I516-L520 PolarHBondContact O-N 3.24Å; Y517-L520 WeakPolarHBondContact O-CB 3.49Å; Y517-L520 PolarHBondContact O-N 3.23Å; I518-L520 VanDerWaalsContact C-N 3.29Å; I518-L520 PolarHBondContact O-N 3.3Å; L520-R522 VanDerWaalsContact C-N 3.34Å; L520-R522 PolarHBondContact O-N 2.99Å; L520-Q523 PolarHBondContact O-N 3.2Å; L520-M524 WeakPolarHBondContact O-CB 3.25Å; L520-M524 VanDerWaalsContact O-CG 3.22Å; L520-M524 WeakPolarHBondContact O-CG 3.44Å; L520-M524 PolarHBondContact O-N 3.26Å
521	I	92.7	Very high	85.7	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-61.3	-43.6	173.9	-74	-168.4	0	0	0	111.5	L493 L494 I497 Y517 I518 I519 Q523 M524 Y525 I563	L493-I521 HydrophobicContact CB-CD1 3.88Å; L493-I521 HydrophobicContact CB-CG1 3.67Å; L493-I521 HydrophobicContact CD1-CG1 3.92Å; L493-I521 HydrophobicContact CG-CG1 4.45Å; L494-I521 HydrophobicContact CB-CD1 4.3Å; L494-I521 HydrophobicContact CD1-CD1 4.46Å; L494-I521 HydrophobicContact CD2-CD1 3.53Å; L494-I521 HydrophobicContact CG-CD1 3.7Å; I497-I521 HydrophobicContact CD1-CD1 3.4Å; I497-I521 VanDerWaalsContact CD1-CD1 3.44Å; I497-I521 HydrophobicContact CD1-CG1 4.08Å; Y517-I521 PolarHBondContact O-N 3.43Å; I518-I521 PolarHBondContact O-N 3Å; I519-I521 PolarHBondContact O-N 3.2Å; I521-Q523 VanDerWaalsContact C-N 3.31Å; I521-Q523 PolarHBondContact O-N 3.27Å; I521-M524 PolarHBondContact O-N 3.13Å; I521-Y525 WeakPolarHBondContact O-CB 3.21Å; I521-Y525 PolarHBondContact O-N 3.22Å; I521-I563 HydrophobicContact CG2-CD1 3.78Å; I521-I563 HydrophobicContact CG2-CG1 4.12Å
522	R	91.9	Very high	87.3	Confident	122.5 Å²	122.5	32.9 Å²	32.9	46%	0.462	17%	0.173	S	C	.	.	H	α-helix	trans	-62.6	-37.9	177.1	-69.1	-179.4	77.2	156.2	8.7	111.9	I518 I519 L520 G526 Y562 I563 E564	I518-R522 WeakPolarHBondContact O-CG 3.35Å; I518-R522 PolarHBondContact O-N 3.22Å; I519-R522 PolarHBondContact O-N 3.11Å; L520-R522 VanDerWaalsContact C-N 3.34Å; L520-R522 PolarHBondContact O-N 2.99Å; R522-G526 PolarHBondContact O-N 3.26Å; R522-Y562 WeakPolarHBondContact CD-O 3.3Å; R522-Y562 VanDerWaalsContact CG-O 3.28Å; R522-Y562 WeakPolarHBondContact CG-O 3.26Å; R522-I563 HydrophobicContact CG-CG1 4.49Å; R522-E564 IonicContact CZ-OE1 3.88Å; R522-E564 IonicContact NH1-OE1 3.09Å; R522-E564 PolarHBondContact NH1-OE1 3.48Å; R522-E564 IonicContact NH2-OE1 3.07Å; R522-E564 PolarHBondContact NH2-OE1 2.95Å
523	Q	92.6	Very high	88.6	Confident	22 Å²	22	33.6 Å²	33.6	10%	0.103	17%	0.168	C	C	.	.	H	α-helix	trans	-71.4	-42.6	174.7	-69.9	-175.8	9.7	0	0	112.6	L463 I519 L520 I521 Y525 G526 Y527	L463-Q523 HydrophobicContact CB-CB 4.37Å; L463-Q523 HydrophobicContact CD1-CB 3.76Å; I519-Q523 HydrophobicContact CG2-CG 4.39Å; I519-Q523 WeakPolarHBondContact O-CB 3.46Å; I519-Q523 WeakPolarHBondContact O-CG 3.36Å; I519-Q523 PolarHBondContact O-N 3.28Å; L520-Q523 PolarHBondContact O-N 3.2Å; I521-Q523 VanDerWaalsContact C-N 3.31Å; I521-Q523 PolarHBondContact O-N 3.27Å; Q523-Y525 VanDerWaalsContact C-N 3.29Å; Q523-Y525 PolarHBondContact O-N 3.05Å; Q523-G526 PolarHBondContact O-N 3.39Å; Q523-Y527 HydrophobicContact CB-CD2 3.86Å; Q523-Y527 HydrophobicContact CB-CE2 3.91Å; Q523-Y527 HydrophobicContact CG-CD2 4.22Å; Q523-Y527 HydrophobicContact CG-CE2 3.73Å; Q523-Y527 VanDerWaalsContact O-CB 3.32Å; Q523-Y527 WeakPolarHBondContact O-CB 3.16Å; Q523-Y527 WeakPolarHBondContact O-CD2 3.34Å; Q523-Y527 PolarHBondContact O-N 2.93Å
524	M	93.3	Very high	89.8	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.155	C	C	.	.	I	π-helix	trans	-58.1	-43.8	174.3	-75.7	-65.6	-66.7	0	0	110.9	F444 L463 I486 F489 T490 L493 L520 I521 L528 L529	F444-M524 HydrophobicContact CE1-SD 4.39Å; F444-M524 HydrophobicContact CE2-CE 4.44Å; F444-M524 HydrophobicContact CZ-CE 4.08Å; F444-M524 HydrophobicContact CZ-SD 3.98Å; L463-M524 HydrophobicContact CD1-CG 3.77Å; L463-M524 HydrophobicContact CD1-SD 3.64Å; L463-M524 VanDerWaalsContact CD1-SD 3.56Å; L463-M524 HydrophobicContact CD2-CG 4.44Å; L463-M524 HydrophobicContact CD2-SD 3.43Å; L463-M524 VanDerWaalsContact CD2-SD 3.53Å; L463-M524 WeakPolarHBondContact CD2-SD 3Å; L463-M524 HydrophobicContact CG-SD 4.13Å; I486-M524 HydrophobicContact CB-CE 4.4Å; I486-M524 HydrophobicContact CG2-CE 3.69Å; I486-M524 VanDerWaalsContact O-CE 3.23Å; I486-M524 WeakPolarHBondContact O-CE 3.43Å; F489-M524 HydrophobicContact CB-CE 4.47Å; F489-M524 HydrophobicContact CD1-CE 3.96Å; F489-M524 HydrophobicContact CD1-CG 4.34Å; F489-M524 HydrophobicContact CD1-SD 3.9Å; F489-M524 HydrophobicContact CE1-CG 4.45Å; F489-M524 HydrophobicContact CE1-SD 4.19Å; T490-M524 WeakPolarHBondContact OG1-CE 3.31Å; L493-M524 HydrophobicContact CD1-CG 4.06Å; L520-M524 WeakPolarHBondContact O-CB 3.25Å; L520-M524 VanDerWaalsContact O-CG 3.22Å; L520-M524 WeakPolarHBondContact O-CG 3.44Å; L520-M524 PolarHBondContact O-N 3.26Å; I521-M524 PolarHBondContact O-N 3.13Å; M524-L528 HydrophobicContact CE-CD1 4.25Å; M524-L528 WeakPolarHBondContact O-CB 3Å; M524-L528 PolarHBondContact O-N 3.18Å; M524-L528 HydrophobicContact SD-CD1 4.07Å; M524-L529 PolarHBondContact O-N 2.99Å
525	Y	93.2	Very high	90.6	Very high	14.5 Å²	14.5	31.1 Å²	31.1	6%	0.057	15%	0.154	C	C	.	.	I	π-helix	trans	-62.6	-63.3	175.2	-176.2	-110	0	0	0	111.5	I521 Q523 Y527 L529 S530 L550 F554 I563 T568	I521-Y525 WeakPolarHBondContact O-CB 3.21Å; I521-Y525 PolarHBondContact O-N 3.22Å; Q523-Y525 VanDerWaalsContact C-N 3.29Å; Q523-Y525 PolarHBondContact O-N 3.05Å; Y525-Y527 VanDerWaalsContact C-N 3.34Å; Y525-Y527 PolarHBondContact O-N 3.17Å; Y525-L529 HydrophobicContact CD2-CB 4.3Å; Y525-L529 PolarHBondContact O-N 3.31Å; Y525-L529 VanDerWaalsContact O-N 3.15Å; Y525-S530 VanDerWaalsContact CZ-CB 3.49Å; Y525-S530 WeakPolarHBondContact O-CB 3.47Å; Y525-S530 PolarHBondContact O-N 2.84Å; Y525-S530 PolarHBondContact O-OG 3.23Å; Y525-S530 VanDerWaalsContact O-OG 3.07Å; Y525-L550 HydrophobicContact CE2-CD2 4.35Å; Y525-F554 HydrophobicContact CD2-CD1 4.42Å; Y525-F554 AromaticContact CD2-CE1 3.28Å; Y525-F554 HydrophobicContact CD2-CE1 3.28Å; Y525-F554 HydrophobicContact CD2-CE2 4.37Å; Y525-F554 AromaticContact CD2-CZ 3.36Å; Y525-F554 HydrophobicContact CD2-CZ 3.36Å; Y525-F554 VanDerWaalsContact CD2-CZ 3.5Å; Y525-F554 HydrophobicContact CE2-CD1 4.46Å; Y525-F554 AromaticContact CE2-CE1 3.66Å; Y525-F554 HydrophobicContact CE2-CE1 3.66Å; Y525-F554 HydrophobicContact CE2-CZ 4.21Å; Y525-F554 HydrophobicContact CG-CE1 4.16Å; Y525-F554 AromaticContact CG-CZ 3.79Å; Y525-F554 HydrophobicContact CG-CZ 3.95Å; Y525-I563 HydrophobicContact CD1-CD1 4.34Å; Y525-I563 HydrophobicContact CD1-CG2 3.76Å; Y525-I563 HydrophobicContact CD2-CD1 4.16Å; Y525-I563 HydrophobicContact CE1-CG2 3.91Å; Y525-I563 HydrophobicContact CG-CD1 3.79Å; Y525-I563 HydrophobicContact CG-CG1 4.5Å; Y525-I563 HydrophobicContact CG-CG2 4.24Å; Y525-T568 VanDerWaalsContact OH-CA 3.26Å; Y525-T568 WeakPolarHBondContact OH-CA 3.33Å; Y525-T568 WeakPolarHBondContact OH-CB 3.23Å; Y525-T568 WeakPolarHBondContact OH-CG2 3.33Å; Y525-T568 PolarHBondContact OH-OG1 2.89Å
526	G	90.2	Very high	90.9	Very high	32 Å²	32	27.6 Å²	27.6	33%	0.33	14%	0.137	S	C	.	.	I	π-helix	trans	-67.6	-31.7	-169.4	0	0	0	0	0	115	R522 Q523	R522-G526 PolarHBondContact O-N 3.26Å; Q523-G526 PolarHBondContact O-N 3.39Å
527	Y	92.1	Very high	90.9	Very high	66 Å²	66	28.8 Å²	28.8	26%	0.259	14%	0.141	S	C	.	.	I	π-helix	trans	-97.8	-29.4	-175.8	-55.9	-36.7	0	0	0	113.7	L463 L464 A467 Q523 Y525 N531	L463-Y527 HydrophobicContact CB-CD2 4.26Å; L464-Y527 HydrophobicContact CB-CD2 3.85Å; L464-Y527 HydrophobicContact CB-CE2 3.8Å; L464-Y527 HydrophobicContact CB-CG 4.26Å; L464-Y527 HydrophobicContact CD1-CD1 3.78Å; L464-Y527 HydrophobicContact CD1-CE1 3.89Å; L464-Y527 HydrophobicContact CD1-CG 4.11Å; A467-Y527 VanDerWaalsContact CB-O 3.29Å; A467-Y527 WeakPolarHBondContact CB-O 3.36Å; Q523-Y527 HydrophobicContact CB-CD2 3.86Å; Q523-Y527 HydrophobicContact CB-CE2 3.91Å; Q523-Y527 HydrophobicContact CG-CD2 4.22Å; Q523-Y527 HydrophobicContact CG-CE2 3.73Å; Q523-Y527 VanDerWaalsContact O-CB 3.32Å; Q523-Y527 WeakPolarHBondContact O-CB 3.16Å; Q523-Y527 WeakPolarHBondContact O-CD2 3.34Å; Q523-Y527 PolarHBondContact O-N 2.93Å; Y525-Y527 VanDerWaalsContact C-N 3.34Å; Y525-Y527 PolarHBondContact O-N 3.17Å; Y527-N531 WeakPolarHBondContact O-CB 3.34Å; Y527-N531 PolarHBondContact O-ND2 2.81Å
528	L	92.9	Very high	90.9	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	14%	0.139	C	C	.	.	I	π-helix	trans	-113.9	-65	-179.2	-65.9	172.6	0	0	0	112	L463 A467 L470 I486 M524 S530 N531 L534 W535	L463-L528 HydrophobicContact CD2-CD1 3.7Å; L463-L528 VanDerWaalsContact CD2-CD1 3.44Å; L463-L528 HydrophobicContact CD2-CG 3.94Å; A467-L528 HydrophobicContact CB-CD2 3.75Å; A467-L528 HydrophobicContact CB-CG 4.35Å; L470-L528 HydrophobicContact CD1-CD2 4.2Å; I486-L528 HydrophobicContact CD1-CD1 4.25Å; I486-L528 HydrophobicContact CG1-CD1 4.18Å; I486-L528 HydrophobicContact CG2-CB 4.42Å; I486-L528 HydrophobicContact CG2-CD1 4.25Å; M524-L528 HydrophobicContact CE-CD1 4.25Å; M524-L528 WeakPolarHBondContact O-CB 3Å; M524-L528 PolarHBondContact O-N 3.18Å; M524-L528 HydrophobicContact SD-CD1 4.07Å; L528-S530 PolarHBondContact O-N 3.15Å; L528-N531 WeakPolarHBondContact O-CB 3.33Å; L528-N531 PolarHBondContact O-N 3.27Å; L528-L534 HydrophobicContact CD2-CD2 3.89Å; L528-W535 PolarHBondContact O-NE1 3.06Å
529	L	93.1	Very high	90.9	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	16%	0.156	C	C	.	.	I	π-helix	trans	-68.5	-37.1	-166.4	-61.3	170.3	0	0	0	114.1	I486 T490 M524 Y525 L546 F549 L550 F554	I486-L529 HydrophobicContact CG2-CD2 3.84Å; I486-L529 HydrophobicContact CG2-CG 4.49Å; T490-L529 HydrophobicContact CG2-CD1 4.11Å; M524-L529 PolarHBondContact O-N 2.99Å; Y525-L529 HydrophobicContact CD2-CB 4.3Å; Y525-L529 PolarHBondContact O-N 3.31Å; Y525-L529 VanDerWaalsContact O-N 3.15Å; L529-L546 HydrophobicContact CB-CD1 4.47Å; L529-L546 HydrophobicContact CD2-CD1 3.72Å; L529-F549 HydrophobicContact CD1-CE1 4.16Å; L529-F549 HydrophobicContact CD2-CD1 4.43Å; L529-F549 HydrophobicContact CD2-CE1 4.21Å; L529-L550 HydrophobicContact CB-CD2 4.24Å; L529-F554 HydrophobicContact CD1-CD2 3.99Å; L529-F554 HydrophobicContact CD1-CE2 3.53Å; L529-F554 VanDerWaalsContact CD1-CE2 3.48Å; L529-F554 HydrophobicContact CD1-CZ 3.94Å
530	S	91	Very high	90.7	Very high	11.5 Å²	11.5	28.6 Å²	28.6	8%	0.08	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	3.5	178.1	70	0	0	0	0	113.9	Y525 L528 S532 H571	Y525-S530 VanDerWaalsContact CZ-CB 3.49Å; Y525-S530 WeakPolarHBondContact O-CB 3.47Å; Y525-S530 PolarHBondContact O-N 2.84Å; Y525-S530 PolarHBondContact O-OG 3.23Å; Y525-S530 VanDerWaalsContact O-OG 3.07Å; L528-S530 PolarHBondContact O-N 3.15Å; S530-S532 PolarHBondContact O-N 2.78Å; S530-S532 VanDerWaalsContact O-N 3.1Å; S530-H571 PolarHBondContact OG-CD2 3.06Å
531	N	91.5	Very high	90.6	Very high	33 Å²	33	34.1 Å²	34.1	18%	0.176	18%	0.176	C	C	.	.			trans	-80.4	89.7	-177.7	-174.6	-10.3	0	0	0	110.5	N471 Y527 L528 E533 L534 W535	N471-N531 PolarHBondContact OD1-ND2 2.76Å; N471-N531 VanDerWaalsContact OD1-ND2 3.14Å; Y527-N531 WeakPolarHBondContact O-CB 3.34Å; Y527-N531 PolarHBondContact O-ND2 2.81Å; L528-N531 WeakPolarHBondContact O-CB 3.33Å; L528-N531 PolarHBondContact O-N 3.27Å; N531-E533 VanDerWaalsContact C-N 3.29Å; N531-E533 PolarHBondContact O-N 3.07Å; N531-E533 WeakPolarHBondContact OD1-CB 3.37Å; N531-E533 PolarHBondContact OD1-N 2.88Å; N531-L534 HydrophobicContact CB-CB 4.08Å; N531-L534 WeakPolarHBondContact O-CB 3.47Å; N531-L534 PolarHBondContact O-N 3.25Å; N531-L534 PolarHBondContact OD1-N 3.22Å; N531-W535 PolarHBondContact O-N 3.14Å
532	S	90.1	Very high	90.5	Very high	13 Å²	13	34.3 Å²	34.3	9%	0.091	18%	0.177	C	C	.	.	H	α-helix	trans	-66.5	-26.9	-178.4	-58.3	0	0	0	0	113.1	S530 L534 C536 A575 Y579	S530-S532 PolarHBondContact O-N 2.78Å; S530-S532 VanDerWaalsContact O-N 3.1Å; S532-L534 VanDerWaalsContact C-N 3.35Å; S532-C536 VanDerWaalsContact O-CB 3.26Å; S532-C536 WeakPolarHBondContact O-CB 3.15Å; S532-C536 PolarHBondContact O-N 3.36Å; S532-C536 PolarHBondContact O-SG 3.45Å; S532-A575 WeakPolarHBondContact OG-CB 3.46Å; S532-Y579 VanDerWaalsContact CB-CD2 3.44Å
533	E	89.2	Confident	90.5	Very high	90 Å²	90	28.5 Å²	28.5	42%	0.421	16%	0.155	S	C	.	.	H	α-helix	trans	-68.2	-33.7	176	-163.9	-162.4	136.2	0	0	112.4	N471 N531 C536 K537 Y579	N471-E533 PolarHBondContact ND2-OE1 3.15Å; N471-E533 PolarHBondContact ND2-OE2 3.31Å; N531-E533 VanDerWaalsContact C-N 3.29Å; N531-E533 PolarHBondContact O-N 3.07Å; N531-E533 WeakPolarHBondContact OD1-CB 3.37Å; N531-E533 PolarHBondContact OD1-N 2.88Å; E533-C536 PolarHBondContact O-SG 3.29Å; E533-K537 WeakPolarHBondContact O-CE 3.46Å; E533-Y579 HydrophobicContact CB-CE1 4.3Å; E533-Y579 WeakPolarHBondContact CB-OH 3.46Å
534	L	90.3	Very high	90.5	Very high	0.5 Å²	0.5	29.9 Å²	29.9	0%	0.003	16%	0.162	C	C	.	.	H	α-helix	trans	-67.9	-55.3	173	179.1	61.3	0	0	0	110.5	L470 N471 L478 L528 N531 S532 C536 K537	L470-L534 HydrophobicContact CB-CD1 3.7Å; N471-L534 HydrophobicContact CB-CD1 4.2Å; N471-L534 VanDerWaalsContact OD1-CB 3.28Å; N471-L534 WeakPolarHBondContact OD1-CB 3.47Å; N471-L534 WeakPolarHBondContact OD1-CD1 2.95Å; L478-L534 HydrophobicContact CD1-CD1 4.31Å; L478-L534 VanDerWaalsContact CD1-O 3.22Å; L478-L534 WeakPolarHBondContact CD1-O 3.37Å; L478-L534 HydrophobicContact CD2-CD1 3.8Å; L478-L534 HydrophobicContact CD2-CG 4.38Å; L528-L534 HydrophobicContact CD2-CD2 3.89Å; N531-L534 HydrophobicContact CB-CB 4.08Å; N531-L534 WeakPolarHBondContact O-CB 3.47Å; N531-L534 PolarHBondContact O-N 3.25Å; N531-L534 PolarHBondContact OD1-N 3.22Å; S532-L534 VanDerWaalsContact C-N 3.35Å; L534-C536 PolarHBondContact O-N 2.91Å; L534-K537 PolarHBondContact O-N 3.28Å
535	W	92.1	Very high	90.5	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-80.8	-16.7	-168.3	-62.1	108.9	0	0	0	114.3	L478 L483 I486 L528 N531 K537 A538 V542 Q543 L546	L478-W535 HydrophobicContact CD2-CZ3 4.46Å; L483-W535 HydrophobicContact CB-CH2 4.16Å; L483-W535 HydrophobicContact CB-CZ3 4.39Å; L483-W535 HydrophobicContact CD1-CH2 3.89Å; L483-W535 HydrophobicContact CD1-CZ2 4.07Å; L483-W535 HydrophobicContact CD1-CZ3 4.37Å; I486-W535 HydrophobicContact CD1-CH2 4.1Å; I486-W535 HydrophobicContact CD1-CZ2 4.09Å; L528-W535 PolarHBondContact O-NE1 3.06Å; N531-W535 PolarHBondContact O-N 3.14Å; W535-K537 PolarHBondContact O-N 3.02Å; W535-A538 HydrophobicContact CE3-CB 3.95Å; W535-A538 HydrophobicContact CZ3-CB 4.47Å; W535-A538 WeakPolarHBondContact O-CB 3.36Å; W535-A538 PolarHBondContact O-N 3.37Å; W535-V542 HydrophobicContact CE3-CG1 4.08Å; W535-V542 HydrophobicContact CZ3-CG1 3.8Å; W535-Q543 VanDerWaalsContact O-CD 3.24Å; W535-Q543 VanDerWaalsContact O-CG 3.26Å; W535-Q543 WeakPolarHBondContact O-CG 3.36Å; W535-Q543 PolarHBondContact O-NE2 3.08Å; W535-Q543 VanDerWaalsContact O-NE2 3.11Å; W535-L546 HydrophobicContact CB-CD2 4Å; W535-L546 HydrophobicContact CD2-CD2 3.83Å; W535-L546 HydrophobicContact CG-CD2 3.44Å; W535-L546 VanDerWaalsContact CG-CD2 3.44Å
536	C	88.2	Confident	90.6	Very high	12 Å²	12	31.1 Å²	31.1	8%	0.081	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.4	173.6	71.2	0	0	0	0	112.9	S532 E533 L534 Q543 Y579 I601	S532-C536 VanDerWaalsContact O-CB 3.26Å; S532-C536 WeakPolarHBondContact O-CB 3.15Å; S532-C536 PolarHBondContact O-N 3.36Å; S532-C536 PolarHBondContact O-SG 3.45Å; E533-C536 PolarHBondContact O-SG 3.29Å; L534-C536 PolarHBondContact O-N 2.91Å; C536-Q543 PolarHBondContact O-NE2 2.79Å; C536-Y579 HydrophobicContact CB-CD1 3.85Å; C536-Y579 HydrophobicContact CB-CE1 4.44Å; C536-I601 HydrophobicContact CB-CD1 3.81Å
537	K	86.1	Confident	90.8	Very high	55.5 Å²	55.5	30.1 Å²	30.1	24%	0.241	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-16.9	175.2	-59.9	176.8	-172.8	175.8	0	113.3	N471 M475 L478 E533 L534 W535 P596	N471-K537 PolarHBondContact O-NZ 2.91Å; N471-K537 PolarHBondContact OD1-NZ 3.27Å; M475-K537 WeakPolarHBondContact CB-O 3.46Å; M475-K537 HydrophobicContact CG-CB 4.07Å; L478-K537 HydrophobicContact CD1-CB 3.82Å; E533-K537 WeakPolarHBondContact O-CE 3.46Å; L534-K537 PolarHBondContact O-N 3.28Å; W535-K537 PolarHBondContact O-N 3.02Å; K537-P596 HydrophobicContact CG-CG 4.3Å
538	A	88.3	Confident	90.8	Very high	7 Å²	7	31 Å²	31	6%	0.058	16%	0.161	C	C	.	.	S	Bend	trans	-79.8	160.8	-178.3	0	0	0	0	0	111.7	L478 W535 V542 Q543	L478-A538 HydrophobicContact CB-CB 3.7Å; L478-A538 HydrophobicContact CD1-CB 4.01Å; W535-A538 HydrophobicContact CE3-CB 3.95Å; W535-A538 HydrophobicContact CZ3-CB 4.47Å; W535-A538 WeakPolarHBondContact O-CB 3.36Å; W535-A538 PolarHBondContact O-N 3.37Å; A538-V542 HydrophobicContact CB-CB 4.32Å; A538-V542 HydrophobicContact CB-CG1 4.19Å; A538-Q543 HydrophobicContact CB-CG 4.4Å; A538-Q543 PolarHBondContact O-NE2 3.29Å
539	T	87.9	Confident	90.9	Very high	85 Å²	85	31.6 Å²	31.6	52%	0.521	16%	0.163	S	C	.	.			trans	-61.9	149.3	174.2	64.5	0	0	0	0	111.4	D541 V542 Q543	T539-D541 PolarHBondContact O-N 3.04Å; T539-D541 VanDerWaalsContact O-N 3.14Å; T539-V542 WeakPolarHBondContact O-CB 3.47Å; T539-V542 PolarHBondContact O-N 3.04Å; T539-V542 WeakPolarHBondContact OG1-CG2 3.25Å; T539-Q543 PolarHBondContact O-N 3.14Å; T539-Q543 VanDerWaalsContact O-N 3.09Å
540	L	86.9	Confident	90.9	Very high	30.5 Å²	30.5	31.8 Å²	31.8	16%	0.16	16%	0.164	C	C	.	.	H	α-helix	trans	-60.1	-30.6	-175.4	-66.8	167.9	0	0	0	112.8	V542 Q543 E544 I601 K606 L610	L540-V542 VanDerWaalsContact C-N 3.34Å; L540-V542 PolarHBondContact O-N 2.9Å; L540-Q543 PolarHBondContact O-N 3.16Å; L540-E544 WeakPolarHBondContact O-CB 3.41Å; L540-E544 PolarHBondContact O-N 2.99Å; L540-I601 HydrophobicContact CD2-CG2 4.12Å; L540-K606 HydrophobicContact CB-CD 4.45Å; L540-K606 HydrophobicContact CD1-CB 3.92Å; L540-K606 HydrophobicContact CD1-CD 3.4Å; L540-K606 VanDerWaalsContact CD1-CD 3.48Å; L540-K606 HydrophobicContact CD1-CG 4.31Å; L540-K606 HydrophobicContact CG-CD 4.47Å; L540-L610 HydrophobicContact CD2-CD1 3.68Å
541	D	88.5	Confident	90.9	Very high	116 Å²	116	31.4 Å²	31.4	62%	0.62	16%	0.162	S	C	*	.	H	α-helix	trans	-67.9	-34.4	177.3	-52.9	-30.2	0	0	0	111.8	T539 Q545	T539-D541 PolarHBondContact O-N 3.04Å; T539-D541 VanDerWaalsContact O-N 3.14Å; D541-Q545 PolarHBondContact O-N 2.67Å; D541-Q545 VanDerWaalsContact O-N 3.14Å
542	V	91.1	Very high	90.8	Very high	4 Å²	4	33 Å²	33	2%	0.024	17%	0.173	C	C	.	.	H	α-helix	trans	-73.3	-41.9	175.1	176.5	0	0	0	0	110.5	K480 L483 W535 A538 T539 L540 E544 Q545 L546	K480-V542 HydrophobicContact CB-CG2 4.1Å; L483-V542 HydrophobicContact CB-CG1 4.19Å; L483-V542 HydrophobicContact CD2-CG1 3.83Å; L483-V542 WeakPolarHBondContact CD2-O 3.05Å; W535-V542 HydrophobicContact CE3-CG1 4.08Å; W535-V542 HydrophobicContact CZ3-CG1 3.8Å; A538-V542 HydrophobicContact CB-CB 4.32Å; A538-V542 HydrophobicContact CB-CG1 4.19Å; T539-V542 WeakPolarHBondContact O-CB 3.47Å; T539-V542 PolarHBondContact O-N 3.04Å; T539-V542 WeakPolarHBondContact OG1-CG2 3.25Å; L540-V542 VanDerWaalsContact C-N 3.34Å; L540-V542 PolarHBondContact O-N 2.9Å; V542-E544 VanDerWaalsContact C-N 3.31Å; V542-E544 PolarHBondContact O-N 3.46Å; V542-Q545 PolarHBondContact O-N 3.2Å; V542-L546 PolarHBondContact O-N 2.71Å
543	Q	92.4	Very high	90.8	Very high	1.5 Å²	1.5	36.4 Å²	36.4	1%	0.007	19%	0.19	C	C	.	.	H	α-helix	trans	-61	-41.1	173.5	-63.4	-175.5	36.3	0	0	111.5	W535 C536 A538 T539 L540 L546 Y547 L610	W535-Q543 VanDerWaalsContact O-CD 3.24Å; W535-Q543 VanDerWaalsContact O-CG 3.26Å; W535-Q543 WeakPolarHBondContact O-CG 3.36Å; W535-Q543 PolarHBondContact O-NE2 3.08Å; W535-Q543 VanDerWaalsContact O-NE2 3.11Å; C536-Q543 PolarHBondContact O-NE2 2.79Å; A538-Q543 HydrophobicContact CB-CG 4.4Å; A538-Q543 PolarHBondContact O-NE2 3.29Å; T539-Q543 PolarHBondContact O-N 3.14Å; T539-Q543 VanDerWaalsContact O-N 3.09Å; L540-Q543 PolarHBondContact O-N 3.16Å; Q543-L546 PolarHBondContact O-N 3.17Å; Q543-Y547 HydrophobicContact CB-CE2 4.33Å; Q543-Y547 WeakPolarHBondContact O-CD2 3.32Å; Q543-Y547 PolarHBondContact O-N 2.9Å; Q543-Y547 VanDerWaalsContact O-N 3.08Å; Q543-L610 HydrophobicContact CB-CD1 4.07Å; Q543-L610 HydrophobicContact CB-CD2 3.9Å
544	E	92	Very high	90.9	Very high	51.5 Å²	51.5	32.2 Å²	32.2	24%	0.241	17%	0.17	C	C	.	.	H	α-helix	trans	-62.4	-46.7	178	-163.5	-178.3	154.9	0	0	110.9	L540 V542 L546 Y547 Q548 L610 N613	L540-E544 WeakPolarHBondContact O-CB 3.41Å; L540-E544 PolarHBondContact O-N 2.99Å; V542-E544 VanDerWaalsContact C-N 3.31Å; V542-E544 PolarHBondContact O-N 3.46Å; E544-L546 VanDerWaalsContact C-N 3.33Å; E544-L546 PolarHBondContact O-N 3.21Å; E544-Y547 PolarHBondContact O-N 2.98Å; E544-Q548 HydrophobicContact CG-CG 4.49Å; E544-Q548 WeakPolarHBondContact O-CB 3.29Å; E544-Q548 VanDerWaalsContact O-CG 3.28Å; E544-Q548 WeakPolarHBondContact O-CG 3.28Å; E544-Q548 PolarHBondContact O-N 2.98Å; E544-Q548 PolarHBondContact OE1-NE2 3.4Å; E544-L610 VanDerWaalsContact CA-CD2 3.43Å; E544-L610 HydrophobicContact CB-CD2 3.76Å; E544-L610 HydrophobicContact CG-CD2 4.27Å; E544-N613 VanDerWaalsContact CG-ND2 3.27Å; E544-N613 WeakPolarHBondContact CG-ND2 3.23Å
545	Q	93.1	Very high	90.7	Very high	39 Å²	39	32.3 Å²	32.3	18%	0.182	17%	0.171	C	C	.	.	H	α-helix	trans	-61.6	-39.6	177.2	-176.3	176.4	-9.9	0	0	112.7	K480 L483 D484 D541 V542 Q548 F549	K480-Q545 VanDerWaalsContact CG-OE1 3.27Å; L483-Q545 HydrophobicContact CD2-CB 3.94Å; L483-Q545 HydrophobicContact CD2-CG 3.97Å; D484-Q545 PolarHBondContact OD1-NE2 3.28Å; D541-Q545 PolarHBondContact O-N 2.67Å; D541-Q545 VanDerWaalsContact O-N 3.14Å; V542-Q545 PolarHBondContact O-N 3.2Å; Q545-Q548 PolarHBondContact O-N 3.24Å; Q545-F549 WeakPolarHBondContact O-CB 3.31Å; Q545-F549 PolarHBondContact O-N 3Å
546	L	94.7	Very high	90.4	Very high	0.5 Å²	0.5	35.4 Å²	35.4	0%	0.003	19%	0.185	C	C	.	.	H	α-helix	trans	-60.8	-49.9	176	172.5	67.1	0	0	0	111.3	L483 L529 W535 V542 Q543 E544 Q548 F549 L550	L483-L546 HydrophobicContact CD1-CB 4.25Å; L483-L546 HydrophobicContact CD1-CD1 3.9Å; L483-L546 HydrophobicContact CD2-CB 3.99Å; L529-L546 HydrophobicContact CB-CD1 4.47Å; L529-L546 HydrophobicContact CD2-CD1 3.72Å; W535-L546 HydrophobicContact CB-CD2 4Å; W535-L546 HydrophobicContact CD2-CD2 3.83Å; W535-L546 HydrophobicContact CG-CD2 3.44Å; W535-L546 VanDerWaalsContact CG-CD2 3.44Å; V542-L546 PolarHBondContact O-N 2.71Å; Q543-L546 PolarHBondContact O-N 3.17Å; E544-L546 VanDerWaalsContact C-N 3.33Å; E544-L546 PolarHBondContact O-N 3.21Å; L546-Q548 VanDerWaalsContact C-N 3.33Å; L546-Q548 PolarHBondContact O-N 3.42Å; L546-F549 WeakPolarHBondContact O-CB 3.34Å; L546-F549 PolarHBondContact O-N 3.24Å; L546-L550 HydrophobicContact CD1-CD1 4.34Å; L546-L550 HydrophobicContact CD1-CG 4.37Å; L546-L550 HydrophobicContact CG-CD1 4.28Å; L546-L550 WeakPolarHBondContact O-CG 3.4Å; L546-L550 PolarHBondContact O-N 3Å
547	Y	94.3	Very high	90.4	Very high	10.5 Å²	10.5	34.8 Å²	34.8	4%	0.041	18%	0.182	C	C	.	.	H	α-helix	trans	-70.3	-31.1	-179	-61.8	-46.8	0	0	0	112.4	Q543 E544 L550 A551 L580 L610 L614	Q543-Y547 HydrophobicContact CB-CE2 4.33Å; Q543-Y547 WeakPolarHBondContact O-CD2 3.32Å; Q543-Y547 PolarHBondContact O-N 2.9Å; Q543-Y547 VanDerWaalsContact O-N 3.08Å; E544-Y547 PolarHBondContact O-N 2.98Å; Y547-L550 HydrophobicContact CD1-CD1 4.11Å; Y547-L550 PolarHBondContact O-N 3.31Å; Y547-A551 VanDerWaalsContact O-CB 3.29Å; Y547-A551 WeakPolarHBondContact O-CB 3.26Å; Y547-A551 PolarHBondContact O-N 3.49Å; Y547-L580 HydrophobicContact CE2-CD1 3.99Å; Y547-L610 HydrophobicContact CD2-CB 4.27Å; Y547-L610 HydrophobicContact CD2-CD2 4.05Å; Y547-L610 HydrophobicContact CE2-CB 4.37Å; Y547-L610 HydrophobicContact CE2-CD2 4.43Å; Y547-L614 HydrophobicContact CD1-CD1 4.23Å; Y547-L614 HydrophobicContact CD1-CD2 3.46Å; Y547-L614 VanDerWaalsContact CD1-CD2 3.46Å; Y547-L614 HydrophobicContact CD1-CG 3.71Å; Y547-L614 HydrophobicContact CD2-CG 4.39Å; Y547-L614 HydrophobicContact CE1-CD1 3.98Å; Y547-L614 HydrophobicContact CE1-CD2 3.76Å; Y547-L614 HydrophobicContact CE1-CG 3.98Å; Y547-L614 HydrophobicContact CE2-CD1 4.4Å; Y547-L614 HydrophobicContact CG-CD2 4.16Å; Y547-L614 HydrophobicContact CG-CG 3.96Å
548	Q	93.7	Very high	90.5	Very high	85 Å²	85	32.6 Å²	32.6	40%	0.397	17%	0.173	S	C	.	.	H	α-helix	trans	-62.9	-46.5	169.5	-74.4	178.3	7.7	0	0	111.5	E544 Q545 L546 L550 A551 T552	E544-Q548 HydrophobicContact CG-CG 4.49Å; E544-Q548 WeakPolarHBondContact O-CB 3.29Å; E544-Q548 VanDerWaalsContact O-CG 3.28Å; E544-Q548 WeakPolarHBondContact O-CG 3.28Å; E544-Q548 PolarHBondContact O-N 2.98Å; E544-Q548 PolarHBondContact OE1-NE2 3.4Å; Q545-Q548 PolarHBondContact O-N 3.24Å; L546-Q548 VanDerWaalsContact C-N 3.33Å; L546-Q548 PolarHBondContact O-N 3.42Å; Q548-L550 PolarHBondContact O-N 3.06Å; Q548-A551 PolarHBondContact O-N 2.95Å; Q548-T552 WeakPolarHBondContact O-CB 3.38Å; Q548-T552 WeakPolarHBondContact O-CG2 3.43Å; Q548-T552 PolarHBondContact O-N 3.38Å; Q548-T552 PolarHBondContact O-OG1 3.11Å
549	F	94.5	Very high	90.3	Very high	13.5 Å²	13.5	35.4 Å²	35.4	6%	0.059	19%	0.192	C	C	.	.	H	α-helix	trans	-60.2	-44.7	175.8	171.7	-102	0	0	0	112	T487 T490 L491 L529 Q545 L546 A551 T552 D553 F554	T487-F549 HydrophobicContact CG2-CB 4.26Å; T487-F549 HydrophobicContact CG2-CD1 3.65Å; T487-F549 HydrophobicContact CG2-CD2 3.84Å; T487-F549 HydrophobicContact CG2-CE1 3.87Å; T487-F549 HydrophobicContact CG2-CE2 4.04Å; T487-F549 HydrophobicContact CG2-CG 3.63Å; T487-F549 HydrophobicContact CG2-CZ 4.06Å; T490-F549 HydrophobicContact CG2-CE1 4.28Å; T490-F549 HydrophobicContact CG2-CZ 3.96Å; L491-F549 HydrophobicContact CD1-CE2 4.31Å; L491-F549 HydrophobicContact CD2-CE2 4Å; L491-F549 HydrophobicContact CD2-CZ 4.5Å; L491-F549 HydrophobicContact CG-CE2 3.97Å; L491-F549 HydrophobicContact CG-CZ 4.45Å; L529-F549 HydrophobicContact CD1-CE1 4.16Å; L529-F549 HydrophobicContact CD2-CD1 4.43Å; L529-F549 HydrophobicContact CD2-CE1 4.21Å; Q545-F549 WeakPolarHBondContact O-CB 3.31Å; Q545-F549 PolarHBondContact O-N 3Å; L546-F549 WeakPolarHBondContact O-CB 3.34Å; L546-F549 PolarHBondContact O-N 3.24Å; F549-A551 VanDerWaalsContact C-N 3.34Å; F549-A551 PolarHBondContact O-N 3.19Å; F549-T552 PolarHBondContact O-N 3.02Å; F549-T552 PolarHBondContact O-OG1 3.45Å; F549-D553 HydrophobicContact CD2-CB 4.08Å; F549-D553 HydrophobicContact CE2-CB 3.9Å; F549-D553 PolarHBondContact O-N 3.1Å; F549-F554 HydrophobicContact CD1-CB 4.28Å; F549-F554 HydrophobicContact CE1-CB 3.97Å; F549-F554 AromaticContact CE1-CD2 3.9Å; F549-F554 HydrophobicContact CE1-CD2 3.9Å; F549-F554 HydrophobicContact CE1-CG 4.25Å; F549-F554 HydrophobicContact CZ-CB 4.32Å; F549-F554 HydrophobicContact CZ-CD2 4.23Å; F549-F554 WeakPolarHBondContact O-CB 3.37Å; F549-F554 PolarHBondContact O-N 3.24Å; F549-F554 VanDerWaalsContact O-N 3.15Å
550	L	93.8	Very high	90	Very high	5.5 Å²	5.5	35.4 Å²	35.4	3%	0.029	19%	0.188	C	C	.	.	H	α-helix	trans	-59.6	-44.8	175.1	-74.2	175.2	0	0	0	111.8	Y525 L529 L546 Y547 Q548 T552 F554 Y617	Y525-L550 HydrophobicContact CE2-CD2 4.35Å; L529-L550 HydrophobicContact CB-CD2 4.24Å; L546-L550 HydrophobicContact CD1-CD1 4.34Å; L546-L550 HydrophobicContact CD1-CG 4.37Å; L546-L550 HydrophobicContact CG-CD1 4.28Å; L546-L550 WeakPolarHBondContact O-CG 3.4Å; L546-L550 PolarHBondContact O-N 3Å; Y547-L550 HydrophobicContact CD1-CD1 4.11Å; Y547-L550 PolarHBondContact O-N 3.31Å; Q548-L550 PolarHBondContact O-N 3.06Å; L550-T552 VanDerWaalsContact C-N 3.29Å; L550-T552 PolarHBondContact O-N 3.21Å; L550-F554 HydrophobicContact CD2-CB 4.16Å; L550-F554 HydrophobicContact CD2-CD1 3.5Å; L550-F554 VanDerWaalsContact CD2-CD1 3.44Å; L550-F554 HydrophobicContact CD2-CE1 3.98Å; L550-F554 HydrophobicContact CD2-CG 3.85Å; L550-Y617 HydrophobicContact CB-CD1 4.26Å; L550-Y617 HydrophobicContact CB-CE1 4.12Å; L550-Y617 VanDerWaalsContact O-CD2 3.26Å; L550-Y617 WeakPolarHBondContact O-CD2 3.24Å; L550-Y617 WeakPolarHBondContact O-CE2 3.44Å
551	A	89.5	Confident	89.9	Confident	4 Å²	4	36.6 Å²	36.6	3%	0.033	21%	0.208	C	C	.	.	H	α-helix	trans	-68.8	-22.2	179.1	0	0	0	0	0	114.2	Y547 Q548 F549 M555 I616 R620	Y547-A551 VanDerWaalsContact O-CB 3.29Å; Y547-A551 WeakPolarHBondContact O-CB 3.26Å; Y547-A551 PolarHBondContact O-N 3.49Å; Q548-A551 PolarHBondContact O-N 2.95Å; F549-A551 VanDerWaalsContact C-N 3.34Å; F549-A551 PolarHBondContact O-N 3.19Å; A551-M555 VanDerWaalsContact O-CG 3.31Å; A551-M555 WeakPolarHBondContact O-CG 3.34Å; A551-I616 HydrophobicContact CB-CG2 4.36Å; A551-R620 VanDerWaalsContact O-CD 3.26Å; A551-R620 WeakPolarHBondContact O-CD 3.33Å; A551-R620 PolarHBondContact O-NH1 3.26Å
552	T	90.9	Very high	89.8	Confident	66 Å²	66	32.4 Å²	32.4	41%	0.405	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-88.5	-171.6	51.3	0	0	0	0	112.3	Q548 F549 L550 F554 M555	Q548-T552 WeakPolarHBondContact O-CB 3.38Å; Q548-T552 WeakPolarHBondContact O-CG2 3.43Å; Q548-T552 PolarHBondContact O-N 3.38Å; Q548-T552 PolarHBondContact O-OG1 3.11Å; F549-T552 PolarHBondContact O-N 3.02Å; F549-T552 PolarHBondContact O-OG1 3.45Å; L550-T552 VanDerWaalsContact C-N 3.29Å; L550-T552 PolarHBondContact O-N 3.21Å; T552-F554 PolarHBondContact O-N 2.93Å; T552-M555 WeakPolarHBondContact O-CB 3.4Å; T552-M555 PolarHBondContact O-N 3.29Å
553	D	88.9	Confident	89.6	Confident	85 Å²	85	32.6 Å²	32.6	46%	0.455	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-36	-169.7	-56.6	-40.3	0	0	0	111.8	L491 F549 M555 E556	L491-D553 HydrophobicContact CD2-CB 3.87Å; F549-D553 HydrophobicContact CD2-CB 4.08Å; F549-D553 HydrophobicContact CE2-CB 3.9Å; F549-D553 PolarHBondContact O-N 3.1Å; D553-M555 VanDerWaalsContact C-N 3.3Å; D553-M555 PolarHBondContact O-N 3.12Å; D553-E556 PolarHBondContact O-N 3.34Å
554	F	91.1	Very high	89.5	Confident	1 Å²	1	38.3 Å²	38.3	0%	0.004	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-20.3	-177.3	-164.3	-102.7	0	0	0	114.1	T490 Y525 L529 F549 L550 T552 E556 A557 V558 I563	T490-F554 HydrophobicContact CG2-CD2 3.76Å; T490-F554 HydrophobicContact CG2-CE2 3.68Å; Y525-F554 HydrophobicContact CD2-CD1 4.42Å; Y525-F554 AromaticContact CD2-CE1 3.28Å; Y525-F554 HydrophobicContact CD2-CE1 3.28Å; Y525-F554 HydrophobicContact CD2-CE2 4.37Å; Y525-F554 AromaticContact CD2-CZ 3.36Å; Y525-F554 HydrophobicContact CD2-CZ 3.36Å; Y525-F554 VanDerWaalsContact CD2-CZ 3.5Å; Y525-F554 HydrophobicContact CE2-CD1 4.46Å; Y525-F554 AromaticContact CE2-CE1 3.66Å; Y525-F554 HydrophobicContact CE2-CE1 3.66Å; Y525-F554 HydrophobicContact CE2-CZ 4.21Å; Y525-F554 HydrophobicContact CG-CE1 4.16Å; Y525-F554 AromaticContact CG-CZ 3.79Å; Y525-F554 HydrophobicContact CG-CZ 3.95Å; L529-F554 HydrophobicContact CD1-CD2 3.99Å; L529-F554 HydrophobicContact CD1-CE2 3.53Å; L529-F554 VanDerWaalsContact CD1-CE2 3.48Å; L529-F554 HydrophobicContact CD1-CZ 3.94Å; F549-F554 HydrophobicContact CD1-CB 4.28Å; F549-F554 HydrophobicContact CE1-CB 3.97Å; F549-F554 AromaticContact CE1-CD2 3.9Å; F549-F554 HydrophobicContact CE1-CD2 3.9Å; F549-F554 HydrophobicContact CE1-CG 4.25Å; F549-F554 HydrophobicContact CZ-CB 4.32Å; F549-F554 HydrophobicContact CZ-CD2 4.23Å; F549-F554 WeakPolarHBondContact O-CB 3.37Å; F549-F554 PolarHBondContact O-N 3.24Å; F549-F554 VanDerWaalsContact O-N 3.15Å; L550-F554 HydrophobicContact CD2-CB 4.16Å; L550-F554 HydrophobicContact CD2-CD1 3.5Å; L550-F554 VanDerWaalsContact CD2-CD1 3.44Å; L550-F554 HydrophobicContact CD2-CE1 3.98Å; L550-F554 HydrophobicContact CD2-CG 3.85Å; T552-F554 PolarHBondContact O-N 2.93Å; F554-E556 PolarHBondContact O-N 3.16Å; F554-A557 HydrophobicContact CD2-CB 4.41Å; F554-A557 HydrophobicContact CE1-CB 4.43Å; F554-A557 HydrophobicContact CE2-CB 4.25Å; F554-A557 HydrophobicContact CZ-CB 4.36Å; F554-A557 WeakPolarHBondContact O-CB 3.47Å; F554-A557 PolarHBondContact O-N 3.11Å; F554-V558 HydrophobicContact CD1-CG2 4.4Å; F554-V558 HydrophobicContact CE1-CG2 4.24Å; F554-I563 HydrophobicContact CE1-CD1 3.53Å; F554-I563 VanDerWaalsContact CE1-CD1 3.5Å; F554-I563 HydrophobicContact CE2-CD1 4.08Å; F554-I563 HydrophobicContact CZ-CD1 3.11Å
555	M	87.7	Confident	89.4	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.02	21%	0.209	C	C	.	.	H	α-helix	trans	-50.8	-30.9	175.8	-87.3	-70.5	-51.1	0	0	112.7	A551 T552 D553 V558 S559 Y617 R620 L621 R624	A551-M555 VanDerWaalsContact O-CG 3.31Å; A551-M555 WeakPolarHBondContact O-CG 3.34Å; T552-M555 WeakPolarHBondContact O-CB 3.4Å; T552-M555 PolarHBondContact O-N 3.29Å; D553-M555 VanDerWaalsContact C-N 3.3Å; D553-M555 PolarHBondContact O-N 3.12Å; M555-V558 PolarHBondContact O-N 2.86Å; M555-S559 WeakPolarHBondContact O-CB 3.48Å; M555-S559 PolarHBondContact O-N 3.22Å; M555-S559 VanDerWaalsContact O-N 3.07Å; M555-S559 PolarHBondContact O-OG 3.13Å; M555-Y617 HydrophobicContact CG-CD2 4Å; M555-Y617 HydrophobicContact CG-CE2 3.98Å; M555-Y617 HydrophobicContact SD-CD2 3.39Å; M555-Y617 WeakPolarHBondContact SD-CD2 3.36Å; M555-Y617 HydrophobicContact SD-CE2 3.39Å; M555-Y617 VanDerWaalsContact SD-CE2 3.53Å; M555-Y617 WeakPolarHBondContact SD-CE2 3.49Å; M555-R620 HydrophobicContact CE-CB 3.76Å; M555-R620 HydrophobicContact CG-CB 4.33Å; M555-R620 HydrophobicContact SD-CB 3.79Å; M555-L621 HydrophobicContact CE-CD2 3.8Å; M555-L621 HydrophobicContact CE-CG 4.28Å; M555-L621 HydrophobicContact SD-CD2 3.7Å; M555-L621 HydrophobicContact SD-CG 3.94Å; M555-R624 HydrophobicContact CE-CG 4.47Å
556	E	85.4	Confident	89.3	Confident	66 Å²	66	39.5 Å²	39.5	31%	0.308	22%	0.216	S	C	.	.	H	α-helix	trans	-63.3	-40.7	179.2	-171.7	168.4	-150.2	0	0	112.6	L494 K498 D553 F554 V558 S559 L560	L494-E556 HydrophobicContact CD2-CB 4.14Å; L494-E556 HydrophobicContact CD2-CG 4.39Å; K498-E556 WeakPolarHBondContact CE-OE1 3.47Å; K498-E556 VanDerWaalsContact CE-OE2 3.22Å; K498-E556 WeakPolarHBondContact CE-OE2 3.29Å; K498-E556 IonicContact NZ-OE1 2.77Å; K498-E556 PolarHBondContact NZ-OE1 3.18Å; K498-E556 IonicContact NZ-OE2 3.3Å; K498-E556 PolarHBondContact NZ-OE2 3.15Å; D553-E556 PolarHBondContact O-N 3.34Å; F554-E556 PolarHBondContact O-N 3.16Å; E556-V558 VanDerWaalsContact C-N 3.29Å; E556-V558 PolarHBondContact O-N 3.13Å; E556-S559 VanDerWaalsContact CA-OG 3.29Å; E556-S559 WeakPolarHBondContact CA-OG 3.23Å; E556-S559 PolarHBondContact O-N 3.13Å; E556-S559 VanDerWaalsContact O-N 3.13Å; E556-S559 PolarHBondContact O-OG 3.32Å; E556-S559 VanDerWaalsContact O-OG 3.08Å; E556-L560 HydrophobicContact CG-CD1 3.8Å; E556-L560 HydrophobicContact CG-CG 4.26Å; E556-L560 WeakPolarHBondContact O-CB 3.08Å; E556-L560 WeakPolarHBondContact O-CG 3.2Å; E556-L560 PolarHBondContact O-N 3.17Å
557	A	87.2	Confident	89.2	Confident	0.5 Å²	0.5	40.5 Å²	40.5	0%	0.004	23%	0.227	C	C	.	.	H	α-helix	trans	-61	-36.2	179.4	0	0	0	0	0	112.5	L494 F554 Y562 I563	L494-A557 HydrophobicContact CD1-CB 4.3Å; L494-A557 HydrophobicContact CD2-CB 3.76Å; F554-A557 HydrophobicContact CD2-CB 4.41Å; F554-A557 HydrophobicContact CE1-CB 4.43Å; F554-A557 HydrophobicContact CE2-CB 4.25Å; F554-A557 HydrophobicContact CZ-CB 4.36Å; F554-A557 WeakPolarHBondContact O-CB 3.47Å; F554-A557 PolarHBondContact O-N 3.11Å; A557-Y562 HydrophobicContact CB-CD2 4.37Å; A557-Y562 WeakPolarHBondContact O-CB 3.29Å; A557-Y562 PolarHBondContact O-N 3.41Å; A557-Y562 VanDerWaalsContact O-N 3.09Å; A557-I563 HydrophobicContact CB-CD1 4.1Å
558	V	88.2	Confident	89.1	Confident	9 Å²	9	40 Å²	40	6%	0.055	23%	0.225	C	C	.	.	H	α-helix	trans	-77.1	-39.8	176.3	-171.9	0	0	0	0	110.8	F554 M555 E556 L560 G561 I563 R565 T568 L621	F554-V558 HydrophobicContact CD1-CG2 4.4Å; F554-V558 HydrophobicContact CE1-CG2 4.24Å; M555-V558 PolarHBondContact O-N 2.86Å; E556-V558 VanDerWaalsContact C-N 3.29Å; E556-V558 PolarHBondContact O-N 3.13Å; V558-L560 VanDerWaalsContact C-N 3.33Å; V558-L560 PolarHBondContact O-N 3.22Å; V558-G561 PolarHBondContact O-N 3.35Å; V558-G561 VanDerWaalsContact O-N 3.11Å; V558-I563 HydrophobicContact CG2-CB 4.34Å; V558-I563 HydrophobicContact CG2-CG2 4.41Å; V558-R565 HydrophobicContact CG1-CB 3.88Å; V558-R565 HydrophobicContact CG1-CG 4.12Å; V558-T568 HydrophobicContact CG2-CG2 4.39Å; V558-L621 HydrophobicContact CB-CD2 4.02Å; V558-L621 HydrophobicContact CG1-CD2 3.63Å
559	S	83.6	Confident	89.1	Confident	66 Å²	66	36 Å²	36	46%	0.462	21%	0.206	S	C	.	.	H	α-helix	trans	-68.2	-29.1	178.9	60.8	0	0	0	0	114.1	M555 E556 G561 R624	M555-S559 WeakPolarHBondContact O-CB 3.48Å; M555-S559 PolarHBondContact O-N 3.22Å; M555-S559 VanDerWaalsContact O-N 3.07Å; M555-S559 PolarHBondContact O-OG 3.13Å; E556-S559 VanDerWaalsContact CA-OG 3.29Å; E556-S559 WeakPolarHBondContact CA-OG 3.23Å; E556-S559 PolarHBondContact O-N 3.13Å; E556-S559 VanDerWaalsContact O-N 3.13Å; E556-S559 PolarHBondContact O-OG 3.32Å; E556-S559 VanDerWaalsContact O-OG 3.08Å; S559-G561 VanDerWaalsContact C-N 3.3Å; S559-G561 PolarHBondContact O-N 3.44Å; S559-R624 PolarHBondContact OG-NH1 3.43Å
560	L	82.6	Confident	89.1	Confident	84 Å²	84	39 Å²	39	44%	0.44	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-0.8	173.7	-65.2	174.2	0	0	0	112.8	E556 V558 Y562	E556-L560 HydrophobicContact CG-CD1 3.8Å; E556-L560 HydrophobicContact CG-CG 4.26Å; E556-L560 WeakPolarHBondContact O-CB 3.08Å; E556-L560 WeakPolarHBondContact O-CG 3.2Å; E556-L560 PolarHBondContact O-N 3.17Å; V558-L560 VanDerWaalsContact C-N 3.33Å; V558-L560 PolarHBondContact O-N 3.22Å; L560-Y562 VanDerWaalsContact C-N 3.3Å; L560-Y562 HydrophobicContact CB-CD2 3.99Å; L560-Y562 HydrophobicContact CB-CE1 4.39Å; L560-Y562 HydrophobicContact CB-CE2 3.61Å; L560-Y562 HydrophobicContact CB-CG 4.49Å; L560-Y562 HydrophobicContact CD1-CE2 3.59Å; L560-Y562 HydrophobicContact CG-CE2 4.26Å; L560-Y562 PolarHBondContact O-N 2.64Å
561	G	83.9	Confident	89	Confident	57 Å²	57	42.3 Å²	42.3	59%	0.588	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.6	8.6	175.6	0	0	0	0	0	115.5	V558 S559 I563	V558-G561 PolarHBondContact O-N 3.35Å; V558-G561 VanDerWaalsContact O-N 3.11Å; S559-G561 VanDerWaalsContact C-N 3.3Å; S559-G561 PolarHBondContact O-N 3.44Å; G561-I563 PolarHBondContact O-N 2.75Å
562	Y	86.3	Confident	89.3	Confident	26.5 Å²	26.5	42.3 Å²	42.3	10%	0.104	24%	0.237	C	C	.	.	S	Bend	trans	-65.5	-25.3	175	-54	-41.7	0	0	0	112.3	L494 I497 H501 I518 R522 A557 L560	L494-Y562 HydrophobicContact CD1-CD2 4.13Å; L494-Y562 HydrophobicContact CD1-CE2 3.93Å; L494-Y562 HydrophobicContact CD2-CD2 4.36Å; I497-Y562 HydrophobicContact CG2-CE1 3.92Å; I497-Y562 HydrophobicContact CG2-CE2 3.87Å; I497-Y562 VanDerWaalsContact CG2-CZ 3.47Å; I497-Y562 VanDerWaalsContact CG2-OH 3.3Å; I497-Y562 WeakPolarHBondContact CG2-OH 3.27Å; H501-Y562 PolarHBondContact CD2-OH 2.88Å; H501-Y562 VanDerWaalsContact CD2-OH 3.31Å; H501-Y562 PolarHBondContact NE2-OH 3.27Å; I518-Y562 HydrophobicContact CD1-CD1 4.1Å; I518-Y562 HydrophobicContact CD1-CE1 3.99Å; I518-Y562 HydrophobicContact CG1-CD1 4.08Å; I518-Y562 HydrophobicContact CG1-CE1 4.32Å; I518-Y562 HydrophobicContact CG1-CG 4.47Å; R522-Y562 WeakPolarHBondContact CD-O 3.3Å; R522-Y562 VanDerWaalsContact CG-O 3.28Å; R522-Y562 WeakPolarHBondContact CG-O 3.26Å; A557-Y562 HydrophobicContact CB-CD2 4.37Å; A557-Y562 WeakPolarHBondContact O-CB 3.29Å; A557-Y562 PolarHBondContact O-N 3.41Å; A557-Y562 VanDerWaalsContact O-N 3.09Å; L560-Y562 VanDerWaalsContact C-N 3.3Å; L560-Y562 HydrophobicContact CB-CD2 3.99Å; L560-Y562 HydrophobicContact CB-CE1 4.39Å; L560-Y562 HydrophobicContact CB-CE2 3.61Å; L560-Y562 HydrophobicContact CB-CG 4.49Å; L560-Y562 HydrophobicContact CD1-CE2 3.59Å; L560-Y562 HydrophobicContact CG-CE2 4.26Å; L560-Y562 PolarHBondContact O-N 2.64Å
563	I	88.3	Confident	89.5	Confident	8 Å²	8	39.7 Å²	39.7	4%	0.041	22%	0.22	C	C	.	.	S	Bend	trans	-126	136	177.5	-64.7	166.2	0	0	0	109	I521 R522 Y525 F554 A557 V558 G561 R565	I521-I563 HydrophobicContact CG2-CD1 3.78Å; I521-I563 HydrophobicContact CG2-CG1 4.12Å; R522-I563 HydrophobicContact CG-CG1 4.49Å; Y525-I563 HydrophobicContact CD1-CD1 4.34Å; Y525-I563 HydrophobicContact CD1-CG2 3.76Å; Y525-I563 HydrophobicContact CD2-CD1 4.16Å; Y525-I563 HydrophobicContact CE1-CG2 3.91Å; Y525-I563 HydrophobicContact CG-CD1 3.79Å; Y525-I563 HydrophobicContact CG-CG1 4.5Å; Y525-I563 HydrophobicContact CG-CG2 4.24Å; F554-I563 HydrophobicContact CE1-CD1 3.53Å; F554-I563 VanDerWaalsContact CE1-CD1 3.5Å; F554-I563 HydrophobicContact CE2-CD1 4.08Å; F554-I563 HydrophobicContact CZ-CD1 3.11Å; A557-I563 HydrophobicContact CB-CD1 4.1Å; V558-I563 HydrophobicContact CG2-CB 4.34Å; V558-I563 HydrophobicContact CG2-CG2 4.41Å; G561-I563 PolarHBondContact O-N 2.75Å; I563-R565 PolarHBondContact O-N 3.12Å
564	E	89.2	Confident	89.7	Confident	122 Å²	122	40.5 Å²	40.5	57%	0.57	22%	0.217	S	C	*	.			trans	-68.2	115.6	179.9	-72.4	165.8	-147.5	0	0	111	R522 I566 G567 T568	R522-E564 IonicContact CZ-OE1 3.88Å; R522-E564 IonicContact NH1-OE1 3.09Å; R522-E564 PolarHBondContact NH1-OE1 3.48Å; R522-E564 IonicContact NH2-OE1 3.07Å; R522-E564 PolarHBondContact NH2-OE1 2.95Å; E564-I566 VanDerWaalsContact C-N 3.3Å; E564-I566 PolarHBondContact O-N 3.3Å; E564-G567 PolarHBondContact O-N 3.18Å; E564-G567 VanDerWaalsContact O-N 3.13Å; E564-T568 PolarHBondContact O-N 3.37Å; E564-T568 VanDerWaalsContact O-N 3.09Å; E564-T568 PolarHBondContact O-OG1 3.13Å
565	R	90.9	Very high	89.9	Confident	50 Å²	50	40.5 Å²	40.5	19%	0.189	22%	0.218	C	C	.	.	H	α-helix	trans	-56.7	-42.1	-178.5	-176.4	-179.3	150.7	177.1	-3.5	113.2	V558 I563 G567 T568 I569 L621 G626 E631	V558-R565 HydrophobicContact CG1-CB 3.88Å; V558-R565 HydrophobicContact CG1-CG 4.12Å; I563-R565 PolarHBondContact O-N 3.12Å; R565-G567 VanDerWaalsContact C-N 3.34Å; R565-G567 PolarHBondContact O-N 3.16Å; R565-T568 VanDerWaalsContact O-CB 3.27Å; R565-T568 WeakPolarHBondContact O-CB 3.45Å; R565-T568 PolarHBondContact O-N 3.25Å; R565-T568 VanDerWaalsContact O-N 3.16Å; R565-I569 HydrophobicContact CG-CD1 4.07Å; R565-I569 WeakPolarHBondContact O-CG1 3.42Å; R565-I569 PolarHBondContact O-N 2.89Å; R565-L621 HydrophobicContact CG-CD2 4.38Å; R565-L621 PolarHBondContact NH1-O 3.08Å; R565-L621 PolarHBondContact NH2-O 3.35Å; R565-G626 VanDerWaalsContact CZ-O 3.29Å; R565-G626 PolarHBondContact NH1-O 3.22Å; R565-G626 VanDerWaalsContact NH1-O 3.08Å; R565-G626 PolarHBondContact NH2-O 3.12Å; R565-E631 WeakPolarHBondContact CD-OE1 3.47Å; R565-E631 WeakPolarHBondContact CG-OE1 3.38Å; R565-E631 IonicContact CZ-OE1 3.17Å; R565-E631 VanDerWaalsContact CZ-OE1 3.29Å; R565-E631 IonicContact CZ-OE2 2.66Å; R565-E631 VanDerWaalsContact CZ-OE2 3.31Å; R565-E631 IonicContact NE-OE1 2.9Å; R565-E631 PolarHBondContact NE-OE1 3.06Å; R565-E631 IonicContact NE-OE2 3.44Å; R565-E631 PolarHBondContact NE-OE2 3.5Å; R565-E631 IonicContact NH2-OE1 2.84Å; R565-E631 PolarHBondContact NH2-OE1 2.95Å; R565-E631 IonicContact NH2-OE2 3.03Å; R565-E631 PolarHBondContact NH2-OE2 3.05Å
566	I	91.4	Very high	90.2	Very high	66 Å²	66	40.4 Å²	40.4	34%	0.338	22%	0.217	S	C	.	.	H	α-helix	trans	-60.9	-46.5	177	-63.3	173.4	0	0	0	110.3	E564 T568 I569 I570 D630 E631 L634	E564-I566 VanDerWaalsContact C-N 3.3Å; E564-I566 PolarHBondContact O-N 3.3Å; I566-T568 VanDerWaalsContact C-N 3.3Å; I566-T568 PolarHBondContact O-N 2.98Å; I566-I569 PolarHBondContact O-N 2.99Å; I566-I569 VanDerWaalsContact O-N 3.15Å; I566-I570 HydrophobicContact CG2-CD1 4.04Å; I566-I570 WeakPolarHBondContact O-CG1 3.34Å; I566-I570 PolarHBondContact O-N 3.35Å; I566-D630 HydrophobicContact CD1-CB 4.38Å; I566-E631 HydrophobicContact CG1-CG 4.05Å; I566-L634 HydrophobicContact CG2-CD1 4.08Å
567	G	91.4	Very high	90.5	Very high	21 Å²	21	38.6 Å²	38.6	22%	0.216	21%	0.209	C	C	.	.	H	α-helix	trans	-57.6	-41.1	174.9	0	0	0	0	0	111.9	E564 R565 I569 I570 H571	E564-G567 PolarHBondContact O-N 3.18Å; E564-G567 VanDerWaalsContact O-N 3.13Å; R565-G567 VanDerWaalsContact C-N 3.34Å; R565-G567 PolarHBondContact O-N 3.16Å; G567-I569 VanDerWaalsContact C-N 3.34Å; G567-I569 PolarHBondContact O-N 3.02Å; G567-I570 PolarHBondContact O-N 3.24Å; G567-H571 PolarHBondContact O-N 3.18Å; G567-H571 VanDerWaalsContact O-N 3.12Å; G567-H571 PolarHBondContact O-ND1 3.1Å
568	T	92.5	Very high	90.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.4	-45.1	175.8	-56.4	0	0	0	0	112.6	Y525 V558 E564 R565 I566 H571 C572 Y617 L621	Y525-T568 VanDerWaalsContact OH-CA 3.26Å; Y525-T568 WeakPolarHBondContact OH-CA 3.33Å; Y525-T568 WeakPolarHBondContact OH-CB 3.23Å; Y525-T568 WeakPolarHBondContact OH-CG2 3.33Å; Y525-T568 PolarHBondContact OH-OG1 2.89Å; V558-T568 HydrophobicContact CG2-CG2 4.39Å; E564-T568 PolarHBondContact O-N 3.37Å; E564-T568 VanDerWaalsContact O-N 3.09Å; E564-T568 PolarHBondContact O-OG1 3.13Å; R565-T568 VanDerWaalsContact O-CB 3.27Å; R565-T568 WeakPolarHBondContact O-CB 3.45Å; R565-T568 PolarHBondContact O-N 3.25Å; R565-T568 VanDerWaalsContact O-N 3.16Å; I566-T568 VanDerWaalsContact C-N 3.3Å; I566-T568 PolarHBondContact O-N 2.98Å; T568-H571 PolarHBondContact O-N 3.14Å; T568-C572 PolarHBondContact O-N 3.39Å; T568-C572 PolarHBondContact O-SG 3.06Å; T568-Y617 HydrophobicContact CG2-CE1 3.55Å; T568-Y617 VanDerWaalsContact CG2-CE1 3.47Å; T568-Y617 VanDerWaalsContact CG2-OH 3.28Å; T568-Y617 WeakPolarHBondContact CG2-OH 3.29Å; T568-L621 HydrophobicContact CG2-CD1 3.79Å
569	I	93.7	Very high	90.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.6	-40.6	179.1	-67.3	158.8	0	0	0	111.1	R565 I566 G567 H571 C572 L573 L618 L621 F622 E631 L634	R565-I569 HydrophobicContact CG-CD1 4.07Å; R565-I569 WeakPolarHBondContact O-CG1 3.42Å; R565-I569 PolarHBondContact O-N 2.89Å; I566-I569 PolarHBondContact O-N 2.99Å; I566-I569 VanDerWaalsContact O-N 3.15Å; G567-I569 VanDerWaalsContact C-N 3.34Å; G567-I569 PolarHBondContact O-N 3.02Å; I569-H571 PolarHBondContact O-N 2.92Å; I569-C572 PolarHBondContact O-N 3.21Å; I569-L573 HydrophobicContact CG2-CD1 3.93Å; I569-L573 HydrophobicContact CG2-CG 4.38Å; I569-L573 WeakPolarHBondContact O-CG 3.35Å; I569-L573 PolarHBondContact O-N 3.11Å; I569-L618 HydrophobicContact CB-CD2 4.14Å; I569-L618 HydrophobicContact CG1-CD2 3.8Å; I569-L618 HydrophobicContact CG2-CD2 4.03Å; I569-L621 HydrophobicContact CG1-CD1 4.12Å; I569-F622 HydrophobicContact CD1-CE1 3.79Å; I569-F622 HydrophobicContact CG1-CE1 4.23Å; I569-E631 HydrophobicContact CD1-CB 4.15Å; I569-E631 HydrophobicContact CD1-CG 3.49Å; I569-E631 VanDerWaalsContact CD1-CG 3.47Å; I569-E631 VanDerWaalsContact CD1-OE1 3.29Å; I569-E631 WeakPolarHBondContact CD1-OE1 3.16Å; I569-L634 HydrophobicContact CG2-CD1 4.43Å
570	I	94.3	Very high	91.2	Very high	78 Å²	78	38.5 Å²	38.5	40%	0.4	20%	0.198	S	C	.	.	H	α-helix	trans	-57.5	-49.2	174.1	-67.4	169	0	0	0	110.5	I566 G567 C572 L573 Y574 L634	I566-I570 HydrophobicContact CG2-CD1 4.04Å; I566-I570 WeakPolarHBondContact O-CG1 3.34Å; I566-I570 PolarHBondContact O-N 3.35Å; G567-I570 PolarHBondContact O-N 3.24Å; I570-C572 VanDerWaalsContact C-N 3.34Å; I570-C572 PolarHBondContact O-N 3.08Å; I570-L573 PolarHBondContact O-N 3.3Å; I570-Y574 WeakPolarHBondContact O-CB 3.32Å; I570-Y574 PolarHBondContact O-N 3.27Å; I570-L634 HydrophobicContact CD1-CD1 4.13Å; I570-L634 HydrophobicContact CD1-CD2 4.46Å; I570-L634 HydrophobicContact CG1-CD1 3.49Å; I570-L634 VanDerWaalsContact CG1-CD1 3.45Å; I570-L634 HydrophobicContact CG1-CD2 3.89Å; I570-L634 HydrophobicContact CG1-CG 4.35Å
571	H	93.1	Very high	91.5	Very high	73.5 Å²	73.5	34.5 Å²	34.5	34%	0.34	18%	0.177	S	C	.	.	H	α-helix	trans	-62.6	-40.2	179.6	-72.5	87	0	0	0	112.2	S530 G567 T568 I569 Y574 A575	S530-H571 PolarHBondContact OG-CD2 3.06Å; G567-H571 PolarHBondContact O-N 3.18Å; G567-H571 VanDerWaalsContact O-N 3.12Å; G567-H571 PolarHBondContact O-ND1 3.1Å; T568-H571 PolarHBondContact O-N 3.14Å; I569-H571 PolarHBondContact O-N 2.92Å; H571-Y574 PolarHBondContact O-N 3.06Å; H571-A575 WeakPolarHBondContact O-CB 3.27Å; H571-A575 PolarHBondContact O-N 3.39Å
572	C	94.7	Very high	91.8	Very high	4.5 Å²	4.5	32.9 Å²	32.9	3%	0.03	16%	0.155	C	C	.	.	H	α-helix	trans	-64.9	-46.7	177.5	-63.9	0	0	0	0	111.9	T568 I569 I570 Y574 A575 L576 L614 L618	T568-C572 PolarHBondContact O-N 3.39Å; T568-C572 PolarHBondContact O-SG 3.06Å; I569-C572 PolarHBondContact O-N 3.21Å; I570-C572 VanDerWaalsContact C-N 3.34Å; I570-C572 PolarHBondContact O-N 3.08Å; C572-Y574 VanDerWaalsContact C-N 3.31Å; C572-Y574 PolarHBondContact O-N 2.97Å; C572-A575 WeakPolarHBondContact O-CB 3.37Å; C572-A575 PolarHBondContact O-N 2.9Å; C572-L576 WeakPolarHBondContact O-CB 3.45Å; C572-L576 VanDerWaalsContact O-CG 3.28Å; C572-L576 WeakPolarHBondContact O-CG 3.41Å; C572-L576 PolarHBondContact O-N 3.24Å; C572-L614 HydrophobicContact CB-CD2 4.47Å; C572-L618 HydrophobicContact CB-CD1 4.02Å; C572-L618 HydrophobicContact CB-CD2 3.78Å; C572-L618 HydrophobicContact CB-CG 3.91Å
573	L	95.2	Very high	91.9	Very high	12 Å²	12	33.8 Å²	33.8	6%	0.063	16%	0.163	C	C	.	.	H	α-helix	trans	-66.5	-34.3	177.3	-68.3	174.6	0	0	0	111.9	I569 I570 L576 K577 L618 L634 I635 F638	I569-L573 HydrophobicContact CG2-CD1 3.93Å; I569-L573 HydrophobicContact CG2-CG 4.38Å; I569-L573 WeakPolarHBondContact O-CG 3.35Å; I569-L573 PolarHBondContact O-N 3.11Å; I570-L573 PolarHBondContact O-N 3.3Å; L573-L576 HydrophobicContact CD2-CD1 4.44Å; L573-L576 PolarHBondContact O-N 3.28Å; L573-K577 VanDerWaalsContact O-CB 3.29Å; L573-K577 WeakPolarHBondContact O-CB 3.34Å; L573-K577 PolarHBondContact O-N 3.18Å; L573-L618 HydrophobicContact CD2-CD1 4.26Å; L573-L634 HydrophobicContact CD1-CB 3.9Å; L573-I635 HydrophobicContact CD1-CG1 4.45Å; L573-F638 HydrophobicContact CB-CD2 4.25Å; L573-F638 HydrophobicContact CD2-CB 4.35Å; L573-F638 HydrophobicContact CD2-CD2 4.12Å; L573-F638 HydrophobicContact CD2-CG 4.22Å; L573-F638 WeakPolarHBondContact O-CE2 3.3Å
574	Y	94	Very high	91.8	Very high	100.5 Å²	100.5	36.5 Å²	36.5	39%	0.394	18%	0.178	S	C	.	.	H	α-helix	trans	-65.8	-44.8	173.8	-172.3	-101	0	0	0	111.5	I570 H571 C572 L576 K577 Y578 Y579	I570-Y574 WeakPolarHBondContact O-CB 3.32Å; I570-Y574 PolarHBondContact O-N 3.27Å; H571-Y574 PolarHBondContact O-N 3.06Å; C572-Y574 VanDerWaalsContact C-N 3.31Å; C572-Y574 PolarHBondContact O-N 2.97Å; Y574-L576 PolarHBondContact O-N 3.39Å; Y574-K577 PolarHBondContact O-N 3.4Å; Y574-Y578 HydrophobicContact CD1-CD2 4.29Å; Y574-Y578 AromaticContact CD2-CD2 3.31Å; Y574-Y578 HydrophobicContact CD2-CD2 3.31Å; Y574-Y578 AromaticContact CD2-CE2 3.45Å; Y574-Y578 HydrophobicContact CD2-CE2 3.45Å; Y574-Y578 VanDerWaalsContact CD2-CE2 3.45Å; Y574-Y578 HydrophobicContact CD2-CG 4.43Å; Y574-Y578 HydrophobicContact CE1-CD2 4.19Å; Y574-Y578 AromaticContact CE2-CD2 3.22Å; Y574-Y578 HydrophobicContact CE2-CD2 3.22Å; Y574-Y578 AromaticContact CE2-CE2 3.3Å; Y574-Y578 HydrophobicContact CE2-CE2 3.3Å; Y574-Y578 AromaticContact CE2-CG 4Å; Y574-Y578 HydrophobicContact CE2-CG 4.04Å; Y574-Y578 AromaticContact CG-CD2 3.94Å; Y574-Y578 HydrophobicContact CG-CD2 3.94Å; Y574-Y578 HydrophobicContact CG-CE2 4.45Å; Y574-Y578 AromaticContact CZ-CD2 3.8Å; Y574-Y578 WeakPolarHBondContact O-CD2 3.44Å; Y574-Y578 PolarHBondContact O-N 3.05Å; Y574-Y579 AromaticContact CD1-CE2 3.96Å; Y574-Y579 HydrophobicContact CD1-CE2 4.06Å; Y574-Y579 AromaticContact CE1-CE2 3.66Å; Y574-Y579 HydrophobicContact CE1-CE2 3.66Å
575	A	93.6	Very high	91.7	Very high	2 Å²	2	31.4 Å²	31.4	2%	0.017	16%	0.155	C	C	.	.	H	α-helix	trans	-58.3	-46.9	173.5	0	0	0	0	0	111.9	S532 H571 C572 K577 Y579 L580 L614	S532-A575 WeakPolarHBondContact OG-CB 3.46Å; H571-A575 WeakPolarHBondContact O-CB 3.27Å; H571-A575 PolarHBondContact O-N 3.39Å; C572-A575 WeakPolarHBondContact O-CB 3.37Å; C572-A575 PolarHBondContact O-N 2.9Å; A575-K577 VanDerWaalsContact C-N 3.31Å; A575-K577 PolarHBondContact O-N 2.83Å; A575-Y579 PolarHBondContact O-N 3.36Å; A575-Y579 VanDerWaalsContact O-N 3.09Å; A575-L580 PolarHBondContact O-N 2.84Å; A575-L614 HydrophobicContact CB-CD1 4.06Å
576	L	94.2	Very high	91.3	Very high	1.5 Å²	1.5	35.2 Å²	35.2	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-64.1	-28.4	176.9	-69.4	174.2	0	0	0	113.6	C572 L573 Y574 R611 L614 L615 L618 F638 V651	C572-L576 WeakPolarHBondContact O-CB 3.45Å; C572-L576 VanDerWaalsContact O-CG 3.28Å; C572-L576 WeakPolarHBondContact O-CG 3.41Å; C572-L576 PolarHBondContact O-N 3.24Å; L573-L576 HydrophobicContact CD2-CD1 4.44Å; L573-L576 PolarHBondContact O-N 3.28Å; Y574-L576 PolarHBondContact O-N 3.39Å; L576-R611 HydrophobicContact CD2-CB 3.98Å; L576-R611 HydrophobicContact CD2-CG 3.75Å; L576-R611 PolarHBondContact O-NH1 2.88Å; L576-R611 VanDerWaalsContact O-NH1 3.15Å; L576-L614 HydrophobicContact CD2-CB 4.38Å; L576-L614 HydrophobicContact CD2-CD1 4.17Å; L576-L614 HydrophobicContact CG-CD1 4.37Å; L576-L615 HydrophobicContact CD1-CD2 3.87Å; L576-L615 HydrophobicContact CD1-CG 4.4Å; L576-L618 HydrophobicContact CD1-CD1 4.25Å; L576-F638 HydrophobicContact CB-CE2 4.09Å; L576-F638 HydrophobicContact CB-CZ 4.33Å; L576-V651 HydrophobicContact CD1-CG2 4.24Å
577	K	92.6	Very high	90.6	Very high	28.5 Å²	28.5	36.9 Å²	36.9	12%	0.124	19%	0.193	C	C	.	.	H	α-helix	trans	-84.7	-47.4	-179.6	-173.7	168.1	178.7	171.9	0	112.8	L573 Y574 A575 Y591 F638 T641 V642	L573-K577 VanDerWaalsContact O-CB 3.29Å; L573-K577 WeakPolarHBondContact O-CB 3.34Å; L573-K577 PolarHBondContact O-N 3.18Å; Y574-K577 PolarHBondContact O-N 3.4Å; A575-K577 VanDerWaalsContact C-N 3.31Å; A575-K577 PolarHBondContact O-N 2.83Å; K577-Y591 HydrophobicContact CD-CE1 4.4Å; K577-Y591 HydrophobicContact CD-CE2 4.47Å; K577-Y591 HydrophobicContact CG-CD2 4.25Å; K577-Y591 HydrophobicContact CG-CE1 4.32Å; K577-Y591 HydrophobicContact CG-CE2 3.81Å; K577-Y591 WeakPolarHBondContact CG-OH 3.29Å; K577-Y591 VanDerWaalsContact O-CE2 3.3Å; K577-Y591 WeakPolarHBondContact O-CE2 3.47Å; K577-Y591 PolarHBondContact O-OH 3.42Å; K577-F638 HydrophobicContact CB-CD2 4.3Å; K577-F638 HydrophobicContact CB-CE2 3.8Å; K577-F638 HydrophobicContact CG-CE2 4.41Å; K577-T641 PolarHBondContact NZ-OG1 3.07Å; K577-T641 VanDerWaalsContact NZ-OG1 3.12Å; K577-V642 HydrophobicContact CD-CG2 4.14Å; K577-V642 HydrophobicContact CG-CG2 4.16Å
578	Y	91.7	Very high	90	Very high	55 Å²	55	42.7 Å²	42.7	22%	0.216	21%	0.208	C	C	.	.	H	α-helix	trans	-105.5	-19.2	-166.3	-69.1	-80.5	0	0	0	115	Y574 Y591 E592 L593 C594	Y574-Y578 HydrophobicContact CD1-CD2 4.29Å; Y574-Y578 AromaticContact CD2-CD2 3.31Å; Y574-Y578 HydrophobicContact CD2-CD2 3.31Å; Y574-Y578 AromaticContact CD2-CE2 3.45Å; Y574-Y578 HydrophobicContact CD2-CE2 3.45Å; Y574-Y578 VanDerWaalsContact CD2-CE2 3.45Å; Y574-Y578 HydrophobicContact CD2-CG 4.43Å; Y574-Y578 HydrophobicContact CE1-CD2 4.19Å; Y574-Y578 AromaticContact CE2-CD2 3.22Å; Y574-Y578 HydrophobicContact CE2-CD2 3.22Å; Y574-Y578 AromaticContact CE2-CE2 3.3Å; Y574-Y578 HydrophobicContact CE2-CE2 3.3Å; Y574-Y578 AromaticContact CE2-CG 4Å; Y574-Y578 HydrophobicContact CE2-CG 4.04Å; Y574-Y578 AromaticContact CG-CD2 3.94Å; Y574-Y578 HydrophobicContact CG-CD2 3.94Å; Y574-Y578 HydrophobicContact CG-CE2 4.45Å; Y574-Y578 AromaticContact CZ-CD2 3.8Å; Y574-Y578 WeakPolarHBondContact O-CD2 3.44Å; Y574-Y578 PolarHBondContact O-N 3.05Å; Y578-Y591 AromaticContact CD1-CD2 3.93Å; Y578-Y591 HydrophobicContact CD1-CD2 3.97Å; Y578-Y591 HydrophobicContact CD1-CE2 4.19Å; Y578-Y591 AromaticContact CE1-CD2 3.72Å; Y578-Y591 HydrophobicContact CE1-CD2 3.72Å; Y578-Y591 HydrophobicContact CE1-CE2 4.24Å; Y578-Y591 HydrophobicContact CE1-CG 4.2Å; Y578-E592 WeakPolarHBondContact CD1-O 3.28Å; Y578-L593 WeakPolarHBondContact O-CA 3.44Å; Y578-C594 PolarHBondContact O-N 3.47Å
579	Y	90.7	Very high	89.5	Confident	17 Å²	17	43.6 Å²	43.6	7%	0.067	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121	-36.6	-175.6	-62.2	-91	0	0	0	113.3	S532 E533 C536 Y574 A575 C594 I601	S532-Y579 VanDerWaalsContact CB-CD2 3.44Å; E533-Y579 HydrophobicContact CB-CE1 4.3Å; E533-Y579 WeakPolarHBondContact CB-OH 3.46Å; C536-Y579 HydrophobicContact CB-CD1 3.85Å; C536-Y579 HydrophobicContact CB-CE1 4.44Å; Y574-Y579 AromaticContact CD1-CE2 3.96Å; Y574-Y579 HydrophobicContact CD1-CE2 4.06Å; Y574-Y579 AromaticContact CE1-CE2 3.66Å; Y574-Y579 HydrophobicContact CE1-CE2 3.66Å; A575-Y579 PolarHBondContact O-N 3.36Å; A575-Y579 VanDerWaalsContact O-N 3.09Å; Y579-C594 HydrophobicContact CD1-CB 4.32Å; Y579-C594 HydrophobicContact CE1-CB 3.68Å; Y579-C594 VanDerWaalsContact CE1-O 3.31Å; Y579-C594 WeakPolarHBondContact CE1-O 3.34Å; Y579-C594 HydrophobicContact CE2-CB 4.02Å; Y579-C594 VanDerWaalsContact CZ-CB 3.41Å; Y579-C594 WeakPolarHBondContact OH-CB 3.18Å; Y579-I601 WeakPolarHBondContact O-CD1 3.39Å
580	L	90.8	Very high	89	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	25%	0.249	C	C	.	.	S	Bend	trans	-111.3	36.3	-174	-59.8	172.2	0	0	0	112.4	Y547 A575 L607 L610 R611 L614	Y547-L580 HydrophobicContact CE2-CD1 3.99Å; A575-L580 PolarHBondContact O-N 2.84Å; L580-L607 HydrophobicContact CD2-CD2 3.78Å; L580-L610 HydrophobicContact CD1-CB 4.32Å; L580-L610 HydrophobicContact CD2-CB 4.2Å; L580-L610 HydrophobicContact CD2-CD1 3.9Å; L580-R611 HydrophobicContact CB-CG 4.05Å; L580-R611 VanDerWaalsContact O-CD 3.28Å; L580-R611 WeakPolarHBondContact O-CD 3.41Å; L580-R611 PolarHBondContact O-NH1 3.13Å; L580-L614 HydrophobicContact CD1-CD1 3.4Å; L580-L614 VanDerWaalsContact CD1-CD1 3.5Å
581	A	89.8	Confident	88.6	Confident	1.5 Å²	1.5	44.5 Å²	44.5	1%	0.012	24%	0.235	C	C	.	.			trans	-69.6	137.3	172.2	0	0	0	0	0	110.6	L593	A581-L593 HydrophobicContact CB-CD1 4.4Å; A581-L593 HydrophobicContact CB-CD2 3.57Å; A581-L593 VanDerWaalsContact CB-CD2 3.49Å
582	L	89.3	Confident	88.2	Confident	21.5 Å²	21.5	46.4 Å²	46.4	11%	0.113	24%	0.244	C	C	.	.	S	Bend	trans	-81	-26.1	174.6	-61.6	-179.4	0	0	0	112.3	V604 L607 I608 E646 N647	L582-V604 HydrophobicContact CD2-CG1 4.23Å; L582-L607 HydrophobicContact CD2-CB 3.63Å; L582-L607 HydrophobicContact CD2-CD1 4.45Å; L582-I608 HydrophobicContact CD1-CG1 4.2Å; L582-I608 HydrophobicContact CD2-CG1 3.99Å; L582-E646 HydrophobicContact CB-CB 4.27Å; L582-E646 WeakPolarHBondContact CD1-O 3.16Å; L582-N647 WeakPolarHBondContact CA-OD1 3.42Å; L582-N647 PolarHBondContact N-OD1 3.48Å
583	T	88.5	Confident	87.9	Confident	46.5 Å²	46.5	46.3 Å²	46.3	29%	0.285	24%	0.243	S	C	.	.	S	Bend	trans	-136.7	143.4	176.3	-60.4	0	0	0	0	109.5	P585 E646 N647	T583-P585 WeakPolarHBondContact O-CD 3.19Å; T583-E646 WeakPolarHBondContact OG1-CG 3.24Å; T583-N647 PolarHBondContact N-OD1 3.2Å; T583-N647 VanDerWaalsContact N-OD1 3.15Å; T583-N647 PolarHBondContact O-ND2 2.82Å
584	N	86.3	Confident	87.5	Confident	64 Å²	64	48 Å²	48	34%	0.342	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-60.7	131.1	-179.2	-125.3	-23.3	0	0	0	111.1	R586 L593 I600	N584-R586 VanDerWaalsContact C-N 3.28Å; N584-R586 PolarHBondContact O-N 3.14Å; N584-R586 WeakPolarHBondContact OD1-CB 3.35Å; N584-R586 PolarHBondContact OD1-N 3.41Å; N584-L593 WeakPolarHBondContact OD1-CD1 3.22Å; N584-I600 HydrophobicContact CB-CD1 4.47Å; N584-I600 VanDerWaalsContact OD1-CG1 3.27Å; N584-I600 WeakPolarHBondContact OD1-CG1 3.42Å
585	P	86.8	Confident	87	Confident	14.5 Å²	14.5	43.5 Å²	43.5	9%	0.094	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-70.6	65.2	-177.8	27.4	-32.5	0	0	0	113.2	T583 A587 S589 G590 Y591 L593 E644	T583-P585 WeakPolarHBondContact O-CD 3.19Å; P585-A587 PolarHBondContact O-N 2.76Å; P585-S589 CarbonylContact O-C 3.5Å; P585-S589 WeakPolarHBondContact O-CA 3.27Å; P585-S589 WeakPolarHBondContact O-CB 3.37Å; P585-S589 PolarHBondContact O-N 3.14Å; P585-G590 PolarHBondContact O-N 2.85Å; P585-Y591 CarbonylContact C-O 3.55Å; P585-Y591 HydrophobicContact CB-CD1 4.35Å; P585-Y591 HydrophobicContact CB-CD2 4.15Å; P585-Y591 HydrophobicContact CB-CE1 3.92Å; P585-Y591 HydrophobicContact CB-CE2 3.7Å; P585-Y591 HydrophobicContact CB-CG 4.44Å; P585-Y591 VanDerWaalsContact CB-O 3.26Å; P585-Y591 WeakPolarHBondContact CB-O 3.47Å; P585-Y591 HydrophobicContact CG-CD2 3.95Å; P585-Y591 HydrophobicContact CG-CE1 4.3Å; P585-Y591 HydrophobicContact CG-CE2 3.61Å; P585-Y591 HydrophobicContact CG-CG 4.43Å; P585-Y591 WeakPolarHBondContact CG-O 3.28Å; P585-L593 HydrophobicContact CG-CD2 4.07Å; P585-L593 HydrophobicContact CG-CG 4.36Å; P585-E644 VanDerWaalsContact CA-CD 3.46Å; P585-E644 WeakPolarHBondContact CA-OE1 3.45Å
586	R	82.5	Confident	86	Confident	130.5 Å²	130.5	47.2 Å²	47.2	49%	0.492	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-72.8	-120.3	-178.3	-114.1	178.3	-169.2	155.3	10.7	110.7	N584 R588 S589 G590 Y591 E592 E644 E646	N584-R586 VanDerWaalsContact C-N 3.28Å; N584-R586 PolarHBondContact O-N 3.14Å; N584-R586 WeakPolarHBondContact OD1-CB 3.35Å; N584-R586 PolarHBondContact OD1-N 3.41Å; R586-R588 PolarHBondContact O-N 2.99Å; R586-S589 WeakPolarHBondContact O-CB 3.49Å; R586-S589 PolarHBondContact O-N 2.97Å; R586-G590 WeakPolarHBondContact O-CA 3.21Å; R586-Y591 WeakPolarHBondContact CA-O 3.29Å; R586-Y591 PolarHBondContact N-O 3.33Å; R586-E592 IonicContact CZ-OE1 3.29Å; R586-E592 IonicContact NE-OE1 3.76Å; R586-E592 IonicContact NH1-OE1 2.74Å; R586-E592 PolarHBondContact NH1-OE1 3.31Å; R586-E592 IonicContact NH2-OE1 3.28Å; R586-E592 PolarHBondContact NH2-OE1 3.5Å; R586-E644 HydrophobicContact CG-CG 4.09Å; R586-E644 PolarHBondContact N-OE1 3.27Å; R586-E646 IonicContact NH2-OE1 3.35Å; R586-E646 PolarHBondContact NH2-OE1 3.25Å; R586-E646 IonicContact NH2-OE2 3.22Å; R586-E646 PolarHBondContact NH2-OE2 2.87Å
587	A	77	Confident	85.2	Confident	101 Å²	101	53.2 Å²	53.2	84%	0.835	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-35	-173.5	0	0	0	0	0	114.4	P585 S589 G590	P585-A587 PolarHBondContact O-N 2.76Å; A587-S589 PolarHBondContact O-N 2.92Å; A587-G590 PolarHBondContact O-N 3.01Å
588	R	79.4	Confident	84.6	Confident	143 Å²	143	56.7 Å²	56.7	54%	0.54	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-36.8	179.2	-117.3	175.7	178.2	-171.4	-5.1	112.9	R586 H643 E644 E686	R586-R588 PolarHBondContact O-N 2.99Å; R588-H643 HydrophobicContact CB-CB 3.95Å; R588-E644 WeakPolarHBondContact CB-OE1 3.33Å; R588-E686 IonicContact CZ-OE2 3.69Å; R588-E686 IonicContact NH1-OE2 3.52Å; R588-E686 IonicContact NH2-OE2 3.29Å; R588-E686 PolarHBondContact NH2-OE2 3.43Å
589	S	81.6	Confident	84.1	Confident	20.5 Å²	20.5	60.5 Å²	60.5	14%	0.143	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-18.1	-178.2	-77.1	0	0	0	0	114.9	P585 R586 A587 Y591 T641 V642 H643 E644	P585-S589 CarbonylContact O-C 3.5Å; P585-S589 WeakPolarHBondContact O-CA 3.27Å; P585-S589 WeakPolarHBondContact O-CB 3.37Å; P585-S589 PolarHBondContact O-N 3.14Å; R586-S589 WeakPolarHBondContact O-CB 3.49Å; R586-S589 PolarHBondContact O-N 2.97Å; A587-S589 PolarHBondContact O-N 2.92Å; S589-Y591 VanDerWaalsContact C-N 3.28Å; S589-Y591 VanDerWaalsContact CB-CE1 3.5Å; S589-Y591 WeakPolarHBondContact O-CD1 3.27Å; S589-Y591 PolarHBondContact O-N 3.1Å; S589-T641 PolarHBondContact OG-O 3.24Å; S589-V642 WeakPolarHBondContact OG-CA 3.31Å; S589-H643 WeakPolarHBondContact OG-CB 3.31Å; S589-H643 PolarHBondContact OG-CD2 3.45Å; S589-H643 VanDerWaalsContact OG-CD2 3.3Å; S589-H643 PolarHBondContact OG-N 3.11Å; S589-E644 WeakPolarHBondContact CB-OE1 3.42Å; S589-E644 PolarHBondContact N-OE1 3.08Å; S589-E644 VanDerWaalsContact OG-CD 3.27Å; S589-E644 PolarHBondContact OG-OE1 3.48Å; S589-E644 PolarHBondContact OG-OE2 2.85Å
590	G	82.5	Confident	83.7	Confident	69 Å²	69	62.5 Å²	62.5	71%	0.711	34%	0.342	S	S	*	.			trans	67.8	15.5	172.3	0	0	0	0	0	115.9	P585 R586 A587	P585-G590 PolarHBondContact O-N 2.85Å; R586-G590 WeakPolarHBondContact O-CA 3.21Å; A587-G590 PolarHBondContact O-N 3.01Å
591	Y	86.5	Confident	83.2	Confident	27 Å²	27	63.9 Å²	63.9	11%	0.106	35%	0.349	C	S	.	.			trans	-120.9	155.8	172.5	71.1	-91.7	0	0	0	110.9	K577 Y578 P585 R586 S589 V642 E644	K577-Y591 HydrophobicContact CD-CE1 4.4Å; K577-Y591 HydrophobicContact CD-CE2 4.47Å; K577-Y591 HydrophobicContact CG-CD2 4.25Å; K577-Y591 HydrophobicContact CG-CE1 4.32Å; K577-Y591 HydrophobicContact CG-CE2 3.81Å; K577-Y591 WeakPolarHBondContact CG-OH 3.29Å; K577-Y591 VanDerWaalsContact O-CE2 3.3Å; K577-Y591 WeakPolarHBondContact O-CE2 3.47Å; K577-Y591 PolarHBondContact O-OH 3.42Å; Y578-Y591 AromaticContact CD1-CD2 3.93Å; Y578-Y591 HydrophobicContact CD1-CD2 3.97Å; Y578-Y591 HydrophobicContact CD1-CE2 4.19Å; Y578-Y591 AromaticContact CE1-CD2 3.72Å; Y578-Y591 HydrophobicContact CE1-CD2 3.72Å; Y578-Y591 HydrophobicContact CE1-CE2 4.24Å; Y578-Y591 HydrophobicContact CE1-CG 4.2Å; P585-Y591 CarbonylContact C-O 3.55Å; P585-Y591 HydrophobicContact CB-CD1 4.35Å; P585-Y591 HydrophobicContact CB-CD2 4.15Å; P585-Y591 HydrophobicContact CB-CE1 3.92Å; P585-Y591 HydrophobicContact CB-CE2 3.7Å; P585-Y591 HydrophobicContact CB-CG 4.44Å; P585-Y591 VanDerWaalsContact CB-O 3.26Å; P585-Y591 WeakPolarHBondContact CB-O 3.47Å; P585-Y591 HydrophobicContact CG-CD2 3.95Å; P585-Y591 HydrophobicContact CG-CE1 4.3Å; P585-Y591 HydrophobicContact CG-CE2 3.61Å; P585-Y591 HydrophobicContact CG-CG 4.43Å; P585-Y591 WeakPolarHBondContact CG-O 3.28Å; R586-Y591 WeakPolarHBondContact CA-O 3.29Å; R586-Y591 PolarHBondContact N-O 3.33Å; S589-Y591 VanDerWaalsContact C-N 3.28Å; S589-Y591 VanDerWaalsContact CB-CE1 3.5Å; S589-Y591 WeakPolarHBondContact O-CD1 3.27Å; S589-Y591 PolarHBondContact O-N 3.1Å; Y591-V642 HydrophobicContact CE1-CG2 4.49Å; Y591-E644 PolarHBondContact OH-OE2 3.18Å
592	E	85.3	Confident	82.6	Confident	113.5 Å²	113.5	66.4 Å²	66.4	53%	0.53	38%	0.376	S	S	.	.			trans	-105.9	157.2	176.3	-65.9	175.3	164.5	0	0	110	Y578 R586	Y578-E592 WeakPolarHBondContact CD1-O 3.28Å; R586-E592 IonicContact CZ-OE1 3.29Å; R586-E592 IonicContact NE-OE1 3.76Å; R586-E592 IonicContact NH1-OE1 2.74Å; R586-E592 PolarHBondContact NH1-OE1 3.31Å; R586-E592 IonicContact NH2-OE1 3.28Å; R586-E592 PolarHBondContact NH2-OE1 3.5Å
593	L	87.7	Confident	82.4	Confident	3 Å²	3	68 Å²	68	2%	0.016	39%	0.389	C	S	.	.			trans	-71	151.1	175	-60.9	179.3	0	0	0	110.5	Y578 A581 N584 P585 T595 H598 I600	Y578-L593 WeakPolarHBondContact O-CA 3.44Å; A581-L593 HydrophobicContact CB-CD1 4.4Å; A581-L593 HydrophobicContact CB-CD2 3.57Å; A581-L593 VanDerWaalsContact CB-CD2 3.49Å; N584-L593 WeakPolarHBondContact OD1-CD1 3.22Å; P585-L593 HydrophobicContact CG-CD2 4.07Å; P585-L593 HydrophobicContact CG-CG 4.36Å; L593-T595 HydrophobicContact CB-CG2 4.27Å; L593-T595 PolarHBondContact O-N 3.2Å; L593-H598 PolarHBondContact O-ND1 3.35Å; L593-I600 HydrophobicContact CD1-CG1 4.16Å
594	C	86	Confident	82.3	Confident	46 Å²	46	69.3 Å²	69.3	31%	0.311	40%	0.396	S	S	.	.			trans	-95.7	22	175.5	-62.7	0	0	0	0	112.2	Y578 Y579	Y578-C594 PolarHBondContact O-N 3.47Å; Y579-C594 HydrophobicContact CD1-CB 4.32Å; Y579-C594 HydrophobicContact CE1-CB 3.68Å; Y579-C594 VanDerWaalsContact CE1-O 3.31Å; Y579-C594 WeakPolarHBondContact CE1-O 3.34Å; Y579-C594 HydrophobicContact CE2-CB 4.02Å; Y579-C594 VanDerWaalsContact CZ-CB 3.41Å; Y579-C594 WeakPolarHBondContact OH-CB 3.18Å
595	T	83.5	Confident	82.3	Confident	6.5 Å²	6.5	73.6 Å²	73.6	4%	0.04	41%	0.414	C	S	.	.	S	Bend	trans	-79.5	158.7	176.7	55.8	0	0	0	0	110.5	L593 D597 H598 E599 I601	L593-T595 HydrophobicContact CB-CG2 4.27Å; L593-T595 PolarHBondContact O-N 3.2Å; T595-D597 PolarHBondContact O-N 3.31Å; T595-D597 VanDerWaalsContact O-N 3.16Å; T595-H598 PolarHBondContact O-N 3Å; T595-H598 VanDerWaalsContact OG1-C 3.3Å; T595-H598 VanDerWaalsContact OG1-CA 3.28Å; T595-H598 WeakPolarHBondContact OG1-CA 3.33Å; T595-H598 PolarHBondContact OG1-N 2.83Å; T595-E599 VanDerWaalsContact CB-O 3.28Å; T595-E599 WeakPolarHBondContact CB-O 3.41Å; T595-E599 WeakPolarHBondContact CG2-O 3.39Å; T595-E599 PolarHBondContact OG1-N 2.97Å; T595-E599 VanDerWaalsContact OG1-N 3.12Å; T595-E599 PolarHBondContact OG1-O 2.94Å; T595-I601 HydrophobicContact CG2-CD1 3.79Å; T595-I601 HydrophobicContact CG2-CG1 3.65Å
596	P	73.6	Confident	82.2	Confident	80 Å²	80	77.5 Å²	77.5	52%	0.519	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-33.6	-171.5	-28.1	35.9	0	0	0	115.2	K537	K537-P596 HydrophobicContact CG-CG 4.3Å
597	D	77.4	Confident	82.5	Confident	128 Å²	128	71.3 Å²	71.3	68%	0.684	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	9.4	179.4	-55.9	-62.7	0	0	0	112.5	T595 E599	T595-D597 PolarHBondContact O-N 3.31Å; T595-D597 VanDerWaalsContact O-N 3.16Å; D597-E599 HydrophobicContact CB-CB 4.32Å; D597-E599 HydrophobicContact CB-CG 4.34Å; D597-E599 PolarHBondContact O-N 3.23Å; D597-E599 VanDerWaalsContact O-N 3.07Å
598	H	80.5	Confident	83.2	Confident	102.5 Å²	102.5	70.3 Å²	70.3	48%	0.475	39%	0.386	S	S	.	.	S	Bend	trans	57.2	14.5	-167.9	-53.8	-76	0	0	0	115	L593 T595	L593-H598 PolarHBondContact O-ND1 3.35Å; T595-H598 PolarHBondContact O-N 3Å; T595-H598 VanDerWaalsContact OG1-C 3.3Å; T595-H598 VanDerWaalsContact OG1-CA 3.28Å; T595-H598 WeakPolarHBondContact OG1-CA 3.33Å; T595-H598 PolarHBondContact OG1-N 2.83Å
599	E	81.4	Confident	83.7	Confident	133.5 Å²	133.5	69.1 Å²	69.1	62%	0.624	39%	0.385	S	S	*	.	S	Bend	trans	-101.1	169.6	178.4	-66.1	-165.4	164.1	0	0	113.5	T595 D597	T595-E599 VanDerWaalsContact CB-O 3.28Å; T595-E599 WeakPolarHBondContact CB-O 3.41Å; T595-E599 WeakPolarHBondContact CG2-O 3.39Å; T595-E599 PolarHBondContact OG1-N 2.97Å; T595-E599 VanDerWaalsContact OG1-N 3.12Å; T595-E599 PolarHBondContact OG1-O 2.94Å; D597-E599 HydrophobicContact CB-CB 4.32Å; D597-E599 HydrophobicContact CB-CG 4.34Å; D597-E599 PolarHBondContact O-N 3.23Å; D597-E599 VanDerWaalsContact O-N 3.07Å
600	I	81.5	Confident	84.2	Confident	59.5 Å²	59.5	68.2 Å²	68.2	31%	0.305	38%	0.379	S	S	.	.			trans	-71.8	131.5	-179.9	-59.1	168.9	0	0	0	110	N584 L593 G602 L607	N584-I600 HydrophobicContact CB-CD1 4.47Å; N584-I600 VanDerWaalsContact OD1-CG1 3.27Å; N584-I600 WeakPolarHBondContact OD1-CG1 3.42Å; L593-I600 HydrophobicContact CD1-CG1 4.16Å; I600-G602 PolarHBondContact O-N 2.91Å; I600-L607 HydrophobicContact CG2-CD1 3.32Å
601	I	79.4	Confident	84.7	Confident	30.3333 Å²	30.3333	64.9 Å²	64.9	16%	0.156	35%	0.345	C	S	.	.			trans	-76.9	97	-175.4	-50.9	176.7	0	0	0	111.3	C536 L540 Y579 T595 L607	C536-I601 HydrophobicContact CB-CD1 3.81Å; L540-I601 HydrophobicContact CD2-CG2 4.12Å; Y579-I601 WeakPolarHBondContact O-CD1 3.39Å; T595-I601 HydrophobicContact CG2-CD1 3.79Å; T595-I601 HydrophobicContact CG2-CG1 3.65Å; I601-L607 HydrophobicContact CB-CD2 4.34Å; I601-L607 WeakPolarHBondContact O-CD1 3.46Å; I601-L607 VanDerWaalsContact O-CG 3.27Å; I601-L607 WeakPolarHBondContact O-CG 3.38Å
602	G	78.8	Confident	85	Confident	55 Å²	55	66.6 Å²	66.6	57%	0.567	36%	0.358	S	S	*	.	S	Bend	trans	70.3	-150.5	170.3	0	0	0	0	0	114.1	I600	I600-G602 PolarHBondContact O-N 2.91Å
603	S	84.2	Confident	85.3	Confident	55 Å²	55	62.3 Å²	62.3	39%	0.385	34%	0.338	S	S	.	.			trans	-80.3	134.5	-175	57.6	0	0	0	0	112.6	E605 K606 L607	S603-E605 VanDerWaalsContact C-N 3.26Å; S603-E605 PolarHBondContact O-N 3.17Å; S603-E605 VanDerWaalsContact O-N 3.12Å; S603-K606 PolarHBondContact O-N 2.9Å; S603-K606 WeakPolarHBondContact OG-CD 3.13Å; S603-K606 VanDerWaalsContact OG-CG 3.29Å; S603-K606 WeakPolarHBondContact OG-CG 3.33Å; S603-L607 PolarHBondContact O-N 3.38Å
604	V	85.7	Confident	85.6	Confident	73.6667 Å²	73.6667	62.4 Å²	62.4	45%	0.446	34%	0.339	S	S	.	.	H	α-helix	trans	-48.5	-42.4	178.2	-177.3	0	0	0	0	112.9	L582 K606 L607 I608	L582-V604 HydrophobicContact CD2-CG1 4.23Å; V604-K606 VanDerWaalsContact C-N 3.28Å; V604-K606 PolarHBondContact O-N 3.17Å; V604-L607 WeakPolarHBondContact O-CB 3.49Å; V604-L607 PolarHBondContact O-N 3Å; V604-L607 VanDerWaalsContact O-N 3.15Å; V604-I608 HydrophobicContact CG1-CD1 4.01Å; V604-I608 HydrophobicContact CG1-CG1 4.41Å; V604-I608 WeakPolarHBondContact O-CG1 3.32Å; V604-I608 PolarHBondContact O-N 3.16Å
605	E	86.6	Confident	86	Confident	154.333 Å²	154.333	61 Å²	61	72%	0.721	33%	0.328	S	S	*	.	H	α-helix	trans	-56.6	-37.8	177.6	-64.2	-176.7	175.7	0	0	113.8	S603 K609	S603-E605 VanDerWaalsContact C-N 3.26Å; S603-E605 PolarHBondContact O-N 3.17Å; S603-E605 VanDerWaalsContact O-N 3.12Å; E605-K609 PolarHBondContact O-N 3.13Å
606	K	85.5	Confident	86.4	Confident	95.6667 Å²	95.6667	63.8 Å²	63.8	42%	0.416	34%	0.342	S	S	.	.	H	α-helix	trans	-77.1	-38.1	178.7	-67	-176	-178.6	-168.5	0	111.1	L540 S603 V604 I608 K609 L610	L540-K606 HydrophobicContact CB-CD 4.45Å; L540-K606 HydrophobicContact CD1-CB 3.92Å; L540-K606 HydrophobicContact CD1-CD 3.4Å; L540-K606 VanDerWaalsContact CD1-CD 3.48Å; L540-K606 HydrophobicContact CD1-CG 4.31Å; L540-K606 HydrophobicContact CG-CD 4.47Å; S603-K606 PolarHBondContact O-N 2.9Å; S603-K606 WeakPolarHBondContact OG-CD 3.13Å; S603-K606 VanDerWaalsContact OG-CG 3.29Å; S603-K606 WeakPolarHBondContact OG-CG 3.33Å; V604-K606 VanDerWaalsContact C-N 3.28Å; V604-K606 PolarHBondContact O-N 3.17Å; K606-I608 VanDerWaalsContact C-N 3.31Å; K606-I608 PolarHBondContact O-N 3.11Å; K606-K609 WeakPolarHBondContact O-CB 3.3Å; K606-K609 PolarHBondContact O-N 2.89Å; K606-K609 VanDerWaalsContact O-N 3.13Å; K606-L610 PolarHBondContact O-N 2.94Å; K606-L610 VanDerWaalsContact O-N 3.13Å
607	L	89.2	Confident	87.3	Confident	0.333333 Å²	0.333333	60 Å²	60	0%	0.002	32%	0.318	C	S	.	.	H	α-helix	trans	-60.8	-40.2	172.8	-73.7	168.1	0	0	0	111.9	L580 L582 I600 I601 S603 V604 K609 L610 R611	L580-L607 HydrophobicContact CD2-CD2 3.78Å; L582-L607 HydrophobicContact CD2-CB 3.63Å; L582-L607 HydrophobicContact CD2-CD1 4.45Å; I600-L607 HydrophobicContact CG2-CD1 3.32Å; I601-L607 HydrophobicContact CB-CD2 4.34Å; I601-L607 WeakPolarHBondContact O-CD1 3.46Å; I601-L607 VanDerWaalsContact O-CG 3.27Å; I601-L607 WeakPolarHBondContact O-CG 3.38Å; S603-L607 PolarHBondContact O-N 3.38Å; V604-L607 WeakPolarHBondContact O-CB 3.49Å; V604-L607 PolarHBondContact O-N 3Å; V604-L607 VanDerWaalsContact O-N 3.15Å; L607-K609 VanDerWaalsContact C-N 3.27Å; L607-K609 PolarHBondContact O-N 3.13Å; L607-L610 PolarHBondContact O-N 3.12Å; L607-L610 VanDerWaalsContact O-N 3.16Å; L607-R611 WeakPolarHBondContact O-CB 3.35Å; L607-R611 VanDerWaalsContact O-CG 3.31Å; L607-R611 WeakPolarHBondContact O-CG 3.33Å; L607-R611 PolarHBondContact O-N 3.18Å
608	I	90.7	Very high	88.1	Confident	81 Å²	81	54 Å²	54	42%	0.415	29%	0.285	S	S	.	.	H	α-helix	trans	-57.2	-40.6	174	-70	166.8	0	0	0	111	L582 V604 K606 T612	L582-I608 HydrophobicContact CD1-CG1 4.2Å; L582-I608 HydrophobicContact CD2-CG1 3.99Å; V604-I608 HydrophobicContact CG1-CD1 4.01Å; V604-I608 HydrophobicContact CG1-CG1 4.41Å; V604-I608 WeakPolarHBondContact O-CG1 3.32Å; V604-I608 PolarHBondContact O-N 3.16Å; K606-I608 VanDerWaalsContact C-N 3.31Å; K606-I608 PolarHBondContact O-N 3.11Å; I608-T612 VanDerWaalsContact O-CB 3.26Å; I608-T612 WeakPolarHBondContact O-CB 3.38Å; I608-T612 PolarHBondContact O-N 3.19Å; I608-T612 PolarHBondContact O-OG1 3.35Å
609	K	89.9	Confident	88.7	Confident	117 Å²	117	51.5 Å²	51.5	51%	0.509	27%	0.273	S	S	.	.	H	α-helix	trans	-64.4	-45.9	175	-64.9	-179.2	-178.6	-176.7	0	112.4	E605 K606 L607 T612 N613	E605-K609 PolarHBondContact O-N 3.13Å; K606-K609 WeakPolarHBondContact O-CB 3.3Å; K606-K609 PolarHBondContact O-N 2.89Å; K606-K609 VanDerWaalsContact O-N 3.13Å; L607-K609 VanDerWaalsContact C-N 3.27Å; L607-K609 PolarHBondContact O-N 3.13Å; K609-T612 WeakPolarHBondContact O-CB 3.35Å; K609-T612 PolarHBondContact O-N 3.25Å; K609-N613 PolarHBondContact O-N 3.18Å; K609-N613 PolarHBondContact O-ND2 3.03Å
610	L	91.2	Very high	89.1	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-61.8	-47.9	178.2	-62.7	-177	0	0	0	111.7	L540 Q543 E544 Y547 L580 K606 L607 T612 N613 L614	L540-L610 HydrophobicContact CD2-CD1 3.68Å; Q543-L610 HydrophobicContact CB-CD1 4.07Å; Q543-L610 HydrophobicContact CB-CD2 3.9Å; E544-L610 VanDerWaalsContact CA-CD2 3.43Å; E544-L610 HydrophobicContact CB-CD2 3.76Å; E544-L610 HydrophobicContact CG-CD2 4.27Å; Y547-L610 HydrophobicContact CD2-CB 4.27Å; Y547-L610 HydrophobicContact CD2-CD2 4.05Å; Y547-L610 HydrophobicContact CE2-CB 4.37Å; Y547-L610 HydrophobicContact CE2-CD2 4.43Å; L580-L610 HydrophobicContact CD1-CB 4.32Å; L580-L610 HydrophobicContact CD2-CB 4.2Å; L580-L610 HydrophobicContact CD2-CD1 3.9Å; K606-L610 PolarHBondContact O-N 2.94Å; K606-L610 VanDerWaalsContact O-N 3.13Å; L607-L610 PolarHBondContact O-N 3.12Å; L607-L610 VanDerWaalsContact O-N 3.16Å; L610-T612 VanDerWaalsContact C-N 3.32Å; L610-T612 PolarHBondContact O-N 2.92Å; L610-N613 PolarHBondContact O-N 2.97Å; L610-L614 PolarHBondContact O-N 3.26Å; L610-L614 VanDerWaalsContact O-N 3.12Å
611	R	94.1	Very high	89.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-58.4	-43.8	174.2	-68	-179.2	68.5	95.5	-3.3	111.3	L576 L580 L607 N613 L614 L615 N647 D650	L576-R611 HydrophobicContact CD2-CB 3.98Å; L576-R611 HydrophobicContact CD2-CG 3.75Å; L576-R611 PolarHBondContact O-NH1 2.88Å; L576-R611 VanDerWaalsContact O-NH1 3.15Å; L580-R611 HydrophobicContact CB-CG 4.05Å; L580-R611 VanDerWaalsContact O-CD 3.28Å; L580-R611 WeakPolarHBondContact O-CD 3.41Å; L580-R611 PolarHBondContact O-NH1 3.13Å; L607-R611 WeakPolarHBondContact O-CB 3.35Å; L607-R611 VanDerWaalsContact O-CG 3.31Å; L607-R611 WeakPolarHBondContact O-CG 3.33Å; L607-R611 PolarHBondContact O-N 3.18Å; R611-N613 VanDerWaalsContact C-N 3.33Å; R611-N613 PolarHBondContact O-N 3.38Å; R611-L614 PolarHBondContact O-N 3.12Å; R611-L615 WeakPolarHBondContact O-CB 3.33Å; R611-L615 VanDerWaalsContact O-CG 3.25Å; R611-L615 WeakPolarHBondContact O-CG 3.36Å; R611-L615 PolarHBondContact O-N 3.28Å; R611-N647 PolarHBondContact NH2-O 3.13Å; R611-D650 IonicContact CZ-OD1 3.16Å; R611-D650 IonicContact CZ-OD2 3.17Å; R611-D650 VanDerWaalsContact CZ-OD2 3.32Å; R611-D650 IonicContact NE-OD1 2.8Å; R611-D650 IonicContact NE-OD2 3.14Å; R611-D650 PolarHBondContact NE-OD2 2.99Å; R611-D650 VanDerWaalsContact NH2-CG 3.32Å; R611-D650 IonicContact NH2-OD1 2.9Å; R611-D650 PolarHBondContact NH2-OD1 3.19Å; R611-D650 IonicContact NH2-OD2 2.77Å; R611-D650 PolarHBondContact NH2-OD2 3.1Å; R611-D650 VanDerWaalsContact NH2-OD2 3.08Å
612	T	93.1	Very high	90	Very high	62.3333 Å²	62.3333	46.4 Å²	46.4	38%	0.382	24%	0.243	S	C	.	.	H	α-helix	trans	-58	-45.1	177.5	-62.3	0	0	0	0	111.8	I608 K609 L610 L614 L615 I616	I608-T612 VanDerWaalsContact O-CB 3.26Å; I608-T612 WeakPolarHBondContact O-CB 3.38Å; I608-T612 PolarHBondContact O-N 3.19Å; I608-T612 PolarHBondContact O-OG1 3.35Å; K609-T612 WeakPolarHBondContact O-CB 3.35Å; K609-T612 PolarHBondContact O-N 3.25Å; L610-T612 VanDerWaalsContact C-N 3.32Å; L610-T612 PolarHBondContact O-N 2.92Å; T612-L614 VanDerWaalsContact C-N 3.35Å; T612-L614 PolarHBondContact O-N 2.78Å; T612-L615 PolarHBondContact O-N 3.18Å; T612-I616 HydrophobicContact CG2-CD1 3.83Å; T612-I616 HydrophobicContact CG2-CG1 4.42Å; T612-I616 WeakPolarHBondContact O-CB 3.35Å; T612-I616 VanDerWaalsContact O-CG1 3.24Å; T612-I616 WeakPolarHBondContact O-CG1 3.39Å; T612-I616 PolarHBondContact O-N 3.04Å
613	N	91.8	Very high	90.4	Very high	23.3333 Å²	23.3333	47 Å²	47	13%	0.125	24%	0.236	C	C	.	.	H	α-helix	trans	-64.2	-41.1	178.4	-70.7	-29.2	0	0	0	112.3	E544 K609 L610 R611 I616 Y617	E544-N613 VanDerWaalsContact CG-ND2 3.27Å; E544-N613 WeakPolarHBondContact CG-ND2 3.23Å; K609-N613 PolarHBondContact O-N 3.18Å; K609-N613 PolarHBondContact O-ND2 3.03Å; L610-N613 PolarHBondContact O-N 2.97Å; R611-N613 VanDerWaalsContact C-N 3.33Å; R611-N613 PolarHBondContact O-N 3.38Å; N613-I616 PolarHBondContact O-N 3.28Å; N613-Y617 PolarHBondContact O-N 3.25Å
614	L	93.1	Very high	90.1	Very high	3.66667 Å²	3.66667	52.3 Å²	52.3	2%	0.019	25%	0.247	C	C	.	.	H	α-helix	trans	-67	-37	174.6	-107.2	172.2	0	0	0	112.8	Y547 C572 A575 L576 L580 L610 R611 T612 Y617 L618	Y547-L614 HydrophobicContact CD1-CD1 4.23Å; Y547-L614 HydrophobicContact CD1-CD2 3.46Å; Y547-L614 VanDerWaalsContact CD1-CD2 3.46Å; Y547-L614 HydrophobicContact CD1-CG 3.71Å; Y547-L614 HydrophobicContact CD2-CG 4.39Å; Y547-L614 HydrophobicContact CE1-CD1 3.98Å; Y547-L614 HydrophobicContact CE1-CD2 3.76Å; Y547-L614 HydrophobicContact CE1-CG 3.98Å; Y547-L614 HydrophobicContact CE2-CD1 4.4Å; Y547-L614 HydrophobicContact CG-CD2 4.16Å; Y547-L614 HydrophobicContact CG-CG 3.96Å; C572-L614 HydrophobicContact CB-CD2 4.47Å; A575-L614 HydrophobicContact CB-CD1 4.06Å; L576-L614 HydrophobicContact CD2-CB 4.38Å; L576-L614 HydrophobicContact CD2-CD1 4.17Å; L576-L614 HydrophobicContact CG-CD1 4.37Å; L580-L614 HydrophobicContact CD1-CD1 3.4Å; L580-L614 VanDerWaalsContact CD1-CD1 3.5Å; L610-L614 PolarHBondContact O-N 3.26Å; L610-L614 VanDerWaalsContact O-N 3.12Å; R611-L614 PolarHBondContact O-N 3.12Å; T612-L614 VanDerWaalsContact C-N 3.35Å; T612-L614 PolarHBondContact O-N 2.78Å; L614-Y617 WeakPolarHBondContact O-CB 3.34Å; L614-Y617 PolarHBondContact O-N 2.91Å; L614-L618 HydrophobicContact CD2-CD1 3.99Å; L614-L618 HydrophobicContact CD2-CG 4.43Å; L614-L618 PolarHBondContact O-N 3.01Å
615	L	94.4	Very high	89.6	Confident	16.3333 Å²	16.3333	51.5 Å²	51.5	9%	0.086	25%	0.254	C	S	.	.	H	α-helix	trans	-71.6	-33.2	175.8	-69.2	167.4	0	0	0	112.1	L576 R611 T612 Y617 L618 K619 D650 V651 L654	L576-L615 HydrophobicContact CD1-CD2 3.87Å; L576-L615 HydrophobicContact CD1-CG 4.4Å; R611-L615 WeakPolarHBondContact O-CB 3.33Å; R611-L615 VanDerWaalsContact O-CG 3.25Å; R611-L615 WeakPolarHBondContact O-CG 3.36Å; R611-L615 PolarHBondContact O-N 3.28Å; T612-L615 PolarHBondContact O-N 3.18Å; L615-Y617 VanDerWaalsContact C-N 3.32Å; L615-L618 HydrophobicContact CD2-CD1 4.3Å; L615-L618 PolarHBondContact O-N 3.17Å; L615-K619 VanDerWaalsContact O-CB 3.31Å; L615-K619 WeakPolarHBondContact O-CB 3.24Å; L615-K619 PolarHBondContact O-N 2.86Å; L615-D650 HydrophobicContact CD1-CB 3.54Å; L615-D650 VanDerWaalsContact CD1-CG 3.48Å; L615-D650 VanDerWaalsContact CD1-OD2 3.27Å; L615-D650 WeakPolarHBondContact CD1-OD2 3.32Å; L615-V651 HydrophobicContact CD2-CG2 4.04Å; L615-L654 HydrophobicContact CB-CD2 4.34Å; L615-L654 HydrophobicContact CD2-CB 4.37Å; L615-L654 HydrophobicContact CD2-CD2 3.55Å; L615-L654 VanDerWaalsContact CD2-CD2 3.48Å
616	I	92.4	Very high	89.5	Confident	65.6667 Å²	65.6667	44.5 Å²	44.5	34%	0.337	22%	0.223	S	C	.	.	H	α-helix	trans	-63.7	-41.1	169.3	-71.3	166	0	0	0	110.3	A551 T612 N613 K619 R620	A551-I616 HydrophobicContact CB-CG2 4.36Å; T612-I616 HydrophobicContact CG2-CD1 3.83Å; T612-I616 HydrophobicContact CG2-CG1 4.42Å; T612-I616 WeakPolarHBondContact O-CB 3.35Å; T612-I616 VanDerWaalsContact O-CG1 3.24Å; T612-I616 WeakPolarHBondContact O-CG1 3.39Å; T612-I616 PolarHBondContact O-N 3.04Å; N613-I616 PolarHBondContact O-N 3.28Å; I616-K619 PolarHBondContact O-N 2.98Å; I616-R620 HydrophobicContact CG2-CG 4.44Å; I616-R620 WeakPolarHBondContact O-CB 3.34Å; I616-R620 VanDerWaalsContact O-CG 3.27Å; I616-R620 WeakPolarHBondContact O-CG 3.42Å; I616-R620 PolarHBondContact O-N 3.3Å
617	Y	92.8	Very high	89.8	Confident	1.66667 Å²	1.66667	40.3 Å²	40.3	1%	0.007	21%	0.206	C	C	.	.	H	α-helix	trans	-60.1	-51.2	174.4	-178.2	-144.3	0	0	0	111.4	L550 M555 T568 N613 L614 L615 K619 R620 L621	L550-Y617 HydrophobicContact CB-CD1 4.26Å; L550-Y617 HydrophobicContact CB-CE1 4.12Å; L550-Y617 VanDerWaalsContact O-CD2 3.26Å; L550-Y617 WeakPolarHBondContact O-CD2 3.24Å; L550-Y617 WeakPolarHBondContact O-CE2 3.44Å; M555-Y617 HydrophobicContact CG-CD2 4Å; M555-Y617 HydrophobicContact CG-CE2 3.98Å; M555-Y617 HydrophobicContact SD-CD2 3.39Å; M555-Y617 WeakPolarHBondContact SD-CD2 3.36Å; M555-Y617 HydrophobicContact SD-CE2 3.39Å; M555-Y617 VanDerWaalsContact SD-CE2 3.53Å; M555-Y617 WeakPolarHBondContact SD-CE2 3.49Å; T568-Y617 HydrophobicContact CG2-CE1 3.55Å; T568-Y617 VanDerWaalsContact CG2-CE1 3.47Å; T568-Y617 VanDerWaalsContact CG2-OH 3.28Å; T568-Y617 WeakPolarHBondContact CG2-OH 3.29Å; N613-Y617 PolarHBondContact O-N 3.25Å; L614-Y617 WeakPolarHBondContact O-CB 3.34Å; L614-Y617 PolarHBondContact O-N 2.91Å; L615-Y617 VanDerWaalsContact C-N 3.32Å; Y617-K619 PolarHBondContact O-N 3.23Å; Y617-R620 PolarHBondContact O-N 3Å; Y617-L621 HydrophobicContact CD2-CD1 4.42Å; Y617-L621 HydrophobicContact CD2-CG 4.43Å; Y617-L621 HydrophobicContact CE1-CD1 4.42Å; Y617-L621 HydrophobicContact CE2-CD1 4.3Å; Y617-L621 HydrophobicContact CE2-CD2 4.35Å; Y617-L621 HydrophobicContact CE2-CG 4.33Å; Y617-L621 WeakPolarHBondContact O-CG 3.43Å; Y617-L621 PolarHBondContact O-N 3.12Å; Y617-L621 VanDerWaalsContact O-N 3.09Å
618	L	93.7	Very high	89.9	Confident	1.66667 Å²	1.66667	43.2 Å²	43.2	1%	0.009	22%	0.223	C	C	.	.	H	α-helix	trans	-56.5	-46.9	174.4	-75.6	173.8	0	0	0	112.3	I569 C572 L573 L576 L614 L615 R620 L621 F622 L654	I569-L618 HydrophobicContact CB-CD2 4.14Å; I569-L618 HydrophobicContact CG1-CD2 3.8Å; I569-L618 HydrophobicContact CG2-CD2 4.03Å; C572-L618 HydrophobicContact CB-CD1 4.02Å; C572-L618 HydrophobicContact CB-CD2 3.78Å; C572-L618 HydrophobicContact CB-CG 3.91Å; L573-L618 HydrophobicContact CD2-CD1 4.26Å; L576-L618 HydrophobicContact CD1-CD1 4.25Å; L614-L618 HydrophobicContact CD2-CD1 3.99Å; L614-L618 HydrophobicContact CD2-CG 4.43Å; L614-L618 PolarHBondContact O-N 3.01Å; L615-L618 HydrophobicContact CD2-CD1 4.3Å; L615-L618 PolarHBondContact O-N 3.17Å; L618-R620 VanDerWaalsContact C-N 3.32Å; L618-R620 PolarHBondContact O-N 3.27Å; L618-L621 HydrophobicContact CD2-CD1 4.44Å; L618-L621 WeakPolarHBondContact O-CB 3.25Å; L618-L621 PolarHBondContact O-N 3.15Å; L618-L621 VanDerWaalsContact O-N 3.15Å; L618-F622 HydrophobicContact CB-CE2 4.11Å; L618-F622 HydrophobicContact CB-CZ 4.17Å; L618-F622 HydrophobicContact CD2-CZ 4.2Å; L618-F622 WeakPolarHBondContact O-CD1 3.45Å; L618-F622 WeakPolarHBondContact O-CD2 3.3Å; L618-F622 VanDerWaalsContact O-CG 3.26Å; L618-F622 WeakPolarHBondContact O-CG 3.4Å; L618-F622 PolarHBondContact O-N 3.09Å; L618-F622 VanDerWaalsContact O-N 3.13Å; L618-L654 HydrophobicContact CB-CD2 3.86Å; L618-L654 HydrophobicContact CD1-CD2 4.27Å
619	K	92.7	Very high	90	Very high	49.6667 Å²	49.6667	40.9 Å²	40.9	22%	0.216	21%	0.212	C	C	.	.	H	α-helix	trans	-58.6	-43.5	177.7	-168.5	165.3	-179.9	165.9	0	112	L615 I616 Y617 L621 F622 T623 L654 S657 E661	L615-K619 VanDerWaalsContact O-CB 3.31Å; L615-K619 WeakPolarHBondContact O-CB 3.24Å; L615-K619 PolarHBondContact O-N 2.86Å; I616-K619 PolarHBondContact O-N 2.98Å; Y617-K619 PolarHBondContact O-N 3.23Å; K619-L621 VanDerWaalsContact C-N 3.31Å; K619-L621 PolarHBondContact O-N 2.93Å; K619-F622 PolarHBondContact O-N 3.46Å; K619-T623 WeakPolarHBondContact O-CB 3.3Å; K619-T623 PolarHBondContact O-N 3.26Å; K619-T623 PolarHBondContact O-OG1 3.09Å; K619-T623 VanDerWaalsContact O-OG1 3.09Å; K619-L654 HydrophobicContact CB-CD1 3.6Å; K619-L654 HydrophobicContact CD-CD1 4.09Å; K619-L654 HydrophobicContact CG-CD1 3.94Å; K619-S657 PolarHBondContact NZ-OG 3.16Å; K619-S657 VanDerWaalsContact NZ-OG 3.15Å; K619-E661 WeakPolarHBondContact CE-OE2 3.21Å; K619-E661 IonicContact NZ-OE1 3.11Å; K619-E661 PolarHBondContact NZ-OE1 3.14Å; K619-E661 IonicContact NZ-OE2 3.23Å; K619-E661 PolarHBondContact NZ-OE2 2.94Å
620	R	91	Very high	90.2	Very high	108.333 Å²	108.333	39.2 Å²	39.2	41%	0.409	21%	0.208	S	C	.	.	H	α-helix	trans	-64.5	-35	178	-74.1	174.1	178.3	-166.3	-0.1	112.5	A551 M555 I616 Y617 L618 T623 R624	A551-R620 VanDerWaalsContact O-CD 3.26Å; A551-R620 WeakPolarHBondContact O-CD 3.33Å; A551-R620 PolarHBondContact O-NH1 3.26Å; M555-R620 HydrophobicContact CE-CB 3.76Å; M555-R620 HydrophobicContact CG-CB 4.33Å; M555-R620 HydrophobicContact SD-CB 3.79Å; I616-R620 HydrophobicContact CG2-CG 4.44Å; I616-R620 WeakPolarHBondContact O-CB 3.34Å; I616-R620 VanDerWaalsContact O-CG 3.27Å; I616-R620 WeakPolarHBondContact O-CG 3.42Å; I616-R620 PolarHBondContact O-N 3.3Å; Y617-R620 PolarHBondContact O-N 3Å; L618-R620 VanDerWaalsContact C-N 3.32Å; L618-R620 PolarHBondContact O-N 3.27Å; R620-T623 PolarHBondContact O-N 3.17Å; R620-R624 PolarHBondContact O-N 3.04Å
621	L	89.7	Confident	90.3	Very high	5.66667 Å²	5.66667	39.2 Å²	39.2	3%	0.03	21%	0.208	C	C	.	.	H	α-helix	trans	-63.3	-46.6	172.3	-66.7	171.4	0	0	0	111	M555 V558 R565 T568 I569 Y617 L618 K619 R624	M555-L621 HydrophobicContact CE-CD2 3.8Å; M555-L621 HydrophobicContact CE-CG 4.28Å; M555-L621 HydrophobicContact SD-CD2 3.7Å; M555-L621 HydrophobicContact SD-CG 3.94Å; V558-L621 HydrophobicContact CB-CD2 4.02Å; V558-L621 HydrophobicContact CG1-CD2 3.63Å; R565-L621 HydrophobicContact CG-CD2 4.38Å; R565-L621 PolarHBondContact NH1-O 3.08Å; R565-L621 PolarHBondContact NH2-O 3.35Å; T568-L621 HydrophobicContact CG2-CD1 3.79Å; I569-L621 HydrophobicContact CG1-CD1 4.12Å; Y617-L621 HydrophobicContact CD2-CD1 4.42Å; Y617-L621 HydrophobicContact CD2-CG 4.43Å; Y617-L621 HydrophobicContact CE1-CD1 4.42Å; Y617-L621 HydrophobicContact CE2-CD1 4.3Å; Y617-L621 HydrophobicContact CE2-CD2 4.35Å; Y617-L621 HydrophobicContact CE2-CG 4.33Å; Y617-L621 WeakPolarHBondContact O-CG 3.43Å; Y617-L621 PolarHBondContact O-N 3.12Å; Y617-L621 VanDerWaalsContact O-N 3.09Å; L618-L621 HydrophobicContact CD2-CD1 4.44Å; L618-L621 WeakPolarHBondContact O-CB 3.25Å; L618-L621 PolarHBondContact O-N 3.15Å; L618-L621 VanDerWaalsContact O-N 3.15Å; K619-L621 VanDerWaalsContact C-N 3.31Å; K619-L621 PolarHBondContact O-N 2.93Å; L621-R624 PolarHBondContact O-N 3.22Å
622	F	89.8	Confident	90.4	Very high	1.66667 Å²	1.66667	39.2 Å²	39.2	1%	0.007	21%	0.208	C	C	.	.	H	α-helix	trans	-64.5	-42.6	179.1	-53.4	-30	0	0	0	112.5	I569 L618 K619 R624 G625 G626 I627 I635 L654 T658	I569-F622 HydrophobicContact CD1-CE1 3.79Å; I569-F622 HydrophobicContact CG1-CE1 4.23Å; L618-F622 HydrophobicContact CB-CE2 4.11Å; L618-F622 HydrophobicContact CB-CZ 4.17Å; L618-F622 HydrophobicContact CD2-CZ 4.2Å; L618-F622 WeakPolarHBondContact O-CD1 3.45Å; L618-F622 WeakPolarHBondContact O-CD2 3.3Å; L618-F622 VanDerWaalsContact O-CG 3.26Å; L618-F622 WeakPolarHBondContact O-CG 3.4Å; L618-F622 PolarHBondContact O-N 3.09Å; L618-F622 VanDerWaalsContact O-N 3.13Å; K619-F622 PolarHBondContact O-N 3.46Å; F622-R624 VanDerWaalsContact C-N 3.33Å; F622-R624 PolarHBondContact O-N 3.14Å; F622-R624 VanDerWaalsContact O-N 3.16Å; F622-G625 PolarHBondContact O-N 3.45Å; F622-G626 CarbonylContact O-C 3.52Å; F622-G626 WeakPolarHBondContact O-CA 3.35Å; F622-G626 PolarHBondContact O-N 3.14Å; F622-I627 HydrophobicContact CB-CD1 4.23Å; F622-I627 HydrophobicContact CB-CG1 3.86Å; F622-I627 HydrophobicContact CD1-CD1 4.11Å; F622-I627 HydrophobicContact CD1-CG1 3.66Å; F622-I627 HydrophobicContact CD2-CD1 4.02Å; F622-I627 HydrophobicContact CD2-CG1 4.38Å; F622-I627 HydrophobicContact CE1-CD1 4.32Å; F622-I627 HydrophobicContact CE1-CG1 4.31Å; F622-I627 HydrophobicContact CE2-CD1 4.32Å; F622-I627 HydrophobicContact CG-CD1 3.86Å; F622-I627 HydrophobicContact CG-CG1 3.71Å; F622-I627 HydrophobicContact CZ-CD1 4.47Å; F622-I635 HydrophobicContact CE1-CD1 4.29Å; F622-I635 HydrophobicContact CE2-CD1 3.95Å; F622-I635 HydrophobicContact CZ-CD1 3.59Å; F622-I635 HydrophobicContact CZ-CG1 4.37Å; F622-L654 HydrophobicContact CD2-CD1 4.49Å; F622-L654 HydrophobicContact CE2-CD1 4.46Å; F622-L654 HydrophobicContact CE2-CD2 4.03Å; F622-L654 HydrophobicContact CE2-CG 4.3Å; F622-T658 HydrophobicContact CB-CG2 4.05Å; F622-T658 HydrophobicContact CD2-CG2 3.96Å; F622-T658 HydrophobicContact CG-CG2 4.33Å
623	T	86.2	Confident	90.5	Very high	69 Å²	69	41.7 Å²	41.7	42%	0.423	21%	0.211	S	C	.	.	H	α-helix	trans	-60.2	-34	178.8	-59	0	0	0	0	113.1	K619 R620 G625 F662	K619-T623 WeakPolarHBondContact O-CB 3.3Å; K619-T623 PolarHBondContact O-N 3.26Å; K619-T623 PolarHBondContact O-OG1 3.09Å; K619-T623 VanDerWaalsContact O-OG1 3.09Å; R620-T623 PolarHBondContact O-N 3.17Å; T623-G625 VanDerWaalsContact C-N 3.33Å; T623-G625 PolarHBondContact O-N 3.01Å; T623-F662 HydrophobicContact CG2-CE1 3.96Å; T623-F662 HydrophobicContact CG2-CZ 3.63Å; T623-F662 WeakPolarHBondContact OG1-CE2 3.41Å; T623-F662 VanDerWaalsContact OG1-CZ 3.24Å; T623-F662 WeakPolarHBondContact OG1-CZ 3.45Å
624	R	78.9	Confident	90.7	Very high	164.667 Å²	164.667	42.9 Å²	42.9	62%	0.621	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-4.2	-175.6	-79.9	-173.6	170.8	170.4	-1.5	115.3	M555 S559 R620 L621 F622	M555-R624 HydrophobicContact CE-CG 4.47Å; S559-R624 PolarHBondContact OG-NH1 3.43Å; R620-R624 PolarHBondContact O-N 3.04Å; L621-R624 PolarHBondContact O-N 3.22Å; F622-R624 VanDerWaalsContact C-N 3.33Å; F622-R624 PolarHBondContact O-N 3.14Å; F622-R624 VanDerWaalsContact O-N 3.16Å
625	G	74.6	Confident	90.8	Very high	56.6667 Å²	56.6667	43 Å²	43	58%	0.584	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-159.8	11.4	179.9	0	0	0	0	0	117	F622 T623	F622-G625 PolarHBondContact O-N 3.45Å; T623-G625 VanDerWaalsContact C-N 3.33Å; T623-G625 PolarHBondContact O-N 3.01Å
626	G	85.3	Confident	90.9	Very high	8 Å²	8	42.9 Å²	42.9	8%	0.082	22%	0.216	C	C	.	.			trans	68.8	-179.4	-166.8	0	0	0	0	0	111.7	R565 F622	R565-G626 VanDerWaalsContact CZ-O 3.29Å; R565-G626 PolarHBondContact NH1-O 3.22Å; R565-G626 VanDerWaalsContact NH1-O 3.08Å; R565-G626 PolarHBondContact NH2-O 3.12Å; F622-G626 CarbonylContact O-C 3.52Å; F622-G626 WeakPolarHBondContact O-CA 3.35Å; F622-G626 PolarHBondContact O-N 3.14Å
627	I	90.7	Very high	91	Very high	8.33333 Å²	8.33333	41.8 Å²	41.8	4%	0.043	22%	0.218	C	C	.	.			trans	-103.8	135.9	175.4	-68	176	0	0	0	109.1	F622 E631 M632 I635 T658 C666 V669	F622-I627 HydrophobicContact CB-CD1 4.23Å; F622-I627 HydrophobicContact CB-CG1 3.86Å; F622-I627 HydrophobicContact CD1-CD1 4.11Å; F622-I627 HydrophobicContact CD1-CG1 3.66Å; F622-I627 HydrophobicContact CD2-CD1 4.02Å; F622-I627 HydrophobicContact CD2-CG1 4.38Å; F622-I627 HydrophobicContact CE1-CD1 4.32Å; F622-I627 HydrophobicContact CE1-CG1 4.31Å; F622-I627 HydrophobicContact CE2-CD1 4.32Å; F622-I627 HydrophobicContact CG-CD1 3.86Å; F622-I627 HydrophobicContact CG-CG1 3.71Å; F622-I627 HydrophobicContact CZ-CD1 4.47Å; I627-E631 HydrophobicContact CG2-CB 3.91Å; I627-M632 HydrophobicContact CB-CE 4.31Å; I627-M632 HydrophobicContact CD1-CE 4.13Å; I627-M632 HydrophobicContact CG2-CB 3.81Å; I627-M632 HydrophobicContact CG2-CE 4.02Å; I627-I635 HydrophobicContact CD1-CD1 4.19Å; I627-T658 HydrophobicContact CD1-CG2 3.86Å; I627-T658 HydrophobicContact CG1-CG2 4.49Å; I627-C666 HydrophobicContact CD1-CB 4.39Å; I627-C666 VanDerWaalsContact CD1-SG 3.57Å; I627-C666 VanDerWaalsContact CG1-SG 3.55Å; I627-V669 HydrophobicContact CG2-CG1 4.46Å
628	T	91.5	Very high	91.1	Very high	60.3333 Å²	60.3333	42.2 Å²	42.2	37%	0.37	22%	0.219	S	C	.	.			trans	-85.9	163.2	172.5	73.8	0	0	0	0	111.8	D630 E631 M632	T628-D630 VanDerWaalsContact C-N 3.28Å; T628-D630 PolarHBondContact O-N 3.05Å; T628-E631 PolarHBondContact N-OE2 3.26Å; T628-E631 VanDerWaalsContact N-OE2 3.08Å; T628-E631 PolarHBondContact O-N 3.14Å; T628-E631 VanDerWaalsContact OG1-CD 3.31Å; T628-E631 VanDerWaalsContact OG1-CG 3.25Å; T628-E631 WeakPolarHBondContact OG1-CG 3.42Å; T628-E631 PolarHBondContact OG1-N 2.97Å; T628-E631 PolarHBondContact OG1-OE2 3.02Å; T628-M632 PolarHBondContact O-N 3.2Å
629	D	92.6	Very high	91.2	Very high	33.3333 Å²	33.3333	42.1 Å²	42.1	18%	0.178	22%	0.219	C	C	.	.	H	α-helix	trans	-57.9	-39.7	-179.7	-61.1	-53.1	0	0	0	113.2	M632 R633 V669 R672 T673	D629-M632 PolarHBondContact O-N 3.39Å; D629-R633 VanDerWaalsContact CB-NH1 3.32Å; D629-R633 WeakPolarHBondContact O-CB 3.47Å; D629-R633 VanDerWaalsContact O-CG 3.25Å; D629-R633 WeakPolarHBondContact O-CG 3.4Å; D629-R633 PolarHBondContact O-N 3.35Å; D629-R633 PolarHBondContact O-NE 2.95Å; D629-R633 IonicContact OD2-CZ 2.79Å; D629-R633 IonicContact OD2-NH2 3.79Å; D629-R633 PolarHBondContact OD2-NH2 3.25Å; D629-R633 VanDerWaalsContact OD2-NH2 3.14Å; D629-V669 HydrophobicContact CB-CG1 4.47Å; D629-R672 IonicContact OD1-CZ 3.38Å; D629-R672 VanDerWaalsContact OD1-CZ 3.23Å; D629-R672 IonicContact OD1-NE 3.76Å; D629-R672 PolarHBondContact OD1-NE 3.09Å; D629-R672 IonicContact OD1-NH1 2.67Å; D629-R672 PolarHBondContact OD1-NH1 3.39Å; D629-R672 IonicContact OD1-NH2 2.94Å; D629-R672 PolarHBondContact OD1-NH2 3.35Å; D629-R672 IonicContact OD2-CZ 2.96Å; D629-R672 IonicContact OD2-NE 3.43Å; D629-R672 IonicContact OD2-NH1 3.89Å; D629-R672 PolarHBondContact OD2-NH1 2.98Å; D629-R672 IonicContact OD2-NH2 3.4Å; D629-R672 PolarHBondContact OD2-NH2 2.95Å; D629-T673 HydrophobicContact CB-CG2 4.01Å; D629-T673 WeakPolarHBondContact O-CG2 3.44Å
630	D	93.6	Very high	91.2	Very high	80.3333 Å²	80.3333	42.2 Å²	42.2	43%	0.43	22%	0.224	S	C	.	.	H	α-helix	trans	-71.5	-36.5	-179.6	-61.6	-44.5	0	0	0	111.7	I566 T628 R633 L634	I566-D630 HydrophobicContact CD1-CB 4.38Å; T628-D630 VanDerWaalsContact C-N 3.28Å; T628-D630 PolarHBondContact O-N 3.05Å; D630-R633 PolarHBondContact O-N 3.2Å; D630-R633 IonicContact OD1-CZ 3.3Å; D630-R633 IonicContact OD1-NH1 3.77Å; D630-R633 PolarHBondContact OD1-NH1 3.13Å; D630-R633 IonicContact OD1-NH2 3.57Å; D630-R633 PolarHBondContact OD1-NH2 3.12Å; D630-R633 IonicContact OD2-NH1 3.27Å; D630-L634 VanDerWaalsContact O-CG 3.27Å; D630-L634 WeakPolarHBondContact O-CG 3.36Å; D630-L634 PolarHBondContact O-N 3.24Å
631	E	94.2	Very high	91.2	Very high	3 Å²	3	40 Å²	40	1%	0.014	22%	0.223	C	C	.	.	H	α-helix	trans	-66.7	-41.4	173.7	-66.4	172.4	166.6	0	0	112	R565 I566 I569 I627 T628 L634 I635	R565-E631 WeakPolarHBondContact CD-OE1 3.47Å; R565-E631 WeakPolarHBondContact CG-OE1 3.38Å; R565-E631 IonicContact CZ-OE1 3.17Å; R565-E631 VanDerWaalsContact CZ-OE1 3.29Å; R565-E631 IonicContact CZ-OE2 2.66Å; R565-E631 VanDerWaalsContact CZ-OE2 3.31Å; R565-E631 IonicContact NE-OE1 2.9Å; R565-E631 PolarHBondContact NE-OE1 3.06Å; R565-E631 IonicContact NE-OE2 3.44Å; R565-E631 PolarHBondContact NE-OE2 3.5Å; R565-E631 IonicContact NH2-OE1 2.84Å; R565-E631 PolarHBondContact NH2-OE1 2.95Å; R565-E631 IonicContact NH2-OE2 3.03Å; R565-E631 PolarHBondContact NH2-OE2 3.05Å; I566-E631 HydrophobicContact CG1-CG 4.05Å; I569-E631 HydrophobicContact CD1-CB 4.15Å; I569-E631 HydrophobicContact CD1-CG 3.49Å; I569-E631 VanDerWaalsContact CD1-CG 3.47Å; I569-E631 VanDerWaalsContact CD1-OE1 3.29Å; I569-E631 WeakPolarHBondContact CD1-OE1 3.16Å; I627-E631 HydrophobicContact CG2-CB 3.91Å; T628-E631 PolarHBondContact N-OE2 3.26Å; T628-E631 VanDerWaalsContact N-OE2 3.08Å; T628-E631 PolarHBondContact O-N 3.14Å; T628-E631 VanDerWaalsContact OG1-CD 3.31Å; T628-E631 VanDerWaalsContact OG1-CG 3.25Å; T628-E631 WeakPolarHBondContact OG1-CG 3.42Å; T628-E631 PolarHBondContact OG1-N 2.97Å; T628-E631 PolarHBondContact OG1-OE2 3.02Å; E631-L634 WeakPolarHBondContact O-CB 3.43Å; E631-L634 PolarHBondContact O-N 2.85Å; E631-I635 WeakPolarHBondContact O-CG1 3.42Å; E631-I635 PolarHBondContact O-N 3.49Å; E631-I635 VanDerWaalsContact O-N 3.13Å
632	M	95.4	Very high	91.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.7	-45.2	173.3	-175.7	62.6	72.4	0	0	110.7	I627 T628 D629 L634 I635 L636 L655 L659 V669 F670 T673	I627-M632 HydrophobicContact CB-CE 4.31Å; I627-M632 HydrophobicContact CD1-CE 4.13Å; I627-M632 HydrophobicContact CG2-CB 3.81Å; I627-M632 HydrophobicContact CG2-CE 4.02Å; T628-M632 PolarHBondContact O-N 3.2Å; D629-M632 PolarHBondContact O-N 3.39Å; M632-L634 VanDerWaalsContact C-N 3.26Å; M632-L634 PolarHBondContact O-N 3.12Å; M632-I635 PolarHBondContact O-N 3.06Å; M632-I635 VanDerWaalsContact O-N 3.17Å; M632-L636 HydrophobicContact CG-CD1 3.9Å; M632-L636 HydrophobicContact CG-CG 4.32Å; M632-L636 WeakPolarHBondContact O-CB 3.33Å; M632-L636 VanDerWaalsContact O-CG 3.26Å; M632-L636 WeakPolarHBondContact O-CG 3.33Å; M632-L636 PolarHBondContact O-N 2.9Å; M632-L636 HydrophobicContact SD-CD1 4.42Å; M632-L636 HydrophobicContact SD-CD2 4.46Å; M632-L636 HydrophobicContact SD-CG 4.34Å; M632-L655 HydrophobicContact CE-CD1 4.11Å; M632-L655 HydrophobicContact SD-CD1 3.77Å; M632-L659 HydrophobicContact CE-CD2 4.37Å; M632-V669 HydrophobicContact CB-CG1 3.74Å; M632-V669 HydrophobicContact CE-CG1 4.49Å; M632-V669 HydrophobicContact CG-CG1 4.19Å; M632-F670 HydrophobicContact CE-CB 3.91Å; M632-F670 HydrophobicContact CE-CD2 4.44Å; M632-F670 HydrophobicContact SD-CB 4.31Å; M632-F670 HydrophobicContact SD-CD2 4.03Å; M632-T673 HydrophobicContact CB-CG2 4.2Å; M632-T673 HydrophobicContact CG-CG2 4.23Å; M632-T673 VanDerWaalsContact CG-OG1 3.23Å; M632-T673 WeakPolarHBondContact CG-OG1 3.31Å
633	R	95.6	Very high	91.3	Very high	115 Å²	115	43.2 Å²	43.2	43%	0.434	24%	0.237	S	C	.	.	H	α-helix	trans	-57.2	-38	174.9	-76.1	172.8	-148.3	118	7.8	112.3	D629 D630 L636 A637 T673	D629-R633 VanDerWaalsContact CB-NH1 3.32Å; D629-R633 WeakPolarHBondContact O-CB 3.47Å; D629-R633 VanDerWaalsContact O-CG 3.25Å; D629-R633 WeakPolarHBondContact O-CG 3.4Å; D629-R633 PolarHBondContact O-N 3.35Å; D629-R633 PolarHBondContact O-NE 2.95Å; D629-R633 IonicContact OD2-CZ 2.79Å; D629-R633 IonicContact OD2-NH2 3.79Å; D629-R633 PolarHBondContact OD2-NH2 3.25Å; D629-R633 VanDerWaalsContact OD2-NH2 3.14Å; D630-R633 PolarHBondContact O-N 3.2Å; D630-R633 IonicContact OD1-CZ 3.3Å; D630-R633 IonicContact OD1-NH1 3.77Å; D630-R633 PolarHBondContact OD1-NH1 3.13Å; D630-R633 IonicContact OD1-NH2 3.57Å; D630-R633 PolarHBondContact OD1-NH2 3.12Å; D630-R633 IonicContact OD2-NH1 3.27Å; R633-L636 PolarHBondContact O-N 3.42Å; R633-A637 VanDerWaalsContact O-CB 3.23Å; R633-A637 WeakPolarHBondContact O-CB 3.32Å; R633-A637 PolarHBondContact O-N 3.19Å; R633-T673 HydrophobicContact CG-CG2 3.99Å
634	L	95.6	Very high	91.6	Very high	48 Å²	48	40 Å²	40	25%	0.251	22%	0.218	S	C	.	.	H	α-helix	trans	-66	-43.2	176.2	-72.9	166.2	0	0	0	112.8	I566 I569 I570 L573 D630 E631 M632 A637 F638	I566-L634 HydrophobicContact CG2-CD1 4.08Å; I569-L634 HydrophobicContact CG2-CD1 4.43Å; I570-L634 HydrophobicContact CD1-CD1 4.13Å; I570-L634 HydrophobicContact CD1-CD2 4.46Å; I570-L634 HydrophobicContact CG1-CD1 3.49Å; I570-L634 VanDerWaalsContact CG1-CD1 3.45Å; I570-L634 HydrophobicContact CG1-CD2 3.89Å; I570-L634 HydrophobicContact CG1-CG 4.35Å; L573-L634 HydrophobicContact CD1-CB 3.9Å; D630-L634 VanDerWaalsContact O-CG 3.27Å; D630-L634 WeakPolarHBondContact O-CG 3.36Å; D630-L634 PolarHBondContact O-N 3.24Å; E631-L634 WeakPolarHBondContact O-CB 3.43Å; E631-L634 PolarHBondContact O-N 2.85Å; M632-L634 VanDerWaalsContact C-N 3.26Å; M632-L634 PolarHBondContact O-N 3.12Å; L634-A637 PolarHBondContact O-N 3.21Å; L634-F638 PolarHBondContact O-N 3.28Å
635	I	95.8	Very high	92.1	Very high	6 Å²	6	32.8 Å²	32.8	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-64.4	-45.4	176	-60.1	164	0	0	0	110.1	L573 F622 I627 E631 M632 A637 F638 L639 V651 L655	L573-I635 HydrophobicContact CD1-CG1 4.45Å; F622-I635 HydrophobicContact CE1-CD1 4.29Å; F622-I635 HydrophobicContact CE2-CD1 3.95Å; F622-I635 HydrophobicContact CZ-CD1 3.59Å; F622-I635 HydrophobicContact CZ-CG1 4.37Å; I627-I635 HydrophobicContact CD1-CD1 4.19Å; E631-I635 WeakPolarHBondContact O-CG1 3.42Å; E631-I635 PolarHBondContact O-N 3.49Å; E631-I635 VanDerWaalsContact O-N 3.13Å; M632-I635 PolarHBondContact O-N 3.06Å; M632-I635 VanDerWaalsContact O-N 3.17Å; I635-A637 VanDerWaalsContact C-N 3.33Å; I635-A637 PolarHBondContact O-N 3.12Å; I635-F638 WeakPolarHBondContact O-CB 3.37Å; I635-F638 PolarHBondContact O-N 3.43Å; I635-L639 HydrophobicContact CG2-CD1 4.17Å; I635-L639 WeakPolarHBondContact O-CG 3.28Å; I635-L639 PolarHBondContact O-N 3.39Å; I635-V651 HydrophobicContact CG2-CG1 4.31Å; I635-L655 HydrophobicContact CG2-CB 4.36Å; I635-L655 HydrophobicContact CG2-CD1 4.34Å; I635-L655 HydrophobicContact CG2-CD2 4.31Å
636	L	96.3	Very high	92.9	Very high	13.3333 Å²	13.3333	33.6 Å²	33.6	7%	0.07	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-38.6	177	-63.4	172.9	0	0	0	111.5	M632 R633 F638 L639 T640 L655 F670 T673 C678	M632-L636 HydrophobicContact CG-CD1 3.9Å; M632-L636 HydrophobicContact CG-CG 4.32Å; M632-L636 WeakPolarHBondContact O-CB 3.33Å; M632-L636 VanDerWaalsContact O-CG 3.26Å; M632-L636 WeakPolarHBondContact O-CG 3.33Å; M632-L636 PolarHBondContact O-N 2.9Å; M632-L636 HydrophobicContact SD-CD1 4.42Å; M632-L636 HydrophobicContact SD-CD2 4.46Å; M632-L636 HydrophobicContact SD-CG 4.34Å; R633-L636 PolarHBondContact O-N 3.42Å; L636-F638 VanDerWaalsContact C-N 3.33Å; L636-F638 PolarHBondContact O-N 3.11Å; L636-L639 PolarHBondContact O-N 3.16Å; L636-T640 WeakPolarHBondContact O-CB 3.36Å; L636-T640 VanDerWaalsContact O-CG2 3.3Å; L636-T640 WeakPolarHBondContact O-CG2 3.3Å; L636-T640 PolarHBondContact O-N 3.11Å; L636-T640 PolarHBondContact O-OG1 3.28Å; L636-T640 VanDerWaalsContact O-OG1 3.11Å; L636-L655 HydrophobicContact CD2-CD2 4.22Å; L636-F670 HydrophobicContact CD2-CD2 4.26Å; L636-F670 HydrophobicContact CD2-CE2 3.94Å; L636-T673 WeakPolarHBondContact CD1-OG1 3.34Å; L636-C678 HydrophobicContact CD2-CB 3.75Å
637	A	94.7	Very high	93.3	Very high	44 Å²	44	33.3 Å²	33.3	36%	0.364	18%	0.177	S	C	.	.	H	α-helix	trans	-65.1	-36.9	175.1	0	0	0	0	0	112.5	R633 L634 I635 T640 T641	R633-A637 VanDerWaalsContact O-CB 3.23Å; R633-A637 WeakPolarHBondContact O-CB 3.32Å; R633-A637 PolarHBondContact O-N 3.19Å; L634-A637 PolarHBondContact O-N 3.21Å; I635-A637 VanDerWaalsContact C-N 3.33Å; I635-A637 PolarHBondContact O-N 3.12Å; A637-T640 WeakPolarHBondContact CA-OG1 3.44Å; A637-T640 PolarHBondContact O-N 2.79Å; A637-T640 PolarHBondContact O-OG1 3.14Å; A637-T641 WeakPolarHBondContact O-CB 3.44Å; A637-T641 VanDerWaalsContact O-CG2 3.29Å; A637-T641 WeakPolarHBondContact O-CG2 3.4Å; A637-T641 PolarHBondContact O-N 3.19Å; A637-T641 VanDerWaalsContact O-N 3.1Å; A637-T641 PolarHBondContact O-OG1 3.09Å
638	F	95.4	Very high	93.4	Very high	8.66667 Å²	8.66667	33 Å²	33	4%	0.038	18%	0.176	C	C	.	.	H	α-helix	trans	-61.3	-53.1	170.5	-177.6	-80.1	0	0	0	110.5	L573 L576 K577 L634 I635 L636 T640 T641 V642 I648 V651	L573-F638 HydrophobicContact CB-CD2 4.25Å; L573-F638 HydrophobicContact CD2-CB 4.35Å; L573-F638 HydrophobicContact CD2-CD2 4.12Å; L573-F638 HydrophobicContact CD2-CG 4.22Å; L573-F638 WeakPolarHBondContact O-CE2 3.3Å; L576-F638 HydrophobicContact CB-CE2 4.09Å; L576-F638 HydrophobicContact CB-CZ 4.33Å; K577-F638 HydrophobicContact CB-CD2 4.3Å; K577-F638 HydrophobicContact CB-CE2 3.8Å; K577-F638 HydrophobicContact CG-CE2 4.41Å; L634-F638 PolarHBondContact O-N 3.28Å; I635-F638 WeakPolarHBondContact O-CB 3.37Å; I635-F638 PolarHBondContact O-N 3.43Å; L636-F638 VanDerWaalsContact C-N 3.33Å; L636-F638 PolarHBondContact O-N 3.11Å; F638-T640 VanDerWaalsContact C-N 3.26Å; F638-T640 PolarHBondContact O-N 3.19Å; F638-T641 PolarHBondContact O-N 3.3Å; F638-T641 VanDerWaalsContact O-N 3.15Å; F638-T641 PolarHBondContact O-OG1 3.14Å; F638-V642 HydrophobicContact CD1-CG2 4.25Å; F638-V642 HydrophobicContact CD2-CG2 4.3Å; F638-V642 HydrophobicContact CE1-CB 4.39Å; F638-V642 HydrophobicContact CE1-CG2 4.03Å; F638-V642 HydrophobicContact CE2-CG2 4.11Å; F638-V642 HydrophobicContact CG-CG2 4.37Å; F638-V642 HydrophobicContact CZ-CG2 3.96Å; F638-V642 WeakPolarHBondContact O-CG2 3.44Å; F638-V642 PolarHBondContact O-N 3.12Å; F638-I648 HydrophobicContact CE1-CG2 4.2Å; F638-V651 HydrophobicContact CD1-CB 4.27Å; F638-V651 HydrophobicContact CD1-CG1 3.89Å; F638-V651 HydrophobicContact CD1-CG2 4.18Å; F638-V651 HydrophobicContact CE1-CB 4.05Å; F638-V651 HydrophobicContact CE1-CG1 4.17Å; F638-V651 HydrophobicContact CE1-CG2 3.64Å; F638-V651 HydrophobicContact CZ-CG2 4.03Å
639	L	95.4	Very high	93.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.3	-25.1	-178.5	-67.2	174.2	0	0	0	113.7	I635 L636 I648 V651 L652 L655 C678 K681 L682	I635-L639 HydrophobicContact CG2-CD1 4.17Å; I635-L639 WeakPolarHBondContact O-CG 3.28Å; I635-L639 PolarHBondContact O-N 3.39Å; L636-L639 PolarHBondContact O-N 3.16Å; L639-I648 HydrophobicContact CD2-CB 4.1Å; L639-I648 HydrophobicContact CD2-CG2 4.21Å; L639-V651 HydrophobicContact CD2-CB 4.26Å; L639-V651 HydrophobicContact CD2-CG1 3.97Å; L639-V651 HydrophobicContact CG-CG1 4.31Å; L639-L652 HydrophobicContact CD1-CD1 4.12Å; L639-L652 HydrophobicContact CD1-CD2 3.72Å; L639-L652 HydrophobicContact CD2-CB 4.03Å; L639-L652 HydrophobicContact CD2-CD1 4.35Å; L639-L652 HydrophobicContact CD2-CD2 3.66Å; L639-L652 HydrophobicContact CD2-CG 3.72Å; L639-L652 HydrophobicContact CG-CD2 4.28Å; L639-L655 HydrophobicContact CD1-CD2 3.58Å; L639-C678 VanDerWaalsContact CB-SG 3.57Å; L639-K681 PolarHBondContact O-NZ 3.11Å; L639-L682 HydrophobicContact CB-CD1 4.47Å
640	T	92.6	Very high	93.7	Very high	52.3333 Å²	52.3333	33 Å²	33	32%	0.321	17%	0.171	S	C	.	.	H	α-helix	trans	-85.6	-30.9	174.2	54	0	0	0	0	114	L636 A637 F638 H643 C678 K681	L636-T640 WeakPolarHBondContact O-CB 3.36Å; L636-T640 VanDerWaalsContact O-CG2 3.3Å; L636-T640 WeakPolarHBondContact O-CG2 3.3Å; L636-T640 PolarHBondContact O-N 3.11Å; L636-T640 PolarHBondContact O-OG1 3.28Å; L636-T640 VanDerWaalsContact O-OG1 3.11Å; A637-T640 WeakPolarHBondContact CA-OG1 3.44Å; A637-T640 PolarHBondContact O-N 2.79Å; A637-T640 PolarHBondContact O-OG1 3.14Å; F638-T640 VanDerWaalsContact C-N 3.26Å; F638-T640 PolarHBondContact O-N 3.19Å; T640-H643 PolarHBondContact O-NE2 2.9Å; T640-C678 HydrophobicContact CG2-CB 4.12Å; T640-K681 HydrophobicContact CG2-CB 4.44Å; T640-K681 HydrophobicContact CG2-CG 4.45Å; T640-K681 VanDerWaalsContact O-CE 3.29Å; T640-K681 WeakPolarHBondContact O-CE 3.37Å; T640-K681 PolarHBondContact O-NZ 3.36Å
641	T	92	Very high	93.8	Very high	62.6667 Å²	62.6667	29.2 Å²	29.2	38%	0.384	15%	0.151	S	C	.	.	H	α-helix	trans	-96.2	-15.5	-175.9	62.1	0	0	0	0	115.2	K577 S589 A637 F638 H643	K577-T641 PolarHBondContact NZ-OG1 3.07Å; K577-T641 VanDerWaalsContact NZ-OG1 3.12Å; S589-T641 PolarHBondContact OG-O 3.24Å; A637-T641 WeakPolarHBondContact O-CB 3.44Å; A637-T641 VanDerWaalsContact O-CG2 3.29Å; A637-T641 WeakPolarHBondContact O-CG2 3.4Å; A637-T641 PolarHBondContact O-N 3.19Å; A637-T641 VanDerWaalsContact O-N 3.1Å; A637-T641 PolarHBondContact O-OG1 3.09Å; F638-T641 PolarHBondContact O-N 3.3Å; F638-T641 VanDerWaalsContact O-N 3.15Å; F638-T641 PolarHBondContact O-OG1 3.14Å; T641-H643 PolarHBondContact O-CD2 3.4Å
642	V	91.3	Very high	93.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.15	C	C	.	.			trans	-94.2	136.5	169.8	-176.1	0	0	0	0	108.6	K577 S589 Y591 F638 E644 N647 I648 K681	K577-V642 HydrophobicContact CD-CG2 4.14Å; K577-V642 HydrophobicContact CG-CG2 4.16Å; S589-V642 WeakPolarHBondContact OG-CA 3.31Å; Y591-V642 HydrophobicContact CE1-CG2 4.49Å; F638-V642 HydrophobicContact CD1-CG2 4.25Å; F638-V642 HydrophobicContact CD2-CG2 4.3Å; F638-V642 HydrophobicContact CE1-CB 4.39Å; F638-V642 HydrophobicContact CE1-CG2 4.03Å; F638-V642 HydrophobicContact CE2-CG2 4.11Å; F638-V642 HydrophobicContact CG-CG2 4.37Å; F638-V642 HydrophobicContact CZ-CG2 3.96Å; F638-V642 WeakPolarHBondContact O-CG2 3.44Å; F638-V642 PolarHBondContact O-N 3.12Å; V642-E644 VanDerWaalsContact CG1-OE2 3.28Å; V642-E644 WeakPolarHBondContact CG1-OE2 3.32Å; V642-N647 HydrophobicContact CG1-CB 3.69Å; V642-I648 HydrophobicContact CB-CD1 4.23Å; V642-I648 HydrophobicContact CB-CG1 3.99Å; V642-I648 HydrophobicContact CB-CG2 3.69Å; V642-I648 HydrophobicContact CG1-CD1 4.03Å; V642-I648 HydrophobicContact CG1-CG1 3.67Å; V642-I648 HydrophobicContact CG1-CG2 3.53Å; V642-I648 VanDerWaalsContact CG1-CG2 3.45Å; V642-I648 WeakPolarHBondContact O-CD1 3.33Å; V642-K681 PolarHBondContact O-NZ 2.9Å
643	H	90.6	Very high	93.8	Very high	73 Å²	73	33.1 Å²	33.1	34%	0.338	17%	0.166	S	C	.	.			trans	-120.9	-12.1	-174.8	-69.4	-88.9	0	0	0	113.9	R588 S589 T640 T641 P645 K681	R588-H643 HydrophobicContact CB-CB 3.95Å; S589-H643 WeakPolarHBondContact OG-CB 3.31Å; S589-H643 PolarHBondContact OG-CD2 3.45Å; S589-H643 VanDerWaalsContact OG-CD2 3.3Å; S589-H643 PolarHBondContact OG-N 3.11Å; T640-H643 PolarHBondContact O-NE2 2.9Å; T641-H643 PolarHBondContact O-CD2 3.4Å; H643-P645 WeakPolarHBondContact O-CD 3.39Å; H643-K681 WeakPolarHBondContact CE1-CE 3.49Å; H643-K681 WeakPolarHBondContact ND1-CE 3.28Å; H643-K681 PolarHBondContact ND1-NZ 2.93Å
644	E	91.9	Very high	93.8	Very high	3 Å²	3	28.2 Å²	28.2	1%	0.014	15%	0.148	C	C	.	.			trans	-79.4	119.6	176.9	-57	68.8	-147	0	0	109.2	P585 R586 R588 S589 Y591 V642 E646 N647 I648	P585-E644 VanDerWaalsContact CA-CD 3.46Å; P585-E644 WeakPolarHBondContact CA-OE1 3.45Å; R586-E644 HydrophobicContact CG-CG 4.09Å; R586-E644 PolarHBondContact N-OE1 3.27Å; R588-E644 WeakPolarHBondContact CB-OE1 3.33Å; S589-E644 WeakPolarHBondContact CB-OE1 3.42Å; S589-E644 PolarHBondContact N-OE1 3.08Å; S589-E644 VanDerWaalsContact OG-CD 3.27Å; S589-E644 PolarHBondContact OG-OE1 3.48Å; S589-E644 PolarHBondContact OG-OE2 2.85Å; Y591-E644 PolarHBondContact OH-OE2 3.18Å; V642-E644 VanDerWaalsContact CG1-OE2 3.28Å; V642-E644 WeakPolarHBondContact CG1-OE2 3.32Å; E644-E646 VanDerWaalsContact C-N 3.32Å; E644-E646 PolarHBondContact O-N 3.17Å; E644-N647 HydrophobicContact CB-CB 4.17Å; E644-N647 WeakPolarHBondContact CB-ND2 3.3Å; E644-N647 PolarHBondContact O-N 3.16Å; E644-N647 VanDerWaalsContact O-N 3.11Å; E644-I648 WeakPolarHBondContact O-CD1 3.22Å; E644-I648 VanDerWaalsContact O-CG1 3.31Å; E644-I648 WeakPolarHBondContact O-CG1 3.27Å; E644-I648 PolarHBondContact O-N 3.07Å
645	P	90	Very high	93.8	Very high	12.6667 Å²	12.6667	26 Å²	26	8%	0.082	14%	0.137	C	C	.	.	H	α-helix	trans	-60.6	-38.4	-173.5	23.5	-32.6	0	0	0	112.4	H643 N647 I648 H649 D687 V690	H643-P645 WeakPolarHBondContact O-CD 3.39Å; P645-N647 PolarHBondContact O-N 3.13Å; P645-N647 VanDerWaalsContact O-N 3.16Å; P645-I648 WeakPolarHBondContact O-CB 3.47Å; P645-I648 WeakPolarHBondContact O-CG1 3.47Å; P645-I648 PolarHBondContact O-N 3.16Å; P645-I648 VanDerWaalsContact O-N 3.11Å; P645-H649 VanDerWaalsContact C-CD2 3.46Å; P645-H649 PolarHBondContact O-CD2 3.39Å; P645-H649 VanDerWaalsContact O-CD2 3.24Å; P645-H649 VanDerWaalsContact O-CG 3.3Å; P645-H649 PolarHBondContact O-N 3.12Å; P645-D687 HydrophobicContact CB-CB 3.54Å; P645-D687 VanDerWaalsContact CB-CB 3.46Å; P645-D687 HydrophobicContact CG-CB 3.96Å; P645-V690 HydrophobicContact CB-CG2 3.94Å
646	E	90.9	Very high	93.8	Very high	74 Å²	74	25.7 Å²	25.7	35%	0.346	14%	0.135	S	C	.	.	H	α-helix	trans	-60.3	-35.8	179.6	-50.1	82.6	177.1	0	0	111.5	L582 T583 R586 E644 I648	L582-E646 HydrophobicContact CB-CB 4.27Å; L582-E646 WeakPolarHBondContact CD1-O 3.16Å; T583-E646 WeakPolarHBondContact OG1-CG 3.24Å; R586-E646 IonicContact NH2-OE1 3.35Å; R586-E646 PolarHBondContact NH2-OE1 3.25Å; R586-E646 IonicContact NH2-OE2 3.22Å; R586-E646 PolarHBondContact NH2-OE2 2.87Å; E644-E646 VanDerWaalsContact C-N 3.32Å; E644-E646 PolarHBondContact O-N 3.17Å; E646-I648 VanDerWaalsContact C-N 3.31Å; E646-I648 PolarHBondContact O-N 3.37Å
647	N	92.4	Very high	93.7	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.011	13%	0.132	C	C	.	.	H	α-helix	trans	-78.1	-11.1	179.8	-67.5	-23.4	0	0	0	113.6	L582 T583 R611 V642 E644 P645	L582-N647 WeakPolarHBondContact CA-OD1 3.42Å; L582-N647 PolarHBondContact N-OD1 3.48Å; T583-N647 PolarHBondContact N-OD1 3.2Å; T583-N647 VanDerWaalsContact N-OD1 3.15Å; T583-N647 PolarHBondContact O-ND2 2.82Å; R611-N647 PolarHBondContact NH2-O 3.13Å; V642-N647 HydrophobicContact CG1-CB 3.69Å; E644-N647 HydrophobicContact CB-CB 4.17Å; E644-N647 WeakPolarHBondContact CB-ND2 3.3Å; E644-N647 PolarHBondContact O-N 3.16Å; E644-N647 VanDerWaalsContact O-N 3.11Å; P645-N647 PolarHBondContact O-N 3.13Å; P645-N647 VanDerWaalsContact O-N 3.16Å
648	I	94.5	Very high	93.6	Very high	2.33333 Å²	2.33333	23.1 Å²	23.1	1%	0.012	12%	0.115	C	C	.	.	H	α-helix	trans	-114.5	-25.2	-173.9	35.2	173.2	0	0	0	113.9	F638 L639 V642 E644 P645 E646 D650 V651 L652 L682 V690	F638-I648 HydrophobicContact CE1-CG2 4.2Å; L639-I648 HydrophobicContact CD2-CB 4.1Å; L639-I648 HydrophobicContact CD2-CG2 4.21Å; V642-I648 HydrophobicContact CB-CD1 4.23Å; V642-I648 HydrophobicContact CB-CG1 3.99Å; V642-I648 HydrophobicContact CB-CG2 3.69Å; V642-I648 HydrophobicContact CG1-CD1 4.03Å; V642-I648 HydrophobicContact CG1-CG1 3.67Å; V642-I648 HydrophobicContact CG1-CG2 3.53Å; V642-I648 VanDerWaalsContact CG1-CG2 3.45Å; V642-I648 WeakPolarHBondContact O-CD1 3.33Å; E644-I648 WeakPolarHBondContact O-CD1 3.22Å; E644-I648 VanDerWaalsContact O-CG1 3.31Å; E644-I648 WeakPolarHBondContact O-CG1 3.27Å; E644-I648 PolarHBondContact O-N 3.07Å; P645-I648 WeakPolarHBondContact O-CB 3.47Å; P645-I648 WeakPolarHBondContact O-CG1 3.47Å; P645-I648 PolarHBondContact O-N 3.16Å; P645-I648 VanDerWaalsContact O-N 3.11Å; E646-I648 VanDerWaalsContact C-N 3.31Å; E646-I648 PolarHBondContact O-N 3.37Å; I648-D650 VanDerWaalsContact C-N 3.29Å; I648-D650 PolarHBondContact O-N 3.05Å; I648-D650 VanDerWaalsContact O-N 3.11Å; I648-V651 PolarHBondContact O-N 3.09Å; I648-L652 HydrophobicContact CB-CD1 4.33Å; I648-L652 HydrophobicContact CD1-CD1 4.12Å; I648-L652 HydrophobicContact CG1-CD1 4.06Å; I648-L652 HydrophobicContact CG2-CB 4.14Å; I648-L652 HydrophobicContact CG2-CD2 4.17Å; I648-L652 VanDerWaalsContact O-CB 3.27Å; I648-L652 WeakPolarHBondContact O-CB 3.34Å; I648-L652 VanDerWaalsContact O-CG 3.27Å; I648-L652 WeakPolarHBondContact O-CG 3.41Å; I648-L652 PolarHBondContact O-N 3.08Å; I648-L682 HydrophobicContact CD1-CD2 3.96Å; I648-L682 HydrophobicContact CG2-CD2 4.36Å; I648-V690 HydrophobicContact CD1-CB 4.45Å; I648-V690 HydrophobicContact CD1-CG1 3.97Å; I648-V690 HydrophobicContact CD1-CG2 3.74Å; I648-V690 HydrophobicContact CG1-CG2 4Å; I648-V690 HydrophobicContact CG2-CG2 4.47Å
649	H	94.1	Very high	93.5	Very high	56.6667 Å²	56.6667	22.7 Å²	22.7	26%	0.262	11%	0.114	S	C	.	.	H	α-helix	trans	-51.6	-44.3	-174.2	-74.3	-143.3	0	0	0	114	P645 L652 Y653 D687	P645-H649 VanDerWaalsContact C-CD2 3.46Å; P645-H649 PolarHBondContact O-CD2 3.39Å; P645-H649 VanDerWaalsContact O-CD2 3.24Å; P645-H649 VanDerWaalsContact O-CG 3.3Å; P645-H649 PolarHBondContact O-N 3.12Å; H649-L652 PolarHBondContact O-N 2.88Å; H649-Y653 WeakPolarHBondContact O-CB 3.28Å; H649-Y653 PolarHBondContact O-N 3.09Å; H649-D687 IonicContact CD2-OD1 2.68Å; H649-D687 IonicContact CE1-OD1 3.45Å; H649-D687 PolarHBondContact CE1-OD1 3.31Å; H649-D687 VanDerWaalsContact CE1-OD1 3.27Å; H649-D687 IonicContact CE1-OD2 3.41Å; H649-D687 IonicContact ND1-OD1 2.7Å; H649-D687 IonicContact NE2-OD1 2.84Å; H649-D687 PolarHBondContact NE2-OD1 3.21Å; H649-D687 IonicContact NE2-OD2 2.92Å
650	D	94.6	Very high	93.4	Very high	35 Å²	35	24.8 Å²	24.8	19%	0.187	13%	0.127	C	C	.	.	H	α-helix	trans	-78.2	-36.4	-174.7	60.7	-6.9	0	0	0	112.9	R611 L615 I648 L652 Y653 L654	R611-D650 IonicContact CZ-OD1 3.16Å; R611-D650 IonicContact CZ-OD2 3.17Å; R611-D650 VanDerWaalsContact CZ-OD2 3.32Å; R611-D650 IonicContact NE-OD1 2.8Å; R611-D650 IonicContact NE-OD2 3.14Å; R611-D650 PolarHBondContact NE-OD2 2.99Å; R611-D650 VanDerWaalsContact NH2-CG 3.32Å; R611-D650 IonicContact NH2-OD1 2.9Å; R611-D650 PolarHBondContact NH2-OD1 3.19Å; R611-D650 IonicContact NH2-OD2 2.77Å; R611-D650 PolarHBondContact NH2-OD2 3.1Å; R611-D650 VanDerWaalsContact NH2-OD2 3.08Å; L615-D650 HydrophobicContact CD1-CB 3.54Å; L615-D650 VanDerWaalsContact CD1-CG 3.48Å; L615-D650 VanDerWaalsContact CD1-OD2 3.27Å; L615-D650 WeakPolarHBondContact CD1-OD2 3.32Å; I648-D650 VanDerWaalsContact C-N 3.29Å; I648-D650 PolarHBondContact O-N 3.05Å; I648-D650 VanDerWaalsContact O-N 3.11Å; D650-L652 VanDerWaalsContact C-N 3.32Å; D650-Y653 PolarHBondContact O-N 2.98Å; D650-L654 WeakPolarHBondContact O-CB 3.34Å; D650-L654 PolarHBondContact O-N 3.15Å
651	V	95.9	Very high	93.3	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.012	13%	0.131	C	C	.	.	H	α-helix	trans	-66.2	-38.2	169.7	-179.3	0	0	0	0	111.1	L576 L615 I635 F638 L639 I648 L654 L655	L576-V651 HydrophobicContact CD1-CG2 4.24Å; L615-V651 HydrophobicContact CD2-CG2 4.04Å; I635-V651 HydrophobicContact CG2-CG1 4.31Å; F638-V651 HydrophobicContact CD1-CB 4.27Å; F638-V651 HydrophobicContact CD1-CG1 3.89Å; F638-V651 HydrophobicContact CD1-CG2 4.18Å; F638-V651 HydrophobicContact CE1-CB 4.05Å; F638-V651 HydrophobicContact CE1-CG1 4.17Å; F638-V651 HydrophobicContact CE1-CG2 3.64Å; F638-V651 HydrophobicContact CZ-CG2 4.03Å; L639-V651 HydrophobicContact CD2-CB 4.26Å; L639-V651 HydrophobicContact CD2-CG1 3.97Å; L639-V651 HydrophobicContact CG-CG1 4.31Å; I648-V651 PolarHBondContact O-N 3.09Å; V651-L654 WeakPolarHBondContact O-CB 3.37Å; V651-L654 PolarHBondContact O-N 3.16Å; V651-L655 PolarHBondContact O-N 3.21Å
652	L	95.3	Very high	93.2	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-68.1	-42.5	176.6	-146.7	86	0	0	0	111.4	L639 I648 H649 D650 L654 L655 V656 L682 V690 Y693 L697	L639-L652 HydrophobicContact CD1-CD1 4.12Å; L639-L652 HydrophobicContact CD1-CD2 3.72Å; L639-L652 HydrophobicContact CD2-CB 4.03Å; L639-L652 HydrophobicContact CD2-CD1 4.35Å; L639-L652 HydrophobicContact CD2-CD2 3.66Å; L639-L652 HydrophobicContact CD2-CG 3.72Å; L639-L652 HydrophobicContact CG-CD2 4.28Å; I648-L652 HydrophobicContact CB-CD1 4.33Å; I648-L652 HydrophobicContact CD1-CD1 4.12Å; I648-L652 HydrophobicContact CG1-CD1 4.06Å; I648-L652 HydrophobicContact CG2-CB 4.14Å; I648-L652 HydrophobicContact CG2-CD2 4.17Å; I648-L652 VanDerWaalsContact O-CB 3.27Å; I648-L652 WeakPolarHBondContact O-CB 3.34Å; I648-L652 VanDerWaalsContact O-CG 3.27Å; I648-L652 WeakPolarHBondContact O-CG 3.41Å; I648-L652 PolarHBondContact O-N 3.08Å; H649-L652 PolarHBondContact O-N 2.88Å; D650-L652 VanDerWaalsContact C-N 3.32Å; L652-L654 VanDerWaalsContact C-N 3.3Å; L652-L654 PolarHBondContact O-N 3.15Å; L652-L655 PolarHBondContact O-N 3.06Å; L652-V656 WeakPolarHBondContact O-CG2 3.28Å; L652-V656 PolarHBondContact O-N 3.36Å; L652-L682 HydrophobicContact CD1-CD1 3.81Å; L652-L682 HydrophobicContact CD1-CD2 4.5Å; L652-L682 HydrophobicContact CD2-CD1 4.08Å; L652-L682 HydrophobicContact CD2-CD2 4.39Å; L652-V690 HydrophobicContact CD1-CB 4.36Å; L652-V690 HydrophobicContact CD1-CG1 4Å; L652-V690 HydrophobicContact CD1-CG2 4.21Å; L652-V690 HydrophobicContact CD2-CG1 4.22Å; L652-V690 HydrophobicContact CD2-CG2 4.47Å; L652-Y693 HydrophobicContact CB-CD2 4.26Å; L652-Y693 HydrophobicContact CB-CG 4.25Å; L652-Y693 VanDerWaalsContact CD2-CB 3.46Å; L652-Y693 HydrophobicContact CD2-CD2 4.43Å; L652-Y693 HydrophobicContact CD2-CG 4.24Å; L652-Y693 HydrophobicContact CG-CG 4.13Å; L652-L697 HydrophobicContact CD1-CD1 3.59Å; L652-L697 HydrophobicContact CD1-CG 4.47Å; L652-L697 HydrophobicContact CD2-CD1 4.14Å
653	Y	95.8	Very high	93.1	Very high	84.6667 Å²	84.6667	28.3 Å²	28.3	33%	0.332	14%	0.138	S	C	.	.	H	α-helix	trans	-61.9	-39.6	170.9	176	-109.8	0	0	0	112.2	H649 D650 V656 S657 Y693 P752 K753	H649-Y653 WeakPolarHBondContact O-CB 3.28Å; H649-Y653 PolarHBondContact O-N 3.09Å; D650-Y653 PolarHBondContact O-N 2.98Å; Y653-V656 PolarHBondContact O-N 3.3Å; Y653-S657 VanDerWaalsContact O-CB 3.28Å; Y653-S657 WeakPolarHBondContact O-CB 3.35Å; Y653-S657 PolarHBondContact O-N 3.19Å; Y653-S657 PolarHBondContact O-OG 3.02Å; Y653-Y693 HydrophobicContact CD2-CE1 4.28Å; Y653-Y693 WeakPolarHBondContact CD2-OH 3.35Å; Y653-P752 VanDerWaalsContact CD2-O 3.24Å; Y653-P752 WeakPolarHBondContact CD2-O 3.44Å; Y653-P752 HydrophobicContact CE2-CB 4.33Å; Y653-P752 WeakPolarHBondContact CE2-O 3.36Å; Y653-K753 HydrophobicContact CE2-CG 4.2Å
654	L	94.9	Very high	92.9	Very high	11.6667 Å²	11.6667	31.8 Å²	31.8	6%	0.061	16%	0.16	C	C	.	.	H	α-helix	trans	-60.2	-47.7	173.6	175.2	60.8	0	0	0	111.2	L615 L618 K619 F622 D650 V651 L652 V656 S657 T658	L615-L654 HydrophobicContact CB-CD2 4.34Å; L615-L654 HydrophobicContact CD2-CB 4.37Å; L615-L654 HydrophobicContact CD2-CD2 3.55Å; L615-L654 VanDerWaalsContact CD2-CD2 3.48Å; L618-L654 HydrophobicContact CB-CD2 3.86Å; L618-L654 HydrophobicContact CD1-CD2 4.27Å; K619-L654 HydrophobicContact CB-CD1 3.6Å; K619-L654 HydrophobicContact CD-CD1 4.09Å; K619-L654 HydrophobicContact CG-CD1 3.94Å; F622-L654 HydrophobicContact CD2-CD1 4.49Å; F622-L654 HydrophobicContact CE2-CD1 4.46Å; F622-L654 HydrophobicContact CE2-CD2 4.03Å; F622-L654 HydrophobicContact CE2-CG 4.3Å; D650-L654 WeakPolarHBondContact O-CB 3.34Å; D650-L654 PolarHBondContact O-N 3.15Å; V651-L654 WeakPolarHBondContact O-CB 3.37Å; V651-L654 PolarHBondContact O-N 3.16Å; L652-L654 VanDerWaalsContact C-N 3.3Å; L652-L654 PolarHBondContact O-N 3.15Å; L654-V656 PolarHBondContact O-N 3.06Å; L654-S657 PolarHBondContact O-N 3.43Å; L654-S657 PolarHBondContact O-OG 2.94Å; L654-T658 HydrophobicContact CD1-CG2 3.91Å; L654-T658 HydrophobicContact CG-CG2 4.46Å; L654-T658 VanDerWaalsContact O-CB 3.25Å; L654-T658 WeakPolarHBondContact O-CB 3.29Å; L654-T658 WeakPolarHBondContact O-CG2 3.27Å; L654-T658 PolarHBondContact O-N 2.9Å; L654-T658 PolarHBondContact O-OG1 3.05Å
655	L	95.5	Very high	92.6	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-61.7	-48.5	178.4	179.1	60.2	0	0	0	111.8	M632 I635 L636 L639 V651 L652 T658 L659 F670 L697	M632-L655 HydrophobicContact CE-CD1 4.11Å; M632-L655 HydrophobicContact SD-CD1 3.77Å; I635-L655 HydrophobicContact CG2-CB 4.36Å; I635-L655 HydrophobicContact CG2-CD1 4.34Å; I635-L655 HydrophobicContact CG2-CD2 4.31Å; L636-L655 HydrophobicContact CD2-CD2 4.22Å; L639-L655 HydrophobicContact CD1-CD2 3.58Å; V651-L655 PolarHBondContact O-N 3.21Å; L652-L655 PolarHBondContact O-N 3.06Å; L655-T658 WeakPolarHBondContact CA-OG1 3.36Å; L655-T658 PolarHBondContact O-N 3.13Å; L655-T658 PolarHBondContact O-OG1 3.31Å; L655-L659 HydrophobicContact CD1-CD1 3.95Å; L655-L659 HydrophobicContact CD1-CG 4.24Å; L655-L659 HydrophobicContact CG-CD1 4Å; L655-L659 WeakPolarHBondContact O-CB 3.34Å; L655-L659 VanDerWaalsContact O-CG 3.29Å; L655-L659 WeakPolarHBondContact O-CG 3.37Å; L655-L659 PolarHBondContact O-N 3.17Å; L655-F670 HydrophobicContact CD2-CE2 4.48Å; L655-L697 HydrophobicContact CD2-CD1 4.09Å; L655-L697 HydrophobicContact CD2-CD2 3.99Å; L655-L697 HydrophobicContact CG-CD2 4.04Å
656	V	95.5	Very high	92.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.2	-43.7	-179.7	173.5	0	0	0	0	111.4	L652 Y653 L654 T658 L659 V660 Y693 K696 L697 L700	L652-V656 WeakPolarHBondContact O-CG2 3.28Å; L652-V656 PolarHBondContact O-N 3.36Å; Y653-V656 PolarHBondContact O-N 3.3Å; L654-V656 PolarHBondContact O-N 3.06Å; V656-T658 PolarHBondContact O-N 2.96Å; V656-L659 PolarHBondContact O-N 2.96Å; V656-V660 HydrophobicContact CG1-CG2 4.37Å; V656-V660 WeakPolarHBondContact O-CB 3.26Å; V656-V660 VanDerWaalsContact O-CG2 3.27Å; V656-V660 WeakPolarHBondContact O-CG2 3.37Å; V656-V660 PolarHBondContact O-N 3Å; V656-V660 VanDerWaalsContact O-N 3.07Å; V656-Y693 HydrophobicContact CB-CD1 4.3Å; V656-Y693 HydrophobicContact CB-CE1 4.47Å; V656-Y693 HydrophobicContact CG1-CD1 4.29Å; V656-Y693 HydrophobicContact CG1-CE1 4.35Å; V656-Y693 HydrophobicContact CG2-CD1 3.96Å; V656-K696 HydrophobicContact CG1-CB 4.39Å; V656-L697 HydrophobicContact CG2-CD1 4.5Å; V656-L697 HydrophobicContact CG2-CD2 3.57Å; V656-L697 HydrophobicContact CG2-CG 3.71Å; V656-L700 HydrophobicContact CG1-CD1 4.14Å
657	S	95	Very high	92.6	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.007	16%	0.158	C	C	.	.	H	α-helix	trans	-64.7	-40.4	176.9	93.1	0	0	0	0	112.4	K619 Y653 L654 L659 V660 E661	K619-S657 PolarHBondContact NZ-OG 3.16Å; K619-S657 VanDerWaalsContact NZ-OG 3.15Å; Y653-S657 VanDerWaalsContact O-CB 3.28Å; Y653-S657 WeakPolarHBondContact O-CB 3.35Å; Y653-S657 PolarHBondContact O-N 3.19Å; Y653-S657 PolarHBondContact O-OG 3.02Å; L654-S657 PolarHBondContact O-N 3.43Å; L654-S657 PolarHBondContact O-OG 2.94Å; S657-L659 PolarHBondContact O-N 3.45Å; S657-V660 PolarHBondContact O-N 3.15Å; S657-E661 VanDerWaalsContact O-CB 3.28Å; S657-E661 WeakPolarHBondContact O-CB 3.36Å; S657-E661 VanDerWaalsContact O-CG 3.26Å; S657-E661 WeakPolarHBondContact O-CG 3.23Å; S657-E661 PolarHBondContact O-N 3.06Å; S657-E661 PolarHBondContact OG-OE1 3.03Å; S657-E661 VanDerWaalsContact OG-OE1 3.05Å
658	T	92.8	Very high	92.5	Very high	0.666667 Å²	0.666667	33.7 Å²	33.7	0%	0.004	18%	0.177	C	C	.	.	H	α-helix	trans	-68.4	-36.3	177.3	-27.7	0	0	0	0	112.2	F622 I627 L654 L655 V656 F662	F622-T658 HydrophobicContact CB-CG2 4.05Å; F622-T658 HydrophobicContact CD2-CG2 3.96Å; F622-T658 HydrophobicContact CG-CG2 4.33Å; I627-T658 HydrophobicContact CD1-CG2 3.86Å; I627-T658 HydrophobicContact CG1-CG2 4.49Å; L654-T658 HydrophobicContact CD1-CG2 3.91Å; L654-T658 HydrophobicContact CG-CG2 4.46Å; L654-T658 VanDerWaalsContact O-CB 3.25Å; L654-T658 WeakPolarHBondContact O-CB 3.29Å; L654-T658 WeakPolarHBondContact O-CG2 3.27Å; L654-T658 PolarHBondContact O-N 2.9Å; L654-T658 PolarHBondContact O-OG1 3.05Å; L655-T658 WeakPolarHBondContact CA-OG1 3.36Å; L655-T658 PolarHBondContact O-N 3.13Å; L655-T658 PolarHBondContact O-OG1 3.31Å; V656-T658 PolarHBondContact O-N 2.96Å; T658-F662 HydrophobicContact CG2-CD2 3.91Å; T658-F662 HydrophobicContact CG2-CE2 4.5Å; T658-F662 WeakPolarHBondContact O-CB 3.38Å; T658-F662 WeakPolarHBondContact O-CD2 3.41Å; T658-F662 PolarHBondContact O-N 3.27Å
659	L	93.5	Very high	92.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.5	-44.6	173.7	-75.5	167.5	0	0	0	112.2	M632 L655 V656 S657 E661 F662 P663 C666 F670 L697 L700 Y704	M632-L659 HydrophobicContact CE-CD2 4.37Å; L655-L659 HydrophobicContact CD1-CD1 3.95Å; L655-L659 HydrophobicContact CD1-CG 4.24Å; L655-L659 HydrophobicContact CG-CD1 4Å; L655-L659 WeakPolarHBondContact O-CB 3.34Å; L655-L659 VanDerWaalsContact O-CG 3.29Å; L655-L659 WeakPolarHBondContact O-CG 3.37Å; L655-L659 PolarHBondContact O-N 3.17Å; V656-L659 PolarHBondContact O-N 2.96Å; S657-L659 PolarHBondContact O-N 3.45Å; L659-E661 PolarHBondContact O-N 2.94Å; L659-F662 CarbonylContact O-C 3.51Å; L659-F662 PolarHBondContact O-N 2.66Å; L659-P663 WeakPolarHBondContact O-CA 3.38Å; L659-C666 HydrophobicContact CD2-CB 3.84Å; L659-C666 WeakPolarHBondContact CD2-O 3.34Å; L659-F670 HydrophobicContact CD1-CB 4.47Å; L659-F670 HydrophobicContact CD1-CD1 4.16Å; L659-F670 HydrophobicContact CD1-CD2 4.25Å; L659-F670 HydrophobicContact CD1-CE1 4.38Å; L659-F670 HydrophobicContact CD1-CE2 4.41Å; L659-F670 HydrophobicContact CD1-CG 4.07Å; L659-F670 HydrophobicContact CD2-CB 3.75Å; L659-F670 HydrophobicContact CD2-CD1 4.44Å; L659-F670 HydrophobicContact CD2-CG 4.18Å; L659-L697 HydrophobicContact CD1-CD2 3.59Å; L659-L700 HydrophobicContact CB-CD1 3.92Å; L659-L700 HydrophobicContact CD1-CD1 4.14Å; L659-Y704 HydrophobicContact CB-CE2 4.4Å; L659-Y704 HydrophobicContact CD2-CE2 4.23Å; L659-Y704 PolarHBondContact O-OH 3.11Å
660	V	92.5	Very high	92.3	Very high	45.3333 Å²	45.3333	31.4 Å²	31.4	28%	0.275	17%	0.168	S	C	.	.	H	α-helix	trans	-67.9	-40.5	178.6	173.7	0	0	0	0	112	V656 S657 L700 I750	V656-V660 HydrophobicContact CG1-CG2 4.37Å; V656-V660 WeakPolarHBondContact O-CB 3.26Å; V656-V660 VanDerWaalsContact O-CG2 3.27Å; V656-V660 WeakPolarHBondContact O-CG2 3.37Å; V656-V660 PolarHBondContact O-N 3Å; V656-V660 VanDerWaalsContact O-N 3.07Å; S657-V660 PolarHBondContact O-N 3.15Å; V660-L700 HydrophobicContact CG2-CD1 4.22Å; V660-L700 HydrophobicContact CG2-CD2 3.9Å; V660-I750 HydrophobicContact CG2-CG2 4.49Å
661	E	90.7	Very high	92.1	Very high	90 Å²	90	30 Å²	30	42%	0.421	16%	0.16	S	C	.	.	H	α-helix	trans	-75.9	-31.7	-178.3	-72.7	168.4	-155.9	0	0	113.3	K619 S657 L659 P663	K619-E661 WeakPolarHBondContact CE-OE2 3.21Å; K619-E661 IonicContact NZ-OE1 3.11Å; K619-E661 PolarHBondContact NZ-OE1 3.14Å; K619-E661 IonicContact NZ-OE2 3.23Å; K619-E661 PolarHBondContact NZ-OE2 2.94Å; S657-E661 VanDerWaalsContact O-CB 3.28Å; S657-E661 WeakPolarHBondContact O-CB 3.36Å; S657-E661 VanDerWaalsContact O-CG 3.26Å; S657-E661 WeakPolarHBondContact O-CG 3.23Å; S657-E661 PolarHBondContact O-N 3.06Å; S657-E661 PolarHBondContact OG-OE1 3.03Å; S657-E661 VanDerWaalsContact OG-OE1 3.05Å; L659-E661 PolarHBondContact O-N 2.94Å; E661-P663 VanDerWaalsContact C-CD 3.42Å; E661-P663 VanDerWaalsContact O-CD 3.31Å; E661-P663 WeakPolarHBondContact O-CD 3.33Å
662	F	90.2	Very high	91.8	Very high	51 Å²	51	37.1 Å²	37.1	22%	0.224	19%	0.187	C	C	.	.			trans	-126	60.1	-174.8	-51.1	-72.9	0	0	0	112.5	T623 T658 L659 N664 T665 C666	T623-F662 HydrophobicContact CG2-CE1 3.96Å; T623-F662 HydrophobicContact CG2-CZ 3.63Å; T623-F662 WeakPolarHBondContact OG1-CE2 3.41Å; T623-F662 VanDerWaalsContact OG1-CZ 3.24Å; T623-F662 WeakPolarHBondContact OG1-CZ 3.45Å; T658-F662 HydrophobicContact CG2-CD2 3.91Å; T658-F662 HydrophobicContact CG2-CE2 4.5Å; T658-F662 WeakPolarHBondContact O-CB 3.38Å; T658-F662 WeakPolarHBondContact O-CD2 3.41Å; T658-F662 PolarHBondContact O-N 3.27Å; L659-F662 CarbonylContact O-C 3.51Å; L659-F662 PolarHBondContact O-N 2.66Å; F662-N664 VanDerWaalsContact C-N 3.35Å; F662-N664 PolarHBondContact O-N 3.4Å; F662-T665 WeakPolarHBondContact CB-OG1 3.46Å; F662-T665 PolarHBondContact O-N 3.17Å; F662-T665 PolarHBondContact O-OG1 3.4Å; F662-C666 HydrophobicContact CB-CB 4.48Å; F662-C666 WeakPolarHBondContact O-CB 3.34Å; F662-C666 PolarHBondContact O-N 3.01Å
663	P	87.9	Confident	91.6	Very high	46.6667 Å²	46.6667	38.1 Å²	38.1	30%	0.303	19%	0.193	S	C	.	.	H	α-helix	trans	-59.2	-42.8	-170.8	22.6	-34.2	0	0	0	113	L659 E661 T665 G667 P668 Y704	L659-P663 WeakPolarHBondContact O-CA 3.38Å; E661-P663 VanDerWaalsContact C-CD 3.42Å; E661-P663 VanDerWaalsContact O-CD 3.31Å; E661-P663 WeakPolarHBondContact O-CD 3.33Å; P663-T665 VanDerWaalsContact C-N 3.3Å; P663-T665 PolarHBondContact O-N 3.26Å; P663-G667 WeakPolarHBondContact O-CA 3.38Å; P663-G667 PolarHBondContact O-N 3.08Å; P663-G667 VanDerWaalsContact O-N 3.17Å; P663-P668 VanDerWaalsContact O-CD 3.28Å; P663-P668 WeakPolarHBondContact O-CD 3.36Å; P663-Y704 WeakPolarHBondContact CA-OH 3.45Å; P663-Y704 HydrophobicContact CB-CE1 3.53Å; P663-Y704 WeakPolarHBondContact CB-OH 3.17Å
664	N	86.1	Confident	91.2	Very high	148 Å²	148	38 Å²	38	79%	0.791	20%	0.198	S	C	*	.	H	α-helix	trans	-68.2	-28.8	-173.8	-63.6	-12.8	0	0	0	113.6	F662	F662-N664 VanDerWaalsContact C-N 3.35Å; F662-N664 PolarHBondContact O-N 3.4Å
665	T	87.4	Confident	91.1	Very high	65.6667 Å²	65.6667	37.5 Å²	37.5	40%	0.403	20%	0.196	S	C	.	.	H	α-helix	trans	-101.5	-38.8	-177.2	53.9	0	0	0	0	112.5	F662 P663 V669	F662-T665 WeakPolarHBondContact CB-OG1 3.46Å; F662-T665 PolarHBondContact O-N 3.17Å; F662-T665 PolarHBondContact O-OG1 3.4Å; P663-T665 VanDerWaalsContact C-N 3.3Å; P663-T665 PolarHBondContact O-N 3.26Å; T665-V669 VanDerWaalsContact O-CG2 3.25Å; T665-V669 WeakPolarHBondContact O-CG2 3.46Å
666	C	90.4	Very high	90.9	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-93.7	-32.9	-173.2	-60	0	0	0	0	112.4	I627 L659 F662 V669 F670	I627-C666 HydrophobicContact CD1-CB 4.39Å; I627-C666 VanDerWaalsContact CD1-SG 3.57Å; I627-C666 VanDerWaalsContact CG1-SG 3.55Å; L659-C666 HydrophobicContact CD2-CB 3.84Å; L659-C666 WeakPolarHBondContact CD2-O 3.34Å; F662-C666 HydrophobicContact CB-CB 4.48Å; F662-C666 WeakPolarHBondContact O-CB 3.34Å; F662-C666 PolarHBondContact O-N 3.01Å; C666-V669 PolarHBondContact O-N 3.05Å; C666-F670 WeakPolarHBondContact O-CB 3.36Å; C666-F670 PolarHBondContact O-N 3.11Å
667	G	89.7	Confident	90.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-55.8	-177.6	0	0	0	0	0	114.1	P663 V669 F670 V671 Y704	P663-G667 WeakPolarHBondContact O-CA 3.38Å; P663-G667 PolarHBondContact O-N 3.08Å; P663-G667 VanDerWaalsContact O-N 3.17Å; G667-V669 PolarHBondContact O-N 2.87Å; G667-F670 PolarHBondContact O-N 3.3Å; G667-V671 PolarHBondContact O-N 3.21Å; G667-V671 VanDerWaalsContact O-N 3.11Å; G667-Y704 VanDerWaalsContact CA-CG 3.46Å
668	P	89.3	Confident	90.7	Very high	64.6667 Å²	64.6667	44.5 Å²	44.5	42%	0.42	23%	0.229	S	C	.	.	H	α-helix	trans	-58.8	-33.3	177.3	-26.6	35.1	0	0	0	113.4	P663 V671 R672	P663-P668 VanDerWaalsContact O-CD 3.28Å; P663-P668 WeakPolarHBondContact O-CD 3.36Å; P668-V671 PolarHBondContact O-N 3.23Å; P668-R672 VanDerWaalsContact O-CB 3.28Å; P668-R672 WeakPolarHBondContact O-CB 3.22Å; P668-R672 PolarHBondContact O-N 3.22Å
669	V	92	Very high	90.8	Very high	11.6667 Å²	11.6667	44.5 Å²	44.5	7%	0.071	23%	0.229	C	C	.	.	H	α-helix	trans	-71.8	-43.3	179.1	177.6	0	0	0	0	110.9	I627 D629 M632 T665 C666 G667 V671 R672 T673	I627-V669 HydrophobicContact CG2-CG1 4.46Å; D629-V669 HydrophobicContact CB-CG1 4.47Å; M632-V669 HydrophobicContact CB-CG1 3.74Å; M632-V669 HydrophobicContact CE-CG1 4.49Å; M632-V669 HydrophobicContact CG-CG1 4.19Å; T665-V669 VanDerWaalsContact O-CG2 3.25Å; T665-V669 WeakPolarHBondContact O-CG2 3.46Å; C666-V669 PolarHBondContact O-N 3.05Å; G667-V669 PolarHBondContact O-N 2.87Å; V669-V671 VanDerWaalsContact C-N 3.31Å; V669-V671 PolarHBondContact O-N 3.13Å; V669-R672 PolarHBondContact O-N 3.08Å; V669-T673 HydrophobicContact CG1-CG2 4.34Å; V669-T673 WeakPolarHBondContact O-CB 3.37Å; V669-T673 WeakPolarHBondContact O-CG2 3.45Å; V669-T673 PolarHBondContact O-N 3.16Å; V669-T673 PolarHBondContact O-OG1 3.22Å
670	F	93.7	Very high	90.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59	-40.7	174.3	176.7	-114	0	0	0	112.5	M632 L636 L655 L659 C666 G667 T673 G675 V679 L697 Y701	M632-F670 HydrophobicContact CE-CB 3.91Å; M632-F670 HydrophobicContact CE-CD2 4.44Å; M632-F670 HydrophobicContact SD-CB 4.31Å; M632-F670 HydrophobicContact SD-CD2 4.03Å; L636-F670 HydrophobicContact CD2-CD2 4.26Å; L636-F670 HydrophobicContact CD2-CE2 3.94Å; L655-F670 HydrophobicContact CD2-CE2 4.48Å; L659-F670 HydrophobicContact CD1-CB 4.47Å; L659-F670 HydrophobicContact CD1-CD1 4.16Å; L659-F670 HydrophobicContact CD1-CD2 4.25Å; L659-F670 HydrophobicContact CD1-CE1 4.38Å; L659-F670 HydrophobicContact CD1-CE2 4.41Å; L659-F670 HydrophobicContact CD1-CG 4.07Å; L659-F670 HydrophobicContact CD2-CB 3.75Å; L659-F670 HydrophobicContact CD2-CD1 4.44Å; L659-F670 HydrophobicContact CD2-CG 4.18Å; C666-F670 WeakPolarHBondContact O-CB 3.36Å; C666-F670 PolarHBondContact O-N 3.11Å; G667-F670 PolarHBondContact O-N 3.3Å; F670-T673 PolarHBondContact O-OG1 3.11Å; F670-T673 VanDerWaalsContact O-OG1 3.06Å; F670-G675 PolarHBondContact O-N 3.07Å; F670-V679 HydrophobicContact CZ-CG2 4.16Å; F670-L697 HydrophobicContact CE1-CD2 4.46Å; F670-L697 HydrophobicContact CE2-CD2 4.34Å; F670-L697 HydrophobicContact CZ-CB 4.16Å; F670-L697 HydrophobicContact CZ-CD2 4.02Å; F670-L697 HydrophobicContact CZ-CG 4.45Å; F670-Y701 HydrophobicContact CD1-CD2 4.41Å; F670-Y701 HydrophobicContact CE1-CD2 4.22Å
671	V	90.4	Very high	90.8	Very high	6 Å²	6	46 Å²	46	4%	0.036	23%	0.231	C	C	.	.	H	α-helix	trans	-66.6	-50.6	174.4	176.5	0	0	0	0	111.1	G667 P668 V669 T673 N674 Y701 V709 Y710	G667-V671 PolarHBondContact O-N 3.21Å; G667-V671 VanDerWaalsContact O-N 3.11Å; P668-V671 PolarHBondContact O-N 3.23Å; V669-V671 VanDerWaalsContact C-N 3.31Å; V669-V671 PolarHBondContact O-N 3.13Å; V671-T673 VanDerWaalsContact C-N 3.26Å; V671-T673 PolarHBondContact O-N 3.22Å; V671-N674 PolarHBondContact O-N 3.11Å; V671-Y701 HydrophobicContact CB-CD2 4.47Å; V671-Y701 HydrophobicContact CB-CE2 4.24Å; V671-Y701 HydrophobicContact CG1-CE2 4.02Å; V671-Y701 HydrophobicContact CG2-CD2 3.98Å; V671-Y701 HydrophobicContact CG2-CE2 4.15Å; V671-V709 HydrophobicContact CG1-CG2 3.6Å; V671-Y710 HydrophobicContact CG1-CD2 4.17Å
672	R	89.3	Confident	90.9	Very high	150 Å²	150	41.8 Å²	41.8	57%	0.566	21%	0.212	S	C	*	.	H	α-helix	trans	-65.1	-23.1	-177.9	-176.8	165.7	62.2	160.6	1.9	114	D629 P668 V669 N674	D629-R672 IonicContact OD1-CZ 3.38Å; D629-R672 VanDerWaalsContact OD1-CZ 3.23Å; D629-R672 IonicContact OD1-NE 3.76Å; D629-R672 PolarHBondContact OD1-NE 3.09Å; D629-R672 IonicContact OD1-NH1 2.67Å; D629-R672 PolarHBondContact OD1-NH1 3.39Å; D629-R672 IonicContact OD1-NH2 2.94Å; D629-R672 PolarHBondContact OD1-NH2 3.35Å; D629-R672 IonicContact OD2-CZ 2.96Å; D629-R672 IonicContact OD2-NE 3.43Å; D629-R672 IonicContact OD2-NH1 3.89Å; D629-R672 PolarHBondContact OD2-NH1 2.98Å; D629-R672 IonicContact OD2-NH2 3.4Å; D629-R672 PolarHBondContact OD2-NH2 2.95Å; P668-R672 VanDerWaalsContact O-CB 3.28Å; P668-R672 WeakPolarHBondContact O-CB 3.22Å; P668-R672 PolarHBondContact O-N 3.22Å; V669-R672 PolarHBondContact O-N 3.08Å; R672-N674 VanDerWaalsContact C-N 3.34Å; R672-N674 PolarHBondContact O-N 2.85Å
673	T	90.7	Very high	91.1	Very high	20.3333 Å²	20.3333	39.4 Å²	39.4	13%	0.125	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	10.3	174	54.3	0	0	0	0	113.7	D629 M632 R633 L636 V669 F670 V671 G675	D629-T673 HydrophobicContact CB-CG2 4.01Å; D629-T673 WeakPolarHBondContact O-CG2 3.44Å; M632-T673 HydrophobicContact CB-CG2 4.2Å; M632-T673 HydrophobicContact CG-CG2 4.23Å; M632-T673 VanDerWaalsContact CG-OG1 3.23Å; M632-T673 WeakPolarHBondContact CG-OG1 3.31Å; R633-T673 HydrophobicContact CG-CG2 3.99Å; L636-T673 WeakPolarHBondContact CD1-OG1 3.34Å; V669-T673 HydrophobicContact CG1-CG2 4.34Å; V669-T673 WeakPolarHBondContact O-CB 3.37Å; V669-T673 WeakPolarHBondContact O-CG2 3.45Å; V669-T673 PolarHBondContact O-N 3.16Å; V669-T673 PolarHBondContact O-OG1 3.22Å; F670-T673 PolarHBondContact O-OG1 3.11Å; F670-T673 VanDerWaalsContact O-OG1 3.06Å; V671-T673 VanDerWaalsContact C-N 3.26Å; V671-T673 PolarHBondContact O-N 3.22Å; T673-G675 VanDerWaalsContact C-N 3.33Å; T673-G675 PolarHBondContact O-N 2.95Å
674	N	88.9	Confident	91.2	Very high	83.6667 Å²	83.6667	39.9 Å²	39.9	45%	0.447	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	43.5	-177.2	-63.2	-9.9	0	0	0	113.4	V671 R672 I676 H677	V671-N674 PolarHBondContact O-N 3.11Å; R672-N674 VanDerWaalsContact C-N 3.34Å; R672-N674 PolarHBondContact O-N 2.85Å; N674-I676 PolarHBondContact O-N 3.14Å; N674-H677 PolarHBondContact O-CD2 3.16Å; N674-H677 PolarHBondContact O-N 3.11Å; N674-H677 VanDerWaalsContact O-N 3.1Å
675	G	91.7	Very high	91.4	Very high	0.333333 Å²	0.333333	33.8 Å²	33.8	0%	0.003	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-19.7	178.1	0	0	0	0	0	114.8	F670 T673 H677 C678 V679	F670-G675 PolarHBondContact O-N 3.07Å; T673-G675 VanDerWaalsContact C-N 3.33Å; T673-G675 PolarHBondContact O-N 2.95Å; G675-H677 VanDerWaalsContact C-N 3.28Å; G675-H677 PolarHBondContact O-N 2.97Å; G675-C678 VanDerWaalsContact O-CB 3.31Å; G675-C678 WeakPolarHBondContact O-CB 3.39Å; G675-C678 PolarHBondContact O-N 3.37Å; G675-C678 VanDerWaalsContact O-N 3.08Å; G675-V679 PolarHBondContact O-N 3.37Å; G675-V679 VanDerWaalsContact O-N 3.14Å
676	I	91.4	Very high	91.4	Very high	14 Å²	14	37.4 Å²	37.4	7%	0.072	19%	0.185	C	C	.	.	H	α-helix	trans	-56.1	-32.2	173.4	-165.4	60.7	0	0	0	113.8	N674 C678 V679 F680 F698 Y701 L719	N674-I676 PolarHBondContact O-N 3.14Å; I676-C678 VanDerWaalsContact C-N 3.32Å; I676-C678 PolarHBondContact O-N 3.38Å; I676-V679 HydrophobicContact CD1-CB 4.35Å; I676-V679 HydrophobicContact CD1-CG1 4.41Å; I676-V679 WeakPolarHBondContact O-CB 3.42Å; I676-V679 PolarHBondContact O-N 3.19Å; I676-F680 HydrophobicContact CD1-CD2 4.12Å; I676-F680 HydrophobicContact CD1-CE2 3.69Å; I676-F680 HydrophobicContact CG1-CD2 4.01Å; I676-F680 HydrophobicContact CG1-CE2 3.83Å; I676-F680 WeakPolarHBondContact O-CD2 3.34Å; I676-F680 PolarHBondContact O-N 3.11Å; I676-F680 VanDerWaalsContact O-N 3.12Å; I676-F698 HydrophobicContact CD1-CD2 3.75Å; I676-F698 HydrophobicContact CD1-CE2 4.08Å; I676-Y701 HydrophobicContact CB-CD1 4.31Å; I676-Y701 HydrophobicContact CB-CD2 4.01Å; I676-Y701 HydrophobicContact CB-CE1 4.19Å; I676-Y701 HydrophobicContact CB-CE2 3.8Å; I676-Y701 HydrophobicContact CB-CG 4.3Å; I676-Y701 HydrophobicContact CD1-CD1 3.96Å; I676-Y701 HydrophobicContact CD1-CE1 4.33Å; I676-Y701 HydrophobicContact CD1-CG 4.15Å; I676-Y701 HydrophobicContact CG1-CD1 4.35Å; I676-Y701 HydrophobicContact CG1-CE1 4.24Å; I676-Y701 HydrophobicContact CG2-CE1 4.44Å; I676-Y701 HydrophobicContact CG2-CE2 4.14Å; I676-L719 HydrophobicContact CD1-CD1 4.4Å; I676-L719 HydrophobicContact CG1-CD1 4.2Å
677	H	91.7	Very high	91.4	Very high	133 Å²	133	39.2 Å²	39.2	62%	0.616	19%	0.194	S	C	*	.	H	α-helix	trans	-67.2	-36.7	174.9	-63.6	-61.8	0	0	0	112	N674 G675 V679 F680 K681	N674-H677 PolarHBondContact O-CD2 3.16Å; N674-H677 PolarHBondContact O-N 3.11Å; N674-H677 VanDerWaalsContact O-N 3.1Å; G675-H677 VanDerWaalsContact C-N 3.28Å; G675-H677 PolarHBondContact O-N 2.97Å; H677-V679 VanDerWaalsContact C-N 3.33Å; H677-F680 PolarHBondContact O-N 3.13Å; H677-K681 PolarHBondContact O-N 3.05Å; H677-K681 VanDerWaalsContact O-N 3.12Å
678	C	94.3	Very high	91.5	Very high	4.33333 Å²	4.33333	41.5 Å²	41.5	3%	0.029	21%	0.205	C	C	.	.	H	α-helix	trans	-65.9	-39	174.3	-172.9	0	0	0	0	110.9	L636 L639 T640 G675 I676 F680 K681 L682	L636-C678 HydrophobicContact CD2-CB 3.75Å; L639-C678 VanDerWaalsContact CB-SG 3.57Å; T640-C678 HydrophobicContact CG2-CB 4.12Å; G675-C678 VanDerWaalsContact O-CB 3.31Å; G675-C678 WeakPolarHBondContact O-CB 3.39Å; G675-C678 PolarHBondContact O-N 3.37Å; G675-C678 VanDerWaalsContact O-N 3.08Å; I676-C678 VanDerWaalsContact C-N 3.32Å; I676-C678 PolarHBondContact O-N 3.38Å; C678-F680 PolarHBondContact O-N 2.75Å; C678-K681 PolarHBondContact O-N 3.24Å; C678-L682 WeakPolarHBondContact O-CB 3.42Å; C678-L682 VanDerWaalsContact O-CG 3.24Å; C678-L682 WeakPolarHBondContact O-CG 3.34Å; C678-L682 PolarHBondContact O-N 3Å
679	V	94.8	Very high	91.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-56.3	-52.6	174.3	172.4	0	0	0	0	111.3	F670 G675 I676 H677 K681 L682 L683 A694 L697 F698	F670-V679 HydrophobicContact CZ-CG2 4.16Å; G675-V679 PolarHBondContact O-N 3.37Å; G675-V679 VanDerWaalsContact O-N 3.14Å; I676-V679 HydrophobicContact CD1-CB 4.35Å; I676-V679 HydrophobicContact CD1-CG1 4.41Å; I676-V679 WeakPolarHBondContact O-CB 3.42Å; I676-V679 PolarHBondContact O-N 3.19Å; H677-V679 VanDerWaalsContact C-N 3.33Å; V679-K681 VanDerWaalsContact C-N 3.33Å; V679-K681 PolarHBondContact O-N 3.19Å; V679-L682 PolarHBondContact O-N 3.33Å; V679-L682 VanDerWaalsContact O-N 3.08Å; V679-L683 HydrophobicContact CG1-CD1 4.09Å; V679-L683 HydrophobicContact CG1-CG 4.45Å; V679-L683 WeakPolarHBondContact O-CG 3.3Å; V679-L683 PolarHBondContact O-N 3.14Å; V679-A694 HydrophobicContact CG1-CB 4.41Å; V679-A694 WeakPolarHBondContact CG1-O 3.25Å; V679-L697 HydrophobicContact CG2-CB 3.57Å; V679-L697 HydrophobicContact CG2-CD1 4.42Å; V679-F698 HydrophobicContact CG1-CB 3.88Å; V679-F698 HydrophobicContact CG1-CD2 4.33Å
680	F	93.2	Very high	91.9	Very high	29.6667 Å²	29.6667	41.6 Å²	41.6	13%	0.13	20%	0.199	C	C	.	.	H	α-helix	trans	-68.2	-28	-179	-77.9	-71.9	0	0	0	114	I676 H677 C678 L683 F698 L719 L722 L723 R726	I676-F680 HydrophobicContact CD1-CD2 4.12Å; I676-F680 HydrophobicContact CD1-CE2 3.69Å; I676-F680 HydrophobicContact CG1-CD2 4.01Å; I676-F680 HydrophobicContact CG1-CE2 3.83Å; I676-F680 WeakPolarHBondContact O-CD2 3.34Å; I676-F680 PolarHBondContact O-N 3.11Å; I676-F680 VanDerWaalsContact O-N 3.12Å; H677-F680 PolarHBondContact O-N 3.13Å; C678-F680 PolarHBondContact O-N 2.75Å; F680-L683 HydrophobicContact CD1-CD1 3.65Å; F680-L683 HydrophobicContact CE1-CD1 3.8Å; F680-L683 HydrophobicContact CG-CD1 4.38Å; F680-F698 HydrophobicContact CE2-CD2 4.49Å; F680-F698 HydrophobicContact CE2-CE2 4.4Å; F680-F698 HydrophobicContact CZ-CD2 4.38Å; F680-F698 HydrophobicContact CZ-CE2 4.14Å; F680-L719 HydrophobicContact CE2-CD2 3.96Å; F680-L719 HydrophobicContact CZ-CB 4.35Å; F680-L719 HydrophobicContact CZ-CD2 4.28Å; F680-L722 HydrophobicContact CD1-CB 4.45Å; F680-L722 HydrophobicContact CD1-CD2 3.82Å; F680-L722 HydrophobicContact CD1-CG 3.87Å; F680-L722 HydrophobicContact CD2-CD2 4.29Å; F680-L722 HydrophobicContact CE1-CB 3.82Å; F680-L722 HydrophobicContact CE1-CD2 3.68Å; F680-L722 HydrophobicContact CE1-CG 3.54Å; F680-L722 HydrophobicContact CE2-CD2 4.17Å; F680-L722 HydrophobicContact CG-CD2 4.13Å; F680-L722 HydrophobicContact CZ-CB 4.03Å; F680-L722 HydrophobicContact CZ-CD2 3.87Å; F680-L722 HydrophobicContact CZ-CG 4.08Å; F680-L723 HydrophobicContact CE1-CB 4.46Å; F680-R726 HydrophobicContact CD1-CG 4.15Å
681	K	92.7	Very high	91.9	Very high	46.3333 Å²	46.3333	42.2 Å²	42.2	20%	0.201	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-45.4	167.1	-179.1	-88.6	-175.9	173.8	0	111.5	L639 T640 V642 H643 H677 C678 V679 L683 T684	L639-K681 PolarHBondContact O-NZ 3.11Å; T640-K681 HydrophobicContact CG2-CB 4.44Å; T640-K681 HydrophobicContact CG2-CG 4.45Å; T640-K681 VanDerWaalsContact O-CE 3.29Å; T640-K681 WeakPolarHBondContact O-CE 3.37Å; T640-K681 PolarHBondContact O-NZ 3.36Å; V642-K681 PolarHBondContact O-NZ 2.9Å; H643-K681 WeakPolarHBondContact CE1-CE 3.49Å; H643-K681 WeakPolarHBondContact ND1-CE 3.28Å; H643-K681 PolarHBondContact ND1-NZ 2.93Å; H677-K681 PolarHBondContact O-N 3.05Å; H677-K681 VanDerWaalsContact O-N 3.12Å; C678-K681 PolarHBondContact O-N 3.24Å; V679-K681 VanDerWaalsContact C-N 3.33Å; V679-K681 PolarHBondContact O-N 3.19Å; K681-L683 VanDerWaalsContact C-N 3.34Å; K681-L683 PolarHBondContact O-N 3.45Å; K681-T684 PolarHBondContact O-N 3.16Å; K681-T684 PolarHBondContact O-OG1 3.26Å
682	L	94	Very high	92.1	Very high	2.33333 Å²	2.33333	42 Å²	42	1%	0.012	20%	0.2	C	C	.	.	H	α-helix	trans	-72.2	-28.6	-176.9	-66.7	168.9	0	0	0	112.7	L639 I648 L652 C678 V679 T684 S685 V690 A694 L697	L639-L682 HydrophobicContact CB-CD1 4.47Å; I648-L682 HydrophobicContact CD1-CD2 3.96Å; I648-L682 HydrophobicContact CG2-CD2 4.36Å; L652-L682 HydrophobicContact CD1-CD1 3.81Å; L652-L682 HydrophobicContact CD1-CD2 4.5Å; L652-L682 HydrophobicContact CD2-CD1 4.08Å; L652-L682 HydrophobicContact CD2-CD2 4.39Å; C678-L682 WeakPolarHBondContact O-CB 3.42Å; C678-L682 VanDerWaalsContact O-CG 3.24Å; C678-L682 WeakPolarHBondContact O-CG 3.34Å; C678-L682 PolarHBondContact O-N 3Å; V679-L682 PolarHBondContact O-N 3.33Å; V679-L682 VanDerWaalsContact O-N 3.08Å; L682-T684 PolarHBondContact O-N 3.27Å; L682-S685 VanDerWaalsContact O-CB 3.26Å; L682-S685 WeakPolarHBondContact O-CB 3.24Å; L682-S685 PolarHBondContact O-N 2.88Å; L682-S685 VanDerWaalsContact O-N 3.1Å; L682-V690 HydrophobicContact CB-CG1 4.04Å; L682-V690 HydrophobicContact CD2-CG1 3.83Å; L682-V690 HydrophobicContact CG-CG1 4.44Å; L682-A694 HydrophobicContact CB-CB 3.69Å; L682-L697 HydrophobicContact CD1-CD1 4.3Å
683	L	93.1	Very high	92.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.9	-25.4	172.9	-74.5	169.4	0	0	0	113.3	V679 F680 K681 S685 R691 A694 I695 L723 R726 L727	V679-L683 HydrophobicContact CG1-CD1 4.09Å; V679-L683 HydrophobicContact CG1-CG 4.45Å; V679-L683 WeakPolarHBondContact O-CG 3.3Å; V679-L683 PolarHBondContact O-N 3.14Å; F680-L683 HydrophobicContact CD1-CD1 3.65Å; F680-L683 HydrophobicContact CE1-CD1 3.8Å; F680-L683 HydrophobicContact CG-CD1 4.38Å; K681-L683 VanDerWaalsContact C-N 3.34Å; K681-L683 PolarHBondContact O-N 3.45Å; L683-S685 VanDerWaalsContact C-N 3.27Å; L683-S685 PolarHBondContact O-N 3.04Å; L683-R691 VanDerWaalsContact O-CD 3.25Å; L683-R691 WeakPolarHBondContact O-CD 3.37Å; L683-R691 WeakPolarHBondContact O-CG 3.32Å; L683-A694 HydrophobicContact CD2-CB 3.86Å; L683-A694 HydrophobicContact CG-CB 3.86Å; L683-I695 HydrophobicContact CD2-CG1 3.93Å; L683-L723 HydrophobicContact CD1-CD1 3.57Å; L683-L723 HydrophobicContact CD2-CD1 3.94Å; L683-L723 HydrophobicContact CG-CD1 4.44Å; L683-R726 HydrophobicContact CB-CB 4.29Å; L683-L727 HydrophobicContact CD2-CD2 3.91Å; L683-L727 HydrophobicContact CD2-CG 4.42Å
684	T	90.7	Very high	92.7	Very high	57.3333 Å²	57.3333	34.9 Å²	34.9	35%	0.352	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	12.3	175.1	65	0	0	0	0	113.9	K681 L682	K681-T684 PolarHBondContact O-N 3.16Å; K681-T684 PolarHBondContact O-OG1 3.26Å; L682-T684 PolarHBondContact O-N 3.27Å
685	S	90	Very high	93	Very high	19.6667 Å²	19.6667	31 Å²	31	14%	0.138	15%	0.15	C	C	.	.			trans	-76.5	136.2	174.7	-173.6	0	0	0	0	111.1	L682 L683 D687 R691 T730	L682-S685 VanDerWaalsContact O-CB 3.26Å; L682-S685 WeakPolarHBondContact O-CB 3.24Å; L682-S685 PolarHBondContact O-N 2.88Å; L682-S685 VanDerWaalsContact O-N 3.1Å; L683-S685 VanDerWaalsContact C-N 3.27Å; L683-S685 PolarHBondContact O-N 3.04Å; S685-D687 VanDerWaalsContact C-N 3.29Å; S685-D687 PolarHBondContact O-N 3.24Å; S685-D687 PolarHBondContact OG-N 3.1Å; S685-D687 PolarHBondContact OG-O 2.77Å; S685-R691 WeakPolarHBondContact O-CD 3.41Å; S685-R691 VanDerWaalsContact O-CG 3.31Å; S685-R691 WeakPolarHBondContact O-CG 3.27Å; S685-R691 PolarHBondContact O-NE 2.98Å; S685-R691 PolarHBondContact O-NH1 3.04Å; S685-T730 WeakPolarHBondContact O-CG2 3.31Å
686	E	87.2	Confident	93.2	Very high	142.333 Å²	142.333	31 Å²	31	67%	0.665	15%	0.15	S	C	*	.	S	Bend	trans	-61.5	-30.7	172.5	-66.7	168.2	-174.6	0	0	112.3	R588 R691	R588-E686 IonicContact CZ-OE2 3.69Å; R588-E686 IonicContact NH1-OE2 3.52Å; R588-E686 IonicContact NH2-OE2 3.29Å; R588-E686 PolarHBondContact NH2-OE2 3.43Å; E686-R691 PolarHBondContact O-NH1 3.28Å
687	D	91.3	Very high	93.4	Very high	37.3333 Å²	37.3333	30.4 Å²	30.4	20%	0.2	15%	0.147	C	C	.	.	S	Bend	trans	-76	131	177.7	174	-95.8	0	0	0	112.2	P645 H649 S685 H689 V690 R691	P645-D687 HydrophobicContact CB-CB 3.54Å; P645-D687 VanDerWaalsContact CB-CB 3.46Å; P645-D687 HydrophobicContact CG-CB 3.96Å; H649-D687 IonicContact CD2-OD1 2.68Å; H649-D687 IonicContact CE1-OD1 3.45Å; H649-D687 PolarHBondContact CE1-OD1 3.31Å; H649-D687 VanDerWaalsContact CE1-OD1 3.27Å; H649-D687 IonicContact CE1-OD2 3.41Å; H649-D687 IonicContact ND1-OD1 2.7Å; H649-D687 IonicContact NE2-OD1 2.84Å; H649-D687 PolarHBondContact NE2-OD1 3.21Å; H649-D687 IonicContact NE2-OD2 2.92Å; S685-D687 VanDerWaalsContact C-N 3.29Å; S685-D687 PolarHBondContact O-N 3.24Å; S685-D687 PolarHBondContact OG-N 3.1Å; S685-D687 PolarHBondContact OG-O 2.77Å; D687-H689 VanDerWaalsContact OD1-CA 3.32Å; D687-H689 WeakPolarHBondContact OD1-CA 3.34Å; D687-H689 VanDerWaalsContact OD1-CB 3.25Å; D687-H689 WeakPolarHBondContact OD1-CB 3.38Å; D687-H689 IonicContact OD1-CG 3.99Å; D687-H689 PolarHBondContact OD1-N 2.98Å; D687-H689 IonicContact OD1-ND1 2.96Å; D687-H689 IonicContact OD2-CE1 2.7Å; D687-H689 IonicContact OD2-CG 2.68Å; D687-H689 PolarHBondContact OD2-N 2.87Å; D687-H689 IonicContact OD2-ND1 3.32Å; D687-H689 PolarHBondContact OD2-ND1 3.13Å; D687-V690 HydrophobicContact CB-CB 4.35Å; D687-V690 HydrophobicContact CB-CG2 4.1Å; D687-V690 WeakPolarHBondContact OD1-CG2 3.39Å; D687-V690 PolarHBondContact OD1-N 2.99Å; D687-R691 VanDerWaalsContact C-NH1 3.32Å; D687-R691 WeakPolarHBondContact O-CG 3.22Å; D687-R691 PolarHBondContact O-N 3.29Å; D687-R691 PolarHBondContact O-NH1 3.13Å
688	E	92.1	Very high	93.5	Very high	47.6667 Å²	47.6667	24 Å²	24	22%	0.223	12%	0.118	C	C	.	.	H	α-helix	trans	-68.4	-38.5	-177.8	-165.9	-171.1	160.6	0	0	112.9	V690 R691 I692 T735 L737 M738	E688-V690 VanDerWaalsContact C-N 3.32Å; E688-V690 PolarHBondContact O-N 3.09Å; E688-R691 CarbonylContact O-C 3.59Å; E688-R691 PolarHBondContact O-N 2.89Å; E688-R691 VanDerWaalsContact O-N 3.1Å; E688-I692 HydrophobicContact CG-CD1 3.92Å; E688-I692 HydrophobicContact CG-CG1 4.44Å; E688-I692 WeakPolarHBondContact O-CD1 3.42Å; E688-I692 VanDerWaalsContact O-CG1 3.3Å; E688-I692 WeakPolarHBondContact O-CG1 3.47Å; E688-I692 PolarHBondContact O-N 3.12Å; E688-T735 VanDerWaalsContact OE1-CB 3.27Å; E688-T735 WeakPolarHBondContact OE1-CB 3.36Å; E688-T735 WeakPolarHBondContact OE1-CG2 3.47Å; E688-T735 PolarHBondContact OE1-OG1 3.18Å; E688-L737 WeakPolarHBondContact OE1-CB 3.21Å; E688-M738 HydrophobicContact CG-CE 3.99Å; E688-M738 HydrophobicContact CG-CG 4.47Å
689	H	93.5	Very high	93.4	Very high	79.6667 Å²	79.6667	23.8 Å²	23.8	37%	0.369	12%	0.116	S	C	.	.	H	α-helix	trans	-66.2	-37.4	-178.3	-57.2	56.3	0	0	0	111.5	D687 R691 I692 Y693 I754	D687-H689 VanDerWaalsContact OD1-CA 3.32Å; D687-H689 WeakPolarHBondContact OD1-CA 3.34Å; D687-H689 VanDerWaalsContact OD1-CB 3.25Å; D687-H689 WeakPolarHBondContact OD1-CB 3.38Å; D687-H689 IonicContact OD1-CG 3.99Å; D687-H689 PolarHBondContact OD1-N 2.98Å; D687-H689 IonicContact OD1-ND1 2.96Å; D687-H689 IonicContact OD2-CE1 2.7Å; D687-H689 IonicContact OD2-CG 2.68Å; D687-H689 PolarHBondContact OD2-N 2.87Å; D687-H689 IonicContact OD2-ND1 3.32Å; D687-H689 PolarHBondContact OD2-ND1 3.13Å; H689-R691 VanDerWaalsContact C-N 3.33Å; H689-R691 PolarHBondContact O-N 3.21Å; H689-I692 PolarHBondContact O-N 3.15Å; H689-Y693 VanDerWaalsContact O-CD2 3.26Å; H689-Y693 WeakPolarHBondContact O-CD2 3.34Å; H689-Y693 PolarHBondContact O-N 3.34Å; H689-I754 HydrophobicContact CB-CD1 3.92Å; H689-I754 WeakPolarHBondContact ND1-CD1 3.42Å
690	V	94.5	Very high	93.3	Very high	0.333333 Å²	0.333333	24 Å²	24	0%	0.002	12%	0.117	C	C	.	.	H	α-helix	trans	-62.3	-44.5	170.8	175.6	0	0	0	0	110.8	P645 I648 L652 L682 D687 E688 Y693 A694	P645-V690 HydrophobicContact CB-CG2 3.94Å; I648-V690 HydrophobicContact CD1-CB 4.45Å; I648-V690 HydrophobicContact CD1-CG1 3.97Å; I648-V690 HydrophobicContact CD1-CG2 3.74Å; I648-V690 HydrophobicContact CG1-CG2 4Å; I648-V690 HydrophobicContact CG2-CG2 4.47Å; L652-V690 HydrophobicContact CD1-CB 4.36Å; L652-V690 HydrophobicContact CD1-CG1 4Å; L652-V690 HydrophobicContact CD1-CG2 4.21Å; L652-V690 HydrophobicContact CD2-CG1 4.22Å; L652-V690 HydrophobicContact CD2-CG2 4.47Å; L682-V690 HydrophobicContact CB-CG1 4.04Å; L682-V690 HydrophobicContact CD2-CG1 3.83Å; L682-V690 HydrophobicContact CG-CG1 4.44Å; D687-V690 HydrophobicContact CB-CB 4.35Å; D687-V690 HydrophobicContact CB-CG2 4.1Å; D687-V690 WeakPolarHBondContact OD1-CG2 3.39Å; D687-V690 PolarHBondContact OD1-N 2.99Å; E688-V690 VanDerWaalsContact C-N 3.32Å; E688-V690 PolarHBondContact O-N 3.09Å; V690-Y693 PolarHBondContact O-N 3.28Å; V690-A694 WeakPolarHBondContact O-CB 3.46Å; V690-A694 PolarHBondContact O-N 3.37Å
691	R	94.1	Very high	93.3	Very high	12.6667 Å²	12.6667	23.3 Å²	23.3	5%	0.048	11%	0.114	C	C	.	.	H	α-helix	trans	-62.6	-42.8	175.6	-65.7	-163.5	-65.6	-100.4	5.9	112	L683 S685 E686 D687 E688 H689 Y693 A694 I695 S731 M738	L683-R691 VanDerWaalsContact O-CD 3.25Å; L683-R691 WeakPolarHBondContact O-CD 3.37Å; L683-R691 WeakPolarHBondContact O-CG 3.32Å; S685-R691 WeakPolarHBondContact O-CD 3.41Å; S685-R691 VanDerWaalsContact O-CG 3.31Å; S685-R691 WeakPolarHBondContact O-CG 3.27Å; S685-R691 PolarHBondContact O-NE 2.98Å; S685-R691 PolarHBondContact O-NH1 3.04Å; E686-R691 PolarHBondContact O-NH1 3.28Å; D687-R691 VanDerWaalsContact C-NH1 3.32Å; D687-R691 WeakPolarHBondContact O-CG 3.22Å; D687-R691 PolarHBondContact O-N 3.29Å; D687-R691 PolarHBondContact O-NH1 3.13Å; E688-R691 CarbonylContact O-C 3.59Å; E688-R691 PolarHBondContact O-N 2.89Å; E688-R691 VanDerWaalsContact O-N 3.1Å; H689-R691 VanDerWaalsContact C-N 3.33Å; H689-R691 PolarHBondContact O-N 3.21Å; R691-Y693 PolarHBondContact O-N 3.06Å; R691-A694 WeakPolarHBondContact O-CB 3.32Å; R691-A694 PolarHBondContact O-N 3.12Å; R691-A694 VanDerWaalsContact O-N 3.17Å; R691-I695 WeakPolarHBondContact O-CG1 3.34Å; R691-I695 PolarHBondContact O-N 3.2Å; R691-S731 PolarHBondContact NH1-OG 2.72Å; R691-S731 PolarHBondContact NH2-OG 3.16Å; R691-M738 HydrophobicContact CB-CE 4.03Å
692	I	94.6	Very high	93.1	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-59.7	-45.4	175.5	-71.3	159.1	0	0	0	111.3	E688 H689 A694 I695 K696 L737 M738 A741 I754	E688-I692 HydrophobicContact CG-CD1 3.92Å; E688-I692 HydrophobicContact CG-CG1 4.44Å; E688-I692 WeakPolarHBondContact O-CD1 3.42Å; E688-I692 VanDerWaalsContact O-CG1 3.3Å; E688-I692 WeakPolarHBondContact O-CG1 3.47Å; E688-I692 PolarHBondContact O-N 3.12Å; H689-I692 PolarHBondContact O-N 3.15Å; I692-A694 VanDerWaalsContact C-N 3.33Å; I692-A694 PolarHBondContact O-N 2.7Å; I692-I695 PolarHBondContact O-N 3.12Å; I692-K696 HydrophobicContact CG2-CD 4.39Å; I692-K696 WeakPolarHBondContact O-CG 3.39Å; I692-K696 PolarHBondContact O-N 3.07Å; I692-L737 HydrophobicContact CD1-CB 3.54Å; I692-L737 HydrophobicContact CD1-CD1 4.16Å; I692-L737 HydrophobicContact CD1-CG 4.46Å; I692-L737 HydrophobicContact CG1-CB 4.43Å; I692-M738 HydrophobicContact CG1-CG 4.39Å; I692-M738 HydrophobicContact CG1-SD 4.42Å; I692-A741 HydrophobicContact CG2-CB 4.03Å; I692-I754 HydrophobicContact CB-CD1 4.35Å; I692-I754 HydrophobicContact CD1-CD1 4.41Å; I692-I754 HydrophobicContact CD1-CG2 4.32Å; I692-I754 HydrophobicContact CG2-CB 4.5Å; I692-I754 HydrophobicContact CG2-CD1 4.05Å; I692-I754 HydrophobicContact CG2-CG1 3.83Å; I692-I754 HydrophobicContact CG2-CG2 4.2Å
693	Y	96.2	Very high	92.8	Very high	22 Å²	22	23.1 Å²	23.1	9%	0.086	12%	0.115	C	C	.	.	H	α-helix	trans	-68.6	-32.6	176	-82	-59.4	0	0	0	112.7	L652 Y653 V656 H689 V690 R691 I695 K696 L697 P752 I754	L652-Y693 HydrophobicContact CB-CD2 4.26Å; L652-Y693 HydrophobicContact CB-CG 4.25Å; L652-Y693 VanDerWaalsContact CD2-CB 3.46Å; L652-Y693 HydrophobicContact CD2-CD2 4.43Å; L652-Y693 HydrophobicContact CD2-CG 4.24Å; L652-Y693 HydrophobicContact CG-CG 4.13Å; Y653-Y693 HydrophobicContact CD2-CE1 4.28Å; Y653-Y693 WeakPolarHBondContact CD2-OH 3.35Å; V656-Y693 HydrophobicContact CB-CD1 4.3Å; V656-Y693 HydrophobicContact CB-CE1 4.47Å; V656-Y693 HydrophobicContact CG1-CD1 4.29Å; V656-Y693 HydrophobicContact CG1-CE1 4.35Å; V656-Y693 HydrophobicContact CG2-CD1 3.96Å; H689-Y693 VanDerWaalsContact O-CD2 3.26Å; H689-Y693 WeakPolarHBondContact O-CD2 3.34Å; H689-Y693 PolarHBondContact O-N 3.34Å; V690-Y693 PolarHBondContact O-N 3.28Å; R691-Y693 PolarHBondContact O-N 3.06Å; Y693-I695 VanDerWaalsContact C-N 3.35Å; Y693-I695 PolarHBondContact O-N 2.83Å; Y693-K696 HydrophobicContact CD1-CD 3.93Å; Y693-K696 HydrophobicContact CE1-CD 4.21Å; Y693-K696 PolarHBondContact O-N 3.3Å; Y693-L697 WeakPolarHBondContact O-CG 3.38Å; Y693-L697 PolarHBondContact O-N 2.85Å; Y693-P752 VanDerWaalsContact CE1-O 3.32Å; Y693-P752 WeakPolarHBondContact CE1-O 3.3Å; Y693-P752 PolarHBondContact OH-O 3.11Å; Y693-P752 VanDerWaalsContact OH-O 3.12Å; Y693-I754 HydrophobicContact CD2-CD1 4.18Å; Y693-I754 HydrophobicContact CD2-CG1 4.43Å; Y693-I754 HydrophobicContact CE1-CG1 4.32Å; Y693-I754 HydrophobicContact CE2-CD1 3.71Å; Y693-I754 HydrophobicContact CE2-CG1 3.94Å
694	A	96.1	Very high	92.6	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.7	-41.5	171.2	0	0	0	0	0	111.7	V679 L682 L683 V690 R691 I692 K696 L697 F698	V679-A694 HydrophobicContact CG1-CB 4.41Å; V679-A694 WeakPolarHBondContact CG1-O 3.25Å; L682-A694 HydrophobicContact CB-CB 3.69Å; L683-A694 HydrophobicContact CD2-CB 3.86Å; L683-A694 HydrophobicContact CG-CB 3.86Å; V690-A694 WeakPolarHBondContact O-CB 3.46Å; V690-A694 PolarHBondContact O-N 3.37Å; R691-A694 WeakPolarHBondContact O-CB 3.32Å; R691-A694 PolarHBondContact O-N 3.12Å; R691-A694 VanDerWaalsContact O-N 3.17Å; I692-A694 VanDerWaalsContact C-N 3.33Å; I692-A694 PolarHBondContact O-N 2.7Å; A694-K696 VanDerWaalsContact C-N 3.33Å; A694-K696 PolarHBondContact O-N 2.75Å; A694-L697 CarbonylContact O-C 3.58Å; A694-L697 WeakPolarHBondContact O-CB 3.41Å; A694-L697 PolarHBondContact O-N 2.78Å; A694-F698 PolarHBondContact O-N 3.19Å
695	I	95.5	Very high	92	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-61	-42.7	172.3	-67.1	167	0	0	0	111.2	L683 R691 I692 Y693 L697 F698 G699 L723 L727 M738 A741 L742 V745	L683-I695 HydrophobicContact CD2-CG1 3.93Å; R691-I695 WeakPolarHBondContact O-CG1 3.34Å; R691-I695 PolarHBondContact O-N 3.2Å; I692-I695 PolarHBondContact O-N 3.12Å; Y693-I695 VanDerWaalsContact C-N 3.35Å; Y693-I695 PolarHBondContact O-N 2.83Å; I695-L697 VanDerWaalsContact C-N 3.31Å; I695-L697 PolarHBondContact O-N 2.82Å; I695-F698 VanDerWaalsContact O-CB 3.29Å; I695-F698 WeakPolarHBondContact O-CB 3.39Å; I695-F698 PolarHBondContact O-N 3.31Å; I695-F698 VanDerWaalsContact O-N 3.16Å; I695-G699 PolarHBondContact O-N 3.05Å; I695-L723 HydrophobicContact CG1-CD1 4.41Å; I695-L727 HydrophobicContact CD1-CD1 4.18Å; I695-L727 HydrophobicContact CD1-CD2 4.15Å; I695-M738 HydrophobicContact CD1-CG 4.21Å; I695-M738 HydrophobicContact CD1-SD 3.11Å; I695-M738 WeakPolarHBondContact CD1-SD 3.35Å; I695-M738 HydrophobicContact CG1-SD 4.43Å; I695-A741 HydrophobicContact CB-CB 4.22Å; I695-A741 HydrophobicContact CD1-CB 4.41Å; I695-A741 HydrophobicContact CG2-CB 3.81Å; I695-L742 HydrophobicContact CD1-CD2 4.27Å; I695-L742 HydrophobicContact CD1-CG 4.3Å; I695-L742 HydrophobicContact CG1-CD2 4.45Å; I695-L742 HydrophobicContact CG2-CD2 3.77Å; I695-L742 HydrophobicContact CG2-CG 4.2Å; I695-V745 HydrophobicContact CG2-CG2 3.72Å; I695-V745 VanDerWaalsContact O-CG2 3.31Å; I695-V745 WeakPolarHBondContact O-CG2 3.36Å
696	K	95.7	Very high	91.2	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.009	12%	0.119	C	C	.	.	H	α-helix	trans	-62.1	-42	174.8	-71.6	169.5	175.5	-80.8	0	111.8	V656 I692 Y693 A694 G699 L700 E744 I750 S751 K753	V656-K696 HydrophobicContact CG1-CB 4.39Å; I692-K696 HydrophobicContact CG2-CD 4.39Å; I692-K696 WeakPolarHBondContact O-CG 3.39Å; I692-K696 PolarHBondContact O-N 3.07Å; Y693-K696 HydrophobicContact CD1-CD 3.93Å; Y693-K696 HydrophobicContact CE1-CD 4.21Å; Y693-K696 PolarHBondContact O-N 3.3Å; A694-K696 VanDerWaalsContact C-N 3.33Å; A694-K696 PolarHBondContact O-N 2.75Å; K696-G699 PolarHBondContact O-N 3.23Å; K696-L700 VanDerWaalsContact O-CG 3.3Å; K696-L700 WeakPolarHBondContact O-CG 3.45Å; K696-L700 PolarHBondContact O-N 2.94Å; K696-E744 IonicContact NZ-OE1 3Å; K696-E744 PolarHBondContact NZ-OE1 3.43Å; K696-E744 IonicContact NZ-OE2 3.28Å; K696-E744 PolarHBondContact NZ-OE2 3.37Å; K696-I750 HydrophobicContact CB-CG2 4.05Å; K696-I750 HydrophobicContact CG-CG2 4.15Å; K696-S751 PolarHBondContact NZ-O 3.28Å; K696-S751 PolarHBondContact NZ-OG 3.21Å; K696-K753 VanDerWaalsContact CE-O 3.24Å; K696-K753 WeakPolarHBondContact CE-O 3.29Å; K696-K753 PolarHBondContact NZ-O 3.13Å
697	L	95.5	Very high	90	Very high	0.333333 Å²	0.333333	25.5 Å²	25.5	0%	0.002	13%	0.127	C	C	.	.	H	α-helix	trans	-65	-36	173.3	-73.6	177	0	0	0	112.8	L652 L655 V656 L659 F670 V679 L682 Y693 A694 I695 L700 Y701	L652-L697 HydrophobicContact CD1-CD1 3.59Å; L652-L697 HydrophobicContact CD1-CG 4.47Å; L652-L697 HydrophobicContact CD2-CD1 4.14Å; L655-L697 HydrophobicContact CD2-CD1 4.09Å; L655-L697 HydrophobicContact CD2-CD2 3.99Å; L655-L697 HydrophobicContact CG-CD2 4.04Å; V656-L697 HydrophobicContact CG2-CD1 4.5Å; V656-L697 HydrophobicContact CG2-CD2 3.57Å; V656-L697 HydrophobicContact CG2-CG 3.71Å; L659-L697 HydrophobicContact CD1-CD2 3.59Å; F670-L697 HydrophobicContact CE1-CD2 4.46Å; F670-L697 HydrophobicContact CE2-CD2 4.34Å; F670-L697 HydrophobicContact CZ-CB 4.16Å; F670-L697 HydrophobicContact CZ-CD2 4.02Å; F670-L697 HydrophobicContact CZ-CG 4.45Å; V679-L697 HydrophobicContact CG2-CB 3.57Å; V679-L697 HydrophobicContact CG2-CD1 4.42Å; L682-L697 HydrophobicContact CD1-CD1 4.3Å; Y693-L697 WeakPolarHBondContact O-CG 3.38Å; Y693-L697 PolarHBondContact O-N 2.85Å; A694-L697 CarbonylContact O-C 3.58Å; A694-L697 WeakPolarHBondContact O-CB 3.41Å; A694-L697 PolarHBondContact O-N 2.78Å; I695-L697 VanDerWaalsContact C-N 3.31Å; I695-L697 PolarHBondContact O-N 2.82Å; L697-L700 HydrophobicContact CD2-CD1 4.37Å; L697-L700 PolarHBondContact O-N 3.31Å; L697-Y701 WeakPolarHBondContact O-CB 3.36Å; L697-Y701 PolarHBondContact O-N 3.23Å
698	F	94.5	Very high	88.2	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-59.3	-48.7	172.7	-177.4	-102.1	0	0	0	110.8	I676 V679 F680 A694 I695 L700 Y701 L702 L719 Y720 L723 V745	I676-F698 HydrophobicContact CD1-CD2 3.75Å; I676-F698 HydrophobicContact CD1-CE2 4.08Å; V679-F698 HydrophobicContact CG1-CB 3.88Å; V679-F698 HydrophobicContact CG1-CD2 4.33Å; F680-F698 HydrophobicContact CE2-CD2 4.49Å; F680-F698 HydrophobicContact CE2-CE2 4.4Å; F680-F698 HydrophobicContact CZ-CD2 4.38Å; F680-F698 HydrophobicContact CZ-CE2 4.14Å; A694-F698 PolarHBondContact O-N 3.19Å; I695-F698 VanDerWaalsContact O-CB 3.29Å; I695-F698 WeakPolarHBondContact O-CB 3.39Å; I695-F698 PolarHBondContact O-N 3.31Å; I695-F698 VanDerWaalsContact O-N 3.16Å; F698-L700 VanDerWaalsContact C-N 3.33Å; F698-L700 PolarHBondContact O-N 3.24Å; F698-Y701 VanDerWaalsContact O-CB 3.31Å; F698-Y701 WeakPolarHBondContact O-CB 3.33Å; F698-Y701 PolarHBondContact O-N 3.43Å; F698-Y701 VanDerWaalsContact O-N 3.15Å; F698-L702 HydrophobicContact CD1-CD1 4.02Å; F698-L702 HydrophobicContact CD1-CG 4.45Å; F698-L702 HydrophobicContact CE1-CD1 3.61Å; F698-L702 HydrophobicContact CE1-CD2 4.5Å; F698-L702 HydrophobicContact CE1-CG 4.19Å; F698-L702 HydrophobicContact CZ-CD1 4.26Å; F698-L702 HydrophobicContact CZ-CD2 4.34Å; F698-L702 HydrophobicContact CZ-CG 4.37Å; F698-L702 WeakPolarHBondContact O-CG 3.48Å; F698-L702 PolarHBondContact O-N 3.12Å; F698-L719 HydrophobicContact CE2-CB 4.11Å; F698-L719 HydrophobicContact CZ-CB 4.3Å; F698-Y720 HydrophobicContact CE1-CD1 4.04Å; F698-Y720 AromaticContact CE1-CE1 3.89Å; F698-Y720 HydrophobicContact CE1-CE1 3.89Å; F698-Y720 HydrophobicContact CZ-CD1 4.07Å; F698-Y720 AromaticContact CZ-CE1 3.99Å; F698-Y720 HydrophobicContact CZ-CE1 4.11Å; F698-L723 HydrophobicContact CD1-CD2 3.92Å; F698-L723 HydrophobicContact CE1-CD2 3.77Å; F698-L723 HydrophobicContact CG-CD2 4.45Å; F698-L723 HydrophobicContact CZ-CD2 4.28Å; F698-V745 HydrophobicContact CD1-CG1 4.21Å
699	G	92.4	Very high	86.3	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.3	-36.8	176.2	0	0	0	0	0	113.7	I695 K696 Y701 L702 I703 I750	I695-G699 PolarHBondContact O-N 3.05Å; K696-G699 PolarHBondContact O-N 3.23Å; G699-Y701 VanDerWaalsContact C-N 3.31Å; G699-Y701 PolarHBondContact O-N 2.88Å; G699-L702 WeakPolarHBondContact O-CB 3.42Å; G699-L702 PolarHBondContact O-N 3.01Å; G699-L702 VanDerWaalsContact O-N 3.14Å; G699-I703 VanDerWaalsContact O-CG1 3.32Å; G699-I703 WeakPolarHBondContact O-CG1 3.24Å; G699-I703 PolarHBondContact O-N 3.04Å; G699-I750 VanDerWaalsContact CA-CD1 3.47Å
700	L	92.8	Very high	84.3	Confident	3 Å²	3	28.2 Å²	28.2	2%	0.016	15%	0.146	C	C	.	.	H	α-helix	trans	-64.9	-38.7	174	-70.7	165.4	0	0	0	111.3	V656 L659 V660 K696 L697 F698 L702 I703 Y704 I750	V656-L700 HydrophobicContact CG1-CD1 4.14Å; L659-L700 HydrophobicContact CB-CD1 3.92Å; L659-L700 HydrophobicContact CD1-CD1 4.14Å; V660-L700 HydrophobicContact CG2-CD1 4.22Å; V660-L700 HydrophobicContact CG2-CD2 3.9Å; K696-L700 VanDerWaalsContact O-CG 3.3Å; K696-L700 WeakPolarHBondContact O-CG 3.45Å; K696-L700 PolarHBondContact O-N 2.94Å; L697-L700 HydrophobicContact CD2-CD1 4.37Å; L697-L700 PolarHBondContact O-N 3.31Å; F698-L700 VanDerWaalsContact C-N 3.33Å; F698-L700 PolarHBondContact O-N 3.24Å; L700-L702 VanDerWaalsContact C-N 3.32Å; L700-L702 PolarHBondContact O-N 3Å; L700-I703 HydrophobicContact CD2-CD1 4.49Å; L700-I703 PolarHBondContact O-N 3.23Å; L700-Y704 HydrophobicContact CB-CD2 4.4Å; L700-Y704 HydrophobicContact CB-CE2 4.01Å; L700-Y704 HydrophobicContact CD2-CE2 3.88Å; L700-Y704 WeakPolarHBondContact CD2-OH 3.45Å; L700-Y704 HydrophobicContact CG-CE2 4.47Å; L700-Y704 WeakPolarHBondContact O-CD2 3.27Å; L700-Y704 PolarHBondContact O-N 3.3Å; L700-Y704 VanDerWaalsContact O-N 3.08Å; L700-I750 HydrophobicContact CB-CD1 4.45Å; L700-I750 HydrophobicContact CD1-CG2 4.49Å; L700-I750 HydrophobicContact CD2-CB 4.37Å; L700-I750 HydrophobicContact CD2-CD1 4.21Å; L700-I750 HydrophobicContact CD2-CG2 4.43Å; L700-I750 HydrophobicContact CG-CD1 3.97Å; L700-I750 HydrophobicContact CG-CG2 4.25Å; L700-I750 VanDerWaalsContact N-CD1 3.34Å
701	Y	91.8	Very high	82.2	Confident	14.6667 Å²	14.6667	30.9 Å²	30.9	6%	0.058	17%	0.174	C	C	.	.	H	α-helix	trans	-59.6	-42.9	171.8	-173.6	-94	0	0	0	111.7	F670 V671 I676 L697 F698 G699 G705 V709	F670-Y701 HydrophobicContact CD1-CD2 4.41Å; F670-Y701 HydrophobicContact CE1-CD2 4.22Å; V671-Y701 HydrophobicContact CB-CD2 4.47Å; V671-Y701 HydrophobicContact CB-CE2 4.24Å; V671-Y701 HydrophobicContact CG1-CE2 4.02Å; V671-Y701 HydrophobicContact CG2-CD2 3.98Å; V671-Y701 HydrophobicContact CG2-CE2 4.15Å; I676-Y701 HydrophobicContact CB-CD1 4.31Å; I676-Y701 HydrophobicContact CB-CD2 4.01Å; I676-Y701 HydrophobicContact CB-CE1 4.19Å; I676-Y701 HydrophobicContact CB-CE2 3.8Å; I676-Y701 HydrophobicContact CB-CG 4.3Å; I676-Y701 HydrophobicContact CD1-CD1 3.96Å; I676-Y701 HydrophobicContact CD1-CE1 4.33Å; I676-Y701 HydrophobicContact CD1-CG 4.15Å; I676-Y701 HydrophobicContact CG1-CD1 4.35Å; I676-Y701 HydrophobicContact CG1-CE1 4.24Å; I676-Y701 HydrophobicContact CG2-CE1 4.44Å; I676-Y701 HydrophobicContact CG2-CE2 4.14Å; L697-Y701 WeakPolarHBondContact O-CB 3.36Å; L697-Y701 PolarHBondContact O-N 3.23Å; F698-Y701 VanDerWaalsContact O-CB 3.31Å; F698-Y701 WeakPolarHBondContact O-CB 3.33Å; F698-Y701 PolarHBondContact O-N 3.43Å; F698-Y701 VanDerWaalsContact O-N 3.15Å; G699-Y701 VanDerWaalsContact C-N 3.31Å; G699-Y701 PolarHBondContact O-N 2.88Å; Y701-G705 WeakPolarHBondContact O-CA 3.34Å; Y701-G705 PolarHBondContact O-N 3.27Å; Y701-V709 HydrophobicContact CE1-CG1 4.15Å
702	L	88.9	Confident	80.4	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-63	-47.1	175.4	-66.6	179.2	0	0	0	112.2	F698 G699 L700 Y704 G705 K706 Y710 I714 Y720 V745 N770	F698-L702 HydrophobicContact CD1-CD1 4.02Å; F698-L702 HydrophobicContact CD1-CG 4.45Å; F698-L702 HydrophobicContact CE1-CD1 3.61Å; F698-L702 HydrophobicContact CE1-CD2 4.5Å; F698-L702 HydrophobicContact CE1-CG 4.19Å; F698-L702 HydrophobicContact CZ-CD1 4.26Å; F698-L702 HydrophobicContact CZ-CD2 4.34Å; F698-L702 HydrophobicContact CZ-CG 4.37Å; F698-L702 WeakPolarHBondContact O-CG 3.48Å; F698-L702 PolarHBondContact O-N 3.12Å; G699-L702 WeakPolarHBondContact O-CB 3.42Å; G699-L702 PolarHBondContact O-N 3.01Å; G699-L702 VanDerWaalsContact O-N 3.14Å; L700-L702 VanDerWaalsContact C-N 3.32Å; L700-L702 PolarHBondContact O-N 3Å; L702-Y704 VanDerWaalsContact C-N 3.32Å; L702-Y704 PolarHBondContact O-N 3.14Å; L702-G705 PolarHBondContact O-N 2.99Å; L702-K706 WeakPolarHBondContact O-CG 3.37Å; L702-K706 PolarHBondContact O-N 3.46Å; L702-Y710 WeakPolarHBondContact CB-OH 3.44Å; L702-Y710 HydrophobicContact CD2-CE2 4.33Å; L702-Y710 WeakPolarHBondContact O-CE2 3.35Å; L702-Y710 PolarHBondContact O-OH 3.41Å; L702-I714 HydrophobicContact CD2-CD1 3.66Å; L702-I714 HydrophobicContact CD2-CG1 4.26Å; L702-Y720 HydrophobicContact CD1-CE1 3.91Å; L702-Y720 WeakPolarHBondContact CD1-OH 3.4Å; L702-V745 HydrophobicContact CD1-CG1 3.88Å; L702-N770 HydrophobicContact CD1-CB 4.42Å
703	I	89.1	Confident	78.7	Confident	44.6667 Å²	44.6667	37 Å²	37	23%	0.229	21%	0.211	C	C	.	.	H	α-helix	trans	-58.2	-49	179.8	-69.7	168.9	0	0	0	111.1	G699 L700 E748 I750	G699-I703 VanDerWaalsContact O-CG1 3.32Å; G699-I703 WeakPolarHBondContact O-CG1 3.24Å; G699-I703 PolarHBondContact O-N 3.04Å; L700-I703 HydrophobicContact CD2-CD1 4.49Å; L700-I703 PolarHBondContact O-N 3.23Å; I703-E748 HydrophobicContact CD1-CB 3.81Å; I703-E748 HydrophobicContact CD1-CG 4.21Å; I703-E748 HydrophobicContact CG1-CB 3.84Å; I703-E748 HydrophobicContact CG1-CG 3.74Å; I703-I750 HydrophobicContact CD1-CD1 3.59Å; I703-I750 HydrophobicContact CD1-CG1 4.09Å
704	Y	87.8	Confident	77.3	Confident	31.6667 Å²	31.6667	36.9 Å²	36.9	12%	0.124	21%	0.211	C	C	.	.	H	α-helix	trans	-82.1	-23.4	-176.3	-54.7	-47.7	0	0	0	113.5	L659 P663 G667 L700 L702 K706 T707	L659-Y704 HydrophobicContact CB-CE2 4.4Å; L659-Y704 HydrophobicContact CD2-CE2 4.23Å; L659-Y704 PolarHBondContact O-OH 3.11Å; P663-Y704 WeakPolarHBondContact CA-OH 3.45Å; P663-Y704 HydrophobicContact CB-CE1 3.53Å; P663-Y704 WeakPolarHBondContact CB-OH 3.17Å; G667-Y704 VanDerWaalsContact CA-CG 3.46Å; L700-Y704 HydrophobicContact CB-CD2 4.4Å; L700-Y704 HydrophobicContact CB-CE2 4.01Å; L700-Y704 HydrophobicContact CD2-CE2 3.88Å; L700-Y704 WeakPolarHBondContact CD2-OH 3.45Å; L700-Y704 HydrophobicContact CG-CE2 4.47Å; L700-Y704 WeakPolarHBondContact O-CD2 3.27Å; L700-Y704 PolarHBondContact O-N 3.3Å; L700-Y704 VanDerWaalsContact O-N 3.08Å; L702-Y704 VanDerWaalsContact C-N 3.32Å; L702-Y704 PolarHBondContact O-N 3.14Å; Y704-K706 VanDerWaalsContact C-N 3.31Å; Y704-K706 PolarHBondContact O-N 3.35Å; Y704-T707 PolarHBondContact O-N 2.68Å; Y704-T707 PolarHBondContact O-OG1 2.69Å
705	G	78.8	Confident	75.9	Confident	3.33333 Å²	3.33333	44.5 Å²	44.5	3%	0.034	25%	0.247	C	C	.	.	H	α-helix	trans	-69.5	-19	178.9	0	0	0	0	0	114.3	Y701 L702 T707 S708 V709	Y701-G705 WeakPolarHBondContact O-CA 3.34Å; Y701-G705 PolarHBondContact O-N 3.27Å; L702-G705 PolarHBondContact O-N 2.99Å; G705-T707 VanDerWaalsContact C-N 3.32Å; G705-T707 PolarHBondContact O-N 3.03Å; G705-T707 VanDerWaalsContact O-N 3.07Å; G705-S708 PolarHBondContact O-N 3.24Å; G705-S708 VanDerWaalsContact O-N 3.14Å; G705-S708 PolarHBondContact O-OG 2.97Å; G705-V709 WeakPolarHBondContact O-CA 3.41Å; G705-V709 VanDerWaalsContact O-CB 3.3Å; G705-V709 WeakPolarHBondContact O-CB 3.43Å; G705-V709 PolarHBondContact O-N 3.36Å
706	K	73.6	Confident	74.4	Confident	97 Å²	97	48 Å²	48	42%	0.422	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-34.5	-175.8	-71.5	-178.7	177.9	-177.4	0	114.9	L702 Y704 Y710 E748 N770	L702-K706 WeakPolarHBondContact O-CG 3.37Å; L702-K706 PolarHBondContact O-N 3.46Å; Y704-K706 VanDerWaalsContact C-N 3.31Å; Y704-K706 PolarHBondContact O-N 3.35Å; K706-Y710 VanDerWaalsContact CA-CD2 3.48Å; K706-Y710 HydrophobicContact CB-CD2 4.37Å; K706-Y710 HydrophobicContact CB-CE2 4.47Å; K706-Y710 HydrophobicContact CG-CD2 4.01Å; K706-Y710 HydrophobicContact CG-CE1 4.32Å; K706-Y710 HydrophobicContact CG-CE2 4.01Å; K706-Y710 HydrophobicContact CG-CG 4.45Å; K706-E748 WeakPolarHBondContact CE-OE1 3.37Å; K706-E748 IonicContact NZ-OE1 3.07Å; K706-E748 PolarHBondContact NZ-OE1 3.21Å; K706-E748 IonicContact NZ-OE2 3.7Å; K706-E748 PolarHBondContact NZ-OE2 3.31Å; K706-N770 PolarHBondContact NZ-OD1 3.48Å
707	T	60.3	Low	73.3	Confident	136.333 Å²	136.333	53.6 Å²	53.6	84%	0.836	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-9.4	-179.3	43.6	0	0	0	0	114.3	Y704 G705	Y704-T707 PolarHBondContact O-N 2.68Å; Y704-T707 PolarHBondContact O-OG1 2.69Å; G705-T707 VanDerWaalsContact C-N 3.32Å; G705-T707 PolarHBondContact O-N 3.03Å; G705-T707 VanDerWaalsContact O-N 3.07Å
708	S	54.9	Low	72.8	Confident	67.3333 Å²	67.3333	55.3 Å²	55.3	47%	0.471	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.8	-25.7	-172.2	60.2	0	0	0	0	114.2	G705 Y710	G705-S708 PolarHBondContact O-N 3.24Å; G705-S708 VanDerWaalsContact O-N 3.14Å; G705-S708 PolarHBondContact O-OG 2.97Å; S708-Y710 PolarHBondContact O-N 2.89Å; S708-Y710 WeakPolarHBondContact OG-CD2 3.49Å
709	V	52.1	Low	72.4	Confident	54 Å²	54	55.9 Å²	55.9	33%	0.327	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-15.9	-171.1	-177.4	0	0	0	0	113.3	V671 Y701 G705 G711 N712 A713 I714	V671-V709 HydrophobicContact CG1-CG2 3.6Å; Y701-V709 HydrophobicContact CE1-CG1 4.15Å; G705-V709 WeakPolarHBondContact O-CA 3.41Å; G705-V709 VanDerWaalsContact O-CB 3.3Å; G705-V709 WeakPolarHBondContact O-CB 3.43Å; G705-V709 PolarHBondContact O-N 3.36Å; V709-G711 VanDerWaalsContact C-N 3.31Å; V709-G711 CarbonylContact O-C 3.55Å; V709-G711 PolarHBondContact O-N 2.92Å; V709-G711 VanDerWaalsContact O-N 3.09Å; V709-N712 PolarHBondContact O-N 3.47Å; V709-A713 HydrophobicContact CG1-CB 3.63Å; V709-A713 PolarHBondContact O-N 3.05Å; V709-I714 HydrophobicContact CG1-CG1 4.32Å
710	Y	51.1	Low	72.2	Confident	100 Å²	100	57.7 Å²	57.7	39%	0.392	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	0.2	-175.5	-85.7	-92.5	0	0	0	115.5	V671 L702 K706 S708 N712 A713 I714 N770	V671-Y710 HydrophobicContact CG1-CD2 4.17Å; L702-Y710 WeakPolarHBondContact CB-OH 3.44Å; L702-Y710 HydrophobicContact CD2-CE2 4.33Å; L702-Y710 WeakPolarHBondContact O-CE2 3.35Å; L702-Y710 PolarHBondContact O-OH 3.41Å; K706-Y710 VanDerWaalsContact CA-CD2 3.48Å; K706-Y710 HydrophobicContact CB-CD2 4.37Å; K706-Y710 HydrophobicContact CB-CE2 4.47Å; K706-Y710 HydrophobicContact CG-CD2 4.01Å; K706-Y710 HydrophobicContact CG-CE1 4.32Å; K706-Y710 HydrophobicContact CG-CE2 4.01Å; K706-Y710 HydrophobicContact CG-CG 4.45Å; S708-Y710 PolarHBondContact O-N 2.89Å; S708-Y710 WeakPolarHBondContact OG-CD2 3.49Å; Y710-N712 PolarHBondContact O-N 3.21Å; Y710-A713 WeakPolarHBondContact O-CB 3.42Å; Y710-A713 PolarHBondContact O-N 3.22Å; Y710-I714 HydrophobicContact CD1-CD1 3.9Å; Y710-I714 HydrophobicContact CD2-CD1 3.75Å; Y710-I714 VanDerWaalsContact CD2-CD1 3.49Å; Y710-I714 HydrophobicContact CE1-CD1 4.07Å; Y710-I714 HydrophobicContact CE2-CD1 3.49Å; Y710-I714 VanDerWaalsContact CE2-CD1 3.45Å; Y710-I714 HydrophobicContact CG-CD1 3.74Å; Y710-N770 PolarHBondContact OH-OD1 3.18Å; Y710-N770 VanDerWaalsContact OH-OD1 3.1Å
711	G	50.9	Low	72	Confident	58 Å²	58	60.2 Å²	60.2	60%	0.598	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-5.9	170.9	0	0	0	0	0	112.7	V709 A713	V709-G711 VanDerWaalsContact C-N 3.31Å; V709-G711 CarbonylContact O-C 3.55Å; V709-G711 PolarHBondContact O-N 2.92Å; V709-G711 VanDerWaalsContact O-N 3.09Å; G711-A713 VanDerWaalsContact C-N 3.27Å; G711-A713 PolarHBondContact O-N 3.36Å; G711-A713 VanDerWaalsContact O-N 3.16Å
712	N	55.4	Low	71.8	Confident	121 Å²	121	61.5 Å²	61.5	65%	0.647	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-28.3	175.7	-65	6.4	0	0	0	115.7	V709 Y710 I714 E715 S716	V709-N712 PolarHBondContact O-N 3.47Å; Y710-N712 PolarHBondContact O-N 3.21Å; N712-I714 VanDerWaalsContact C-N 3.3Å; N712-I714 PolarHBondContact O-N 3.25Å; N712-E715 PolarHBondContact O-N 3.4Å; N712-S716 WeakPolarHBondContact O-CA 3.39Å; N712-S716 WeakPolarHBondContact O-CB 3.36Å; N712-S716 PolarHBondContact O-N 3.22Å; N712-S716 PolarHBondContact O-OG 3.21Å
713	A	59.3	Low	71.9	Confident	21 Å²	21	61.4 Å²	61.4	17%	0.174	35%	0.346	C	S	.	.	H	α-helix	trans	-69	-35.1	-166.6	0	0	0	0	0	113.9	V709 Y710 G711 E715 S716 F717	V709-A713 HydrophobicContact CG1-CB 3.63Å; V709-A713 PolarHBondContact O-N 3.05Å; Y710-A713 WeakPolarHBondContact O-CB 3.42Å; Y710-A713 PolarHBondContact O-N 3.22Å; G711-A713 VanDerWaalsContact C-N 3.27Å; G711-A713 PolarHBondContact O-N 3.36Å; G711-A713 VanDerWaalsContact O-N 3.16Å; A713-E715 VanDerWaalsContact C-N 3.34Å; A713-E715 PolarHBondContact O-N 3.17Å; A713-S716 VanDerWaalsContact CA-OG 3.28Å; A713-S716 WeakPolarHBondContact CA-OG 3.32Å; A713-S716 PolarHBondContact O-N 3.33Å; A713-S716 PolarHBondContact O-OG 3.43Å; A713-F717 HydrophobicContact CB-CD2 4.22Å; A713-F717 HydrophobicContact CB-CE2 4.28Å; A713-F717 WeakPolarHBondContact O-CB 3.37Å; A713-F717 WeakPolarHBondContact O-CD2 3.44Å; A713-F717 PolarHBondContact O-N 3.21Å; A713-F717 VanDerWaalsContact O-N 3.07Å
714	I	66	Low	71.9	Confident	19 Å²	19	60.5 Å²	60.5	10%	0.097	34%	0.34	C	S	.	.	H	α-helix	trans	-67.4	-41.1	-178.7	-62.6	167.4	0	0	0	110.7	L702 V709 Y710 N712 A718 L719 Y720	L702-I714 HydrophobicContact CD2-CD1 3.66Å; L702-I714 HydrophobicContact CD2-CG1 4.26Å; V709-I714 HydrophobicContact CG1-CG1 4.32Å; Y710-I714 HydrophobicContact CD1-CD1 3.9Å; Y710-I714 HydrophobicContact CD2-CD1 3.75Å; Y710-I714 VanDerWaalsContact CD2-CD1 3.49Å; Y710-I714 HydrophobicContact CE1-CD1 4.07Å; Y710-I714 HydrophobicContact CE2-CD1 3.49Å; Y710-I714 VanDerWaalsContact CE2-CD1 3.45Å; Y710-I714 HydrophobicContact CG-CD1 3.74Å; N712-I714 VanDerWaalsContact C-N 3.3Å; N712-I714 PolarHBondContact O-N 3.25Å; I714-A718 PolarHBondContact O-N 2.99Å; I714-L719 HydrophobicContact CB-CD1 4.46Å; I714-L719 HydrophobicContact CG1-CD1 4.23Å; I714-L719 HydrophobicContact CG2-CB 4.48Å; I714-L719 PolarHBondContact O-N 3.25Å; I714-L719 VanDerWaalsContact O-N 3.14Å; I714-Y720 HydrophobicContact CG2-CD2 4.02Å; I714-Y720 HydrophobicContact CG2-CE2 3.49Å; I714-Y720 VanDerWaalsContact CG2-CE2 3.44Å
715	E	66.8	Low	71.9	Confident	160 Å²	160	63.5 Å²	63.5	75%	0.748	36%	0.355	S	S	*	.	H	α-helix	trans	-80.9	-33.6	178.7	-64.2	-179.5	175	0	0	112.3	N712 A713 F717 A718	N712-E715 PolarHBondContact O-N 3.4Å; A713-E715 VanDerWaalsContact C-N 3.34Å; A713-E715 PolarHBondContact O-N 3.17Å; E715-F717 VanDerWaalsContact C-N 3.27Å; E715-F717 PolarHBondContact O-N 3.22Å; E715-A718 PolarHBondContact O-N 3.25Å
716	S	64.2	Low	72.3	Confident	73 Å²	73	67.6 Å²	67.6	51%	0.51	37%	0.37	S	S	.	.	H	α-helix	trans	-70.1	-28	179.9	-29.4	0	0	0	0	113.5	N712 A713	N712-S716 WeakPolarHBondContact O-CA 3.39Å; N712-S716 WeakPolarHBondContact O-CB 3.36Å; N712-S716 PolarHBondContact O-N 3.22Å; N712-S716 PolarHBondContact O-OG 3.21Å; A713-S716 VanDerWaalsContact CA-OG 3.28Å; A713-S716 WeakPolarHBondContact CA-OG 3.32Å; A713-S716 PolarHBondContact O-N 3.33Å; A713-S716 PolarHBondContact O-OG 3.43Å
717	F	73.3	Confident	73.1	Confident	120.333 Å²	120.333	63.1 Å²	63.1	53%	0.528	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	9.5	179.6	-61.6	-63.3	0	0	0	113.1	A713 E715 L719 L722	A713-F717 HydrophobicContact CB-CD2 4.22Å; A713-F717 HydrophobicContact CB-CE2 4.28Å; A713-F717 WeakPolarHBondContact O-CB 3.37Å; A713-F717 WeakPolarHBondContact O-CD2 3.44Å; A713-F717 PolarHBondContact O-N 3.21Å; A713-F717 VanDerWaalsContact O-N 3.07Å; E715-F717 VanDerWaalsContact C-N 3.27Å; E715-F717 PolarHBondContact O-N 3.22Å; F717-L719 HydrophobicContact CB-CD2 3.57Å; F717-L719 HydrophobicContact CB-CG 4.1Å; F717-L719 PolarHBondContact O-N 3.24Å; F717-L719 VanDerWaalsContact O-N 3.12Å; F717-L722 VanDerWaalsContact O-CD1 3.24Å; F717-L722 WeakPolarHBondContact O-CD1 3.38Å
718	A	83.7	Confident	74.3	Confident	36.6667 Å²	36.6667	58.6 Å²	58.6	30%	0.303	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.8	44.4	-179.5	0	0	0	0	0	113.9	I714 E715 Y720 S721 L722	I714-A718 PolarHBondContact O-N 2.99Å; E715-A718 PolarHBondContact O-N 3.25Å; A718-Y720 PolarHBondContact O-N 3.09Å; A718-Y720 VanDerWaalsContact O-N 3.08Å; A718-S721 WeakPolarHBondContact O-CA 3.36Å; A718-S721 WeakPolarHBondContact O-CB 3.28Å; A718-S721 PolarHBondContact O-N 3.04Å; A718-L722 PolarHBondContact O-N 3.12Å; A718-L722 VanDerWaalsContact O-N 3.08Å
719	L	87	Confident	75.6	Confident	12.3333 Å²	12.3333	59.2 Å²	59.2	7%	0.065	33%	0.325	C	S	.	.	H	α-helix	trans	-59.1	-28.6	-163.4	-63.2	-176.4	0	0	0	114.4	I676 F680 F698 I714 F717 L722 L723	I676-L719 HydrophobicContact CD1-CD1 4.4Å; I676-L719 HydrophobicContact CG1-CD1 4.2Å; F680-L719 HydrophobicContact CE2-CD2 3.96Å; F680-L719 HydrophobicContact CZ-CB 4.35Å; F680-L719 HydrophobicContact CZ-CD2 4.28Å; F698-L719 HydrophobicContact CE2-CB 4.11Å; F698-L719 HydrophobicContact CZ-CB 4.3Å; I714-L719 HydrophobicContact CB-CD1 4.46Å; I714-L719 HydrophobicContact CG1-CD1 4.23Å; I714-L719 HydrophobicContact CG2-CB 4.48Å; I714-L719 PolarHBondContact O-N 3.25Å; I714-L719 VanDerWaalsContact O-N 3.14Å; F717-L719 HydrophobicContact CB-CD2 3.57Å; F717-L719 HydrophobicContact CB-CG 4.1Å; F717-L719 PolarHBondContact O-N 3.24Å; F717-L719 VanDerWaalsContact O-N 3.12Å; L719-L722 HydrophobicContact CD2-CD1 4.4Å; L719-L722 HydrophobicContact CD2-CD2 4.41Å; L719-L722 PolarHBondContact O-N 2.67Å; L719-L723 WeakPolarHBondContact O-CB 3.47Å; L719-L723 PolarHBondContact O-N 3.28Å; L719-L723 VanDerWaalsContact O-N 3.08Å
720	Y	89.2	Confident	76.7	Confident	37.6667 Å²	37.6667	58.7 Å²	58.7	15%	0.148	32%	0.323	C	S	.	.	H	α-helix	trans	-70.5	-39.2	174.2	-63.8	-72.4	0	0	0	112.7	F698 L702 I714 A718 L722 L723 E724 A772 V773 V776	F698-Y720 HydrophobicContact CE1-CD1 4.04Å; F698-Y720 AromaticContact CE1-CE1 3.89Å; F698-Y720 HydrophobicContact CE1-CE1 3.89Å; F698-Y720 HydrophobicContact CZ-CD1 4.07Å; F698-Y720 AromaticContact CZ-CE1 3.99Å; F698-Y720 HydrophobicContact CZ-CE1 4.11Å; L702-Y720 HydrophobicContact CD1-CE1 3.91Å; L702-Y720 WeakPolarHBondContact CD1-OH 3.4Å; I714-Y720 HydrophobicContact CG2-CD2 4.02Å; I714-Y720 HydrophobicContact CG2-CE2 3.49Å; I714-Y720 VanDerWaalsContact CG2-CE2 3.44Å; A718-Y720 PolarHBondContact O-N 3.09Å; A718-Y720 VanDerWaalsContact O-N 3.08Å; Y720-L722 VanDerWaalsContact C-N 3.33Å; Y720-L723 WeakPolarHBondContact O-CB 3.31Å; Y720-L723 PolarHBondContact O-N 3.3Å; Y720-E724 PolarHBondContact O-N 3.18Å; Y720-E724 VanDerWaalsContact O-N 3.1Å; Y720-A772 HydrophobicContact CD1-CB 4.06Å; Y720-A772 HydrophobicContact CD2-CB 3.55Å; Y720-A772 HydrophobicContact CE1-CB 4.13Å; Y720-A772 HydrophobicContact CE2-CB 3.62Å; Y720-A772 HydrophobicContact CG-CB 3.77Å; Y720-V773 HydrophobicContact CD1-CG2 4.12Å; Y720-V773 HydrophobicContact CE1-CG2 3.7Å; Y720-V776 WeakPolarHBondContact O-CG2 3.36Å
721	S	87.2	Confident	77.6	Confident	55.3333 Å²	55.3333	55.3 Å²	55.3	39%	0.387	31%	0.314	S	S	.	.	H	α-helix	trans	-69.3	-36.2	174.9	-137	0	0	0	0	111.2	A718 L723 E724 E725	A718-S721 WeakPolarHBondContact O-CA 3.36Å; A718-S721 WeakPolarHBondContact O-CB 3.28Å; A718-S721 PolarHBondContact O-N 3.04Å; S721-L723 VanDerWaalsContact C-N 3.32Å; S721-L723 PolarHBondContact O-N 3.25Å; S721-E724 WeakPolarHBondContact O-CB 3.4Å; S721-E724 PolarHBondContact O-N 3.35Å; S721-E725 WeakPolarHBondContact O-CB 3.34Å; S721-E725 PolarHBondContact O-N 2.91Å
722	L	87.9	Confident	78.5	Confident	41.6667 Å²	41.6667	55.4 Å²	55.4	22%	0.218	31%	0.305	C	S	.	.	H	α-helix	trans	-66.7	-34.3	173	-142.8	94.3	0	0	0	111.9	F680 F717 A718 L719 Y720 R726	F680-L722 HydrophobicContact CD1-CB 4.45Å; F680-L722 HydrophobicContact CD1-CD2 3.82Å; F680-L722 HydrophobicContact CD1-CG 3.87Å; F680-L722 HydrophobicContact CD2-CD2 4.29Å; F680-L722 HydrophobicContact CE1-CB 3.82Å; F680-L722 HydrophobicContact CE1-CD2 3.68Å; F680-L722 HydrophobicContact CE1-CG 3.54Å; F680-L722 HydrophobicContact CE2-CD2 4.17Å; F680-L722 HydrophobicContact CG-CD2 4.13Å; F680-L722 HydrophobicContact CZ-CB 4.03Å; F680-L722 HydrophobicContact CZ-CD2 3.87Å; F680-L722 HydrophobicContact CZ-CG 4.08Å; F717-L722 VanDerWaalsContact O-CD1 3.24Å; F717-L722 WeakPolarHBondContact O-CD1 3.38Å; A718-L722 PolarHBondContact O-N 3.12Å; A718-L722 VanDerWaalsContact O-N 3.08Å; L719-L722 HydrophobicContact CD2-CD1 4.4Å; L719-L722 HydrophobicContact CD2-CD2 4.41Å; L719-L722 PolarHBondContact O-N 2.67Å; Y720-L722 VanDerWaalsContact C-N 3.33Å; L722-R726 HydrophobicContact CD1-CG 4.23Å; L722-R726 HydrophobicContact CG-CG 4.31Å; L722-R726 VanDerWaalsContact O-CB 3.31Å; L722-R726 WeakPolarHBondContact O-CB 3.32Å; L722-R726 WeakPolarHBondContact O-CG 3.1Å; L722-R726 PolarHBondContact O-N 2.99Å; L722-R726 VanDerWaalsContact O-N 3.09Å
723	L	91.2	Very high	79.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63.8	-44.6	173.8	176.2	64.7	0	0	0	111.1	F680 L683 I695 F698 L719 Y720 S721 L727 L742 V776	F680-L723 HydrophobicContact CE1-CB 4.46Å; L683-L723 HydrophobicContact CD1-CD1 3.57Å; L683-L723 HydrophobicContact CD2-CD1 3.94Å; L683-L723 HydrophobicContact CG-CD1 4.44Å; I695-L723 HydrophobicContact CG1-CD1 4.41Å; F698-L723 HydrophobicContact CD1-CD2 3.92Å; F698-L723 HydrophobicContact CE1-CD2 3.77Å; F698-L723 HydrophobicContact CG-CD2 4.45Å; F698-L723 HydrophobicContact CZ-CD2 4.28Å; L719-L723 WeakPolarHBondContact O-CB 3.47Å; L719-L723 PolarHBondContact O-N 3.28Å; L719-L723 VanDerWaalsContact O-N 3.08Å; Y720-L723 WeakPolarHBondContact O-CB 3.31Å; Y720-L723 PolarHBondContact O-N 3.3Å; S721-L723 VanDerWaalsContact C-N 3.32Å; S721-L723 PolarHBondContact O-N 3.25Å; L723-L727 HydrophobicContact CD1-CD1 3.9Å; L723-L727 HydrophobicContact CD1-CG 4.29Å; L723-L727 HydrophobicContact CG-CD1 4.11Å; L723-L727 WeakPolarHBondContact O-CB 3.4Å; L723-L727 VanDerWaalsContact O-CG 3.29Å; L723-L727 WeakPolarHBondContact O-CG 3.36Å; L723-L727 PolarHBondContact O-N 2.99Å; L723-L727 VanDerWaalsContact O-N 3.08Å; L723-L742 HydrophobicContact CD2-CD2 3.98Å; L723-V776 HydrophobicContact CD2-CG1 4.39Å; L723-V776 HydrophobicContact CG-CG1 4.42Å
724	E	89.4	Confident	80.9	Confident	24.6667 Å²	24.6667	55 Å²	55	12%	0.115	30%	0.295	C	S	.	.	H	α-helix	trans	-59.1	-54.5	174.3	-172.3	-169.1	141	0	0	111.6	Y720 S721 R726 L727 N728 V776 H779 L780 Q783	Y720-E724 PolarHBondContact O-N 3.18Å; Y720-E724 VanDerWaalsContact O-N 3.1Å; S721-E724 WeakPolarHBondContact O-CB 3.4Å; S721-E724 PolarHBondContact O-N 3.35Å; E724-R726 VanDerWaalsContact C-N 3.31Å; E724-R726 PolarHBondContact O-N 3.03Å; E724-L727 PolarHBondContact O-N 3.27Å; E724-N728 PolarHBondContact O-N 3.38Å; E724-N728 VanDerWaalsContact O-N 3.1Å; E724-N728 PolarHBondContact O-ND2 3.34Å; E724-V776 HydrophobicContact CB-CG1 4.14Å; E724-H779 VanDerWaalsContact CD-CB 3.41Å; E724-H779 HydrophobicContact CG-CB 4.07Å; E724-H779 WeakPolarHBondContact OE1-CB 3.35Å; E724-H779 IonicContact OE1-CD2 3.13Å; E724-H779 PolarHBondContact OE1-CD2 3.13Å; E724-H779 IonicContact OE1-CG 3.56Å; E724-H779 IonicContact OE2-CD2 2.66Å; E724-H779 PolarHBondContact OE2-CD2 3.31Å; E724-H779 IonicContact OE2-CG 3.18Å; E724-L780 HydrophobicContact CG-CD2 4.43Å; E724-Q783 PolarHBondContact OE1-NE2 3.06Å
725	E	87.9	Confident	82	Confident	94 Å²	94	54.9 Å²	54.9	44%	0.439	30%	0.296	S	S	.	.	H	α-helix	trans	-55.7	-44.3	-179.6	-172.6	-163.3	141.7	0	0	111.8	S721 N728 S729	S721-E725 WeakPolarHBondContact O-CB 3.34Å; S721-E725 PolarHBondContact O-N 2.91Å; E725-N728 PolarHBondContact O-N 3.03Å; E725-S729 VanDerWaalsContact O-CB 3.26Å; E725-S729 WeakPolarHBondContact O-CB 3.42Å; E725-S729 PolarHBondContact O-N 3.34Å; E725-S729 PolarHBondContact O-OG 3.42Å
726	R	88	Confident	83	Confident	89.6667 Å²	89.6667	49.7 Å²	49.7	34%	0.338	28%	0.277	S	S	.	.	H	α-helix	trans	-73.2	-33.4	-175.9	-66.5	-71.7	165.8	-166.6	-8.1	113.1	F680 L683 L722 E724 N728 S729 T730	F680-R726 HydrophobicContact CD1-CG 4.15Å; L683-R726 HydrophobicContact CB-CB 4.29Å; L722-R726 HydrophobicContact CD1-CG 4.23Å; L722-R726 HydrophobicContact CG-CG 4.31Å; L722-R726 VanDerWaalsContact O-CB 3.31Å; L722-R726 WeakPolarHBondContact O-CB 3.32Å; L722-R726 WeakPolarHBondContact O-CG 3.1Å; L722-R726 PolarHBondContact O-N 2.99Å; L722-R726 VanDerWaalsContact O-N 3.09Å; E724-R726 VanDerWaalsContact C-N 3.31Å; E724-R726 PolarHBondContact O-N 3.03Å; R726-N728 VanDerWaalsContact C-N 3.34Å; R726-N728 PolarHBondContact O-N 3.02Å; R726-S729 WeakPolarHBondContact CA-OG 3.34Å; R726-S729 PolarHBondContact O-N 3.41Å; R726-S729 PolarHBondContact O-OG 3.09Å; R726-T730 WeakPolarHBondContact O-CB 3.43Å; R726-T730 PolarHBondContact O-N 3.06Å; R726-T730 PolarHBondContact O-OG1 2.94Å
727	L	88.5	Confident	84.3	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-69.8	-47.4	174.7	-71.5	172.3	0	0	0	111	L683 I695 L723 E724 S729 T730 S731 M738 L780	L683-L727 HydrophobicContact CD2-CD2 3.91Å; L683-L727 HydrophobicContact CD2-CG 4.42Å; I695-L727 HydrophobicContact CD1-CD1 4.18Å; I695-L727 HydrophobicContact CD1-CD2 4.15Å; L723-L727 HydrophobicContact CD1-CD1 3.9Å; L723-L727 HydrophobicContact CD1-CG 4.29Å; L723-L727 HydrophobicContact CG-CD1 4.11Å; L723-L727 WeakPolarHBondContact O-CB 3.4Å; L723-L727 VanDerWaalsContact O-CG 3.29Å; L723-L727 WeakPolarHBondContact O-CG 3.36Å; L723-L727 PolarHBondContact O-N 2.99Å; L723-L727 VanDerWaalsContact O-N 3.08Å; E724-L727 PolarHBondContact O-N 3.27Å; L727-S729 PolarHBondContact O-N 3.24Å; L727-T730 PolarHBondContact O-N 3.14Å; L727-S731 PolarHBondContact O-N 3Å; L727-M738 HydrophobicContact CD2-CE 4.18Å; L727-M738 HydrophobicContact CD2-SD 4.14Å; L727-L780 HydrophobicContact CB-CD2 3.88Å; L727-L780 HydrophobicContact CD1-CD1 3.85Å; L727-L780 HydrophobicContact CD1-CD2 4.43Å
728	N	85.4	Confident	85.2	Confident	40.3333 Å²	40.3333	42.2 Å²	42.2	22%	0.216	24%	0.236	C	C	.	.	H	α-helix	trans	-66	-38.2	179.1	-75.2	-35.2	0	0	0	113.3	E724 E725 R726 T730 L780 Q783	E724-N728 PolarHBondContact O-N 3.38Å; E724-N728 VanDerWaalsContact O-N 3.1Å; E724-N728 PolarHBondContact O-ND2 3.34Å; E725-N728 PolarHBondContact O-N 3.03Å; R726-N728 VanDerWaalsContact C-N 3.34Å; R726-N728 PolarHBondContact O-N 3.02Å; N728-T730 VanDerWaalsContact C-N 3.27Å; N728-T730 PolarHBondContact O-N 3.06Å; N728-L780 WeakPolarHBondContact OD1-CD2 3.23Å; N728-Q783 VanDerWaalsContact CG-OE1 3.28Å; N728-Q783 VanDerWaalsContact ND2-CD 3.34Å; N728-Q783 PolarHBondContact ND2-OE1 3.01Å
729	S	83	Confident	85.7	Confident	80.3333 Å²	80.3333	40.6 Å²	40.6	56%	0.562	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-18.6	179	60.3	0	0	0	0	114.4	E725 R726 L727	E725-S729 VanDerWaalsContact O-CB 3.26Å; E725-S729 WeakPolarHBondContact O-CB 3.42Å; E725-S729 PolarHBondContact O-N 3.34Å; E725-S729 PolarHBondContact O-OG 3.42Å; R726-S729 WeakPolarHBondContact CA-OG 3.34Å; R726-S729 PolarHBondContact O-N 3.41Å; R726-S729 PolarHBondContact O-OG 3.09Å; L727-S729 PolarHBondContact O-N 3.24Å
730	T	74.9	Confident	85.9	Confident	44.3333 Å²	44.3333	40.3 Å²	40.3	27%	0.272	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-30.8	-177.2	-51.3	0	0	0	0	112.7	S685 R726 L727 N728	S685-T730 WeakPolarHBondContact O-CG2 3.31Å; R726-T730 WeakPolarHBondContact O-CB 3.43Å; R726-T730 PolarHBondContact O-N 3.06Å; R726-T730 PolarHBondContact O-OG1 2.94Å; L727-T730 PolarHBondContact O-N 3.14Å; N728-T730 VanDerWaalsContact C-N 3.27Å; N728-T730 PolarHBondContact O-N 3.06Å
731	S	71.4	Confident	86.1	Confident	29 Å²	29	38.6 Å²	38.6	20%	0.203	22%	0.215	C	C	.	.			trans	-155.4	129.4	176.8	58.9	0	0	0	0	112.2	R691 L727 Q733	R691-S731 PolarHBondContact NH1-OG 2.72Å; R691-S731 PolarHBondContact NH2-OG 3.16Å; L727-S731 PolarHBondContact O-N 3Å; S731-Q733 PolarHBondContact O-N 2.98Å; S731-Q733 PolarHBondContact OG-O 3.11Å
732	S	69.5	Low	86.4	Confident	60 Å²	60	36 Å²	36	42%	0.42	20%	0.197	S	C	.	.	S	Bend	trans	-71.8	-6.2	175.4	60.8	0	0	0	0	114.5	S784 E785	S732-S784 WeakPolarHBondContact O-CB 3.44Å; S732-E785 WeakPolarHBondContact CB-OE1 3.47Å; S732-E785 PolarHBondContact OG-OE1 3.4Å; S732-E785 VanDerWaalsContact OG-OE1 3.09Å
733	Q	76.4	Confident	86.6	Confident	122.667 Å²	122.667	34.2 Å²	34.2	57%	0.573	19%	0.187	S	C	*	.			trans	-103.9	114.6	-176.4	-64.1	179.6	-3.9	0	0	110.5	S731	S731-Q733 PolarHBondContact O-N 2.98Å; S731-Q733 PolarHBondContact OG-O 3.11Å
734	F	87.8	Confident	86.6	Confident	9.66667 Å²	9.66667	34.3 Å²	34.3	4%	0.042	19%	0.187	C	C	.	.			trans	-92.7	114.8	173.4	-177.8	-122.2	0	0	0	109.9	M738 Y739 L742 I777 L780 I781 I790 I793	F734-M738 HydrophobicContact CD2-CB 4.06Å; F734-M738 HydrophobicContact CD2-CG 4.05Å; F734-M738 HydrophobicContact CD2-SD 4.39Å; F734-M738 HydrophobicContact CE2-CB 3.83Å; F734-M738 HydrophobicContact CE2-CG 3.8Å; F734-Y739 HydrophobicContact CE1-CD2 4.21Å; F734-Y739 HydrophobicContact CZ-CD2 4.2Å; F734-Y739 HydrophobicContact CZ-CG 4.5Å; F734-L742 HydrophobicContact CE2-CD1 3.77Å; F734-L742 HydrophobicContact CZ-CD1 4.02Å; F734-I777 HydrophobicContact CE1-CG2 4.46Å; F734-I777 HydrophobicContact CZ-CG2 4.42Å; F734-L780 HydrophobicContact CD1-CB 4.29Å; F734-L780 HydrophobicContact CD2-CB 3.96Å; F734-L780 HydrophobicContact CD2-CD1 4.03Å; F734-L780 HydrophobicContact CD2-CG 4.47Å; F734-L780 HydrophobicContact CE1-CB 4.43Å; F734-L780 HydrophobicContact CE2-CB 4.13Å; F734-L780 HydrophobicContact CE2-CD1 3.69Å; F734-L780 HydrophobicContact CE2-CG 4.49Å; F734-L780 HydrophobicContact CG-CB 4.08Å; F734-L780 HydrophobicContact CZ-CB 4.39Å; F734-L780 HydrophobicContact CZ-CD1 4.32Å; F734-I781 HydrophobicContact CD1-CG1 3.81Å; F734-I781 HydrophobicContact CE1-CD1 4.31Å; F734-I781 HydrophobicContact CE1-CG1 3.69Å; F734-I790 WeakPolarHBondContact O-CG1 3.43Å; F734-I793 HydrophobicContact CD1-CD1 4.45Å; F734-I793 HydrophobicContact CD1-CG2 4.09Å; F734-I793 HydrophobicContact CE1-CG2 3.7Å; F734-I793 VanDerWaalsContact O-CD1 3.23Å; F734-I793 WeakPolarHBondContact O-CD1 3.42Å
735	T	89.6	Confident	86.7	Confident	18 Å²	18	33.1 Å²	33.1	11%	0.11	18%	0.182	C	C	.	.			trans	-98.3	160.9	-171.3	65.4	0	0	0	0	113	E688 L737 M738 Y739 E789 I793	E688-T735 VanDerWaalsContact OE1-CB 3.27Å; E688-T735 WeakPolarHBondContact OE1-CB 3.36Å; E688-T735 WeakPolarHBondContact OE1-CG2 3.47Å; E688-T735 PolarHBondContact OE1-OG1 3.18Å; T735-L737 VanDerWaalsContact C-N 3.28Å; T735-L737 PolarHBondContact O-N 2.96Å; T735-M738 HydrophobicContact CG2-CE 4.33Å; T735-M738 PolarHBondContact O-N 2.94Å; T735-M738 WeakPolarHBondContact OG1-CB 3.45Å; T735-M738 WeakPolarHBondContact OG1-CG 3.4Å; T735-M738 PolarHBondContact OG1-N 3.19Å; T735-Y739 PolarHBondContact O-N 3.1Å; T735-E789 WeakPolarHBondContact CA-OE1 3.37Å; T735-I793 VanDerWaalsContact C-CD1 3.42Å
736	S	88.7	Confident	86.9	Confident	49.6667 Å²	49.6667	28.7 Å²	28.7	35%	0.347	16%	0.162	S	C	.	.	H	α-helix	trans	-60.6	-30.5	174.2	55.8	0	0	0	0	113.1	Y739 N740 E789 I793	S736-Y739 WeakPolarHBondContact O-CB 3.25Å; S736-Y739 PolarHBondContact O-N 3.16Å; S736-N740 WeakPolarHBondContact O-CB 3.36Å; S736-N740 VanDerWaalsContact O-CG 3.24Å; S736-N740 PolarHBondContact O-N 3.11Å; S736-N740 PolarHBondContact O-ND2 3.22Å; S736-E789 WeakPolarHBondContact CB-OE1 3.05Å; S736-E789 PolarHBondContact N-OE1 3.05Å; S736-E789 PolarHBondContact OG-OE1 3.01Å; S736-I793 VanDerWaalsContact N-CD1 3.34Å
737	L	90.9	Very high	86.9	Confident	32 Å²	32	24.8 Å²	24.8	17%	0.168	15%	0.148	C	C	.	.	H	α-helix	trans	-72	-41.4	176.5	-57.6	179.1	0	0	0	112	E688 I692 T735 Y739 N740 A741 I754 I756	E688-L737 WeakPolarHBondContact OE1-CB 3.21Å; I692-L737 HydrophobicContact CD1-CB 3.54Å; I692-L737 HydrophobicContact CD1-CD1 4.16Å; I692-L737 HydrophobicContact CD1-CG 4.46Å; I692-L737 HydrophobicContact CG1-CB 4.43Å; T735-L737 VanDerWaalsContact C-N 3.28Å; T735-L737 PolarHBondContact O-N 2.96Å; L737-Y739 VanDerWaalsContact C-N 3.34Å; L737-N740 PolarHBondContact O-N 3.35Å; L737-A741 PolarHBondContact O-N 3.1Å; L737-A741 VanDerWaalsContact O-N 3.08Å; L737-I754 HydrophobicContact CD2-CG2 4.35Å; L737-I756 HydrophobicContact CD2-CB 4.32Å; L737-I756 HydrophobicContact CD2-CG1 4.23Å; L737-I756 HydrophobicContact CD2-CG2 4.42Å
738	M	91.9	Very high	87	Confident	3.66667 Å²	3.66667	26.1 Å²	26.1	2%	0.018	15%	0.154	C	C	.	.	H	α-helix	trans	-63.2	-42.6	172.6	-96.6	161.2	-165.8	0	0	111.1	E688 R691 I692 I695 L727 F734 T735 A741 L742	E688-M738 HydrophobicContact CG-CE 3.99Å; E688-M738 HydrophobicContact CG-CG 4.47Å; R691-M738 HydrophobicContact CB-CE 4.03Å; I692-M738 HydrophobicContact CG1-CG 4.39Å; I692-M738 HydrophobicContact CG1-SD 4.42Å; I695-M738 HydrophobicContact CD1-CG 4.21Å; I695-M738 HydrophobicContact CD1-SD 3.11Å; I695-M738 WeakPolarHBondContact CD1-SD 3.35Å; I695-M738 HydrophobicContact CG1-SD 4.43Å; L727-M738 HydrophobicContact CD2-CE 4.18Å; L727-M738 HydrophobicContact CD2-SD 4.14Å; F734-M738 HydrophobicContact CD2-CB 4.06Å; F734-M738 HydrophobicContact CD2-CG 4.05Å; F734-M738 HydrophobicContact CD2-SD 4.39Å; F734-M738 HydrophobicContact CE2-CB 3.83Å; F734-M738 HydrophobicContact CE2-CG 3.8Å; T735-M738 HydrophobicContact CG2-CE 4.33Å; T735-M738 PolarHBondContact O-N 2.94Å; T735-M738 WeakPolarHBondContact OG1-CB 3.45Å; T735-M738 WeakPolarHBondContact OG1-CG 3.4Å; T735-M738 PolarHBondContact OG1-N 3.19Å; M738-A741 WeakPolarHBondContact O-CB 3.33Å; M738-A741 PolarHBondContact O-N 3.17Å; M738-L742 WeakPolarHBondContact O-CG 3.22Å; M738-L742 PolarHBondContact O-N 3.12Å
739	Y	93.2	Very high	87.1	Confident	4 Å²	4	27.1 Å²	27.1	2%	0.016	16%	0.163	C	C	.	.	H	α-helix	trans	-57.3	-49.9	174.1	175.4	-96.6	0	0	0	112.1	F734 T735 S736 L737 A741 L742 F743 I777 I793 T796 F797 H800	F734-Y739 HydrophobicContact CE1-CD2 4.21Å; F734-Y739 HydrophobicContact CZ-CD2 4.2Å; F734-Y739 HydrophobicContact CZ-CG 4.5Å; T735-Y739 PolarHBondContact O-N 3.1Å; S736-Y739 WeakPolarHBondContact O-CB 3.25Å; S736-Y739 PolarHBondContact O-N 3.16Å; L737-Y739 VanDerWaalsContact C-N 3.34Å; Y739-A741 VanDerWaalsContact C-N 3.26Å; Y739-A741 PolarHBondContact O-N 2.94Å; Y739-L742 PolarHBondContact O-N 3.23Å; Y739-F743 WeakPolarHBondContact O-CB 3.4Å; Y739-F743 PolarHBondContact O-N 3.12Å; Y739-I777 HydrophobicContact CD2-CG2 4.04Å; Y739-I777 HydrophobicContact CE2-CG2 3.99Å; Y739-I793 HydrophobicContact CD2-CG2 3.69Å; Y739-I793 HydrophobicContact CE2-CG2 4.4Å; Y739-I793 HydrophobicContact CG-CG2 3.8Å; Y739-T796 HydrophobicContact CE1-CG2 3.89Å; Y739-F797 HydrophobicContact CE2-CB 3.88Å; Y739-F797 AromaticContact CE2-CD2 3.92Å; Y739-F797 HydrophobicContact CE2-CD2 3.92Å; Y739-F797 HydrophobicContact CE2-CG 4.29Å; Y739-F797 WeakPolarHBondContact OH-CA 3.5Å; Y739-H800 AromaticContact CZ-ND1 3.87Å; Y739-H800 PolarHBondContact OH-ND1 3.08Å
740	N	92.1	Very high	87.4	Confident	6 Å²	6	24.1 Å²	24.1	3%	0.032	14%	0.141	C	C	.	.	H	α-helix	trans	-59.3	-37.4	177.2	-74.8	-18.9	0	0	0	112.2	S736 L737 F743 E744 R755 I756 N757 I759	S736-N740 WeakPolarHBondContact O-CB 3.36Å; S736-N740 VanDerWaalsContact O-CG 3.24Å; S736-N740 PolarHBondContact O-N 3.11Å; S736-N740 PolarHBondContact O-ND2 3.22Å; L737-N740 PolarHBondContact O-N 3.35Å; N740-F743 PolarHBondContact O-N 3.46Å; N740-E744 WeakPolarHBondContact O-CG 3.46Å; N740-E744 PolarHBondContact O-N 2.98Å; N740-E744 VanDerWaalsContact O-N 3.17Å; N740-R755 HydrophobicContact CB-CB 4.42Å; N740-R755 PolarHBondContact ND2-O 2.99Å; N740-I756 PolarHBondContact ND2-O 3.12Å; N740-N757 PolarHBondContact ND2-O 2.91Å; N740-I759 HydrophobicContact CB-CD1 4.09Å
741	A	92.5	Very high	88.1	Confident	2.33333 Å²	2.33333	23.2 Å²	23.2	2%	0.019	14%	0.136	C	C	.	.	H	α-helix	trans	-67.7	-46.6	176.5	0	0	0	0	0	112.2	I692 I695 L737 M738 Y739 F743 E744 V745	I692-A741 HydrophobicContact CG2-CB 4.03Å; I695-A741 HydrophobicContact CB-CB 4.22Å; I695-A741 HydrophobicContact CD1-CB 4.41Å; I695-A741 HydrophobicContact CG2-CB 3.81Å; L737-A741 PolarHBondContact O-N 3.1Å; L737-A741 VanDerWaalsContact O-N 3.08Å; M738-A741 WeakPolarHBondContact O-CB 3.33Å; M738-A741 PolarHBondContact O-N 3.17Å; Y739-A741 VanDerWaalsContact C-N 3.26Å; Y739-A741 PolarHBondContact O-N 2.94Å; A741-F743 VanDerWaalsContact C-N 3.3Å; A741-F743 PolarHBondContact O-N 3.04Å; A741-E744 WeakPolarHBondContact O-CB 3.42Å; A741-E744 PolarHBondContact O-N 3.2Å; A741-V745 WeakPolarHBondContact O-CG2 3.34Å; A741-V745 PolarHBondContact O-N 3.28Å; A741-V745 VanDerWaalsContact O-N 3.12Å
742	L	94.1	Very high	88.9	Confident	0.333333 Å²	0.333333	23.5 Å²	23.5	0%	0.002	14%	0.137	C	C	.	.	H	α-helix	trans	-64.5	-35.2	176.6	-69	170.2	0	0	0	111.9	I695 L723 F734 M738 Y739 V745 M746 V773 I777 L780	I695-L742 HydrophobicContact CD1-CD2 4.27Å; I695-L742 HydrophobicContact CD1-CG 4.3Å; I695-L742 HydrophobicContact CG1-CD2 4.45Å; I695-L742 HydrophobicContact CG2-CD2 3.77Å; I695-L742 HydrophobicContact CG2-CG 4.2Å; L723-L742 HydrophobicContact CD2-CD2 3.98Å; F734-L742 HydrophobicContact CE2-CD1 3.77Å; F734-L742 HydrophobicContact CZ-CD1 4.02Å; M738-L742 WeakPolarHBondContact O-CG 3.22Å; M738-L742 PolarHBondContact O-N 3.12Å; Y739-L742 PolarHBondContact O-N 3.23Å; L742-V745 WeakPolarHBondContact O-CB 3.47Å; L742-V745 PolarHBondContact O-N 3.03Å; L742-M746 WeakPolarHBondContact O-CB 3.43Å; L742-M746 PolarHBondContact O-N 3.11Å; L742-V773 HydrophobicContact CB-CG1 4.17Å; L742-V773 HydrophobicContact CD2-CG1 4.34Å; L742-I777 HydrophobicContact CB-CD1 3.91Å; L742-I777 HydrophobicContact CB-CG1 3.84Å; L742-I777 HydrophobicContact CD1-CG1 3.89Å; L742-I777 HydrophobicContact CG-CG1 4.47Å; L742-L780 HydrophobicContact CD1-CD1 3.59Å; L742-L780 VanDerWaalsContact CD1-CD1 3.49Å
743	F	91.8	Very high	89.8	Confident	3.66667 Å²	3.66667	27.2 Å²	27.2	2%	0.016	15%	0.146	C	C	.	.	H	α-helix	trans	-61.7	-43.1	173.2	-173.1	-76	0	0	0	112	Y739 N740 A741 V745 M746 T747 I759 I761 V765 H800 F804	Y739-F743 WeakPolarHBondContact O-CB 3.4Å; Y739-F743 PolarHBondContact O-N 3.12Å; N740-F743 PolarHBondContact O-N 3.46Å; A741-F743 VanDerWaalsContact C-N 3.3Å; A741-F743 PolarHBondContact O-N 3.04Å; F743-V745 VanDerWaalsContact C-N 3.3Å; F743-V745 PolarHBondContact O-N 3.11Å; F743-M746 HydrophobicContact CD2-CE 3.54Å; F743-M746 VanDerWaalsContact CD2-CE 3.5Å; F743-M746 HydrophobicContact CE2-CE 3.65Å; F743-M746 HydrophobicContact CG-CE 4.13Å; F743-M746 HydrophobicContact CZ-CE 4.3Å; F743-M746 WeakPolarHBondContact O-CB 3.08Å; F743-M746 PolarHBondContact O-N 3.08Å; F743-M746 VanDerWaalsContact O-N 3.15Å; F743-T747 HydrophobicContact CD1-CG2 4.19Å; F743-T747 HydrophobicContact CE1-CG2 3.68Å; F743-T747 HydrophobicContact CZ-CG2 4.01Å; F743-T747 PolarHBondContact O-N 3.42Å; F743-T747 VanDerWaalsContact O-N 3.12Å; F743-T747 PolarHBondContact O-OG1 3.12Å; F743-I759 HydrophobicContact CB-CD1 3.86Å; F743-I759 HydrophobicContact CD1-CB 4.38Å; F743-I759 HydrophobicContact CD1-CD1 3.46Å; F743-I759 HydrophobicContact CD1-CG1 4.35Å; F743-I759 HydrophobicContact CD1-CG2 3.95Å; F743-I759 HydrophobicContact CE1-CB 4.4Å; F743-I759 HydrophobicContact CE1-CD1 4.24Å; F743-I759 HydrophobicContact CE1-CG2 3.6Å; F743-I759 HydrophobicContact CG-CD1 3.78Å; F743-I759 HydrophobicContact CZ-CG2 4.12Å; F743-I761 HydrophobicContact CE2-CD1 4.09Å; F743-I761 HydrophobicContact CE2-CG1 4.35Å; F743-I761 HydrophobicContact CZ-CD1 3.99Å; F743-I761 HydrophobicContact CZ-CG1 3.87Å; F743-V765 HydrophobicContact CE1-CG1 4.09Å; F743-V765 HydrophobicContact CZ-CG1 4.28Å; F743-H800 AromaticContact CD2-CE1 3.99Å; F743-H800 AromaticContact CD2-ND1 3.6Å; F743-H800 WeakPolarHBondContact CD2-ND1 3.28Å; F743-H800 HydrophobicContact CE2-CB 4.3Å; F743-H800 AromaticContact CE2-CE1 3.76Å; F743-H800 AromaticContact CE2-CG 3.94Å; F743-H800 AromaticContact CE2-ND1 3.29Å; F743-H800 WeakPolarHBondContact CE2-ND1 3.3Å; F743-F804 HydrophobicContact CE1-CZ 4.42Å; F743-F804 AromaticContact CE2-CE2 3.68Å; F743-F804 HydrophobicContact CE2-CE2 3.68Å; F743-F804 AromaticContact CE2-CZ 3.76Å; F743-F804 HydrophobicContact CE2-CZ 3.76Å; F743-F804 AromaticContact CZ-CE2 3.83Å; F743-F804 HydrophobicContact CZ-CE2 3.98Å; F743-F804 AromaticContact CZ-CZ 3.57Å; F743-F804 HydrophobicContact CZ-CZ 3.57Å
744	E	91.8	Very high	90.3	Very high	1.33333 Å²	1.33333	23.2 Å²	23.2	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-60.8	-36	173.8	-77.6	-172.7	177.7	0	0	112.4	K696 N740 A741 T747 E748 C749 I750 S751 R755	K696-E744 IonicContact NZ-OE1 3Å; K696-E744 PolarHBondContact NZ-OE1 3.43Å; K696-E744 IonicContact NZ-OE2 3.28Å; K696-E744 PolarHBondContact NZ-OE2 3.37Å; N740-E744 WeakPolarHBondContact O-CG 3.46Å; N740-E744 PolarHBondContact O-N 2.98Å; N740-E744 VanDerWaalsContact O-N 3.17Å; A741-E744 WeakPolarHBondContact O-CB 3.42Å; A741-E744 PolarHBondContact O-N 3.2Å; E744-T747 PolarHBondContact O-OG1 3.19Å; E744-E748 CarbonylContact O-C 3.51Å; E744-E748 VanDerWaalsContact O-CA 3.29Å; E744-E748 WeakPolarHBondContact O-CA 3.4Å; E744-E748 PolarHBondContact O-N 2.77Å; E744-C749 WeakPolarHBondContact CG-O 3.48Å; E744-C749 PolarHBondContact O-N 3.2Å; E744-C749 VanDerWaalsContact O-N 3.12Å; E744-I750 HydrophobicContact CB-CG1 4.41Å; E744-I750 WeakPolarHBondContact OE2-CA 3.34Å; E744-S751 VanDerWaalsContact CD-OG 3.25Å; E744-S751 WeakPolarHBondContact OE1-CB 3.36Å; E744-S751 PolarHBondContact OE1-N 2.86Å; E744-S751 PolarHBondContact OE1-OG 3.29Å; E744-S751 PolarHBondContact OE2-N 3.12Å; E744-S751 VanDerWaalsContact OE2-N 3.11Å; E744-S751 PolarHBondContact OE2-OG 3.06Å; E744-S751 VanDerWaalsContact OE2-OG 3.07Å; E744-R755 VanDerWaalsContact CG-NH1 3.27Å; E744-R755 WeakPolarHBondContact OE1-CD 3.34Å; E744-R755 WeakPolarHBondContact OE1-CG 3.17Å; E744-R755 IonicContact OE1-CZ 2.91Å; E744-R755 IonicContact OE1-NE 3.64Å; E744-R755 PolarHBondContact OE1-NE 3.31Å; E744-R755 IonicContact OE1-NH1 3.44Å; E744-R755 PolarHBondContact OE1-NH1 3.02Å; E744-R755 IonicContact OE1-NH2 3.52Å; E744-R755 PolarHBondContact OE1-NH2 2.75Å
745	V	92.4	Very high	90	Very high	0.333333 Å²	0.333333	27.2 Å²	27.2	0%	0.002	14%	0.143	C	C	.	.	H	α-helix	trans	-68.5	-43.6	174.6	179.3	0	0	0	0	111.7	I695 F698 L702 A741 L742 F743 T747 E748 N770 V773	I695-V745 HydrophobicContact CG2-CG2 3.72Å; I695-V745 VanDerWaalsContact O-CG2 3.31Å; I695-V745 WeakPolarHBondContact O-CG2 3.36Å; F698-V745 HydrophobicContact CD1-CG1 4.21Å; L702-V745 HydrophobicContact CD1-CG1 3.88Å; A741-V745 WeakPolarHBondContact O-CG2 3.34Å; A741-V745 PolarHBondContact O-N 3.28Å; A741-V745 VanDerWaalsContact O-N 3.12Å; L742-V745 WeakPolarHBondContact O-CB 3.47Å; L742-V745 PolarHBondContact O-N 3.03Å; F743-V745 VanDerWaalsContact C-N 3.3Å; F743-V745 PolarHBondContact O-N 3.11Å; V745-T747 VanDerWaalsContact C-N 3.26Å; V745-T747 PolarHBondContact O-N 3.31Å; V745-E748 PolarHBondContact O-N 3.24Å; V745-N770 PolarHBondContact O-ND2 2.96Å; V745-V773 HydrophobicContact CG1-CG2 4.03Å
746	M	91.5	Very high	89.5	Confident	2.33333 Å²	2.33333	32.3 Å²	32.3	1%	0.011	17%	0.168	C	C	.	.	H	α-helix	trans	-60.1	-37.8	179.9	-179.8	-178.7	65.8	0	0	112.7	L742 F743 I768 K769 N770 V773 L774 F804	L742-M746 WeakPolarHBondContact O-CB 3.43Å; L742-M746 PolarHBondContact O-N 3.11Å; F743-M746 HydrophobicContact CD2-CE 3.54Å; F743-M746 VanDerWaalsContact CD2-CE 3.5Å; F743-M746 HydrophobicContact CE2-CE 3.65Å; F743-M746 HydrophobicContact CG-CE 4.13Å; F743-M746 HydrophobicContact CZ-CE 4.3Å; F743-M746 WeakPolarHBondContact O-CB 3.08Å; F743-M746 PolarHBondContact O-N 3.08Å; F743-M746 VanDerWaalsContact O-N 3.15Å; M746-I768 HydrophobicContact CG-CG2 4Å; M746-K769 PolarHBondContact O-N 3.25Å; M746-N770 PolarHBondContact O-N 3.05Å; M746-N770 VanDerWaalsContact O-N 3.1Å; M746-V773 HydrophobicContact CB-CB 4.18Å; M746-V773 HydrophobicContact CB-CG1 4.15Å; M746-L774 HydrophobicContact SD-CD2 3.34Å; M746-L774 WeakPolarHBondContact SD-CD2 3.36Å; M746-L774 HydrophobicContact SD-CG 3.92Å; M746-F804 HydrophobicContact CE-CD2 4.46Å; M746-F804 HydrophobicContact CE-CE2 3.45Å; M746-F804 VanDerWaalsContact CE-CE2 3.45Å; M746-F804 HydrophobicContact CE-CZ 3.69Å
747	T	88.2	Confident	88.9	Confident	7.66667 Å²	7.66667	35.9 Å²	35.9	5%	0.047	18%	0.183	C	C	.	.	H	α-helix	trans	-98.2	-5.2	-179	62.1	0	0	0	0	113.9	F743 E744 V745 C749 V765 F804	F743-T747 HydrophobicContact CD1-CG2 4.19Å; F743-T747 HydrophobicContact CE1-CG2 3.68Å; F743-T747 HydrophobicContact CZ-CG2 4.01Å; F743-T747 PolarHBondContact O-N 3.42Å; F743-T747 VanDerWaalsContact O-N 3.12Å; F743-T747 PolarHBondContact O-OG1 3.12Å; E744-T747 PolarHBondContact O-OG1 3.19Å; V745-T747 VanDerWaalsContact C-N 3.26Å; V745-T747 PolarHBondContact O-N 3.31Å; T747-C749 VanDerWaalsContact C-N 3.29Å; T747-C749 PolarHBondContact O-N 3.12Å; T747-C749 VanDerWaalsContact O-N 3.08Å; T747-C749 PolarHBondContact O-SG 3.23Å; T747-C749 VanDerWaalsContact O-SG 3.32Å; T747-C749 WeakPolarHBondContact OG1-CB 3.38Å; T747-C749 PolarHBondContact OG1-SG 3.2Å; T747-V765 HydrophobicContact CG2-CG1 3.7Å; T747-F804 HydrophobicContact CG2-CE1 4.23Å; T747-F804 HydrophobicContact CG2-CZ 3.83Å
748	E	89.1	Confident	87.8	Confident	31 Å²	31	39.1 Å²	39.1	15%	0.145	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	24	-172.1	-60.7	-178.7	163.8	0	0	114.8	I703 K706 E744 V745 I750 K769 N770	I703-E748 HydrophobicContact CD1-CB 3.81Å; I703-E748 HydrophobicContact CD1-CG 4.21Å; I703-E748 HydrophobicContact CG1-CB 3.84Å; I703-E748 HydrophobicContact CG1-CG 3.74Å; K706-E748 WeakPolarHBondContact CE-OE1 3.37Å; K706-E748 IonicContact NZ-OE1 3.07Å; K706-E748 PolarHBondContact NZ-OE1 3.21Å; K706-E748 IonicContact NZ-OE2 3.7Å; K706-E748 PolarHBondContact NZ-OE2 3.31Å; E744-E748 CarbonylContact O-C 3.51Å; E744-E748 VanDerWaalsContact O-CA 3.29Å; E744-E748 WeakPolarHBondContact O-CA 3.4Å; E744-E748 PolarHBondContact O-N 2.77Å; V745-E748 PolarHBondContact O-N 3.24Å; E748-I750 PolarHBondContact O-N 2.95Å; E748-K769 HydrophobicContact CB-CB 4.31Å; E748-K769 HydrophobicContact CB-CD 3.98Å; E748-K769 HydrophobicContact CB-CG 4.27Å; E748-K769 VanDerWaalsContact CD-CB 3.43Å; E748-K769 VanDerWaalsContact CD-CD 3.49Å; E748-K769 HydrophobicContact CG-CB 3.84Å; E748-K769 HydrophobicContact CG-CD 3.92Å; E748-K769 HydrophobicContact CG-CG 4.15Å; E748-K769 WeakPolarHBondContact OE2-CD 3.35Å; E748-K769 IonicContact OE2-NZ 3.09Å; E748-K769 PolarHBondContact OE2-NZ 3.06Å; E748-N770 VanDerWaalsContact CG-ND2 3.29Å; E748-N770 WeakPolarHBondContact CG-ND2 3.39Å; E748-N770 PolarHBondContact OE1-ND2 3.29Å; E748-N770 PolarHBondContact OE1-OD1 2.91Å
749	C	87.5	Confident	87	Confident	61 Å²	61	39.7 Å²	39.7	41%	0.412	21%	0.209	S	C	.	.			trans	-98	51.1	179.9	-64.7	0	0	0	0	111.3	E744 T747 S751 R755	E744-C749 WeakPolarHBondContact CG-O 3.48Å; E744-C749 PolarHBondContact O-N 3.2Å; E744-C749 VanDerWaalsContact O-N 3.12Å; T747-C749 VanDerWaalsContact C-N 3.29Å; T747-C749 PolarHBondContact O-N 3.12Å; T747-C749 VanDerWaalsContact O-N 3.08Å; T747-C749 PolarHBondContact O-SG 3.23Å; T747-C749 VanDerWaalsContact O-SG 3.32Å; T747-C749 WeakPolarHBondContact OG1-CB 3.38Å; T747-C749 PolarHBondContact OG1-SG 3.2Å; C749-S751 PolarHBondContact O-N 3.16Å; C749-R755 PolarHBondContact O-NH2 2.86Å; C749-R755 VanDerWaalsContact O-NH2 3.07Å
750	I	89.8	Confident	85.9	Confident	18 Å²	18	46.5 Å²	46.5	9%	0.092	24%	0.244	C	C	.	.			trans	-71.9	124.6	-170	-55	177.3	0	0	0	111	V660 K696 G699 L700 I703 E744 E748	V660-I750 HydrophobicContact CG2-CG2 4.49Å; K696-I750 HydrophobicContact CB-CG2 4.05Å; K696-I750 HydrophobicContact CG-CG2 4.15Å; G699-I750 VanDerWaalsContact CA-CD1 3.47Å; L700-I750 HydrophobicContact CB-CD1 4.45Å; L700-I750 HydrophobicContact CD1-CG2 4.49Å; L700-I750 HydrophobicContact CD2-CB 4.37Å; L700-I750 HydrophobicContact CD2-CD1 4.21Å; L700-I750 HydrophobicContact CD2-CG2 4.43Å; L700-I750 HydrophobicContact CG-CD1 3.97Å; L700-I750 HydrophobicContact CG-CG2 4.25Å; L700-I750 VanDerWaalsContact N-CD1 3.34Å; I703-I750 HydrophobicContact CD1-CD1 3.59Å; I703-I750 HydrophobicContact CD1-CG1 4.09Å; E744-I750 HydrophobicContact CB-CG1 4.41Å; E744-I750 WeakPolarHBondContact OE2-CA 3.34Å; E748-I750 PolarHBondContact O-N 2.95Å
751	S	89.4	Confident	84.8	Confident	23.6667 Å²	23.6667	47.1 Å²	47.1	17%	0.166	25%	0.247	C	C	.	.			trans	-101.3	150	176.7	70.6	0	0	0	0	111.6	K696 E744 C749 K753 R755	K696-S751 PolarHBondContact NZ-O 3.28Å; K696-S751 PolarHBondContact NZ-OG 3.21Å; E744-S751 VanDerWaalsContact CD-OG 3.25Å; E744-S751 WeakPolarHBondContact OE1-CB 3.36Å; E744-S751 PolarHBondContact OE1-N 2.86Å; E744-S751 PolarHBondContact OE1-OG 3.29Å; E744-S751 PolarHBondContact OE2-N 3.12Å; E744-S751 VanDerWaalsContact OE2-N 3.11Å; E744-S751 PolarHBondContact OE2-OG 3.06Å; E744-S751 VanDerWaalsContact OE2-OG 3.07Å; C749-S751 PolarHBondContact O-N 3.16Å; S751-K753 VanDerWaalsContact C-N 3.3Å; S751-K753 PolarHBondContact O-N 3.28Å; S751-K753 PolarHBondContact OG-O 2.82Å; S751-K753 VanDerWaalsContact OG-O 3.09Å; S751-R755 PolarHBondContact OG-NE 3.02Å
752	P	88	Confident	83.6	Confident	35.3333 Å²	35.3333	51.7 Å²	51.7	23%	0.229	27%	0.271	C	S	.	.	S	Bend	trans	-75.7	-19	-179	30.2	-34.9	0	0	0	113.2	Y653 Y693	Y653-P752 VanDerWaalsContact CD2-O 3.24Å; Y653-P752 WeakPolarHBondContact CD2-O 3.44Å; Y653-P752 HydrophobicContact CE2-CB 4.33Å; Y653-P752 WeakPolarHBondContact CE2-O 3.36Å; Y693-P752 VanDerWaalsContact CE1-O 3.32Å; Y693-P752 WeakPolarHBondContact CE1-O 3.3Å; Y693-P752 PolarHBondContact OH-O 3.11Å; Y693-P752 VanDerWaalsContact OH-O 3.12Å
753	K	89.4	Confident	81.9	Confident	139 Å²	139	59.1 Å²	59.1	60%	0.604	30%	0.303	S	S	*	.	S	Bend	trans	-97.1	155.2	177.1	-65.1	-175.2	178.5	-176.6	0	110.7	Y653 K696 S751 R755	Y653-K753 HydrophobicContact CE2-CG 4.2Å; K696-K753 VanDerWaalsContact CE-O 3.24Å; K696-K753 WeakPolarHBondContact CE-O 3.29Å; K696-K753 PolarHBondContact NZ-O 3.13Å; S751-K753 VanDerWaalsContact C-N 3.3Å; S751-K753 PolarHBondContact O-N 3.28Å; S751-K753 PolarHBondContact OG-O 2.82Å; S751-K753 VanDerWaalsContact OG-O 3.09Å; K753-R755 PolarHBondContact O-N 3.27Å
754	I	87.4	Confident	80.2	Confident	38 Å²	38	64.5 Å²	64.5	20%	0.195	34%	0.337	C	S	.	.			trans	-70.5	128.7	170.1	-61.8	179.6	0	0	0	108.4	H689 I692 Y693 L737	H689-I754 HydrophobicContact CB-CD1 3.92Å; H689-I754 WeakPolarHBondContact ND1-CD1 3.42Å; I692-I754 HydrophobicContact CB-CD1 4.35Å; I692-I754 HydrophobicContact CD1-CD1 4.41Å; I692-I754 HydrophobicContact CD1-CG2 4.32Å; I692-I754 HydrophobicContact CG2-CB 4.5Å; I692-I754 HydrophobicContact CG2-CD1 4.05Å; I692-I754 HydrophobicContact CG2-CG1 3.83Å; I692-I754 HydrophobicContact CG2-CG2 4.2Å; Y693-I754 HydrophobicContact CD2-CD1 4.18Å; Y693-I754 HydrophobicContact CD2-CG1 4.43Å; Y693-I754 HydrophobicContact CE1-CG1 4.32Å; Y693-I754 HydrophobicContact CE2-CD1 3.71Å; Y693-I754 HydrophobicContact CE2-CG1 3.94Å; L737-I754 HydrophobicContact CD2-CG2 4.35Å
755	R	79.8	Confident	78.8	Confident	94.6667 Å²	94.6667	67 Å²	67	36%	0.357	35%	0.352	S	S	.	.			trans	-92.3	109.9	179.3	-102.2	-176.9	-175.9	161.5	4.6	109.6	N740 E744 C749 S751 K753	N740-R755 HydrophobicContact CB-CB 4.42Å; N740-R755 PolarHBondContact ND2-O 2.99Å; E744-R755 VanDerWaalsContact CG-NH1 3.27Å; E744-R755 WeakPolarHBondContact OE1-CD 3.34Å; E744-R755 WeakPolarHBondContact OE1-CG 3.17Å; E744-R755 IonicContact OE1-CZ 2.91Å; E744-R755 IonicContact OE1-NE 3.64Å; E744-R755 PolarHBondContact OE1-NE 3.31Å; E744-R755 IonicContact OE1-NH1 3.44Å; E744-R755 PolarHBondContact OE1-NH1 3.02Å; E744-R755 IonicContact OE1-NH2 3.52Å; E744-R755 PolarHBondContact OE1-NH2 2.75Å; C749-R755 PolarHBondContact O-NH2 2.86Å; C749-R755 VanDerWaalsContact O-NH2 3.07Å; S751-R755 PolarHBondContact OG-NE 3.02Å; K753-R755 PolarHBondContact O-N 3.27Å
756	I	79.6	Confident	77.8	Confident	125.333 Å²	125.333	68 Å²	68	64%	0.643	36%	0.359	S	S	*	.			trans	-82.3	-43.7	178.9	-56.7	169.2	0	0	0	110.4	L737 N740	L737-I756 HydrophobicContact CD2-CB 4.32Å; L737-I756 HydrophobicContact CD2-CG1 4.23Å; L737-I756 HydrophobicContact CD2-CG2 4.42Å; N740-I756 PolarHBondContact ND2-O 3.12Å
757	N	75.4	Confident	77.4	Confident	124.667 Å²	124.667	71.2 Å²	71.2	67%	0.667	38%	0.375	S	S	*	.	S	Bend	trans	-71.8	144.1	-175.6	-62.3	9.7	0	0	0	111.8	N740	N740-N757 PolarHBondContact ND2-O 2.91Å
758	P	68.3	Low	77.3	Confident	99.3333 Å²	99.3333	70.9 Å²	70.9	65%	0.645	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-59.6	143.5	175.4	25.8	-34.5	0	0	0	111.3	I760	P758-I760 PolarHBondContact O-N 3.24Å
759	I	75.3	Confident	77.2	Confident	15.3333 Å²	15.3333	74.3 Å²	74.3	8%	0.079	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-84.2	118	-171.9	-59.7	172.7	0	0	0	110.2	N740 F743 I761 H800	N740-I759 HydrophobicContact CB-CD1 4.09Å; F743-I759 HydrophobicContact CB-CD1 3.86Å; F743-I759 HydrophobicContact CD1-CB 4.38Å; F743-I759 HydrophobicContact CD1-CD1 3.46Å; F743-I759 HydrophobicContact CD1-CG1 4.35Å; F743-I759 HydrophobicContact CD1-CG2 3.95Å; F743-I759 HydrophobicContact CE1-CB 4.4Å; F743-I759 HydrophobicContact CE1-CD1 4.24Å; F743-I759 HydrophobicContact CE1-CG2 3.6Å; F743-I759 HydrophobicContact CG-CD1 3.78Å; F743-I759 HydrophobicContact CZ-CG2 4.12Å; I759-I761 PolarHBondContact O-N 2.91Å; I759-H800 PolarHBondContact O-CE1 3Å; I759-H800 VanDerWaalsContact O-CE1 3.3Å; I759-H800 PolarHBondContact O-NE2 3.02Å
760	I	70.8	Confident	77.2	Confident	146.667 Å²	146.667	71.6 Å²	71.6	75%	0.752	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-85.6	122	172.1	-56.9	174.2	0	0	0	108.6	P758 N762	P758-I760 PolarHBondContact O-N 3.24Å; I760-N762 PolarHBondContact O-N 3.34Å; I760-N762 VanDerWaalsContact O-N 3.15Å
761	I	69.8	Low	77.2	Confident	18.3333 Å²	18.3333	72.3 Å²	72.3	9%	0.094	38%	0.375	C	S	.	.			trans	-78.9	108.9	180	-57.3	179.6	0	0	0	110.1	F743 I759 K763 S766 H800 V803 F804 Q807	F743-I761 HydrophobicContact CE2-CD1 4.09Å; F743-I761 HydrophobicContact CE2-CG1 4.35Å; F743-I761 HydrophobicContact CZ-CD1 3.99Å; F743-I761 HydrophobicContact CZ-CG1 3.87Å; I759-I761 PolarHBondContact O-N 2.91Å; I761-K763 PolarHBondContact O-N 3.4Å; I761-S766 VanDerWaalsContact CG2-OG 3.3Å; I761-S766 WeakPolarHBondContact CG2-OG 3.44Å; I761-H800 HydrophobicContact CD1-CB 3.7Å; I761-H800 VanDerWaalsContact CD1-CG 3.43Å; I761-V803 HydrophobicContact CB-CG1 3.88Å; I761-V803 HydrophobicContact CD1-CB 4.11Å; I761-V803 HydrophobicContact CD1-CG1 3.97Å; I761-V803 HydrophobicContact CG1-CG1 4.37Å; I761-V803 HydrophobicContact CG2-CB 4.34Å; I761-V803 HydrophobicContact CG2-CG1 3.73Å; I761-F804 HydrophobicContact CD1-CD2 4.23Å; I761-F804 HydrophobicContact CD1-CE1 4.45Å; I761-F804 HydrophobicContact CD1-CE2 3.84Å; I761-F804 HydrophobicContact CD1-CZ 4.03Å; I761-Q807 PolarHBondContact O-NE2 3.18Å
762	N	65.8	Low	77.1	Confident	99.3333 Å²	99.3333	72.4 Å²	72.4	53%	0.531	38%	0.378	S	S	.	.			trans	-80.5	144.7	169.6	-97.1	-6.6	0	0	0	110.4	I760 T764 V765 S766	I760-N762 PolarHBondContact O-N 3.34Å; I760-N762 VanDerWaalsContact O-N 3.15Å; N762-T764 VanDerWaalsContact C-N 3.28Å; N762-T764 PolarHBondContact O-N 3.25Å; N762-T764 VanDerWaalsContact O-N 3.15Å; N762-V765 PolarHBondContact O-N 3.31Å; N762-S766 WeakPolarHBondContact O-CB 3.44Å; N762-S766 PolarHBondContact O-N 2.91Å; N762-S766 PolarHBondContact O-OG 2.93Å
763	K	58.8	Low	77.3	Confident	156 Å²	156	70.8 Å²	70.8	68%	0.678	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-53.6	-30	-174.9	-64.5	-171.7	177.1	-175.3	0	114.3	I761 V765 S766 V803	I761-K763 PolarHBondContact O-N 3.4Å; K763-V765 VanDerWaalsContact C-N 3.32Å; K763-V765 PolarHBondContact O-N 3.38Å; K763-S766 WeakPolarHBondContact O-CB 3.39Å; K763-S766 PolarHBondContact O-OG 2.96Å; K763-V803 HydrophobicContact CB-CG1 4.2Å; K763-V803 HydrophobicContact CG-CG1 3.99Å
764	T	55.5	Low	77.4	Confident	118 Å²	118	64.2 Å²	64.2	72%	0.724	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-80.4	-23	-178.7	51.2	0	0	0	0	114.6	N762	N762-T764 VanDerWaalsContact C-N 3.28Å; N762-T764 PolarHBondContact O-N 3.25Å; N762-T764 VanDerWaalsContact O-N 3.15Å
765	V	63.4	Low	77.6	Confident	52.3333 Å²	52.3333	65.9 Å²	65.9	32%	0.317	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-104.3	8	-175	-169.5	0	0	0	0	111.2	F743 T747 N762 K763 I767 F804	F743-V765 HydrophobicContact CE1-CG1 4.09Å; F743-V765 HydrophobicContact CZ-CG1 4.28Å; T747-V765 HydrophobicContact CG2-CG1 3.7Å; N762-V765 PolarHBondContact O-N 3.31Å; K763-V765 VanDerWaalsContact C-N 3.32Å; K763-V765 PolarHBondContact O-N 3.38Å; V765-I767 PolarHBondContact O-N 3.32Å; V765-F804 WeakPolarHBondContact O-CE1 3.43Å
766	S	70.8	Confident	78.2	Confident	21.3333 Å²	21.3333	61.5 Å²	61.5	15%	0.149	33%	0.328	C	S	.	.			trans	-81.1	38.5	-170.7	30.8	0	0	0	0	114.2	I761 N762 K763 Q807 N808 N811	I761-S766 VanDerWaalsContact CG2-OG 3.3Å; I761-S766 WeakPolarHBondContact CG2-OG 3.44Å; N762-S766 WeakPolarHBondContact O-CB 3.44Å; N762-S766 PolarHBondContact O-N 2.91Å; N762-S766 PolarHBondContact O-OG 2.93Å; K763-S766 WeakPolarHBondContact O-CB 3.39Å; K763-S766 PolarHBondContact O-OG 2.96Å; S766-Q807 VanDerWaalsContact CB-OE1 3.23Å; S766-N808 WeakPolarHBondContact O-CB 3.06Å; S766-N811 PolarHBondContact O-ND2 2.94Å
767	I	82.8	Confident	78.8	Confident	69.3333 Å²	69.3333	55.6 Å²	55.6	36%	0.356	30%	0.298	S	S	.	.			trans	-119.6	127.9	-177.4	-60	173.9	0	0	0	110.4	V765 K769 N808 Y810 N811	V765-I767 PolarHBondContact O-N 3.32Å; I767-K769 HydrophobicContact CG2-CD 4.12Å; I767-K769 HydrophobicContact CG2-CG 4.31Å; I767-K769 PolarHBondContact O-N 3.23Å; I767-N808 WeakPolarHBondContact CG1-ND2 3.21Å; I767-Y810 HydrophobicContact CG2-CD1 4.23Å; I767-Y810 HydrophobicContact CG2-CE1 3.67Å; I767-N811 WeakPolarHBondContact CA-OD1 3.39Å
768	I	87	Confident	79.6	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.015	27%	0.266	C	S	.	.			trans	-77.2	121.5	171.2	-58.5	169.6	0	0	0	108.3	M746 P771 L774 F804 N811 I815	M746-I768 HydrophobicContact CG-CG2 4Å; I768-P771 HydrophobicContact CG2-CB 3.88Å; I768-L774 HydrophobicContact CD1-CD1 4.23Å; I768-F804 HydrophobicContact CD1-CB 4.03Å; I768-F804 HydrophobicContact CD1-CD1 4.32Å; I768-F804 HydrophobicContact CD1-CD2 4.3Å; I768-F804 HydrophobicContact CD1-CG 3.99Å; I768-F804 HydrophobicContact CG1-CB 4.45Å; I768-F804 HydrophobicContact CG1-CD1 3.82Å; I768-F804 HydrophobicContact CG1-CD2 4.34Å; I768-F804 HydrophobicContact CG1-CE1 4.06Å; I768-F804 HydrophobicContact CG1-CG 3.97Å; I768-F804 HydrophobicContact CG1-CZ 4.39Å; I768-N811 HydrophobicContact CD1-CB 4.07Å; I768-N811 HydrophobicContact CG1-CB 4.49Å; I768-N811 PolarHBondContact N-OD1 3.47Å; I768-I815 HydrophobicContact CD1-CD1 4Å; I768-I815 HydrophobicContact CD1-CG1 4.27Å
769	K	86.3	Confident	80.6	Confident	102.333 Å²	102.333	46.5 Å²	46.5	45%	0.445	24%	0.243	S	C	.	.	S	Bend	trans	-107.8	-34.2	-176.9	-67.5	-139.9	-173.8	174.8	0	113.8	M746 E748 I767 P771	M746-K769 PolarHBondContact O-N 3.25Å; E748-K769 HydrophobicContact CB-CB 4.31Å; E748-K769 HydrophobicContact CB-CD 3.98Å; E748-K769 HydrophobicContact CB-CG 4.27Å; E748-K769 VanDerWaalsContact CD-CB 3.43Å; E748-K769 VanDerWaalsContact CD-CD 3.49Å; E748-K769 HydrophobicContact CG-CB 3.84Å; E748-K769 HydrophobicContact CG-CD 3.92Å; E748-K769 HydrophobicContact CG-CG 4.15Å; E748-K769 WeakPolarHBondContact OE2-CD 3.35Å; E748-K769 IonicContact OE2-NZ 3.09Å; E748-K769 PolarHBondContact OE2-NZ 3.06Å; I767-K769 HydrophobicContact CG2-CD 4.12Å; I767-K769 HydrophobicContact CG2-CG 4.31Å; I767-K769 PolarHBondContact O-N 3.23Å; K769-P771 VanDerWaalsContact O-CD 3.3Å; K769-P771 WeakPolarHBondContact O-CD 3.35Å
770	N	88.2	Confident	81.3	Confident	3.66667 Å²	3.66667	45.9 Å²	45.9	2%	0.02	24%	0.24	C	C	.	.			trans	-117.5	77.3	175.5	-65.7	-53.1	0	0	0	109.3	L702 K706 Y710 V745 M746 E748 A772 V773	L702-N770 HydrophobicContact CD1-CB 4.42Å; K706-N770 PolarHBondContact NZ-OD1 3.48Å; Y710-N770 PolarHBondContact OH-OD1 3.18Å; Y710-N770 VanDerWaalsContact OH-OD1 3.1Å; V745-N770 PolarHBondContact O-ND2 2.96Å; M746-N770 PolarHBondContact O-N 3.05Å; M746-N770 VanDerWaalsContact O-N 3.1Å; E748-N770 VanDerWaalsContact CG-ND2 3.29Å; E748-N770 WeakPolarHBondContact CG-ND2 3.39Å; E748-N770 PolarHBondContact OE1-ND2 3.29Å; E748-N770 PolarHBondContact OE1-OD1 2.91Å; N770-A772 VanDerWaalsContact C-N 3.3Å; N770-A772 PolarHBondContact O-N 3.26Å; N770-V773 HydrophobicContact CB-CG2 3.97Å; N770-V773 WeakPolarHBondContact O-CB 3.36Å; N770-V773 VanDerWaalsContact O-CG2 3.31Å; N770-V773 WeakPolarHBondContact O-CG2 3.23Å; N770-V773 PolarHBondContact O-N 3.34Å; N770-V773 VanDerWaalsContact O-N 3.15Å
771	P	89	Confident	82.2	Confident	31.6667 Å²	31.6667	38.9 Å²	38.9	21%	0.206	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-24.7	-168.1	29.4	-37.8	0	0	0	113.7	I768 K769 V773 L774 T814 L818	I768-P771 HydrophobicContact CG2-CB 3.88Å; K769-P771 VanDerWaalsContact O-CD 3.3Å; K769-P771 WeakPolarHBondContact O-CD 3.35Å; P771-V773 PolarHBondContact O-N 3.28Å; P771-V773 VanDerWaalsContact O-N 3.13Å; P771-L774 VanDerWaalsContact O-CB 3.27Å; P771-L774 WeakPolarHBondContact O-CB 3.31Å; P771-L774 WeakPolarHBondContact O-CG 3.34Å; P771-L774 PolarHBondContact O-N 2.95Å; P771-T814 HydrophobicContact CB-CG2 3.6Å; P771-T814 HydrophobicContact CG-CG2 3.67Å; P771-L818 HydrophobicContact CB-CD1 4.16Å; P771-L818 HydrophobicContact CB-CD2 3.99Å; P771-L818 HydrophobicContact CB-CG 4.26Å; P771-L818 HydrophobicContact CG-CD2 4.2Å; P771-L818 WeakPolarHBondContact O-CD1 3.36Å
772	A	88.1	Confident	83	Confident	27.6667 Å²	27.6667	39.9 Å²	39.9	23%	0.229	21%	0.214	C	C	.	.	H	α-helix	trans	-59.7	-22.4	174.3	0	0	0	0	0	113.4	Y720 N770 L774 K775 V776	Y720-A772 HydrophobicContact CD1-CB 4.06Å; Y720-A772 HydrophobicContact CD2-CB 3.55Å; Y720-A772 HydrophobicContact CE1-CB 4.13Å; Y720-A772 HydrophobicContact CE2-CB 3.62Å; Y720-A772 HydrophobicContact CG-CB 3.77Å; N770-A772 VanDerWaalsContact C-N 3.3Å; N770-A772 PolarHBondContact O-N 3.26Å; A772-L774 VanDerWaalsContact C-N 3.26Å; A772-L774 PolarHBondContact O-N 3.13Å; A772-K775 WeakPolarHBondContact O-CB 3.45Å; A772-K775 PolarHBondContact O-N 3.23Å; A772-V776 PolarHBondContact O-N 2.9Å
773	V	91.3	Very high	84	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.7	-25.5	174.8	-176.5	0	0	0	0	111.8	Y720 L742 V745 M746 N770 P771 K775 V776 I777	Y720-V773 HydrophobicContact CD1-CG2 4.12Å; Y720-V773 HydrophobicContact CE1-CG2 3.7Å; L742-V773 HydrophobicContact CB-CG1 4.17Å; L742-V773 HydrophobicContact CD2-CG1 4.34Å; V745-V773 HydrophobicContact CG1-CG2 4.03Å; M746-V773 HydrophobicContact CB-CB 4.18Å; M746-V773 HydrophobicContact CB-CG1 4.15Å; N770-V773 HydrophobicContact CB-CG2 3.97Å; N770-V773 WeakPolarHBondContact O-CB 3.36Å; N770-V773 VanDerWaalsContact O-CG2 3.31Å; N770-V773 WeakPolarHBondContact O-CG2 3.23Å; N770-V773 PolarHBondContact O-N 3.34Å; N770-V773 VanDerWaalsContact O-N 3.15Å; P771-V773 PolarHBondContact O-N 3.28Å; P771-V773 VanDerWaalsContact O-N 3.13Å; V773-K775 VanDerWaalsContact C-N 3.32Å; V773-K775 PolarHBondContact O-N 3.14Å; V773-V776 PolarHBondContact O-N 3.28Å; V773-I777 HydrophobicContact CG1-CD1 3.95Å; V773-I777 HydrophobicContact CG1-CG1 4.2Å; V773-I777 WeakPolarHBondContact O-CG1 3.34Å; V773-I777 PolarHBondContact O-N 3.21Å
774	L	92.4	Very high	85.3	Confident	0.666667 Å²	0.666667	33.2 Å²	33.2	0%	0.003	18%	0.183	C	C	.	.	H	α-helix	trans	-59.7	-45.1	173	-71.2	175.6	0	0	0	111.8	M746 I768 P771 A772 V776 I777 A778 F797 L801 I815 L818 W824	M746-L774 HydrophobicContact SD-CD2 3.34Å; M746-L774 WeakPolarHBondContact SD-CD2 3.36Å; M746-L774 HydrophobicContact SD-CG 3.92Å; I768-L774 HydrophobicContact CD1-CD1 4.23Å; P771-L774 VanDerWaalsContact O-CB 3.27Å; P771-L774 WeakPolarHBondContact O-CB 3.31Å; P771-L774 WeakPolarHBondContact O-CG 3.34Å; P771-L774 PolarHBondContact O-N 2.95Å; A772-L774 VanDerWaalsContact C-N 3.26Å; A772-L774 PolarHBondContact O-N 3.13Å; L774-V776 VanDerWaalsContact C-N 3.34Å; L774-V776 PolarHBondContact O-N 2.88Å; L774-I777 PolarHBondContact O-N 3.06Å; L774-A778 WeakPolarHBondContact O-CB 3.39Å; L774-A778 PolarHBondContact O-N 3Å; L774-F797 HydrophobicContact CD2-CE2 3.72Å; L774-F797 HydrophobicContact CD2-CZ 4.05Å; L774-L801 HydrophobicContact CD1-CD2 4.2Å; L774-L801 HydrophobicContact CD2-CD2 3.78Å; L774-I815 HydrophobicContact CD1-CD1 4.24Å; L774-I815 HydrophobicContact CD1-CG1 3.84Å; L774-L818 HydrophobicContact CB-CD1 4.48Å; L774-L818 HydrophobicContact CD1-CD1 4.22Å; L774-W824 HydrophobicContact CB-CH2 3.94Å; L774-W824 HydrophobicContact CB-CZ2 4.16Å; L774-W824 HydrophobicContact CB-CZ3 4.3Å; L774-W824 HydrophobicContact CD1-CH2 4.1Å; L774-W824 HydrophobicContact CD1-CZ2 4.39Å; L774-W824 HydrophobicContact CG-CH2 4.42Å
775	K	91.2	Very high	86.4	Confident	74.6667 Å²	74.6667	32.5 Å²	32.5	33%	0.325	17%	0.172	S	C	.	.	H	α-helix	trans	-59.8	-47.3	177	-177.5	175.2	175.8	166.9	0	110.2	A772 V773 I777 A778 H779 D823 W824	A772-K775 WeakPolarHBondContact O-CB 3.45Å; A772-K775 PolarHBondContact O-N 3.23Å; V773-K775 VanDerWaalsContact C-N 3.32Å; V773-K775 PolarHBondContact O-N 3.14Å; K775-I777 PolarHBondContact O-N 3.23Å; K775-A778 PolarHBondContact O-N 3.25Å; K775-H779 VanDerWaalsContact CE-CE1 3.49Å; K775-H779 WeakPolarHBondContact CE-CE1 3.29Å; K775-H779 WeakPolarHBondContact CE-NE2 3.45Å; K775-H779 VanDerWaalsContact CG-CE1 3.42Å; K775-H779 WeakPolarHBondContact CG-CE1 3.36Å; K775-H779 WeakPolarHBondContact CG-ND1 3.38Å; K775-H779 PolarHBondContact NZ-NE2 3.06Å; K775-H779 WeakPolarHBondContact O-CB 3.47Å; K775-H779 PolarHBondContact O-N 3.04Å; K775-H779 PolarHBondContact O-ND1 3.23Å; K775-D823 IonicContact NZ-OD2 2.74Å; K775-W824 HydrophobicContact CB-CD2 4.47Å; K775-W824 HydrophobicContact CB-CG 4.15Å; K775-W824 HydrophobicContact CG-CB 4.25Å; K775-W824 HydrophobicContact CG-CG 4.24Å
776	V	91.6	Very high	87.1	Confident	2.33333 Å²	2.33333	34.9 Å²	34.9	1%	0.014	18%	0.179	C	C	.	.	H	α-helix	trans	-58.4	-50.7	178	178.9	0	0	0	0	111.2	Y720 L723 E724 A772 V773 L774 A778 H779 L780	Y720-V776 WeakPolarHBondContact O-CG2 3.36Å; L723-V776 HydrophobicContact CD2-CG1 4.39Å; L723-V776 HydrophobicContact CG-CG1 4.42Å; E724-V776 HydrophobicContact CB-CG1 4.14Å; A772-V776 PolarHBondContact O-N 2.9Å; V773-V776 PolarHBondContact O-N 3.28Å; L774-V776 VanDerWaalsContact C-N 3.34Å; L774-V776 PolarHBondContact O-N 2.88Å; V776-A778 VanDerWaalsContact C-N 3.3Å; V776-A778 PolarHBondContact O-N 3.09Å; V776-H779 PolarHBondContact O-N 3.09Å; V776-L780 HydrophobicContact CG1-CD1 3.89Å; V776-L780 HydrophobicContact CG1-CG 4.32Å; V776-L780 WeakPolarHBondContact O-CB 3.44Å; V776-L780 VanDerWaalsContact O-CG 3.24Å; V776-L780 WeakPolarHBondContact O-CG 3.2Å; V776-L780 PolarHBondContact O-N 3Å
777	I	92.9	Very high	87.5	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.5	-44.2	178	-67.6	166.8	0	0	0	110.8	F734 Y739 L742 V773 L774 K775 H779 L780 I781 F797	F734-I777 HydrophobicContact CE1-CG2 4.46Å; F734-I777 HydrophobicContact CZ-CG2 4.42Å; Y739-I777 HydrophobicContact CD2-CG2 4.04Å; Y739-I777 HydrophobicContact CE2-CG2 3.99Å; L742-I777 HydrophobicContact CB-CD1 3.91Å; L742-I777 HydrophobicContact CB-CG1 3.84Å; L742-I777 HydrophobicContact CD1-CG1 3.89Å; L742-I777 HydrophobicContact CG-CG1 4.47Å; V773-I777 HydrophobicContact CG1-CD1 3.95Å; V773-I777 HydrophobicContact CG1-CG1 4.2Å; V773-I777 WeakPolarHBondContact O-CG1 3.34Å; V773-I777 PolarHBondContact O-N 3.21Å; L774-I777 PolarHBondContact O-N 3.06Å; K775-I777 PolarHBondContact O-N 3.23Å; I777-H779 PolarHBondContact O-N 2.76Å; I777-L780 PolarHBondContact O-N 3Å; I777-I781 HydrophobicContact CG2-CD1 3.76Å; I777-I781 HydrophobicContact CG2-CG1 4.45Å; I777-I781 VanDerWaalsContact O-CG1 3.29Å; I777-I781 WeakPolarHBondContact O-CG1 3.46Å; I777-I781 PolarHBondContact O-N 3.05Å; I777-F797 HydrophobicContact CB-CE2 4.04Å; I777-F797 HydrophobicContact CB-CZ 4.27Å; I777-F797 HydrophobicContact CD1-CE2 4.38Å; I777-F797 HydrophobicContact CG2-CD1 4.3Å; I777-F797 HydrophobicContact CG2-CD2 3.63Å; I777-F797 HydrophobicContact CG2-CE1 4.25Å; I777-F797 HydrophobicContact CG2-CE2 3.58Å; I777-F797 HydrophobicContact CG2-CG 4.03Å; I777-F797 HydrophobicContact CG2-CZ 3.96Å
778	A	91.7	Very high	87.4	Confident	0.666667 Å²	0.666667	39.8 Å²	39.8	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-64.6	-41.9	-179.5	0	0	0	0	0	112.6	L774 K775 V776 I781 A782 F797 W824 L828	L774-A778 WeakPolarHBondContact O-CB 3.39Å; L774-A778 PolarHBondContact O-N 3Å; K775-A778 PolarHBondContact O-N 3.25Å; V776-A778 VanDerWaalsContact C-N 3.3Å; V776-A778 PolarHBondContact O-N 3.09Å; A778-I781 PolarHBondContact O-N 3.02Å; A778-A782 WeakPolarHBondContact O-CB 3.41Å; A778-A782 PolarHBondContact O-N 2.89Å; A778-F797 HydrophobicContact CB-CE1 4.11Å; A778-F797 HydrophobicContact CB-CZ 4.36Å; A778-W824 HydrophobicContact CB-CB 4.23Å; A778-W824 HydrophobicContact CB-CD2 4.13Å; A778-W824 HydrophobicContact CB-CE3 3.44Å; A778-W824 VanDerWaalsContact CB-CE3 3.44Å; A778-W824 HydrophobicContact CB-CG 4.38Å; A778-W824 HydrophobicContact CB-CZ3 4.2Å; A778-L828 HydrophobicContact CB-CD1 4.42Å; A778-L828 HydrophobicContact CB-CD2 4.02Å; A778-L828 HydrophobicContact CB-CG 4.19Å; A778-L828 WeakPolarHBondContact O-CD2 3.28Å
779	H	90.3	Very high	87.3	Confident	33.6667 Å²	33.6667	44.1 Å²	44.1	16%	0.156	23%	0.227	C	C	.	.	H	α-helix	trans	-67	-40.4	176.7	-75.3	52.8	0	0	0	112	E724 K775 V776 I777 I781 A782 Q783	E724-H779 VanDerWaalsContact CD-CB 3.41Å; E724-H779 HydrophobicContact CG-CB 4.07Å; E724-H779 WeakPolarHBondContact OE1-CB 3.35Å; E724-H779 IonicContact OE1-CD2 3.13Å; E724-H779 PolarHBondContact OE1-CD2 3.13Å; E724-H779 IonicContact OE1-CG 3.56Å; E724-H779 IonicContact OE2-CD2 2.66Å; E724-H779 PolarHBondContact OE2-CD2 3.31Å; E724-H779 IonicContact OE2-CG 3.18Å; K775-H779 VanDerWaalsContact CE-CE1 3.49Å; K775-H779 WeakPolarHBondContact CE-CE1 3.29Å; K775-H779 WeakPolarHBondContact CE-NE2 3.45Å; K775-H779 VanDerWaalsContact CG-CE1 3.42Å; K775-H779 WeakPolarHBondContact CG-CE1 3.36Å; K775-H779 WeakPolarHBondContact CG-ND1 3.38Å; K775-H779 PolarHBondContact NZ-NE2 3.06Å; K775-H779 WeakPolarHBondContact O-CB 3.47Å; K775-H779 PolarHBondContact O-N 3.04Å; K775-H779 PolarHBondContact O-ND1 3.23Å; V776-H779 PolarHBondContact O-N 3.09Å; I777-H779 PolarHBondContact O-N 2.76Å; H779-I781 VanDerWaalsContact C-N 3.34Å; H779-I781 PolarHBondContact O-N 2.99Å; H779-A782 PolarHBondContact O-N 2.95Å; H779-Q783 VanDerWaalsContact O-CB 3.3Å; H779-Q783 WeakPolarHBondContact O-CB 3.35Å; H779-Q783 VanDerWaalsContact O-CG 3.27Å; H779-Q783 WeakPolarHBondContact O-CG 3.37Å; H779-Q783 PolarHBondContact O-N 3.01Å
780	L	90.1	Very high	87.3	Confident	2.33333 Å²	2.33333	39.4 Å²	39.4	1%	0.012	21%	0.206	C	C	.	.	H	α-helix	trans	-61	-41.3	173.8	-67.6	171.8	0	0	0	111.7	E724 L727 N728 F734 L742 V776 I777 S784	E724-L780 HydrophobicContact CG-CD2 4.43Å; L727-L780 HydrophobicContact CB-CD2 3.88Å; L727-L780 HydrophobicContact CD1-CD1 3.85Å; L727-L780 HydrophobicContact CD1-CD2 4.43Å; N728-L780 WeakPolarHBondContact OD1-CD2 3.23Å; F734-L780 HydrophobicContact CD1-CB 4.29Å; F734-L780 HydrophobicContact CD2-CB 3.96Å; F734-L780 HydrophobicContact CD2-CD1 4.03Å; F734-L780 HydrophobicContact CD2-CG 4.47Å; F734-L780 HydrophobicContact CE1-CB 4.43Å; F734-L780 HydrophobicContact CE2-CB 4.13Å; F734-L780 HydrophobicContact CE2-CD1 3.69Å; F734-L780 HydrophobicContact CE2-CG 4.49Å; F734-L780 HydrophobicContact CG-CB 4.08Å; F734-L780 HydrophobicContact CZ-CB 4.39Å; F734-L780 HydrophobicContact CZ-CD1 4.32Å; L742-L780 HydrophobicContact CD1-CD1 3.59Å; L742-L780 VanDerWaalsContact CD1-CD1 3.49Å; V776-L780 HydrophobicContact CG1-CD1 3.89Å; V776-L780 HydrophobicContact CG1-CG 4.32Å; V776-L780 WeakPolarHBondContact O-CB 3.44Å; V776-L780 VanDerWaalsContact O-CG 3.24Å; V776-L780 WeakPolarHBondContact O-CG 3.2Å; V776-L780 PolarHBondContact O-N 3Å; I777-L780 PolarHBondContact O-N 3Å; L780-S784 VanDerWaalsContact O-CB 3.25Å; L780-S784 WeakPolarHBondContact O-CB 3.38Å; L780-S784 PolarHBondContact O-N 3.18Å; L780-S784 PolarHBondContact O-OG 3.41Å; L780-S784 VanDerWaalsContact O-OG 3.12Å
781	I	89.9	Confident	87.2	Confident	0.333333 Å²	0.333333	41.4 Å²	41.4	0%	0.002	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-43.6	175.2	-67.8	166.3	0	0	0	111.1	F734 I777 A778 H779 S784 I790 I793 K794 F797 L828	F734-I781 HydrophobicContact CD1-CG1 3.81Å; F734-I781 HydrophobicContact CE1-CD1 4.31Å; F734-I781 HydrophobicContact CE1-CG1 3.69Å; I777-I781 HydrophobicContact CG2-CD1 3.76Å; I777-I781 HydrophobicContact CG2-CG1 4.45Å; I777-I781 VanDerWaalsContact O-CG1 3.29Å; I777-I781 WeakPolarHBondContact O-CG1 3.46Å; I777-I781 PolarHBondContact O-N 3.05Å; A778-I781 PolarHBondContact O-N 3.02Å; H779-I781 VanDerWaalsContact C-N 3.34Å; H779-I781 PolarHBondContact O-N 2.99Å; I781-S784 PolarHBondContact O-OG 3.08Å; I781-I790 HydrophobicContact CG2-CG2 4.29Å; I781-I793 HydrophobicContact CD1-CG2 4.32Å; I781-I793 HydrophobicContact CG1-CG2 4.43Å; I781-K794 HydrophobicContact CG2-CB 4.02Å; I781-K794 HydrophobicContact CG2-CD 4.23Å; I781-K794 HydrophobicContact CG2-CG 4.17Å; I781-F797 HydrophobicContact CD1-CB 3.97Å; I781-F797 HydrophobicContact CD1-CD1 3.77Å; I781-F797 HydrophobicContact CD1-CE1 4.41Å; I781-F797 HydrophobicContact CD1-CG 3.96Å; I781-L828 HydrophobicContact CB-CD2 3.92Å; I781-L828 HydrophobicContact CD1-CD2 4.48Å; I781-L828 HydrophobicContact CG2-CD2 3.76Å
782	A	86.7	Confident	87.1	Confident	38.3333 Å²	38.3333	42.9 Å²	42.9	32%	0.317	23%	0.228	S	C	.	.	H	α-helix	trans	-70.7	-37.4	-177.4	0	0	0	0	0	113.5	A778 H779 H827	A778-A782 WeakPolarHBondContact O-CB 3.41Å; A778-A782 PolarHBondContact O-N 2.89Å; H779-A782 PolarHBondContact O-N 2.95Å; A782-H827 HydrophobicContact CB-CB 4.39Å; A782-H827 WeakPolarHBondContact CB-O 3.38Å
783	Q	86.6	Confident	87.1	Confident	108 Å²	108	41.8 Å²	41.8	51%	0.505	22%	0.219	S	C	.	.	H	α-helix	trans	-82.9	-14.5	-178.6	-66.3	171.9	29.6	0	0	113.2	E724 N728 H779	E724-Q783 PolarHBondContact OE1-NE2 3.06Å; N728-Q783 VanDerWaalsContact CG-OE1 3.28Å; N728-Q783 VanDerWaalsContact ND2-CD 3.34Å; N728-Q783 PolarHBondContact ND2-OE1 3.01Å; H779-Q783 VanDerWaalsContact O-CB 3.3Å; H779-Q783 WeakPolarHBondContact O-CB 3.35Å; H779-Q783 VanDerWaalsContact O-CG 3.27Å; H779-Q783 WeakPolarHBondContact O-CG 3.37Å; H779-Q783 PolarHBondContact O-N 3.01Å
784	S	85.5	Confident	87.1	Confident	6.33333 Å²	6.33333	41.9 Å²	41.9	4%	0.044	22%	0.219	C	C	.	.	S	Bend	trans	-81.9	148.4	-178.4	62.7	0	0	0	0	113.9	S732 L780 I781 Q786 I790	S732-S784 WeakPolarHBondContact O-CB 3.44Å; L780-S784 VanDerWaalsContact O-CB 3.25Å; L780-S784 WeakPolarHBondContact O-CB 3.38Å; L780-S784 PolarHBondContact O-N 3.18Å; L780-S784 PolarHBondContact O-OG 3.41Å; L780-S784 VanDerWaalsContact O-OG 3.12Å; I781-S784 PolarHBondContact O-OG 3.08Å; S784-Q786 PolarHBondContact O-N 3.37Å; S784-Q786 PolarHBondContact O-NE2 3.04Å; S784-Q786 VanDerWaalsContact O-NE2 3.11Å; S784-I790 WeakPolarHBondContact OG-CD1 3.18Å; S784-I790 WeakPolarHBondContact OG-CG2 3.5Å
785	E	78.6	Confident	87	Confident	104.333 Å²	104.333	43.7 Å²	43.7	49%	0.488	23%	0.228	S	C	.	.			trans	-60.9	129.9	178.7	-69.7	178.4	-142	0	0	111.1	S732 T787 I790 K918	S732-E785 WeakPolarHBondContact CB-OE1 3.47Å; S732-E785 PolarHBondContact OG-OE1 3.4Å; S732-E785 VanDerWaalsContact OG-OE1 3.09Å; E785-T787 VanDerWaalsContact C-N 3.3Å; E785-T787 PolarHBondContact O-N 2.98Å; E785-I790 WeakPolarHBondContact O-CD1 3.42Å; E785-K918 IonicContact OE2-NZ 2.66Å; E785-K918 PolarHBondContact OE2-NZ 2.84Å
786	Q	78.6	Confident	86.9	Confident	101.333 Å²	101.333	41.9 Å²	41.9	47%	0.474	22%	0.224	S	C	.	.			trans	-69.9	83.1	-172	-62.1	-62.7	-70.8	0	0	112.9	S784	S784-Q786 PolarHBondContact O-N 3.37Å; S784-Q786 PolarHBondContact O-NE2 3.04Å; S784-Q786 VanDerWaalsContact O-NE2 3.11Å
787	T	79.7	Confident	86.9	Confident	53 Å²	53	41.9 Å²	41.9	33%	0.325	22%	0.223	S	C	.	.			trans	-96.1	165	173.8	69	0	0	0	0	111.9	E785 E789 I790 L791	E785-T787 VanDerWaalsContact C-N 3.3Å; E785-T787 PolarHBondContact O-N 2.98Å; T787-E789 VanDerWaalsContact C-N 3.27Å; T787-E789 PolarHBondContact O-N 3.19Å; T787-I790 HydrophobicContact CG2-CD1 4.45Å; T787-I790 PolarHBondContact O-N 3.06Å; T787-I790 PolarHBondContact OG1-N 3.31Å; T787-L791 WeakPolarHBondContact O-CG 3.38Å; T787-L791 PolarHBondContact O-N 3.1Å; T787-L791 VanDerWaalsContact O-N 3.1Å
788	N	80.4	Confident	86.8	Confident	141.667 Å²	141.667	41.9 Å²	41.9	76%	0.758	22%	0.224	S	C	*	.	H	α-helix	trans	-59.8	-33	175.3	-69.9	-19.6	0	0	0	113.1	L791 S792	N788-L791 WeakPolarHBondContact O-CB 3.5Å; N788-L791 PolarHBondContact O-N 3.47Å; N788-S792 PolarHBondContact O-N 3.12Å; N788-S792 VanDerWaalsContact O-N 3.17Å
789	E	84	Confident	86.7	Confident	93.3333 Å²	93.3333	46.5 Å²	46.5	44%	0.436	25%	0.245	S	C	.	.	H	α-helix	trans	-67.7	-47.3	176.2	-139.9	-176.3	169.3	0	0	110.6	T735 S736 T787 L791 S792 I793	T735-E789 WeakPolarHBondContact CA-OE1 3.37Å; S736-E789 WeakPolarHBondContact CB-OE1 3.05Å; S736-E789 PolarHBondContact N-OE1 3.05Å; S736-E789 PolarHBondContact OG-OE1 3.01Å; T787-E789 VanDerWaalsContact C-N 3.27Å; T787-E789 PolarHBondContact O-N 3.19Å; E789-L791 VanDerWaalsContact C-N 3.29Å; E789-L791 PolarHBondContact O-N 3.31Å; E789-S792 CarbonylContact O-C 3.6Å; E789-S792 WeakPolarHBondContact O-CA 3.36Å; E789-S792 WeakPolarHBondContact O-CB 3.26Å; E789-S792 PolarHBondContact O-N 3.33Å; E789-S792 PolarHBondContact O-OG 3Å; E789-I793 HydrophobicContact CG-CD1 3.98Å; E789-I793 HydrophobicContact CG-CG1 4.42Å; E789-I793 WeakPolarHBondContact O-CG1 3.41Å; E789-I793 PolarHBondContact O-N 3.23Å
790	I	86.2	Confident	86.6	Confident	2.66667 Å²	2.66667	45.7 Å²	45.7	1%	0.014	24%	0.241	C	C	.	.	H	α-helix	trans	-62	-36.2	178.2	-74.8	156.8	0	0	0	111.5	F734 I781 S784 E785 T787 S792 I793 K794	F734-I790 WeakPolarHBondContact O-CG1 3.43Å; I781-I790 HydrophobicContact CG2-CG2 4.29Å; S784-I790 WeakPolarHBondContact OG-CD1 3.18Å; S784-I790 WeakPolarHBondContact OG-CG2 3.5Å; E785-I790 WeakPolarHBondContact O-CD1 3.42Å; T787-I790 HydrophobicContact CG2-CD1 4.45Å; T787-I790 PolarHBondContact O-N 3.06Å; T787-I790 PolarHBondContact OG1-N 3.31Å; I790-S792 VanDerWaalsContact C-N 3.31Å; I790-S792 PolarHBondContact O-N 3.22Å; I790-I793 PolarHBondContact O-N 3.37Å; I790-K794 WeakPolarHBondContact O-CB 3.35Å; I790-K794 PolarHBondContact O-N 3.08Å
791	L	85.4	Confident	86.6	Confident	46.6667 Å²	46.6667	45.8 Å²	45.8	24%	0.244	24%	0.242	C	C	.	.	H	α-helix	trans	-60.8	-38.5	171.4	-89.6	139.7	0	0	0	112.4	T787 N788 E789 D795 A837 F841	T787-L791 WeakPolarHBondContact O-CG 3.38Å; T787-L791 PolarHBondContact O-N 3.1Å; T787-L791 VanDerWaalsContact O-N 3.1Å; N788-L791 WeakPolarHBondContact O-CB 3.5Å; N788-L791 PolarHBondContact O-N 3.47Å; E789-L791 VanDerWaalsContact C-N 3.29Å; E789-L791 PolarHBondContact O-N 3.31Å; L791-D795 PolarHBondContact O-N 3.12Å; L791-D795 VanDerWaalsContact O-N 3.14Å; L791-A837 HydrophobicContact CD2-CB 3.85Å; L791-A837 HydrophobicContact CG-CB 4.43Å; L791-F841 HydrophobicContact CD1-CE2 3.9Å; L791-F841 HydrophobicContact CD2-CE2 3.88Å; L791-F841 HydrophobicContact CG-CE2 3.84Å; L791-F841 HydrophobicContact CG-CZ 4.07Å; L791-F841 WeakPolarHBondContact O-CZ 3.36Å
792	S	87.6	Confident	86.5	Confident	63.6667 Å²	63.6667	48 Å²	48	45%	0.445	25%	0.251	S	S	.	.	H	α-helix	trans	-72.7	-38.6	176.2	77.6	0	0	0	0	113.1	N788 E789 I790 K794 D795 T796	N788-S792 PolarHBondContact O-N 3.12Å; N788-S792 VanDerWaalsContact O-N 3.17Å; E789-S792 CarbonylContact O-C 3.6Å; E789-S792 WeakPolarHBondContact O-CA 3.36Å; E789-S792 WeakPolarHBondContact O-CB 3.26Å; E789-S792 PolarHBondContact O-N 3.33Å; E789-S792 PolarHBondContact O-OG 3Å; I790-S792 VanDerWaalsContact C-N 3.31Å; I790-S792 PolarHBondContact O-N 3.22Å; S792-K794 VanDerWaalsContact C-N 3.32Å; S792-K794 PolarHBondContact O-N 2.96Å; S792-D795 PolarHBondContact O-N 3.09Å; S792-T796 WeakPolarHBondContact O-CB 3.46Å; S792-T796 PolarHBondContact O-N 2.95Å; S792-T796 PolarHBondContact O-OG1 2.93Å; S792-T796 VanDerWaalsContact O-OG1 3.08Å
793	I	89.2	Confident	86.5	Confident	4.33333 Å²	4.33333	48 Å²	48	2%	0.022	25%	0.248	C	C	.	.	H	α-helix	trans	-64.8	-42.4	175.2	-64.8	163.6	0	0	0	110	F734 T735 S736 Y739 I781 E789 I790 T796 F797	F734-I793 HydrophobicContact CD1-CD1 4.45Å; F734-I793 HydrophobicContact CD1-CG2 4.09Å; F734-I793 HydrophobicContact CE1-CG2 3.7Å; F734-I793 VanDerWaalsContact O-CD1 3.23Å; F734-I793 WeakPolarHBondContact O-CD1 3.42Å; T735-I793 VanDerWaalsContact C-CD1 3.42Å; S736-I793 VanDerWaalsContact N-CD1 3.34Å; Y739-I793 HydrophobicContact CD2-CG2 3.69Å; Y739-I793 HydrophobicContact CE2-CG2 4.4Å; Y739-I793 HydrophobicContact CG-CG2 3.8Å; I781-I793 HydrophobicContact CD1-CG2 4.32Å; I781-I793 HydrophobicContact CG1-CG2 4.43Å; E789-I793 HydrophobicContact CG-CD1 3.98Å; E789-I793 HydrophobicContact CG-CG1 4.42Å; E789-I793 WeakPolarHBondContact O-CG1 3.41Å; E789-I793 PolarHBondContact O-N 3.23Å; I790-I793 PolarHBondContact O-N 3.37Å; I793-T796 WeakPolarHBondContact O-CB 3.41Å; I793-T796 PolarHBondContact O-N 3.02Å; I793-F797 WeakPolarHBondContact O-CB 3.35Å; I793-F797 PolarHBondContact O-N 3.32Å
794	K	90.5	Very high	86.5	Confident	1.33333 Å²	1.33333	43 Å²	43	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-60	-45.5	175.2	178.5	174.7	172.6	175.8	0	111.9	I781 I790 S792 T796 F797 I798 L828 N838 F841	I781-K794 HydrophobicContact CG2-CB 4.02Å; I781-K794 HydrophobicContact CG2-CD 4.23Å; I781-K794 HydrophobicContact CG2-CG 4.17Å; I790-K794 WeakPolarHBondContact O-CB 3.35Å; I790-K794 PolarHBondContact O-N 3.08Å; S792-K794 VanDerWaalsContact C-N 3.32Å; S792-K794 PolarHBondContact O-N 2.96Å; K794-T796 VanDerWaalsContact C-N 3.34Å; K794-F797 PolarHBondContact O-N 3.2Å; K794-I798 HydrophobicContact CG-CD1 4.04Å; K794-I798 WeakPolarHBondContact O-CD1 3.39Å; K794-I798 VanDerWaalsContact O-CG1 3.28Å; K794-I798 WeakPolarHBondContact O-CG1 3.33Å; K794-I798 PolarHBondContact O-N 3.1Å; K794-I798 VanDerWaalsContact O-N 3.08Å; K794-L828 WeakPolarHBondContact CE-O 3.44Å; K794-L828 PolarHBondContact NZ-O 3.04Å; K794-N838 PolarHBondContact NZ-OD1 2.9Å; K794-N838 VanDerWaalsContact NZ-OD1 3.13Å; K794-F841 HydrophobicContact CD-CD2 4.11Å; K794-F841 HydrophobicContact CD-CE2 4.09Å; K794-F841 HydrophobicContact CD-CG 4.42Å; K794-F841 HydrophobicContact CD-CZ 4.37Å; K794-F841 HydrophobicContact CG-CD1 4.47Å; K794-F841 HydrophobicContact CG-CD2 4.45Å; K794-F841 HydrophobicContact CG-CE1 4.36Å; K794-F841 HydrophobicContact CG-CE2 4.34Å; K794-F841 HydrophobicContact CG-CZ 4.29Å
795	D	89.4	Confident	86.5	Confident	38.3333 Å²	38.3333	42.7 Å²	42.7	21%	0.205	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-44.1	174.5	-159	43.4	0	0	0	111.7	L791 S792 F797 I798 Q799 F841 K844	L791-D795 PolarHBondContact O-N 3.12Å; L791-D795 VanDerWaalsContact O-N 3.14Å; S792-D795 PolarHBondContact O-N 3.09Å; D795-F797 VanDerWaalsContact C-N 3.34Å; D795-F797 PolarHBondContact O-N 3.23Å; D795-I798 PolarHBondContact O-N 3.1Å; D795-Q799 VanDerWaalsContact CG-NE2 3.28Å; D795-Q799 WeakPolarHBondContact O-CB 3.43Å; D795-Q799 VanDerWaalsContact O-CG 3.28Å; D795-Q799 WeakPolarHBondContact O-CG 3.31Å; D795-Q799 PolarHBondContact O-N 3.29Å; D795-Q799 PolarHBondContact OD1-NE2 2.66Å; D795-Q799 PolarHBondContact OD2-NE2 3Å; D795-F841 HydrophobicContact CB-CE1 3.64Å; D795-F841 HydrophobicContact CB-CZ 4.12Å; D795-F841 VanDerWaalsContact OD1-CE1 3.31Å; D795-F841 WeakPolarHBondContact OD1-CE1 3.45Å; D795-K844 IonicContact OD1-NZ 2.92Å; D795-K844 PolarHBondContact OD1-NZ 3.04Å; D795-K844 IonicContact OD2-NZ 3.32Å; D795-K844 PolarHBondContact OD2-NZ 3.02Å
796	T	89.4	Confident	86.6	Confident	36.6667 Å²	36.6667	40.8 Å²	40.8	23%	0.225	22%	0.221	C	C	.	.	H	α-helix	trans	-59.4	-44	176.7	-57.5	0	0	0	0	111.6	Y739 S792 I793 K794 Q799 H800	Y739-T796 HydrophobicContact CE1-CG2 3.89Å; S792-T796 WeakPolarHBondContact O-CB 3.46Å; S792-T796 PolarHBondContact O-N 2.95Å; S792-T796 PolarHBondContact O-OG1 2.93Å; S792-T796 VanDerWaalsContact O-OG1 3.08Å; I793-T796 WeakPolarHBondContact O-CB 3.41Å; I793-T796 PolarHBondContact O-N 3.02Å; K794-T796 VanDerWaalsContact C-N 3.34Å; T796-Q799 PolarHBondContact O-N 2.86Å; T796-H800 VanDerWaalsContact CG2-CE1 3.49Å; T796-H800 WeakPolarHBondContact CG2-CE1 3.45Å; T796-H800 VanDerWaalsContact O-CB 3.26Å; T796-H800 WeakPolarHBondContact O-CB 3.39Å; T796-H800 PolarHBondContact O-CD2 3.05Å; T796-H800 VanDerWaalsContact O-CD2 3.3Å; T796-H800 PolarHBondContact O-N 3.12Å
797	F	92.4	Very high	86.6	Confident	2.33333 Å²	2.33333	40.2 Å²	40.2	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-62.9	-45	177.4	179	-121.3	0	0	0	112.6	Y739 L774 I777 A778 I781 I793 K794 D795 H800 L801 W824 L828	Y739-F797 HydrophobicContact CE2-CB 3.88Å; Y739-F797 AromaticContact CE2-CD2 3.92Å; Y739-F797 HydrophobicContact CE2-CD2 3.92Å; Y739-F797 HydrophobicContact CE2-CG 4.29Å; Y739-F797 WeakPolarHBondContact OH-CA 3.5Å; L774-F797 HydrophobicContact CD2-CE2 3.72Å; L774-F797 HydrophobicContact CD2-CZ 4.05Å; I777-F797 HydrophobicContact CB-CE2 4.04Å; I777-F797 HydrophobicContact CB-CZ 4.27Å; I777-F797 HydrophobicContact CD1-CE2 4.38Å; I777-F797 HydrophobicContact CG2-CD1 4.3Å; I777-F797 HydrophobicContact CG2-CD2 3.63Å; I777-F797 HydrophobicContact CG2-CE1 4.25Å; I777-F797 HydrophobicContact CG2-CE2 3.58Å; I777-F797 HydrophobicContact CG2-CG 4.03Å; I777-F797 HydrophobicContact CG2-CZ 3.96Å; A778-F797 HydrophobicContact CB-CE1 4.11Å; A778-F797 HydrophobicContact CB-CZ 4.36Å; I781-F797 HydrophobicContact CD1-CB 3.97Å; I781-F797 HydrophobicContact CD1-CD1 3.77Å; I781-F797 HydrophobicContact CD1-CE1 4.41Å; I781-F797 HydrophobicContact CD1-CG 3.96Å; I793-F797 WeakPolarHBondContact O-CB 3.35Å; I793-F797 PolarHBondContact O-N 3.32Å; K794-F797 PolarHBondContact O-N 3.2Å; D795-F797 VanDerWaalsContact C-N 3.34Å; D795-F797 PolarHBondContact O-N 3.23Å; F797-H800 PolarHBondContact O-N 2.97Å; F797-L801 HydrophobicContact CD1-CD1 4.18Å; F797-L801 HydrophobicContact CD2-CD1 4.48Å; F797-L801 HydrophobicContact CE1-CD1 3.75Å; F797-L801 HydrophobicContact CE2-CD1 4.16Å; F797-L801 HydrophobicContact CE2-CG 4.33Å; F797-L801 HydrophobicContact CZ-CD1 3.76Å; F797-L801 HydrophobicContact CZ-CG 4.39Å; F797-L801 WeakPolarHBondContact O-CG 3.43Å; F797-L801 PolarHBondContact O-N 3.22Å; F797-W824 HydrophobicContact CE1-CZ3 4.34Å; F797-W824 HydrophobicContact CZ-CZ3 4.37Å; F797-L828 HydrophobicContact CD1-CD1 4.27Å; F797-L828 HydrophobicContact CD1-CD2 4.41Å; F797-L828 HydrophobicContact CE1-CD1 4.02Å; F797-L828 HydrophobicContact CE1-CD2 4.34Å
798	I	89.8	Confident	86.7	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-65.6	-44.9	177.4	-68.3	166.2	0	0	0	110.5	K794 D795 H800 L801 F802 F841 K844 I845	K794-I798 HydrophobicContact CG-CD1 4.04Å; K794-I798 WeakPolarHBondContact O-CD1 3.39Å; K794-I798 VanDerWaalsContact O-CG1 3.28Å; K794-I798 WeakPolarHBondContact O-CG1 3.33Å; K794-I798 PolarHBondContact O-N 3.1Å; K794-I798 VanDerWaalsContact O-N 3.08Å; D795-I798 PolarHBondContact O-N 3.1Å; I798-H800 VanDerWaalsContact C-N 3.33Å; I798-H800 PolarHBondContact O-N 3.21Å; I798-L801 WeakPolarHBondContact O-CB 3.46Å; I798-L801 PolarHBondContact O-N 3.26Å; I798-F802 HydrophobicContact CG2-CD2 3.97Å; I798-F802 HydrophobicContact CG2-CE2 3.77Å; I798-F802 VanDerWaalsContact O-CD2 3.3Å; I798-F802 WeakPolarHBondContact O-CD2 3.32Å; I798-F802 PolarHBondContact O-N 3.09Å; I798-F802 VanDerWaalsContact O-N 3.08Å; I798-F841 HydrophobicContact CD1-CB 4.24Å; I798-F841 HydrophobicContact CD1-CD1 3.76Å; I798-F841 HydrophobicContact CD1-CE1 4.37Å; I798-F841 HydrophobicContact CD1-CG 4.35Å; I798-K844 HydrophobicContact CG2-CB 3.77Å; I798-K844 HydrophobicContact CG2-CD 4.04Å; I798-K844 HydrophobicContact CG2-CG 4.42Å; I798-I845 HydrophobicContact CD1-CD1 4.08Å; I798-I845 HydrophobicContact CD1-CG1 4.04Å; I798-I845 HydrophobicContact CG1-CG1 4.4Å
799	Q	89.7	Confident	86.8	Confident	96 Å²	96	35.4 Å²	35.4	45%	0.449	19%	0.193	S	C	.	.	H	α-helix	trans	-58.8	-43.6	173.8	-72.7	-177.4	30.1	0	0	111.6	D795 T796 L801 F802 V803	D795-Q799 VanDerWaalsContact CG-NE2 3.28Å; D795-Q799 WeakPolarHBondContact O-CB 3.43Å; D795-Q799 VanDerWaalsContact O-CG 3.28Å; D795-Q799 WeakPolarHBondContact O-CG 3.31Å; D795-Q799 PolarHBondContact O-N 3.29Å; D795-Q799 PolarHBondContact OD1-NE2 2.66Å; D795-Q799 PolarHBondContact OD2-NE2 3Å; T796-Q799 PolarHBondContact O-N 2.86Å; Q799-L801 PolarHBondContact O-N 3.16Å; Q799-F802 WeakPolarHBondContact O-CB 3.43Å; Q799-F802 PolarHBondContact O-N 3.19Å; Q799-V803 WeakPolarHBondContact O-CG2 3.43Å; Q799-V803 PolarHBondContact O-N 3.06Å
800	H	89.9	Confident	86.9	Confident	18.6667 Å²	18.6667	37.2 Å²	37.2	9%	0.086	20%	0.197	C	C	.	.	H	α-helix	trans	-62.9	-43.1	177.5	-75.1	-173	0	0	0	112	Y739 F743 I759 I761 T796 F797 I798 F802 V803 F804	Y739-H800 AromaticContact CZ-ND1 3.87Å; Y739-H800 PolarHBondContact OH-ND1 3.08Å; F743-H800 AromaticContact CD2-CE1 3.99Å; F743-H800 AromaticContact CD2-ND1 3.6Å; F743-H800 WeakPolarHBondContact CD2-ND1 3.28Å; F743-H800 HydrophobicContact CE2-CB 4.3Å; F743-H800 AromaticContact CE2-CE1 3.76Å; F743-H800 AromaticContact CE2-CG 3.94Å; F743-H800 AromaticContact CE2-ND1 3.29Å; F743-H800 WeakPolarHBondContact CE2-ND1 3.3Å; I759-H800 PolarHBondContact O-CE1 3Å; I759-H800 VanDerWaalsContact O-CE1 3.3Å; I759-H800 PolarHBondContact O-NE2 3.02Å; I761-H800 HydrophobicContact CD1-CB 3.7Å; I761-H800 VanDerWaalsContact CD1-CG 3.43Å; T796-H800 VanDerWaalsContact CG2-CE1 3.49Å; T796-H800 WeakPolarHBondContact CG2-CE1 3.45Å; T796-H800 VanDerWaalsContact O-CB 3.26Å; T796-H800 WeakPolarHBondContact O-CB 3.39Å; T796-H800 PolarHBondContact O-CD2 3.05Å; T796-H800 VanDerWaalsContact O-CD2 3.3Å; T796-H800 PolarHBondContact O-N 3.12Å; F797-H800 PolarHBondContact O-N 2.97Å; I798-H800 VanDerWaalsContact C-N 3.33Å; I798-H800 PolarHBondContact O-N 3.21Å; H800-F802 VanDerWaalsContact C-N 3.32Å; H800-F802 PolarHBondContact O-N 2.94Å; H800-V803 PolarHBondContact O-N 3.06Å; H800-V803 VanDerWaalsContact O-N 3.16Å; H800-F804 HydrophobicContact CB-CD2 4.45Å; H800-F804 HydrophobicContact CB-CE2 4.3Å; H800-F804 WeakPolarHBondContact O-CD2 3.36Å; H800-F804 PolarHBondContact O-N 2.94Å
801	L	89.4	Confident	87	Confident	2.5 Å²	2.5	37.1 Å²	37.1	1%	0.013	20%	0.197	C	C	.	.	H	α-helix	trans	-57.7	-42.6	172.2	-81.6	170.7	0	0	0	112.1	L774 F797 I798 Q799 V803 F804 C805 I815 W824 L825 L848	L774-L801 HydrophobicContact CD1-CD2 4.2Å; L774-L801 HydrophobicContact CD2-CD2 3.78Å; F797-L801 HydrophobicContact CD1-CD1 4.18Å; F797-L801 HydrophobicContact CD2-CD1 4.48Å; F797-L801 HydrophobicContact CE1-CD1 3.75Å; F797-L801 HydrophobicContact CE2-CD1 4.16Å; F797-L801 HydrophobicContact CE2-CG 4.33Å; F797-L801 HydrophobicContact CZ-CD1 3.76Å; F797-L801 HydrophobicContact CZ-CG 4.39Å; F797-L801 WeakPolarHBondContact O-CG 3.43Å; F797-L801 PolarHBondContact O-N 3.22Å; I798-L801 WeakPolarHBondContact O-CB 3.46Å; I798-L801 PolarHBondContact O-N 3.26Å; Q799-L801 PolarHBondContact O-N 3.16Å; L801-V803 VanDerWaalsContact C-N 3.35Å; L801-V803 PolarHBondContact O-N 3.19Å; L801-F804 PolarHBondContact O-N 3.12Å; L801-C805 VanDerWaalsContact O-CB 3.28Å; L801-C805 WeakPolarHBondContact O-CB 3.29Å; L801-C805 PolarHBondContact O-N 3.01Å; L801-C805 PolarHBondContact O-SG 2.94Å; L801-C805 VanDerWaalsContact O-SG 3.38Å; L801-I815 HydrophobicContact CD2-CD1 4.17Å; L801-W824 HydrophobicContact CD1-CZ3 4.45Å; L801-L825 HydrophobicContact CD1-CD2 4.07Å; L801-L848 HydrophobicContact CB-CD1 4.39Å; L801-L848 HydrophobicContact CB-CD2 3.81Å; L801-L848 HydrophobicContact CD1-CD2 3.91Å; L801-L848 HydrophobicContact CG-CD2 4.38Å
802	F	87.6	Confident	87.2	Confident	46.5 Å²	46.5	36.8 Å²	36.8	20%	0.204	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-42.5	174.4	-102.1	-74.7	0	0	0	112.9	I798 Q799 H800 C805 S806 K844 H847 L848 I851	I798-F802 HydrophobicContact CG2-CD2 3.97Å; I798-F802 HydrophobicContact CG2-CE2 3.77Å; I798-F802 VanDerWaalsContact O-CD2 3.3Å; I798-F802 WeakPolarHBondContact O-CD2 3.32Å; I798-F802 PolarHBondContact O-N 3.09Å; I798-F802 VanDerWaalsContact O-N 3.08Å; Q799-F802 WeakPolarHBondContact O-CB 3.43Å; Q799-F802 PolarHBondContact O-N 3.19Å; H800-F802 VanDerWaalsContact C-N 3.32Å; H800-F802 PolarHBondContact O-N 2.94Å; F802-C805 PolarHBondContact O-N 3.02Å; F802-S806 VanDerWaalsContact O-CB 3.23Å; F802-S806 WeakPolarHBondContact O-CB 3.42Å; F802-S806 PolarHBondContact O-N 3.2Å; F802-S806 PolarHBondContact O-OG 3.29Å; F802-K844 HydrophobicContact CE2-CB 4.04Å; F802-K844 HydrophobicContact CE2-CG 4.38Å; F802-K844 VanDerWaalsContact CE2-O 3.23Å; F802-K844 WeakPolarHBondContact CE2-O 3.36Å; F802-K844 HydrophobicContact CZ-CB 4.43Å; F802-K844 WeakPolarHBondContact CZ-O 3.38Å; F802-H847 HydrophobicContact CE1-CB 4.36Å; F802-H847 AromaticContact CE1-CD2 3.36Å; F802-H847 VanDerWaalsContact CE1-CD2 3.5Å; F802-H847 WeakPolarHBondContact CE1-CD2 3.4Å; F802-H847 AromaticContact CE2-CD2 3.31Å; F802-H847 WeakPolarHBondContact CE2-CD2 3.43Å; F802-H847 AromaticContact CE2-NE2 3.68Å; F802-H847 HydrophobicContact CZ-CB 4.13Å; F802-H847 AromaticContact CZ-CD2 3.61Å; F802-H847 VanDerWaalsContact CZ-CD2 3.47Å; F802-H847 WeakPolarHBondContact CZ-CD2 3.49Å; F802-H847 AromaticContact CZ-NE2 3.63Å; F802-L848 HydrophobicContact CD1-CD1 4.05Å; F802-L848 HydrophobicContact CD2-CD1 4.43Å; F802-L848 HydrophobicContact CE1-CB 4.08Å; F802-L848 HydrophobicContact CE1-CD1 4.08Å; F802-L848 HydrophobicContact CE2-CB 4.1Å; F802-L848 HydrophobicContact CG-CD1 4.43Å; F802-L848 HydrophobicContact CZ-CB 3.88Å; F802-L848 HydrophobicContact CZ-CD1 4.42Å; F802-I851 HydrophobicContact CD1-CD1 4.05Å; F802-I851 HydrophobicContact CD2-CD1 4.23Å; F802-I851 HydrophobicContact CE1-CD1 3.75Å; F802-I851 HydrophobicContact CE2-CD1 3.39Å; F802-I851 HydrophobicContact CZ-CD1 3.96Å
803	V	85.9	Confident	87.3	Confident	40 Å²	40	37.4 Å²	37.4	24%	0.242	19%	0.188	C	C	.	.	H	α-helix	trans	-65.2	-44.3	176.7	177	0	0	0	0	110.9	I761 K763 Q799 H800 L801 C805 S806 Q807	I761-V803 HydrophobicContact CB-CG1 3.88Å; I761-V803 HydrophobicContact CD1-CB 4.11Å; I761-V803 HydrophobicContact CD1-CG1 3.97Å; I761-V803 HydrophobicContact CG1-CG1 4.37Å; I761-V803 HydrophobicContact CG2-CB 4.34Å; I761-V803 HydrophobicContact CG2-CG1 3.73Å; K763-V803 HydrophobicContact CB-CG1 4.2Å; K763-V803 HydrophobicContact CG-CG1 3.99Å; Q799-V803 WeakPolarHBondContact O-CG2 3.43Å; Q799-V803 PolarHBondContact O-N 3.06Å; H800-V803 PolarHBondContact O-N 3.06Å; H800-V803 VanDerWaalsContact O-N 3.16Å; L801-V803 VanDerWaalsContact C-N 3.35Å; L801-V803 PolarHBondContact O-N 3.19Å; V803-C805 VanDerWaalsContact C-N 3.32Å; V803-C805 PolarHBondContact O-N 3.33Å; V803-S806 WeakPolarHBondContact CA-OG 3.32Å; V803-S806 PolarHBondContact O-N 3.16Å; V803-S806 PolarHBondContact O-OG 3.24Å; V803-Q807 VanDerWaalsContact CG1-CD 3.5Å; V803-Q807 HydrophobicContact CG1-CG 4Å; V803-Q807 VanDerWaalsContact CG1-NE2 3.27Å; V803-Q807 VanDerWaalsContact O-CB 3.3Å; V803-Q807 WeakPolarHBondContact O-CB 3.37Å; V803-Q807 VanDerWaalsContact O-CG 3.29Å; V803-Q807 WeakPolarHBondContact O-CG 3.43Å; V803-Q807 PolarHBondContact O-N 3.25Å
804	F	86.9	Confident	87.2	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.009	19%	0.191	C	C	.	.	H	α-helix	trans	-61	-44	175.7	-75.7	-61.8	0	0	0	112.8	F743 M746 T747 I761 V765 I768 H800 L801 S806 N808 N811	F743-F804 HydrophobicContact CE1-CZ 4.42Å; F743-F804 AromaticContact CE2-CE2 3.68Å; F743-F804 HydrophobicContact CE2-CE2 3.68Å; F743-F804 AromaticContact CE2-CZ 3.76Å; F743-F804 HydrophobicContact CE2-CZ 3.76Å; F743-F804 AromaticContact CZ-CE2 3.83Å; F743-F804 HydrophobicContact CZ-CE2 3.98Å; F743-F804 AromaticContact CZ-CZ 3.57Å; F743-F804 HydrophobicContact CZ-CZ 3.57Å; M746-F804 HydrophobicContact CE-CD2 4.46Å; M746-F804 HydrophobicContact CE-CE2 3.45Å; M746-F804 VanDerWaalsContact CE-CE2 3.45Å; M746-F804 HydrophobicContact CE-CZ 3.69Å; T747-F804 HydrophobicContact CG2-CE1 4.23Å; T747-F804 HydrophobicContact CG2-CZ 3.83Å; I761-F804 HydrophobicContact CD1-CD2 4.23Å; I761-F804 HydrophobicContact CD1-CE1 4.45Å; I761-F804 HydrophobicContact CD1-CE2 3.84Å; I761-F804 HydrophobicContact CD1-CZ 4.03Å; V765-F804 WeakPolarHBondContact O-CE1 3.43Å; I768-F804 HydrophobicContact CD1-CB 4.03Å; I768-F804 HydrophobicContact CD1-CD1 4.32Å; I768-F804 HydrophobicContact CD1-CD2 4.3Å; I768-F804 HydrophobicContact CD1-CG 3.99Å; I768-F804 HydrophobicContact CG1-CB 4.45Å; I768-F804 HydrophobicContact CG1-CD1 3.82Å; I768-F804 HydrophobicContact CG1-CD2 4.34Å; I768-F804 HydrophobicContact CG1-CE1 4.06Å; I768-F804 HydrophobicContact CG1-CG 3.97Å; I768-F804 HydrophobicContact CG1-CZ 4.39Å; H800-F804 HydrophobicContact CB-CD2 4.45Å; H800-F804 HydrophobicContact CB-CE2 4.3Å; H800-F804 WeakPolarHBondContact O-CD2 3.36Å; H800-F804 PolarHBondContact O-N 2.94Å; L801-F804 PolarHBondContact O-N 3.12Å; F804-S806 VanDerWaalsContact C-N 3.34Å; F804-S806 PolarHBondContact O-N 3.27Å; F804-N808 PolarHBondContact O-N 2.83Å; F804-N811 HydrophobicContact CB-CB 4.43Å; F804-N811 WeakPolarHBondContact O-CB 3.43Å; F804-N811 PolarHBondContact O-ND2 3.05Å
805	C	85.7	Confident	87.2	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.007	19%	0.191	C	C	.	.	H	α-helix	trans	-76.5	-25.8	-178.5	-71.6	0	0	0	0	113.4	L801 F802 V803 K812 I815 L848 I851	L801-C805 VanDerWaalsContact O-CB 3.28Å; L801-C805 WeakPolarHBondContact O-CB 3.29Å; L801-C805 PolarHBondContact O-N 3.01Å; L801-C805 PolarHBondContact O-SG 2.94Å; L801-C805 VanDerWaalsContact O-SG 3.38Å; F802-C805 PolarHBondContact O-N 3.02Å; V803-C805 VanDerWaalsContact C-N 3.32Å; V803-C805 PolarHBondContact O-N 3.33Å; C805-K812 HydrophobicContact CB-CG 4.16Å; C805-K812 WeakPolarHBondContact O-CE 3.29Å; C805-K812 WeakPolarHBondContact O-CG 3.34Å; C805-I815 WeakPolarHBondContact SG-CD1 3.27Å; C805-L848 HydrophobicContact CB-CD1 3.97Å; C805-I851 HydrophobicContact CB-CG2 4.4Å; C805-I851 WeakPolarHBondContact O-CG2 3.44Å
806	S	81.1	Confident	87.2	Confident	64.75 Å²	64.75	37.1 Å²	37.1	45%	0.453	19%	0.187	S	C	.	.	H	α-helix	trans	-73.7	-51.4	-178.9	53.6	0	0	0	0	112.5	F802 V803 F804 K812	F802-S806 VanDerWaalsContact O-CB 3.23Å; F802-S806 WeakPolarHBondContact O-CB 3.42Å; F802-S806 PolarHBondContact O-N 3.2Å; F802-S806 PolarHBondContact O-OG 3.29Å; V803-S806 WeakPolarHBondContact CA-OG 3.32Å; V803-S806 PolarHBondContact O-N 3.16Å; V803-S806 PolarHBondContact O-OG 3.24Å; F804-S806 VanDerWaalsContact C-N 3.34Å; F804-S806 PolarHBondContact O-N 3.27Å; S806-K812 WeakPolarHBondContact O-CE 3.48Å; S806-K812 PolarHBondContact O-NZ 3.34Å
807	Q	78.2	Confident	87.1	Confident	87.5 Å²	87.5	41.4 Å²	41.4	41%	0.409	20%	0.204	S	C	.	.	H	α-helix	trans	-88	-24.9	-171.7	-68.3	-174.4	-17.3	0	0	114.6	I761 S766 V803 P809	I761-Q807 PolarHBondContact O-NE2 3.18Å; S766-Q807 VanDerWaalsContact CB-OE1 3.23Å; V803-Q807 VanDerWaalsContact CG1-CD 3.5Å; V803-Q807 HydrophobicContact CG1-CG 4Å; V803-Q807 VanDerWaalsContact CG1-NE2 3.27Å; V803-Q807 VanDerWaalsContact O-CB 3.3Å; V803-Q807 WeakPolarHBondContact O-CB 3.37Å; V803-Q807 VanDerWaalsContact O-CG 3.29Å; V803-Q807 WeakPolarHBondContact O-CG 3.43Å; V803-Q807 PolarHBondContact O-N 3.25Å; Q807-P809 WeakPolarHBondContact O-CD 3.42Å
808	N	82.1	Confident	86.8	Confident	26 Å²	26	42.7 Å²	42.7	14%	0.139	21%	0.211	C	C	.	.			trans	-124.7	114	-174.4	-169	-25.8	0	0	0	112.7	S766 I767 F804 Y810 N811 K812	S766-N808 WeakPolarHBondContact O-CB 3.06Å; I767-N808 WeakPolarHBondContact CG1-ND2 3.21Å; F804-N808 PolarHBondContact O-N 2.83Å; N808-Y810 VanDerWaalsContact C-N 3.31Å; N808-Y810 PolarHBondContact O-N 3.16Å; N808-Y810 VanDerWaalsContact OD1-CB 3.3Å; N808-Y810 WeakPolarHBondContact OD1-CB 3.32Å; N808-Y810 PolarHBondContact OD1-N 3.13Å; N808-N811 HydrophobicContact CB-CB 4.19Å; N808-N811 WeakPolarHBondContact CB-ND2 3.45Å; N808-N811 PolarHBondContact ND2-ND2 3.43Å; N808-N811 WeakPolarHBondContact O-CB 3.43Å; N808-N811 PolarHBondContact O-N 3.31Å; N808-N811 VanDerWaalsContact O-N 3.11Å; N808-N811 PolarHBondContact OD1-N 3.37Å; N808-K812 PolarHBondContact O-N 3.21Å
809	P	82.7	Confident	86.6	Confident	67.5 Å²	67.5	47.1 Å²	47.1	44%	0.438	24%	0.242	S	C	.	.	H	α-helix	trans	-66.3	-25.6	179.5	27.9	-35	0	0	0	113.3	Q807 N811 K812 K813 Y855	Q807-P809 WeakPolarHBondContact O-CD 3.42Å; P809-N811 VanDerWaalsContact C-N 3.26Å; P809-N811 PolarHBondContact O-N 3.24Å; P809-K812 WeakPolarHBondContact O-CB 3.38Å; P809-K812 PolarHBondContact O-N 3.04Å; P809-K812 VanDerWaalsContact O-N 3.13Å; P809-K813 WeakPolarHBondContact O-CB 3.42Å; P809-K813 PolarHBondContact O-N 3.15Å; P809-Y855 HydrophobicContact CB-CE2 3.78Å; P809-Y855 PolarHBondContact O-OH 3.02Å
810	Y	85.7	Confident	86.4	Confident	132.75 Å²	132.75	45.1 Å²	45.1	52%	0.521	24%	0.236	S	C	.	.	H	α-helix	trans	-61.1	-44	174.3	-176.1	-92.5	0	0	0	110.9	I767 N808 K812 K813 T814	I767-Y810 HydrophobicContact CG2-CD1 4.23Å; I767-Y810 HydrophobicContact CG2-CE1 3.67Å; N808-Y810 VanDerWaalsContact C-N 3.31Å; N808-Y810 PolarHBondContact O-N 3.16Å; N808-Y810 VanDerWaalsContact OD1-CB 3.3Å; N808-Y810 WeakPolarHBondContact OD1-CB 3.32Å; N808-Y810 PolarHBondContact OD1-N 3.13Å; Y810-K812 VanDerWaalsContact C-N 3.31Å; Y810-K812 PolarHBondContact O-N 3.12Å; Y810-K813 WeakPolarHBondContact O-CB 3.39Å; Y810-K813 PolarHBondContact O-N 3.18Å; Y810-K813 VanDerWaalsContact O-N 3.12Å; Y810-T814 WeakPolarHBondContact CD1-OG1 3.42Å; Y810-T814 VanDerWaalsContact CE1-OG1 3.28Å; Y810-T814 WeakPolarHBondContact CE1-OG1 3.41Å; Y810-T814 PolarHBondContact O-N 2.98Å; Y810-T814 PolarHBondContact O-OG1 3.12Å
811	N	89.4	Confident	86.5	Confident	0.25 Å²	0.25	44.4 Å²	44.4	0%	0.001	23%	0.233	C	C	.	.	H	α-helix	trans	-61.3	-39	178	-66.9	-24.6	0	0	0	112.1	S766 I767 I768 F804 N808 P809 K813 T814 I815	S766-N811 PolarHBondContact O-ND2 2.94Å; I767-N811 WeakPolarHBondContact CA-OD1 3.39Å; I768-N811 HydrophobicContact CD1-CB 4.07Å; I768-N811 HydrophobicContact CG1-CB 4.49Å; I768-N811 PolarHBondContact N-OD1 3.47Å; F804-N811 HydrophobicContact CB-CB 4.43Å; F804-N811 WeakPolarHBondContact O-CB 3.43Å; F804-N811 PolarHBondContact O-ND2 3.05Å; N808-N811 HydrophobicContact CB-CB 4.19Å; N808-N811 WeakPolarHBondContact CB-ND2 3.45Å; N808-N811 PolarHBondContact ND2-ND2 3.43Å; N808-N811 WeakPolarHBondContact O-CB 3.43Å; N808-N811 PolarHBondContact O-N 3.31Å; N808-N811 VanDerWaalsContact O-N 3.11Å; N808-N811 PolarHBondContact OD1-N 3.37Å; P809-N811 VanDerWaalsContact C-N 3.26Å; P809-N811 PolarHBondContact O-N 3.24Å; N811-K813 VanDerWaalsContact C-N 3.31Å; N811-K813 PolarHBondContact O-N 3.29Å; N811-T814 PolarHBondContact O-N 3Å; N811-I815 VanDerWaalsContact O-CG1 3.29Å; N811-I815 WeakPolarHBondContact O-CG1 3.38Å; N811-I815 PolarHBondContact O-N 3.26Å
812	K	89.8	Confident	86.6	Confident	40.75 Å²	40.75	44.7 Å²	44.7	18%	0.177	23%	0.234	C	C	.	.	H	α-helix	trans	-58.8	-48.5	174.7	-61.8	-179	-175.2	177.9	0	110.8	C805 S806 N808 P809 Y810 I815 L816 I851 L852 Y855	C805-K812 HydrophobicContact CB-CG 4.16Å; C805-K812 WeakPolarHBondContact O-CE 3.29Å; C805-K812 WeakPolarHBondContact O-CG 3.34Å; S806-K812 WeakPolarHBondContact O-CE 3.48Å; S806-K812 PolarHBondContact O-NZ 3.34Å; N808-K812 PolarHBondContact O-N 3.21Å; P809-K812 WeakPolarHBondContact O-CB 3.38Å; P809-K812 PolarHBondContact O-N 3.04Å; P809-K812 VanDerWaalsContact O-N 3.13Å; Y810-K812 VanDerWaalsContact C-N 3.31Å; Y810-K812 PolarHBondContact O-N 3.12Å; K812-I815 PolarHBondContact O-N 3.07Å; K812-L816 WeakPolarHBondContact O-CB 3.41Å; K812-L816 VanDerWaalsContact O-CG 3.31Å; K812-L816 WeakPolarHBondContact O-CG 3.42Å; K812-L816 PolarHBondContact O-N 2.95Å; K812-I851 HydrophobicContact CD-CG2 4.41Å; K812-L852 HydrophobicContact CB-CD2 4.23Å; K812-L852 HydrophobicContact CG-CD2 4.43Å; K812-Y855 HydrophobicContact CB-CD1 3.53Å; K812-Y855 HydrophobicContact CB-CD2 4.34Å; K812-Y855 HydrophobicContact CB-CE1 3.77Å; K812-Y855 HydrophobicContact CB-CE2 4.46Å; K812-Y855 HydrophobicContact CB-CG 3.84Å; K812-Y855 HydrophobicContact CD-CD1 4.1Å; K812-Y855 HydrophobicContact CD-CD2 3.5Å; K812-Y855 VanDerWaalsContact CD-CD2 3.48Å; K812-Y855 HydrophobicContact CD-CE1 4.48Å; K812-Y855 HydrophobicContact CD-CE2 4.11Å; K812-Y855 HydrophobicContact CD-CG 3.48Å; K812-Y855 VanDerWaalsContact CD-CG 3.47Å; K812-Y855 HydrophobicContact CG-CD1 4.45Å; K812-Y855 HydrophobicContact CG-CG 4.31Å
813	K	88.4	Confident	86.7	Confident	74.75 Å²	74.75	43.7 Å²	43.7	33%	0.325	23%	0.231	S	C	.	.	H	α-helix	trans	-60.2	-46.1	175.7	-179.8	171.8	-175.1	100.2	0	111.9	P809 Y810 N811 I815 L816 Q817 Y855 E860	P809-K813 WeakPolarHBondContact O-CB 3.42Å; P809-K813 PolarHBondContact O-N 3.15Å; Y810-K813 WeakPolarHBondContact O-CB 3.39Å; Y810-K813 PolarHBondContact O-N 3.18Å; Y810-K813 VanDerWaalsContact O-N 3.12Å; N811-K813 VanDerWaalsContact C-N 3.31Å; N811-K813 PolarHBondContact O-N 3.29Å; K813-I815 VanDerWaalsContact C-N 3.28Å; K813-I815 PolarHBondContact O-N 3.03Å; K813-L816 PolarHBondContact O-N 2.95Å; K813-Q817 VanDerWaalsContact CE-NE2 3.32Å; K813-Q817 HydrophobicContact CG-CG 4.47Å; K813-Q817 WeakPolarHBondContact O-CB 3.33Å; K813-Q817 VanDerWaalsContact O-CG 3.27Å; K813-Q817 WeakPolarHBondContact O-CG 3.26Å; K813-Q817 PolarHBondContact O-N 3.22Å; K813-Q817 VanDerWaalsContact O-N 3.1Å; K813-Y855 HydrophobicContact CB-CE1 4.13Å; K813-E860 VanDerWaalsContact CD-OE1 3.25Å; K813-E860 WeakPolarHBondContact CD-OE1 3.45Å; K813-E860 WeakPolarHBondContact CE-OE1 3.27Å; K813-E860 VanDerWaalsContact CG-OE1 3.29Å; K813-E860 WeakPolarHBondContact CG-OE1 3.41Å; K813-E860 IonicContact NZ-OE1 3.27Å; K813-E860 PolarHBondContact NZ-OE1 3.11Å; K813-E860 IonicContact NZ-OE2 3.08Å; K813-E860 PolarHBondContact NZ-OE2 2.59Å
814	T	88.2	Confident	86.9	Confident	13.75 Å²	13.75	42 Å²	42	8%	0.084	22%	0.22	C	C	.	.	H	α-helix	trans	-61.5	-36.9	178.9	-52	0	0	0	0	112.4	P771 Y810 N811 Q817	P771-T814 HydrophobicContact CB-CG2 3.6Å; P771-T814 HydrophobicContact CG-CG2 3.67Å; Y810-T814 WeakPolarHBondContact CD1-OG1 3.42Å; Y810-T814 VanDerWaalsContact CE1-OG1 3.28Å; Y810-T814 WeakPolarHBondContact CE1-OG1 3.41Å; Y810-T814 PolarHBondContact O-N 2.98Å; Y810-T814 PolarHBondContact O-OG1 3.12Å; N811-T814 PolarHBondContact O-N 3Å; T814-Q817 PolarHBondContact O-N 3.35Å
815	I	90	Very high	87.1	Confident	1.75 Å²	1.75	42 Å²	42	1%	0.009	22%	0.22	C	C	.	.	H	α-helix	trans	-72.6	-43	176.3	-67.9	165	0	0	0	111.1	I768 L774 L801 C805 N811 K812 K813 Q817 L818 W821 L852	I768-I815 HydrophobicContact CD1-CD1 4Å; I768-I815 HydrophobicContact CD1-CG1 4.27Å; L774-I815 HydrophobicContact CD1-CD1 4.24Å; L774-I815 HydrophobicContact CD1-CG1 3.84Å; L801-I815 HydrophobicContact CD2-CD1 4.17Å; C805-I815 WeakPolarHBondContact SG-CD1 3.27Å; N811-I815 VanDerWaalsContact O-CG1 3.29Å; N811-I815 WeakPolarHBondContact O-CG1 3.38Å; N811-I815 PolarHBondContact O-N 3.26Å; K812-I815 PolarHBondContact O-N 3.07Å; K813-I815 VanDerWaalsContact C-N 3.28Å; K813-I815 PolarHBondContact O-N 3.03Å; I815-Q817 PolarHBondContact O-N 3.24Å; I815-L818 WeakPolarHBondContact O-CB 3.39Å; I815-L818 PolarHBondContact O-N 3.06Å; I815-W821 HydrophobicContact CG2-CB 4.48Å; I815-W821 HydrophobicContact CG2-CD2 4.46Å; I815-W821 HydrophobicContact CG2-CE3 4.43Å; I815-W821 HydrophobicContact CG2-CG 4.48Å; I815-L852 HydrophobicContact CB-CD2 4.11Å; I815-L852 HydrophobicContact CD1-CD2 4.48Å; I815-L852 HydrophobicContact CG2-CD1 3.74Å; I815-L852 HydrophobicContact CG2-CD2 4Å
816	L	88.5	Confident	87.2	Confident	22.25 Å²	22.25	42 Å²	42	12%	0.116	22%	0.22	C	C	.	.	H	α-helix	trans	-60.6	-26.5	174.9	-73.7	172.8	0	0	0	113.2	K812 K813 L818 W821 L852 Y855 V866	K812-L816 WeakPolarHBondContact O-CB 3.41Å; K812-L816 VanDerWaalsContact O-CG 3.31Å; K812-L816 WeakPolarHBondContact O-CG 3.42Å; K812-L816 PolarHBondContact O-N 2.95Å; K813-L816 PolarHBondContact O-N 2.95Å; L816-L818 VanDerWaalsContact C-N 3.32Å; L816-W821 HydrophobicContact CD2-CZ2 3.65Å; L816-L852 HydrophobicContact CD2-CB 4.12Å; L816-L852 HydrophobicContact CG-CD2 4.47Å; L816-Y855 HydrophobicContact CD1-CD1 3.79Å; L816-Y855 HydrophobicContact CD1-CE1 4.41Å; L816-V866 HydrophobicContact CD2-CG1 4.3Å
817	Q	87.9	Confident	87.6	Confident	127.25 Å²	127.25	43 Å²	43	60%	0.595	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-6.8	176.2	-72.5	177.7	-29.5	0	0	114.1	K813 T814 I815	K813-Q817 VanDerWaalsContact CE-NE2 3.32Å; K813-Q817 HydrophobicContact CG-CG 4.47Å; K813-Q817 WeakPolarHBondContact O-CB 3.33Å; K813-Q817 VanDerWaalsContact O-CG 3.27Å; K813-Q817 WeakPolarHBondContact O-CG 3.26Å; K813-Q817 PolarHBondContact O-N 3.22Å; K813-Q817 VanDerWaalsContact O-N 3.1Å; T814-Q817 PolarHBondContact O-N 3.35Å; I815-Q817 PolarHBondContact O-N 3.24Å
818	L	86.8	Confident	88	Confident	30.25 Å²	30.25	39.1 Å²	39.1	16%	0.158	20%	0.199	C	C	.	.	S	Bend	trans	-75.8	137.6	171.7	-71	173.1	0	0	0	110.5	P771 L774 I815 L816 V820 W821 W824	P771-L818 HydrophobicContact CB-CD1 4.16Å; P771-L818 HydrophobicContact CB-CD2 3.99Å; P771-L818 HydrophobicContact CB-CG 4.26Å; P771-L818 HydrophobicContact CG-CD2 4.2Å; P771-L818 WeakPolarHBondContact O-CD1 3.36Å; L774-L818 HydrophobicContact CB-CD1 4.48Å; L774-L818 HydrophobicContact CD1-CD1 4.22Å; I815-L818 WeakPolarHBondContact O-CB 3.39Å; I815-L818 PolarHBondContact O-N 3.06Å; L816-L818 VanDerWaalsContact C-N 3.32Å; L818-V820 PolarHBondContact O-N 3.27Å; L818-W821 HydrophobicContact CB-CB 4.13Å; L818-W824 HydrophobicContact CD1-CZ2 4.01Å
819	S	85	Confident	88.1	Confident	92.5 Å²	92.5	38 Å²	38	65%	0.647	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	130.3	174.6	51	0	0	0	0	111.3	W821	S819-W821 VanDerWaalsContact C-N 3.3Å; S819-W821 PolarHBondContact O-N 3.07Å
820	V	85.7	Confident	88	Confident	54.5 Å²	54.5	36.7 Å²	36.7	33%	0.33	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	44.8	175.5	-147	0	0	0	0	112.9	L818 Q822 D823 L873 L1787	L818-V820 PolarHBondContact O-N 3.27Å; V820-Q822 PolarHBondContact O-N 3.22Å; V820-D823 HydrophobicContact CB-CB 4.31Å; V820-D823 HydrophobicContact CG1-CB 3.5Å; V820-D823 VanDerWaalsContact CG1-CB 3.46Å; V820-D823 WeakPolarHBondContact O-CB 3.32Å; V820-D823 PolarHBondContact O-N 3.02Å; V820-L873 HydrophobicContact CG1-CD1 3.71Å; V820-L873 HydrophobicContact CG1-CD2 4.22Å; V820-L1787 HydrophobicContact CB-CD2 4.23Å; V820-L1787 HydrophobicContact CG1-CD2 4.17Å; V820-L1787 HydrophobicContact CG2-CD2 4.06Å
821	W	91.8	Very high	87.7	Confident	4 Å²	4	30.4 Å²	30.4	2%	0.015	16%	0.161	C	C	.	.	H	α-helix	trans	-65	-22	-176.3	66	-96.5	0	0	0	114.2	I815 L816 L818 S819 D823 W824 L825 I849 L852 L853 V866	I815-W821 HydrophobicContact CG2-CB 4.48Å; I815-W821 HydrophobicContact CG2-CD2 4.46Å; I815-W821 HydrophobicContact CG2-CE3 4.43Å; I815-W821 HydrophobicContact CG2-CG 4.48Å; L816-W821 HydrophobicContact CD2-CZ2 3.65Å; L818-W821 HydrophobicContact CB-CB 4.13Å; S819-W821 VanDerWaalsContact C-N 3.3Å; S819-W821 PolarHBondContact O-N 3.07Å; W821-D823 VanDerWaalsContact C-N 3.34Å; W821-W824 HydrophobicContact CB-CZ2 4.04Å; W821-W824 VanDerWaalsContact O-CE2 3.3Å; W821-L825 HydrophobicContact CE3-CD1 3.68Å; W821-L825 HydrophobicContact CZ3-CD1 3.76Å; W821-L825 WeakPolarHBondContact O-CG 3.15Å; W821-L825 PolarHBondContact O-N 3.06Å; W821-I849 HydrophobicContact CH2-CB 4.5Å; W821-I849 HydrophobicContact CH2-CG1 4.48Å; W821-I849 HydrophobicContact CH2-CG2 4.24Å; W821-I849 HydrophobicContact CZ3-CB 4.4Å; W821-I849 HydrophobicContact CZ3-CG1 4.04Å; W821-I849 HydrophobicContact CZ3-CG2 4.38Å; W821-L852 HydrophobicContact CD2-CD1 4.46Å; W821-L852 HydrophobicContact CE3-CD1 3.8Å; W821-L852 HydrophobicContact CH2-CB 3.68Å; W821-L852 HydrophobicContact CH2-CD1 3.9Å; W821-L852 HydrophobicContact CH2-CG 4.45Å; W821-L852 HydrophobicContact CZ2-CB 4.17Å; W821-L852 HydrophobicContact CZ3-CB 4.12Å; W821-L852 HydrophobicContact CZ3-CD1 3.42Å; W821-L852 VanDerWaalsContact CZ3-CD1 3.43Å; W821-L852 HydrophobicContact CZ3-CG 4.41Å; W821-L853 HydrophobicContact CH2-CD2 4.49Å; W821-L853 HydrophobicContact CH2-CG 4.4Å; W821-L853 HydrophobicContact CZ2-CD2 4.35Å; W821-V866 HydrophobicContact CZ2-CG1 3.77Å
822	Q	91.4	Very high	87.1	Confident	8.75 Å²	8.75	32.1 Å²	32.1	4%	0.041	17%	0.167	C	C	.	.	H	α-helix	trans	-70	-42.4	177.1	-48.2	94.2	-42.1	0	0	111.3	V820 W824 L825 L826 V866 T870 L873	V820-Q822 PolarHBondContact O-N 3.22Å; Q822-W824 PolarHBondContact O-N 2.98Å; Q822-L825 WeakPolarHBondContact O-CB 3.34Å; Q822-L825 PolarHBondContact O-N 3.04Å; Q822-L825 VanDerWaalsContact O-N 3.15Å; Q822-L826 HydrophobicContact CB-CD1 4.43Å; Q822-L826 WeakPolarHBondContact O-CB 3.49Å; Q822-L826 WeakPolarHBondContact O-CD1 3.36Å; Q822-L826 VanDerWaalsContact O-CG 3.26Å; Q822-L826 WeakPolarHBondContact O-CG 3.27Å; Q822-L826 PolarHBondContact O-N 3.15Å; Q822-V866 VanDerWaalsContact NE2-CG1 3.28Å; Q822-V866 PolarHBondContact NE2-O 3.23Å; Q822-T870 HydrophobicContact CB-CG2 4.33Å; Q822-T870 HydrophobicContact CG-CG2 4.2Å; Q822-T870 WeakPolarHBondContact CG-OG1 3.34Å; Q822-T870 PolarHBondContact NE2-OG1 3.1Å; Q822-L873 HydrophobicContact CB-CD1 3.91Å; Q822-L873 HydrophobicContact CG-CD1 4.38Å
823	D	89.2	Confident	86.4	Confident	26 Å²	26	30.7 Å²	30.7	14%	0.139	16%	0.162	C	C	.	.	H	α-helix	trans	-58.2	-50.6	-176.3	170.1	64.2	0	0	0	111.7	K775 V820 W821 L825 L826 H827 L873 H877	K775-D823 IonicContact NZ-OD2 2.74Å; V820-D823 HydrophobicContact CB-CB 4.31Å; V820-D823 HydrophobicContact CG1-CB 3.5Å; V820-D823 VanDerWaalsContact CG1-CB 3.46Å; V820-D823 WeakPolarHBondContact O-CB 3.32Å; V820-D823 PolarHBondContact O-N 3.02Å; W821-D823 VanDerWaalsContact C-N 3.34Å; D823-L825 VanDerWaalsContact C-N 3.29Å; D823-L825 PolarHBondContact O-N 3.11Å; D823-L826 PolarHBondContact O-N 3.12Å; D823-H827 WeakPolarHBondContact O-CB 3.41Å; D823-H827 PolarHBondContact O-N 3.24Å; D823-H827 PolarHBondContact O-ND1 3.09Å; D823-H827 IonicContact OD1-CE1 3.09Å; D823-H827 PolarHBondContact OD1-CE1 3.09Å; D823-H827 IonicContact OD1-ND1 2.92Å; D823-H827 PolarHBondContact OD1-ND1 3.14Å; D823-H827 VanDerWaalsContact OD1-ND1 3.12Å; D823-H827 IonicContact OD2-CE1 3.87Å; D823-H827 IonicContact OD2-ND1 3.74Å; D823-H827 PolarHBondContact OD2-ND1 3.49Å; D823-L873 HydrophobicContact CB-CD1 4.24Å; D823-L873 HydrophobicContact CB-CD2 4.21Å; D823-H877 PolarHBondContact O-NE2 3.01Å; D823-H877 IonicContact OD1-CE1 3.7Å; D823-H877 PolarHBondContact OD1-CE1 2.95Å; D823-H877 IonicContact OD1-NE2 2.64Å
824	W	90	Very high	85.8	Confident	4 Å²	4	32.8 Å²	32.8	2%	0.015	18%	0.177	C	C	.	.	H	α-helix	trans	-75	-17.5	-179.4	64.5	-107.7	0	0	0	114	L774 K775 A778 F797 L801 L818 W821 Q822 L828	L774-W824 HydrophobicContact CB-CH2 3.94Å; L774-W824 HydrophobicContact CB-CZ2 4.16Å; L774-W824 HydrophobicContact CB-CZ3 4.3Å; L774-W824 HydrophobicContact CD1-CH2 4.1Å; L774-W824 HydrophobicContact CD1-CZ2 4.39Å; L774-W824 HydrophobicContact CG-CH2 4.42Å; K775-W824 HydrophobicContact CB-CD2 4.47Å; K775-W824 HydrophobicContact CB-CG 4.15Å; K775-W824 HydrophobicContact CG-CB 4.25Å; K775-W824 HydrophobicContact CG-CG 4.24Å; A778-W824 HydrophobicContact CB-CB 4.23Å; A778-W824 HydrophobicContact CB-CD2 4.13Å; A778-W824 HydrophobicContact CB-CE3 3.44Å; A778-W824 VanDerWaalsContact CB-CE3 3.44Å; A778-W824 HydrophobicContact CB-CG 4.38Å; A778-W824 HydrophobicContact CB-CZ3 4.2Å; F797-W824 HydrophobicContact CE1-CZ3 4.34Å; F797-W824 HydrophobicContact CZ-CZ3 4.37Å; L801-W824 HydrophobicContact CD1-CZ3 4.45Å; L818-W824 HydrophobicContact CD1-CZ2 4.01Å; W821-W824 HydrophobicContact CB-CZ2 4.04Å; W821-W824 VanDerWaalsContact O-CE2 3.3Å; Q822-W824 PolarHBondContact O-N 2.98Å; W824-L828 WeakPolarHBondContact O-CG 3.23Å
825	L	90.8	Very high	85.2	Confident	1.25 Å²	1.25	37 Å²	37	1%	0.007	20%	0.199	C	C	.	.	H	α-helix	trans	-76.4	-43.1	167.3	-79.6	-179.9	0	0	0	111.6	L801 W821 Q822 D823 L828 I845 L848 I849 L852	L801-L825 HydrophobicContact CD1-CD2 4.07Å; W821-L825 HydrophobicContact CE3-CD1 3.68Å; W821-L825 HydrophobicContact CZ3-CD1 3.76Å; W821-L825 WeakPolarHBondContact O-CG 3.15Å; W821-L825 PolarHBondContact O-N 3.06Å; Q822-L825 WeakPolarHBondContact O-CB 3.34Å; Q822-L825 PolarHBondContact O-N 3.04Å; Q822-L825 VanDerWaalsContact O-N 3.15Å; D823-L825 VanDerWaalsContact C-N 3.29Å; D823-L825 PolarHBondContact O-N 3.11Å; L825-L828 HydrophobicContact CD2-CD1 4.05Å; L825-L828 WeakPolarHBondContact O-CB 3.35Å; L825-L828 PolarHBondContact O-N 3Å; L825-I845 HydrophobicContact CB-CG2 4.14Å; L825-I845 WeakPolarHBondContact O-CD1 3.35Å; L825-L848 HydrophobicContact CD1-CD2 4.18Å; L825-L848 HydrophobicContact CD2-CD2 4.03Å; L825-I849 HydrophobicContact CB-CD1 4.5Å; L825-I849 HydrophobicContact CD1-CG1 4.06Å; L825-L852 HydrophobicContact CD1-CD1 4.45Å
826	L	89.4	Confident	84.6	Confident	1.75 Å²	1.75	41 Å²	41	1%	0.009	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-44.9	178.7	-73.7	157.5	0	0	0	110.7	Q822 D823 L828 V829 L831 I849 L873 I874 H877	Q822-L826 HydrophobicContact CB-CD1 4.43Å; Q822-L826 WeakPolarHBondContact O-CB 3.49Å; Q822-L826 WeakPolarHBondContact O-CD1 3.36Å; Q822-L826 VanDerWaalsContact O-CG 3.26Å; Q822-L826 WeakPolarHBondContact O-CG 3.27Å; Q822-L826 PolarHBondContact O-N 3.15Å; D823-L826 PolarHBondContact O-N 3.12Å; L826-L828 PolarHBondContact O-N 3.12Å; L826-L828 VanDerWaalsContact O-N 3.08Å; L826-V829 PolarHBondContact O-N 3.02Å; L826-V829 VanDerWaalsContact O-N 3.14Å; L826-L831 HydrophobicContact CD2-CD2 4.16Å; L826-L831 HydrophobicContact CG-CD2 4.43Å; L826-I849 HydrophobicContact CD2-CD1 3.89Å; L826-I849 HydrophobicContact CG-CD1 4.39Å; L826-L873 HydrophobicContact CD1-CB 4.32Å; L826-I874 HydrophobicContact CD1-CG1 3.76Å; L826-I874 HydrophobicContact CD2-CG1 4.04Å; L826-I874 HydrophobicContact CG-CG1 4.41Å; L826-H877 VanDerWaalsContact CB-CD2 3.46Å; L826-H877 WeakPolarHBondContact CB-CD2 3.27Å; L826-H877 WeakPolarHBondContact CB-NE2 3.23Å
827	H	88.2	Confident	84.2	Confident	84.5 Å²	84.5	41.9 Å²	41.9	39%	0.391	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-15.1	177.1	-85.7	102.1	0	0	0	115.4	A782 D823 V829 H877	A782-H827 HydrophobicContact CB-CB 4.39Å; A782-H827 WeakPolarHBondContact CB-O 3.38Å; D823-H827 WeakPolarHBondContact O-CB 3.41Å; D823-H827 PolarHBondContact O-N 3.24Å; D823-H827 PolarHBondContact O-ND1 3.09Å; D823-H827 IonicContact OD1-CE1 3.09Å; D823-H827 PolarHBondContact OD1-CE1 3.09Å; D823-H827 IonicContact OD1-ND1 2.92Å; D823-H827 PolarHBondContact OD1-ND1 3.14Å; D823-H827 VanDerWaalsContact OD1-ND1 3.12Å; D823-H827 IonicContact OD2-CE1 3.87Å; D823-H827 IonicContact OD2-ND1 3.74Å; D823-H827 PolarHBondContact OD2-ND1 3.49Å; H827-V829 VanDerWaalsContact C-N 3.27Å; H827-V829 PolarHBondContact O-N 3.2Å; H827-H877 AromaticContact CD2-CE1 3.59Å; H827-H877 PolarHBondContact CD2-CE1 3.29Å; H827-H877 VanDerWaalsContact CD2-CE1 3.49Å; H827-H877 AromaticContact CD2-NE2 3.75Å; H827-H877 AromaticContact CE1-CD2 3.88Å; H827-H877 AromaticContact CE1-CE1 3.64Å; H827-H877 PolarHBondContact CE1-CE1 2.88Å; H827-H877 AromaticContact CE1-ND1 3.71Å; H827-H877 AromaticContact CE1-NE2 3.47Å; H827-H877 PolarHBondContact CE1-NE2 3.37Å; H827-H877 AromaticContact CG-CE1 3.94Å; H827-H877 AromaticContact CG-NE2 3.44Å; H827-H877 PolarHBondContact N-NE2 3.31Å; H827-H877 AromaticContact ND1-CD2 3.81Å; H827-H877 AromaticContact ND1-CE1 3.68Å; H827-H877 PolarHBondContact ND1-CE1 2.66Å; H827-H877 AromaticContact ND1-NE2 3.23Å; H827-H877 PolarHBondContact ND1-NE2 3.09Å; H827-H877 VanDerWaalsContact ND1-NE2 3.14Å; H827-H877 AromaticContact NE2-CE1 3.66Å; H827-H877 PolarHBondContact NE2-CE1 3.27Å; H827-H877 VanDerWaalsContact NE2-CE1 3.32Å; H827-H877 AromaticContact NE2-ND1 3.73Å; H827-H877 AromaticContact NE2-NE2 3.85Å
828	L	86.5	Confident	83.9	Confident	5.75 Å²	5.75	36.8 Å²	36.8	3%	0.03	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-25.6	175.6	-71.7	169.6	0	0	0	112.9	A778 I781 K794 F797 W824 L825 L826 I845	A778-L828 HydrophobicContact CB-CD1 4.42Å; A778-L828 HydrophobicContact CB-CD2 4.02Å; A778-L828 HydrophobicContact CB-CG 4.19Å; A778-L828 WeakPolarHBondContact O-CD2 3.28Å; I781-L828 HydrophobicContact CB-CD2 3.92Å; I781-L828 HydrophobicContact CD1-CD2 4.48Å; I781-L828 HydrophobicContact CG2-CD2 3.76Å; K794-L828 WeakPolarHBondContact CE-O 3.44Å; K794-L828 PolarHBondContact NZ-O 3.04Å; F797-L828 HydrophobicContact CD1-CD1 4.27Å; F797-L828 HydrophobicContact CD1-CD2 4.41Å; F797-L828 HydrophobicContact CE1-CD1 4.02Å; F797-L828 HydrophobicContact CE1-CD2 4.34Å; W824-L828 WeakPolarHBondContact O-CG 3.23Å; L825-L828 HydrophobicContact CD2-CD1 4.05Å; L825-L828 WeakPolarHBondContact O-CB 3.35Å; L825-L828 PolarHBondContact O-N 3Å; L826-L828 PolarHBondContact O-N 3.12Å; L826-L828 VanDerWaalsContact O-N 3.08Å; L828-I845 HydrophobicContact CB-CD1 3.68Å; L828-I845 HydrophobicContact CD1-CD1 3.95Å; L828-I845 HydrophobicContact CG-CD1 4.44Å
829	V	84.2	Confident	83.5	Confident	3.5 Å²	3.5	35.6 Å²	35.6	2%	0.021	20%	0.198	C	C	.	.	S	Bend	trans	-142.3	129.9	-170.5	-178.8	0	0	0	0	110.4	L826 H827 L831 N838 F841 L842 I845	L826-V829 PolarHBondContact O-N 3.02Å; L826-V829 VanDerWaalsContact O-N 3.14Å; H827-V829 VanDerWaalsContact C-N 3.27Å; H827-V829 PolarHBondContact O-N 3.2Å; V829-L831 PolarHBondContact O-N 3.02Å; V829-L831 VanDerWaalsContact O-N 3.15Å; V829-N838 HydrophobicContact CG1-CB 4.3Å; V829-N838 VanDerWaalsContact CG1-O 3.28Å; V829-N838 WeakPolarHBondContact CG1-O 3.29Å; V829-F841 HydrophobicContact CG1-CB 4.3Å; V829-F841 HydrophobicContact CG2-CB 3.41Å; V829-F841 VanDerWaalsContact CG2-CB 3.44Å; V829-F841 HydrophobicContact CG2-CG 4.43Å; V829-L842 HydrophobicContact CG1-CB 3.87Å; V829-L842 HydrophobicContact CG1-CD1 4.43Å; V829-I845 HydrophobicContact CB-CD1 4.27Å; V829-I845 HydrophobicContact CG2-CD1 3.45Å; V829-I845 VanDerWaalsContact CG2-CD1 3.47Å; V829-I845 HydrophobicContact CG2-CG1 4.4Å
830	P	81	Confident	83.4	Confident	40 Å²	40	33.3 Å²	33.3	26%	0.26	18%	0.179	S	C	.	.			trans	-59.7	129.7	173.6	25.5	-34.4	0	0	0	110.6	Y832 P833 N838 E881	P830-Y832 CarbonylContact O-C 3.38Å; P830-Y832 PolarHBondContact O-N 3.07Å; P830-P833 WeakPolarHBondContact O-CD 3.31Å; P830-N838 HydrophobicContact CG-CB 4.44Å; P830-E881 VanDerWaalsContact C-OE1 3.27Å; P830-E881 VanDerWaalsContact CA-OE1 3.28Å; P830-E881 WeakPolarHBondContact CA-OE1 3.41Å; P830-E881 WeakPolarHBondContact CB-OE1 3.38Å
831	L	80	Confident	83.4	Confident	0.5 Å²	0.5	31.3 Å²	31.3	0%	0.003	17%	0.166	C	C	.	.	S	Bend	trans	-69.1	-17.3	-179.2	-58.2	-177.9	0	0	0	111.7	L826 V829 P833 L842 I874 H877 I878 E881 Y1055 V1056	L826-L831 HydrophobicContact CD2-CD2 4.16Å; L826-L831 HydrophobicContact CG-CD2 4.43Å; V829-L831 PolarHBondContact O-N 3.02Å; V829-L831 VanDerWaalsContact O-N 3.15Å; L831-P833 VanDerWaalsContact C-CD 3.45Å; L831-P833 WeakPolarHBondContact O-CD 3.27Å; L831-L842 HydrophobicContact CD2-CD1 3.72Å; L831-L842 HydrophobicContact CD2-CD2 4.49Å; L831-L842 WeakPolarHBondContact O-CD2 3.49Å; L831-I874 HydrophobicContact CD1-CG2 4.28Å; L831-H877 HydrophobicContact CD1-CB 3.78Å; L831-H877 VanDerWaalsContact CD1-CD2 3.45Å; L831-H877 WeakPolarHBondContact CD1-CD2 3.42Å; L831-I878 HydrophobicContact CB-CG1 4.42Å; L831-I878 HydrophobicContact CD1-CD1 4.33Å; L831-I878 HydrophobicContact CD1-CG1 3.56Å; L831-E881 WeakPolarHBondContact CA-OE2 3.34Å; L831-E881 VanDerWaalsContact CB-OE2 3.23Å; L831-E881 WeakPolarHBondContact CB-OE2 3.42Å; L831-E881 VanDerWaalsContact N-CD 3.29Å; L831-E881 PolarHBondContact N-OE1 3.24Å; L831-E881 PolarHBondContact N-OE2 3.13Å; L831-Y1055 PolarHBondContact O-OH 3.12Å; L831-V1056 HydrophobicContact CB-CG2 4.39Å; L831-V1056 HydrophobicContact CD2-CG1 4.29Å; L831-V1056 HydrophobicContact CD2-CG2 4.46Å
832	Y	76.5	Confident	83.1	Confident	36.75 Å²	36.75	31.3 Å²	31.3	14%	0.144	17%	0.166	C	C	.	.	S	Bend	trans	-103	91	159.2	-63.3	-85.4	0	0	0	110	P830 N834 I878 E881 R882 L1002 Y1055 Q1427 L1428	P830-Y832 CarbonylContact O-C 3.38Å; P830-Y832 PolarHBondContact O-N 3.07Å; Y832-N834 PolarHBondContact O-N 2.87Å; Y832-N834 PolarHBondContact O-OD1 2.99Å; Y832-I878 HydrophobicContact CE2-CG2 4.35Å; Y832-E881 HydrophobicContact CD2-CB 4.19Å; Y832-E881 HydrophobicContact CD2-CG 4.07Å; Y832-E881 VanDerWaalsContact CD2-OE2 3.28Å; Y832-E881 WeakPolarHBondContact CD2-OE2 3.33Å; Y832-E881 HydrophobicContact CE2-CB 4.47Å; Y832-E881 PolarHBondContact N-OE1 3Å; Y832-E881 PolarHBondContact N-OE2 2.92Å; Y832-R882 HydrophobicContact CE2-CG 4.27Å; Y832-R882 PolarHBondContact OH-NE 3.04Å; Y832-R882 PolarHBondContact OH-NH2 3.16Å; Y832-R882 VanDerWaalsContact OH-NH2 3.09Å; Y832-L1002 HydrophobicContact CD1-CD2 3.99Å; Y832-Y1055 HydrophobicContact CD1-CE1 4.21Å; Y832-Y1055 VanDerWaalsContact CD1-OH 3.27Å; Y832-Y1055 WeakPolarHBondContact CD1-OH 3.42Å; Y832-Y1055 HydrophobicContact CE1-CD1 4.35Å; Y832-Y1055 AromaticContact CE1-CE1 3.87Å; Y832-Y1055 HydrophobicContact CE1-CE1 3.93Å; Y832-Q1427 HydrophobicContact CE1-CB 4.12Å; Y832-Q1427 HydrophobicContact CE1-CG 4.13Å; Y832-L1428 VanDerWaalsContact CB-CD1 3.49Å; Y832-L1428 HydrophobicContact CD1-CD1 3.68Å; Y832-L1428 HydrophobicContact CD1-CG 3.68Å; Y832-L1428 HydrophobicContact CD2-CD1 4.29Å; Y832-L1428 HydrophobicContact CE1-CD1 4.35Å; Y832-L1428 HydrophobicContact CE1-CG 3.91Å; Y832-L1428 HydrophobicContact CG-CD1 3.78Å; Y832-L1428 HydrophobicContact CG-CG 4.38Å
833	P	74.8	Confident	82.7	Confident	11 Å²	11	32.6 Å²	32.6	7%	0.071	17%	0.174	C	C	.	.			trans	-72.3	116	-175.2	26.9	-34.8	0	0	0	112.3	P830 L831 N835 N838 A839 L842 Y1055 L1420 L1421 S1424	P830-P833 WeakPolarHBondContact O-CD 3.31Å; L831-P833 VanDerWaalsContact C-CD 3.45Å; L831-P833 WeakPolarHBondContact O-CD 3.27Å; P833-N835 VanDerWaalsContact C-N 3.28Å; P833-N835 PolarHBondContact O-N 3.05Å; P833-N838 HydrophobicContact CB-CB 3.78Å; P833-A839 HydrophobicContact CB-CB 3.97Å; P833-A839 HydrophobicContact CG-CB 3.91Å; P833-L842 HydrophobicContact CG-CD2 4.17Å; P833-Y1055 WeakPolarHBondContact CD-OH 3.47Å; P833-L1420 HydrophobicContact CG-CD2 3.52Å; P833-L1421 WeakPolarHBondContact O-CD2 3.45Å; P833-S1424 PolarHBondContact O-OG 3.3Å
834	N	75.9	Confident	82.5	Confident	118.25 Å²	118.25	33.6 Å²	33.6	63%	0.632	18%	0.178	S	C	*	.	S	Bend	trans	-73.3	-18.9	177.7	-63.3	-24.7	0	0	0	114.3	Y832 R1425	Y832-N834 PolarHBondContact O-N 2.87Å; Y832-N834 PolarHBondContact O-OD1 2.99Å; N834-R1425 PolarHBondContact O-NH2 3.31Å
835	N	76.5	Confident	82.5	Confident	103.25 Å²	103.25	33.5 Å²	33.5	55%	0.552	18%	0.177	S	C	*	.	S	Bend	trans	-136.5	152.2	-171.9	-75	-30.2	0	0	0	111.7	P833 A837 N838 A839	P833-N835 VanDerWaalsContact C-N 3.28Å; P833-N835 PolarHBondContact O-N 3.05Å; N835-A837 VanDerWaalsContact C-N 3.26Å; N835-A837 PolarHBondContact O-N 3.07Å; N835-N838 WeakPolarHBondContact O-CA 3.3Å; N835-N838 WeakPolarHBondContact O-CB 3.39Å; N835-N838 PolarHBondContact O-N 3.18Å; N835-A839 PolarHBondContact O-N 3.14Å
836	K	76.9	Confident	82.3	Confident	85 Å²	85	34 Å²	34	37%	0.37	18%	0.18	S	C	.	.	H	α-helix	trans	-54.7	-38.6	178.6	-172.3	175.9	-175.3	-176.2	0	112.8	A839 N840 L927 G928 V929 E1414 T1417 L1421	K836-A839 WeakPolarHBondContact O-CB 3.45Å; K836-A839 PolarHBondContact O-N 3.22Å; K836-N840 WeakPolarHBondContact O-CB 3.43Å; K836-N840 PolarHBondContact O-N 3.21Å; K836-N840 PolarHBondContact O-ND2 2.82Å; K836-N840 PolarHBondContact O-OD1 3.1Å; K836-L927 HydrophobicContact CB-CB 4.11Å; K836-L927 HydrophobicContact CB-CD1 4.36Å; K836-L927 HydrophobicContact CB-CD2 4.09Å; K836-L927 HydrophobicContact CB-CG 4.43Å; K836-L927 HydrophobicContact CD-CB 4.47Å; K836-L927 HydrophobicContact CD-CD2 3.96Å; K836-G928 PolarHBondContact NZ-O 3.02Å; K836-V929 HydrophobicContact CB-CG2 4.35Å; K836-V929 HydrophobicContact CD-CG2 3.69Å; K836-V929 HydrophobicContact CG-CG2 3.52Å; K836-E1414 WeakPolarHBondContact CE-OE1 3.37Å; K836-E1414 IonicContact NZ-OE1 3Å; K836-E1414 PolarHBondContact NZ-OE1 2.91Å; K836-E1414 IonicContact NZ-OE2 3.27Å; K836-E1414 PolarHBondContact NZ-OE2 3.46Å; K836-T1417 HydrophobicContact CB-CG2 4.5Å; K836-T1417 HydrophobicContact CG-CG2 3.64Å; K836-T1417 WeakPolarHBondContact O-CG2 3.24Å; K836-L1421 HydrophobicContact CB-CD1 3.91Å; K836-L1421 HydrophobicContact CG-CD1 4.35Å
837	A	79.7	Confident	82.1	Confident	40.25 Å²	40.25	36.1 Å²	36.1	33%	0.333	19%	0.189	S	C	.	.	H	α-helix	trans	-60.9	-45.7	174.7	0	0	0	0	0	112.4	L791 N835 A839 N840 F841	L791-A837 HydrophobicContact CD2-CB 3.85Å; L791-A837 HydrophobicContact CG-CB 4.43Å; N835-A837 VanDerWaalsContact C-N 3.26Å; N835-A837 PolarHBondContact O-N 3.07Å; A837-A839 VanDerWaalsContact C-N 3.33Å; A837-A839 PolarHBondContact O-N 3.21Å; A837-N840 WeakPolarHBondContact O-CB 3.39Å; A837-N840 PolarHBondContact O-N 3.14Å; A837-F841 VanDerWaalsContact C-CD2 3.46Å; A837-F841 HydrophobicContact CB-CD2 4.41Å; A837-F841 HydrophobicContact CB-CE2 4.19Å; A837-F841 WeakPolarHBondContact O-CD2 3.29Å; A837-F841 VanDerWaalsContact O-CG 3.27Å; A837-F841 WeakPolarHBondContact O-CG 3.26Å; A837-F841 PolarHBondContact O-N 2.98Å
838	N	81.8	Confident	82.2	Confident	20.5 Å²	20.5	32.2 Å²	32.2	11%	0.11	17%	0.171	C	C	.	.	H	α-helix	trans	-66.5	-37.1	177.7	-74.7	-10.7	0	0	0	112	K794 V829 P830 P833 N835 N840 F841 L842	K794-N838 PolarHBondContact NZ-OD1 2.9Å; K794-N838 VanDerWaalsContact NZ-OD1 3.13Å; V829-N838 HydrophobicContact CG1-CB 4.3Å; V829-N838 VanDerWaalsContact CG1-O 3.28Å; V829-N838 WeakPolarHBondContact CG1-O 3.29Å; P830-N838 HydrophobicContact CG-CB 4.44Å; P833-N838 HydrophobicContact CB-CB 3.78Å; N835-N838 WeakPolarHBondContact O-CA 3.3Å; N835-N838 WeakPolarHBondContact O-CB 3.39Å; N835-N838 PolarHBondContact O-N 3.18Å; N838-N840 VanDerWaalsContact C-N 3.34Å; N838-N840 PolarHBondContact O-N 3.06Å; N838-F841 PolarHBondContact O-N 3.11Å; N838-L842 WeakPolarHBondContact O-CB 3.42Å; N838-L842 PolarHBondContact O-N 3.19Å
839	A	78.1	Confident	82.4	Confident	5 Å²	5	31.9 Å²	31.9	4%	0.041	17%	0.17	C	C	.	.	H	α-helix	trans	-63.3	-42.6	173.4	0	0	0	0	0	111.6	P833 N835 K836 A837 F841 L842 V843 T1417 L1420 L1421	P833-A839 HydrophobicContact CB-CB 3.97Å; P833-A839 HydrophobicContact CG-CB 3.91Å; N835-A839 PolarHBondContact O-N 3.14Å; K836-A839 WeakPolarHBondContact O-CB 3.45Å; K836-A839 PolarHBondContact O-N 3.22Å; A837-A839 VanDerWaalsContact C-N 3.33Å; A837-A839 PolarHBondContact O-N 3.21Å; A839-F841 VanDerWaalsContact C-N 3.31Å; A839-F841 PolarHBondContact O-N 3.08Å; A839-L842 WeakPolarHBondContact O-CB 3.46Å; A839-L842 PolarHBondContact O-N 3.29Å; A839-L842 VanDerWaalsContact O-N 3.11Å; A839-V843 WeakPolarHBondContact O-CG2 3.29Å; A839-V843 PolarHBondContact O-N 3.15Å; A839-V843 VanDerWaalsContact O-N 3.1Å; A839-T1417 HydrophobicContact CB-CG2 3.78Å; A839-T1417 WeakPolarHBondContact CB-O 3.4Å; A839-L1420 HydrophobicContact CB-CD2 3.95Å; A839-L1421 HydrophobicContact CB-CB 4.24Å; A839-L1421 HydrophobicContact CB-CG 4.02Å
840	N	82.5	Confident	82.7	Confident	44.25 Å²	44.25	32.9 Å²	32.9	24%	0.237	17%	0.173	C	C	.	.	H	α-helix	trans	-60.2	-44.3	173.7	-94.7	-17.8	0	0	0	111.8	K836 A837 N838 L842 V843 K844 V929 T1417	K836-N840 WeakPolarHBondContact O-CB 3.43Å; K836-N840 PolarHBondContact O-N 3.21Å; K836-N840 PolarHBondContact O-ND2 2.82Å; K836-N840 PolarHBondContact O-OD1 3.1Å; A837-N840 WeakPolarHBondContact O-CB 3.39Å; A837-N840 PolarHBondContact O-N 3.14Å; N838-N840 VanDerWaalsContact C-N 3.34Å; N838-N840 PolarHBondContact O-N 3.06Å; N840-L842 VanDerWaalsContact C-N 3.31Å; N840-L842 PolarHBondContact O-N 3.11Å; N840-V843 PolarHBondContact O-N 3.09Å; N840-K844 WeakPolarHBondContact O-CG 3.38Å; N840-K844 PolarHBondContact O-N 3.33Å; N840-K844 VanDerWaalsContact O-N 3.09Å; N840-K844 VanDerWaalsContact OD1-CE 3.22Å; N840-K844 WeakPolarHBondContact OD1-CE 3.31Å; N840-V929 WeakPolarHBondContact OD1-CG1 3.26Å; N840-T1417 WeakPolarHBondContact CA-OG1 3.45Å; N840-T1417 HydrophobicContact CB-CG2 4.16Å; N840-T1417 WeakPolarHBondContact CB-OG1 3.47Å; N840-T1417 PolarHBondContact N-OG1 3.45Å; N840-T1417 WeakPolarHBondContact OD1-CG2 3.11Å; N840-T1417 PolarHBondContact OD1-OG1 3.29Å
841	F	85.9	Confident	83	Confident	13 Å²	13	32.5 Å²	32.5	6%	0.057	17%	0.169	C	C	.	.	H	α-helix	trans	-63.9	-39.3	176.2	-63.7	-49.9	0	0	0	112.4	L791 K794 D795 I798 V829 A837 N838 A839 V843 K844 I845	L791-F841 HydrophobicContact CD1-CE2 3.9Å; L791-F841 HydrophobicContact CD2-CE2 3.88Å; L791-F841 HydrophobicContact CG-CE2 3.84Å; L791-F841 HydrophobicContact CG-CZ 4.07Å; L791-F841 WeakPolarHBondContact O-CZ 3.36Å; K794-F841 HydrophobicContact CD-CD2 4.11Å; K794-F841 HydrophobicContact CD-CE2 4.09Å; K794-F841 HydrophobicContact CD-CG 4.42Å; K794-F841 HydrophobicContact CD-CZ 4.37Å; K794-F841 HydrophobicContact CG-CD1 4.47Å; K794-F841 HydrophobicContact CG-CD2 4.45Å; K794-F841 HydrophobicContact CG-CE1 4.36Å; K794-F841 HydrophobicContact CG-CE2 4.34Å; K794-F841 HydrophobicContact CG-CZ 4.29Å; D795-F841 HydrophobicContact CB-CE1 3.64Å; D795-F841 HydrophobicContact CB-CZ 4.12Å; D795-F841 VanDerWaalsContact OD1-CE1 3.31Å; D795-F841 WeakPolarHBondContact OD1-CE1 3.45Å; I798-F841 HydrophobicContact CD1-CB 4.24Å; I798-F841 HydrophobicContact CD1-CD1 3.76Å; I798-F841 HydrophobicContact CD1-CE1 4.37Å; I798-F841 HydrophobicContact CD1-CG 4.35Å; V829-F841 HydrophobicContact CG1-CB 4.3Å; V829-F841 HydrophobicContact CG2-CB 3.41Å; V829-F841 VanDerWaalsContact CG2-CB 3.44Å; V829-F841 HydrophobicContact CG2-CG 4.43Å; A837-F841 VanDerWaalsContact C-CD2 3.46Å; A837-F841 HydrophobicContact CB-CD2 4.41Å; A837-F841 HydrophobicContact CB-CE2 4.19Å; A837-F841 WeakPolarHBondContact O-CD2 3.29Å; A837-F841 VanDerWaalsContact O-CG 3.27Å; A837-F841 WeakPolarHBondContact O-CG 3.26Å; A837-F841 PolarHBondContact O-N 2.98Å; N838-F841 PolarHBondContact O-N 3.11Å; A839-F841 VanDerWaalsContact C-N 3.31Å; A839-F841 PolarHBondContact O-N 3.08Å; F841-V843 VanDerWaalsContact C-N 3.34Å; F841-V843 PolarHBondContact O-N 3.15Å; F841-K844 PolarHBondContact O-N 2.92Å; F841-I845 WeakPolarHBondContact O-CB 3.21Å; F841-I845 VanDerWaalsContact O-CG1 3.31Å; F841-I845 WeakPolarHBondContact O-CG1 3.33Å; F841-I845 PolarHBondContact O-N 3.16Å
842	L	85.3	Confident	83.6	Confident	4.75 Å²	4.75	32.5 Å²	32.5	3%	0.025	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-44	177.5	-174.1	57.6	0	0	0	111.3	V829 L831 P833 N838 A839 N840 K844 I845 L846 Y1055 L1420	V829-L842 HydrophobicContact CG1-CB 3.87Å; V829-L842 HydrophobicContact CG1-CD1 4.43Å; L831-L842 HydrophobicContact CD2-CD1 3.72Å; L831-L842 HydrophobicContact CD2-CD2 4.49Å; L831-L842 WeakPolarHBondContact O-CD2 3.49Å; P833-L842 HydrophobicContact CG-CD2 4.17Å; N838-L842 WeakPolarHBondContact O-CB 3.42Å; N838-L842 PolarHBondContact O-N 3.19Å; A839-L842 WeakPolarHBondContact O-CB 3.46Å; A839-L842 PolarHBondContact O-N 3.29Å; A839-L842 VanDerWaalsContact O-N 3.11Å; N840-L842 VanDerWaalsContact C-N 3.31Å; N840-L842 PolarHBondContact O-N 3.11Å; L842-K844 VanDerWaalsContact C-N 3.3Å; L842-K844 PolarHBondContact O-N 3.19Å; L842-I845 PolarHBondContact O-N 3.19Å; L842-L846 HydrophobicContact CD1-CD1 4.26Å; L842-L846 HydrophobicContact CD1-CG 4.23Å; L842-L846 HydrophobicContact CG-CD1 4.06Å; L842-L846 HydrophobicContact CG-CG 4.42Å; L842-L846 WeakPolarHBondContact O-CB 3.32Å; L842-L846 WeakPolarHBondContact O-CG 3.36Å; L842-L846 PolarHBondContact O-N 3.1Å; L842-Y1055 WeakPolarHBondContact CD2-OH 3.36Å; L842-L1420 HydrophobicContact CB-CD1 4.47Å; L842-L1420 HydrophobicContact CB-CD2 4.48Å; L842-L1420 HydrophobicContact CD2-CD1 4.28Å; L842-L1420 HydrophobicContact CD2-CD2 3.81Å; L842-L1420 HydrophobicContact CG-CD1 4.27Å; L842-L1420 HydrophobicContact CG-CD2 4.48Å
843	V	82.7	Confident	84.3	Confident	35.5 Å²	35.5	30.8 Å²	30.8	22%	0.215	16%	0.162	C	C	.	.	H	α-helix	trans	-58.5	-47.5	173.7	175.1	0	0	0	0	110.9	A839 N840 F841 I845 L846 H847 L931 Y997 M1413 L1416 T1417 L1420	A839-V843 WeakPolarHBondContact O-CG2 3.29Å; A839-V843 PolarHBondContact O-N 3.15Å; A839-V843 VanDerWaalsContact O-N 3.1Å; N840-V843 PolarHBondContact O-N 3.09Å; F841-V843 VanDerWaalsContact C-N 3.34Å; F841-V843 PolarHBondContact O-N 3.15Å; V843-I845 VanDerWaalsContact C-N 3.29Å; V843-I845 PolarHBondContact O-N 3.21Å; V843-L846 PolarHBondContact O-N 3.39Å; V843-H847 VanDerWaalsContact O-CB 3.27Å; V843-H847 WeakPolarHBondContact O-CB 3.28Å; V843-H847 PolarHBondContact O-N 3.36Å; V843-L931 HydrophobicContact CG1-CD1 4.17Å; V843-L931 HydrophobicContact CG2-CD1 4.17Å; V843-Y997 HydrophobicContact CB-CD1 4.43Å; V843-Y997 HydrophobicContact CB-CE1 4.18Å; V843-Y997 HydrophobicContact CG1-CD1 4.37Å; V843-Y997 HydrophobicContact CG1-CD2 4.25Å; V843-Y997 HydrophobicContact CG1-CE1 4.01Å; V843-Y997 HydrophobicContact CG1-CE2 3.87Å; V843-Y997 HydrophobicContact CG1-CG 4.48Å; V843-Y997 HydrophobicContact CG2-CD1 3.34Å; V843-Y997 HydrophobicContact CG2-CD2 4.47Å; V843-Y997 HydrophobicContact CG2-CE1 3.47Å; V843-Y997 VanDerWaalsContact CG2-CE1 3.47Å; V843-Y997 HydrophobicContact CG2-CG 3.89Å; V843-M1413 HydrophobicContact CG1-CG 4.25Å; V843-L1416 HydrophobicContact CG1-CB 4.27Å; V843-L1416 HydrophobicContact CG1-CD2 4.2Å; V843-L1416 HydrophobicContact CG2-CB 4.38Å; V843-L1416 HydrophobicContact CG2-CD2 3.59Å; V843-T1417 WeakPolarHBondContact CG2-OG1 3.3Å; V843-L1420 HydrophobicContact CG2-CB 4.43Å; V843-L1420 HydrophobicContact CG2-CD1 3.72Å
844	K	86.5	Confident	85	Confident	47.75 Å²	47.75	31.5 Å²	31.5	21%	0.208	17%	0.165	C	C	.	.	H	α-helix	trans	-59.7	-42	176.6	-73	-179.5	-178.7	-175.3	0	112.3	D795 I798 F802 N840 F841 L842 H847 L848 M1413	D795-K844 IonicContact OD1-NZ 2.92Å; D795-K844 PolarHBondContact OD1-NZ 3.04Å; D795-K844 IonicContact OD2-NZ 3.32Å; D795-K844 PolarHBondContact OD2-NZ 3.02Å; I798-K844 HydrophobicContact CG2-CB 3.77Å; I798-K844 HydrophobicContact CG2-CD 4.04Å; I798-K844 HydrophobicContact CG2-CG 4.42Å; F802-K844 HydrophobicContact CE2-CB 4.04Å; F802-K844 HydrophobicContact CE2-CG 4.38Å; F802-K844 VanDerWaalsContact CE2-O 3.23Å; F802-K844 WeakPolarHBondContact CE2-O 3.36Å; F802-K844 HydrophobicContact CZ-CB 4.43Å; F802-K844 WeakPolarHBondContact CZ-O 3.38Å; N840-K844 WeakPolarHBondContact O-CG 3.38Å; N840-K844 PolarHBondContact O-N 3.33Å; N840-K844 VanDerWaalsContact O-N 3.09Å; N840-K844 VanDerWaalsContact OD1-CE 3.22Å; N840-K844 WeakPolarHBondContact OD1-CE 3.31Å; F841-K844 PolarHBondContact O-N 2.92Å; L842-K844 VanDerWaalsContact C-N 3.3Å; L842-K844 PolarHBondContact O-N 3.19Å; K844-H847 PolarHBondContact O-N 3.02Å; K844-L848 WeakPolarHBondContact O-CB 3.46Å; K844-L848 PolarHBondContact O-N 3.19Å; K844-M1413 HydrophobicContact CD-SD 4.31Å; K844-M1413 HydrophobicContact CG-SD 3.88Å
845	I	89.2	Confident	85.7	Confident	1.5 Å²	1.5	27.5 Å²	27.5	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-71.4	-43.5	-179	-70.5	178	0	0	0	111.8	I798 L825 L828 V829 F841 L842 V843 H847 L848 I849	I798-I845 HydrophobicContact CD1-CD1 4.08Å; I798-I845 HydrophobicContact CD1-CG1 4.04Å; I798-I845 HydrophobicContact CG1-CG1 4.4Å; L825-I845 HydrophobicContact CB-CG2 4.14Å; L825-I845 WeakPolarHBondContact O-CD1 3.35Å; L828-I845 HydrophobicContact CB-CD1 3.68Å; L828-I845 HydrophobicContact CD1-CD1 3.95Å; L828-I845 HydrophobicContact CG-CD1 4.44Å; V829-I845 HydrophobicContact CB-CD1 4.27Å; V829-I845 HydrophobicContact CG2-CD1 3.45Å; V829-I845 VanDerWaalsContact CG2-CD1 3.47Å; V829-I845 HydrophobicContact CG2-CG1 4.4Å; F841-I845 WeakPolarHBondContact O-CB 3.21Å; F841-I845 VanDerWaalsContact O-CG1 3.31Å; F841-I845 WeakPolarHBondContact O-CG1 3.33Å; F841-I845 PolarHBondContact O-N 3.16Å; L842-I845 PolarHBondContact O-N 3.19Å; V843-I845 VanDerWaalsContact C-N 3.29Å; V843-I845 PolarHBondContact O-N 3.21Å; I845-H847 VanDerWaalsContact C-N 3.29Å; I845-H847 PolarHBondContact O-N 3.06Å; I845-L848 WeakPolarHBondContact O-CB 3.19Å; I845-L848 PolarHBondContact O-N 3.14Å; I845-L848 VanDerWaalsContact O-N 3.12Å; I845-I849 HydrophobicContact CG2-CD1 3.83Å; I845-I849 HydrophobicContact CG2-CG1 4.39Å; I845-I849 VanDerWaalsContact O-CG1 3.32Å; I845-I849 WeakPolarHBondContact O-CG1 3.35Å; I845-I849 PolarHBondContact O-N 3.16Å
846	L	85.8	Confident	86.4	Confident	11 Å²	11	22.6 Å²	22.6	6%	0.058	12%	0.115	C	C	.	.	H	α-helix	trans	-60.5	-39.8	174.3	-68.9	172.4	0	0	0	111.3	L842 V843 L848 I849 R850 V1056 L1059 L1420	L842-L846 HydrophobicContact CD1-CD1 4.26Å; L842-L846 HydrophobicContact CD1-CG 4.23Å; L842-L846 HydrophobicContact CG-CD1 4.06Å; L842-L846 HydrophobicContact CG-CG 4.42Å; L842-L846 WeakPolarHBondContact O-CB 3.32Å; L842-L846 WeakPolarHBondContact O-CG 3.36Å; L842-L846 PolarHBondContact O-N 3.1Å; V843-L846 PolarHBondContact O-N 3.39Å; L846-L848 VanDerWaalsContact C-N 3.33Å; L846-L848 PolarHBondContact O-N 2.92Å; L846-I849 PolarHBondContact O-N 3.09Å; L846-R850 VanDerWaalsContact O-CB 3.3Å; L846-R850 WeakPolarHBondContact O-CB 3.37Å; L846-R850 PolarHBondContact O-N 3.13Å; L846-V1056 HydrophobicContact CD1-CG1 4.36Å; L846-V1056 HydrophobicContact CD2-CG1 3.97Å; L846-L1059 HydrophobicContact CD1-CB 4.37Å; L846-L1059 HydrophobicContact CD1-CD1 4.38Å; L846-L1420 HydrophobicContact CD1-CD1 4.39Å
847	H	86.2	Confident	87.1	Confident	46 Å²	46	18.5 Å²	18.5	21%	0.213	10%	0.098	C	C	.	.	H	α-helix	trans	-64.3	-37.1	174.5	-172.5	65.8	0	0	0	112.7	F802 V843 K844 I845 R850 I851	F802-H847 HydrophobicContact CE1-CB 4.36Å; F802-H847 AromaticContact CE1-CD2 3.36Å; F802-H847 VanDerWaalsContact CE1-CD2 3.5Å; F802-H847 WeakPolarHBondContact CE1-CD2 3.4Å; F802-H847 AromaticContact CE2-CD2 3.31Å; F802-H847 WeakPolarHBondContact CE2-CD2 3.43Å; F802-H847 AromaticContact CE2-NE2 3.68Å; F802-H847 HydrophobicContact CZ-CB 4.13Å; F802-H847 AromaticContact CZ-CD2 3.61Å; F802-H847 VanDerWaalsContact CZ-CD2 3.47Å; F802-H847 WeakPolarHBondContact CZ-CD2 3.49Å; F802-H847 AromaticContact CZ-NE2 3.63Å; V843-H847 VanDerWaalsContact O-CB 3.27Å; V843-H847 WeakPolarHBondContact O-CB 3.28Å; V843-H847 PolarHBondContact O-N 3.36Å; K844-H847 PolarHBondContact O-N 3.02Å; I845-H847 VanDerWaalsContact C-N 3.29Å; I845-H847 PolarHBondContact O-N 3.06Å; H847-R850 PolarHBondContact CE1-NH2 3.05Å; H847-R850 PolarHBondContact ND1-NH2 2.72Å; H847-R850 WeakPolarHBondContact O-CB 3.32Å; H847-R850 PolarHBondContact O-N 3.29Å; H847-I851 WeakPolarHBondContact O-CG1 3.24Å; H847-I851 PolarHBondContact O-N 3.03Å; H847-I851 VanDerWaalsContact O-N 3.14Å
848	L	89.7	Confident	87.5	Confident	2 Å²	2	17 Å²	17	1%	0.01	8%	0.084	C	C	.	.	H	α-helix	trans	-68.1	-45.6	174.1	-174.5	69.5	0	0	0	111.9	L801 F802 C805 L825 K844 I845 L846 R850 I851 L852	L801-L848 HydrophobicContact CB-CD1 4.39Å; L801-L848 HydrophobicContact CB-CD2 3.81Å; L801-L848 HydrophobicContact CD1-CD2 3.91Å; L801-L848 HydrophobicContact CG-CD2 4.38Å; F802-L848 HydrophobicContact CD1-CD1 4.05Å; F802-L848 HydrophobicContact CD2-CD1 4.43Å; F802-L848 HydrophobicContact CE1-CB 4.08Å; F802-L848 HydrophobicContact CE1-CD1 4.08Å; F802-L848 HydrophobicContact CE2-CB 4.1Å; F802-L848 HydrophobicContact CG-CD1 4.43Å; F802-L848 HydrophobicContact CZ-CB 3.88Å; F802-L848 HydrophobicContact CZ-CD1 4.42Å; C805-L848 HydrophobicContact CB-CD1 3.97Å; L825-L848 HydrophobicContact CD1-CD2 4.18Å; L825-L848 HydrophobicContact CD2-CD2 4.03Å; K844-L848 WeakPolarHBondContact O-CB 3.46Å; K844-L848 PolarHBondContact O-N 3.19Å; I845-L848 WeakPolarHBondContact O-CB 3.19Å; I845-L848 PolarHBondContact O-N 3.14Å; I845-L848 VanDerWaalsContact O-N 3.12Å; L846-L848 VanDerWaalsContact C-N 3.33Å; L846-L848 PolarHBondContact O-N 2.92Å; L848-R850 VanDerWaalsContact C-N 3.28Å; L848-R850 PolarHBondContact O-N 3.05Å; L848-I851 PolarHBondContact O-N 3.16Å; L848-I851 VanDerWaalsContact O-N 3.15Å; L848-L852 HydrophobicContact CG-CD1 4.39Å; L848-L852 WeakPolarHBondContact O-CG 3.31Å; L848-L852 PolarHBondContact O-N 3.2Å; L848-L852 VanDerWaalsContact O-N 3.13Å
849	I	91.4	Very high	87.8	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-56.2	-45.6	174.1	-70.1	166.8	0	0	0	109.8	W821 L825 L826 I845 L846 I851 L852 L853 T870 L1060	W821-I849 HydrophobicContact CH2-CB 4.5Å; W821-I849 HydrophobicContact CH2-CG1 4.48Å; W821-I849 HydrophobicContact CH2-CG2 4.24Å; W821-I849 HydrophobicContact CZ3-CB 4.4Å; W821-I849 HydrophobicContact CZ3-CG1 4.04Å; W821-I849 HydrophobicContact CZ3-CG2 4.38Å; L825-I849 HydrophobicContact CB-CD1 4.5Å; L825-I849 HydrophobicContact CD1-CG1 4.06Å; L826-I849 HydrophobicContact CD2-CD1 3.89Å; L826-I849 HydrophobicContact CG-CD1 4.39Å; I845-I849 HydrophobicContact CG2-CD1 3.83Å; I845-I849 HydrophobicContact CG2-CG1 4.39Å; I845-I849 VanDerWaalsContact O-CG1 3.32Å; I845-I849 WeakPolarHBondContact O-CG1 3.35Å; I845-I849 PolarHBondContact O-N 3.16Å; L846-I849 PolarHBondContact O-N 3.09Å; I849-I851 PolarHBondContact O-N 3.07Å; I849-L852 PolarHBondContact O-N 3.04Å; I849-L853 HydrophobicContact CG2-CD1 3.68Å; I849-L853 HydrophobicContact CG2-CG 4.22Å; I849-L853 WeakPolarHBondContact O-CB 3.38Å; I849-L853 VanDerWaalsContact O-CG 3.3Å; I849-L853 WeakPolarHBondContact O-CG 3.29Å; I849-L853 PolarHBondContact O-N 3.01Å; I849-T870 HydrophobicContact CG2-CG2 3.95Å; I849-L1060 HydrophobicContact CG2-CD1 4Å; I849-L1060 HydrophobicContact CG2-CD2 4.37Å
850	R	89.3	Confident	88.2	Confident	24.75 Å²	24.75	20.8 Å²	20.8	9%	0.093	10%	0.1	C	C	.	.	H	α-helix	trans	-57.7	-46.5	175.3	-173	-167.2	78.6	154.3	12.9	112.4	L846 H847 L848 L852 L853 I854 D1063 S1067	L846-R850 VanDerWaalsContact O-CB 3.3Å; L846-R850 WeakPolarHBondContact O-CB 3.37Å; L846-R850 PolarHBondContact O-N 3.13Å; H847-R850 PolarHBondContact CE1-NH2 3.05Å; H847-R850 PolarHBondContact ND1-NH2 2.72Å; H847-R850 WeakPolarHBondContact O-CB 3.32Å; H847-R850 PolarHBondContact O-N 3.29Å; L848-R850 VanDerWaalsContact C-N 3.28Å; L848-R850 PolarHBondContact O-N 3.05Å; R850-L852 VanDerWaalsContact C-N 3.3Å; R850-L852 PolarHBondContact O-N 3.19Å; R850-L853 PolarHBondContact O-N 3.22Å; R850-I854 HydrophobicContact CG-CD1 3.69Å; R850-I854 HydrophobicContact CG-CG1 4.34Å; R850-I854 VanDerWaalsContact O-CB 3.31Å; R850-I854 WeakPolarHBondContact O-CB 3.33Å; R850-I854 WeakPolarHBondContact O-CD1 3.37Å; R850-I854 VanDerWaalsContact O-CG1 3.24Å; R850-I854 WeakPolarHBondContact O-CG1 3.19Å; R850-I854 PolarHBondContact O-N 3.24Å; R850-D1063 VanDerWaalsContact CD-CG 3.43Å; R850-D1063 VanDerWaalsContact CD-OD1 3.31Å; R850-D1063 WeakPolarHBondContact CD-OD1 3.33Å; R850-D1063 WeakPolarHBondContact CD-OD2 3.34Å; R850-D1063 IonicContact CZ-OD1 3.32Å; R850-D1063 IonicContact CZ-OD2 2.85Å; R850-D1063 IonicContact NE-OD1 3.7Å; R850-D1063 IonicContact NE-OD2 3.3Å; R850-D1063 PolarHBondContact NE-OD2 3.28Å; R850-D1063 VanDerWaalsContact NH1-CG 3.34Å; R850-D1063 IonicContact NH1-OD1 3.43Å; R850-D1063 PolarHBondContact NH1-OD1 3.07Å; R850-D1063 IonicContact NH1-OD2 3.25Å; R850-D1063 PolarHBondContact NH1-OD2 3.23Å; R850-S1067 WeakPolarHBondContact CD-OG 3.07Å; R850-S1067 PolarHBondContact NH1-OG 3.17Å; R850-S1067 VanDerWaalsContact NH1-OG 3.09Å
851	I	88.3	Confident	88.4	Confident	31.25 Å²	31.25	23.9 Å²	23.9	16%	0.16	11%	0.11	C	C	.	.	H	α-helix	trans	-60.2	-40.7	178	-72.9	168.3	0	0	0	111.6	F802 C805 K812 H847 L848 I849 Y855	F802-I851 HydrophobicContact CD1-CD1 4.05Å; F802-I851 HydrophobicContact CD2-CD1 4.23Å; F802-I851 HydrophobicContact CE1-CD1 3.75Å; F802-I851 HydrophobicContact CE2-CD1 3.39Å; F802-I851 HydrophobicContact CZ-CD1 3.96Å; C805-I851 HydrophobicContact CB-CG2 4.4Å; C805-I851 WeakPolarHBondContact O-CG2 3.44Å; K812-I851 HydrophobicContact CD-CG2 4.41Å; H847-I851 WeakPolarHBondContact O-CG1 3.24Å; H847-I851 PolarHBondContact O-N 3.03Å; H847-I851 VanDerWaalsContact O-N 3.14Å; L848-I851 PolarHBondContact O-N 3.16Å; L848-I851 VanDerWaalsContact O-N 3.15Å; I849-I851 PolarHBondContact O-N 3.07Å; I851-Y855 WeakPolarHBondContact O-CB 3.36Å; I851-Y855 PolarHBondContact O-N 3.17Å; I851-Y855 VanDerWaalsContact O-N 3.13Å
852	L	91.6	Very high	88.5	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-69.7	-47.3	178.5	-69.5	166.9	0	0	0	111.4	K812 I815 L816 W821 L825 L848 I849 R850 Y855 G856	K812-L852 HydrophobicContact CB-CD2 4.23Å; K812-L852 HydrophobicContact CG-CD2 4.43Å; I815-L852 HydrophobicContact CB-CD2 4.11Å; I815-L852 HydrophobicContact CD1-CD2 4.48Å; I815-L852 HydrophobicContact CG2-CD1 3.74Å; I815-L852 HydrophobicContact CG2-CD2 4Å; L816-L852 HydrophobicContact CD2-CB 4.12Å; L816-L852 HydrophobicContact CG-CD2 4.47Å; W821-L852 HydrophobicContact CD2-CD1 4.46Å; W821-L852 HydrophobicContact CE3-CD1 3.8Å; W821-L852 HydrophobicContact CH2-CB 3.68Å; W821-L852 HydrophobicContact CH2-CD1 3.9Å; W821-L852 HydrophobicContact CH2-CG 4.45Å; W821-L852 HydrophobicContact CZ2-CB 4.17Å; W821-L852 HydrophobicContact CZ3-CB 4.12Å; W821-L852 HydrophobicContact CZ3-CD1 3.42Å; W821-L852 VanDerWaalsContact CZ3-CD1 3.43Å; W821-L852 HydrophobicContact CZ3-CG 4.41Å; L825-L852 HydrophobicContact CD1-CD1 4.45Å; L848-L852 HydrophobicContact CG-CD1 4.39Å; L848-L852 WeakPolarHBondContact O-CG 3.31Å; L848-L852 PolarHBondContact O-N 3.2Å; L848-L852 VanDerWaalsContact O-N 3.13Å; I849-L852 PolarHBondContact O-N 3.04Å; R850-L852 VanDerWaalsContact C-N 3.3Å; R850-L852 PolarHBondContact O-N 3.19Å; L852-Y855 PolarHBondContact O-N 3.3Å; L852-G856 PolarHBondContact O-N 3.07Å
853	L	92.2	Very high	88.7	Confident	1.75 Å²	1.75	24.2 Å²	24.2	1%	0.009	12%	0.115	C	C	.	.	H	α-helix	trans	-61.5	-46.2	177.9	-71.9	173.5	0	0	0	112.4	W821 I849 R850 Y855 G856 I857 V866 L867 T870 L1060 L1064	W821-L853 HydrophobicContact CH2-CD2 4.49Å; W821-L853 HydrophobicContact CH2-CG 4.4Å; W821-L853 HydrophobicContact CZ2-CD2 4.35Å; I849-L853 HydrophobicContact CG2-CD1 3.68Å; I849-L853 HydrophobicContact CG2-CG 4.22Å; I849-L853 WeakPolarHBondContact O-CB 3.38Å; I849-L853 VanDerWaalsContact O-CG 3.3Å; I849-L853 WeakPolarHBondContact O-CG 3.29Å; I849-L853 PolarHBondContact O-N 3.01Å; R850-L853 PolarHBondContact O-N 3.22Å; L853-Y855 VanDerWaalsContact C-N 3.31Å; L853-Y855 PolarHBondContact O-N 3.03Å; L853-G856 PolarHBondContact O-N 2.98Å; L853-I857 WeakPolarHBondContact O-CB 3.38Å; L853-I857 WeakPolarHBondContact O-CD1 3.31Å; L853-I857 VanDerWaalsContact O-CG1 3.23Å; L853-I857 WeakPolarHBondContact O-CG1 3.38Å; L853-I857 PolarHBondContact O-N 3.21Å; L853-V866 HydrophobicContact CD2-CB 4.32Å; L853-V866 HydrophobicContact CD2-CG1 3.91Å; L853-L867 HydrophobicContact CD1-CD1 4Å; L853-L867 HydrophobicContact CD2-CB 4.35Å; L853-T870 HydrophobicContact CD1-CG2 4.39Å; L853-L1060 HydrophobicContact CD1-CD1 4.25Å; L853-L1060 HydrophobicContact CD1-CD2 4.35Å; L853-L1064 HydrophobicContact CB-CD1 3.86Å; L853-L1064 HydrophobicContact CD1-CD1 3.98Å; L853-L1064 HydrophobicContact CG-CD1 4.44Å
854	I	90.2	Very high	89	Confident	25.25 Å²	25.25	23.5 Å²	23.5	13%	0.129	11%	0.109	C	C	.	.	H	α-helix	trans	-59.2	-43.7	176.9	-70.7	-177.2	0	0	0	110.9	R850 G856 I857 C858 L1064 L1068 I1071	R850-I854 HydrophobicContact CG-CD1 3.69Å; R850-I854 HydrophobicContact CG-CG1 4.34Å; R850-I854 VanDerWaalsContact O-CB 3.31Å; R850-I854 WeakPolarHBondContact O-CB 3.33Å; R850-I854 WeakPolarHBondContact O-CD1 3.37Å; R850-I854 VanDerWaalsContact O-CG1 3.24Å; R850-I854 WeakPolarHBondContact O-CG1 3.19Å; R850-I854 PolarHBondContact O-N 3.24Å; I854-G856 PolarHBondContact O-N 3.38Å; I854-I857 PolarHBondContact O-N 3.3Å; I854-C858 VanDerWaalsContact O-CB 3.3Å; I854-C858 WeakPolarHBondContact O-CB 3.32Å; I854-C858 PolarHBondContact O-N 2.99Å; I854-C858 PolarHBondContact O-SG 2.98Å; I854-C858 VanDerWaalsContact O-SG 3.35Å; I854-L1064 HydrophobicContact CD1-CD1 3.67Å; I854-L1064 HydrophobicContact CD1-CG 4.35Å; I854-L1064 HydrophobicContact CG1-CD1 3.93Å; I854-L1068 HydrophobicContact CD1-CD2 3.53Å; I854-L1068 HydrophobicContact CD1-CG 3.76Å; I854-I1071 HydrophobicContact CG2-CD1 3.49Å; I854-I1071 VanDerWaalsContact CG2-CD1 3.46Å
855	Y	90.5	Very high	89.3	Confident	33 Å²	33	25.9 Å²	25.9	13%	0.129	12%	0.121	C	C	.	.	H	α-helix	trans	-64.1	-44.7	178.4	177.5	-94.7	0	0	0	111.7	P809 K812 K813 L816 I851 L852 L853 C858 H859 E860	P809-Y855 HydrophobicContact CB-CE2 3.78Å; P809-Y855 PolarHBondContact O-OH 3.02Å; K812-Y855 HydrophobicContact CB-CD1 3.53Å; K812-Y855 HydrophobicContact CB-CD2 4.34Å; K812-Y855 HydrophobicContact CB-CE1 3.77Å; K812-Y855 HydrophobicContact CB-CE2 4.46Å; K812-Y855 HydrophobicContact CB-CG 3.84Å; K812-Y855 HydrophobicContact CD-CD1 4.1Å; K812-Y855 HydrophobicContact CD-CD2 3.5Å; K812-Y855 VanDerWaalsContact CD-CD2 3.48Å; K812-Y855 HydrophobicContact CD-CE1 4.48Å; K812-Y855 HydrophobicContact CD-CE2 4.11Å; K812-Y855 HydrophobicContact CD-CG 3.48Å; K812-Y855 VanDerWaalsContact CD-CG 3.47Å; K812-Y855 HydrophobicContact CG-CD1 4.45Å; K812-Y855 HydrophobicContact CG-CG 4.31Å; K813-Y855 HydrophobicContact CB-CE1 4.13Å; L816-Y855 HydrophobicContact CD1-CD1 3.79Å; L816-Y855 HydrophobicContact CD1-CE1 4.41Å; I851-Y855 WeakPolarHBondContact O-CB 3.36Å; I851-Y855 PolarHBondContact O-N 3.17Å; I851-Y855 VanDerWaalsContact O-N 3.13Å; L852-Y855 PolarHBondContact O-N 3.3Å; L853-Y855 VanDerWaalsContact C-N 3.31Å; L853-Y855 PolarHBondContact O-N 3.03Å; Y855-C858 PolarHBondContact O-N 3.17Å; Y855-H859 AromaticContact CD2-CD2 3.39Å; Y855-H859 VanDerWaalsContact CD2-CD2 3.43Å; Y855-H859 WeakPolarHBondContact CD2-CD2 3.36Å; Y855-H859 AromaticContact CD2-NE2 3.96Å; Y855-H859 HydrophobicContact CE2-CB 4.4Å; Y855-H859 AromaticContact CE2-CD2 3.46Å; Y855-H859 VanDerWaalsContact CE2-CD2 3.46Å; Y855-H859 WeakPolarHBondContact CE2-CD2 3.28Å; Y855-H859 AromaticContact CE2-CG 4Å; Y855-H859 WeakPolarHBondContact O-CB 3.35Å; Y855-H859 PolarHBondContact O-CD2 3.24Å; Y855-H859 VanDerWaalsContact O-CD2 3.3Å; Y855-H859 PolarHBondContact O-N 3.1Å; Y855-H859 VanDerWaalsContact O-N 3.09Å; Y855-E860 HydrophobicContact CE1-CG 4.37Å
856	G	90.5	Very high	89.4	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-57.4	-53.6	173.4	0	0	0	0	0	111.6	L852 L853 I854 C858 H859 E860 S863	L852-G856 PolarHBondContact O-N 3.07Å; L853-G856 PolarHBondContact O-N 2.98Å; I854-G856 PolarHBondContact O-N 3.38Å; G856-C858 PolarHBondContact O-N 2.98Å; G856-C858 VanDerWaalsContact O-N 3.1Å; G856-H859 PolarHBondContact O-N 3.2Å; G856-H859 VanDerWaalsContact O-N 3.12Å; G856-E860 PolarHBondContact O-N 3.15Å; G856-E860 VanDerWaalsContact O-O 3.11Å; G856-S863 VanDerWaalsContact C-OG 3.22Å; G856-S863 WeakPolarHBondContact CA-OG 3.34Å; G856-S863 WeakPolarHBondContact O-CB 3.29Å; G856-S863 PolarHBondContact O-OG 3.14Å; G856-S863 VanDerWaalsContact O-OG 3.08Å
857	I	91.1	Very high	89.7	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-55.9	-37.1	179.1	-67.5	163.1	0	0	0	111.7	L853 I854 L1064 L1068 F1195 N1198 I1199 I1202	L853-I857 WeakPolarHBondContact O-CB 3.38Å; L853-I857 WeakPolarHBondContact O-CD1 3.31Å; L853-I857 VanDerWaalsContact O-CG1 3.23Å; L853-I857 WeakPolarHBondContact O-CG1 3.38Å; L853-I857 PolarHBondContact O-N 3.21Å; I854-I857 PolarHBondContact O-N 3.3Å; I857-L1064 HydrophobicContact CD1-CD1 4.19Å; I857-L1064 HydrophobicContact CD1-CD2 4.45Å; I857-L1068 HydrophobicContact CD1-CD1 4.34Å; I857-L1068 HydrophobicContact CG2-CD2 3.89Å; I857-F1195 HydrophobicContact CG2-CD2 4.15Å; I857-F1195 HydrophobicContact CG2-CE2 4.36Å; I857-F1195 WeakPolarHBondContact O-CA 3.38Å; I857-N1198 HydrophobicContact CG2-CB 4.09Å; I857-N1198 PolarHBondContact O-ND2 3.22Å; I857-I1199 HydrophobicContact CG2-CG1 4.24Å; I857-I1202 HydrophobicContact CD1-CD1 3.6Å; I857-I1202 HydrophobicContact CG1-CD1 3.92Å; I857-I1202 HydrophobicContact CG2-CD1 4.34Å
858	C	88.7	Confident	89.9	Confident	7.75 Å²	7.75	25.5 Å²	25.5	5%	0.052	12%	0.122	C	C	.	.	H	α-helix	trans	-80.6	-24.3	-179.1	-71.2	0	0	0	0	115.9	I854 Y855 G856 F1195	I854-C858 VanDerWaalsContact O-CB 3.3Å; I854-C858 WeakPolarHBondContact O-CB 3.32Å; I854-C858 PolarHBondContact O-N 2.99Å; I854-C858 PolarHBondContact O-SG 2.98Å; I854-C858 VanDerWaalsContact O-SG 3.35Å; Y855-C858 PolarHBondContact O-N 3.17Å; G856-C858 PolarHBondContact O-N 2.98Å; G856-C858 VanDerWaalsContact O-N 3.1Å; C858-F1195 HydrophobicContact CB-CD2 4.37Å; C858-F1195 VanDerWaalsContact SG-CD2 3.51Å
859	H	87.1	Confident	90	Very high	68 Å²	68	28.8 Å²	28.8	32%	0.315	14%	0.14	S	C	.	.	H	α-helix	trans	-134	-18.2	-166.6	-61.3	-69.5	0	0	0	115.4	Y855 G856	Y855-H859 AromaticContact CD2-CD2 3.39Å; Y855-H859 VanDerWaalsContact CD2-CD2 3.43Å; Y855-H859 WeakPolarHBondContact CD2-CD2 3.36Å; Y855-H859 AromaticContact CD2-NE2 3.96Å; Y855-H859 HydrophobicContact CE2-CB 4.4Å; Y855-H859 AromaticContact CE2-CD2 3.46Å; Y855-H859 VanDerWaalsContact CE2-CD2 3.46Å; Y855-H859 WeakPolarHBondContact CE2-CD2 3.28Å; Y855-H859 AromaticContact CE2-CG 4Å; Y855-H859 WeakPolarHBondContact O-CB 3.35Å; Y855-H859 PolarHBondContact O-CD2 3.24Å; Y855-H859 VanDerWaalsContact O-CD2 3.3Å; Y855-H859 PolarHBondContact O-N 3.1Å; Y855-H859 VanDerWaalsContact O-N 3.09Å; G856-H859 PolarHBondContact O-N 3.2Å; G856-H859 VanDerWaalsContact O-N 3.12Å
860	E	87.9	Confident	90	Very high	36.25 Å²	36.25	28.8 Å²	28.8	17%	0.169	14%	0.14	C	C	.	.	S	Bend	trans	-121.9	121.9	-173.5	-60.2	-142	146.5	0	0	110.9	K813 Y855 G856 G862 S863 N1198	K813-E860 VanDerWaalsContact CD-OE1 3.25Å; K813-E860 WeakPolarHBondContact CD-OE1 3.45Å; K813-E860 WeakPolarHBondContact CE-OE1 3.27Å; K813-E860 VanDerWaalsContact CG-OE1 3.29Å; K813-E860 WeakPolarHBondContact CG-OE1 3.41Å; K813-E860 IonicContact NZ-OE1 3.27Å; K813-E860 PolarHBondContact NZ-OE1 3.11Å; K813-E860 IonicContact NZ-OE2 3.08Å; K813-E860 PolarHBondContact NZ-OE2 2.59Å; Y855-E860 HydrophobicContact CE1-CG 4.37Å; G856-E860 PolarHBondContact O-N 3.15Å; G856-E860 VanDerWaalsContact O-O 3.11Å; E860-G862 PolarHBondContact O-N 3.15Å; E860-S863 VanDerWaalsContact CB-OG 3.25Å; E860-S863 WeakPolarHBondContact CB-OG 3.44Å; E860-S863 VanDerWaalsContact O-CB 3.31Å; E860-S863 WeakPolarHBondContact O-CB 3.49Å; E860-S863 PolarHBondContact O-N 3.35Å; E860-S863 PolarHBondContact O-OG 3.11Å; E860-S863 VanDerWaalsContact O-OG 3.09Å; E860-N1198 PolarHBondContact O-ND2 3.15Å
861	Y	86.6	Confident	90.1	Very high	111.25 Å²	111.25	27.8 Å²	27.8	44%	0.436	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	133	-178.7	-172.9	-88.8	0	0	0	111.1	S863 I1194 T1197 L1269 E1273	Y861-S863 VanDerWaalsContact C-N 3.34Å; Y861-I1194 HydrophobicContact CD2-CG1 4.4Å; Y861-T1197 HydrophobicContact CE2-CG2 3.88Å; Y861-L1269 VanDerWaalsContact OH-CD2 3.32Å; Y861-L1269 WeakPolarHBondContact OH-CD2 3.42Å; Y861-E1273 VanDerWaalsContact CE1-OE1 3.3Å; Y861-E1273 WeakPolarHBondContact CE1-OE1 3.31Å; Y861-E1273 VanDerWaalsContact OH-CD 3.28Å; Y861-E1273 PolarHBondContact OH-OE1 3.16Å; Y861-E1273 PolarHBondContact OH-OE2 3.12Å; Y861-E1273 VanDerWaalsContact OH-OE2 3.13Å
862	G	86.6	Confident	90.2	Very high	13 Å²	13	27.7 Å²	27.7	13%	0.134	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	87	-3.1	-179.6	0	0	0	0	0	114.7	E860 W864 Q865 N1198	E860-G862 PolarHBondContact O-N 3.15Å; G862-W864 PolarHBondContact O-N 3.17Å; G862-Q865 WeakPolarHBondContact O-CB 3.32Å; G862-Q865 WeakPolarHBondContact O-CG 3.43Å; G862-Q865 PolarHBondContact O-N 3.01Å; G862-N1198 PolarHBondContact N-OD1 3.3Å; G862-N1198 VanDerWaalsContact N-OD1 3.12Å
863	S	90.2	Very high	90.1	Very high	9.25 Å²	9.25	28.6 Å²	28.6	7%	0.065	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-10.9	-179.3	-63.2	0	0	0	0	115.4	G856 E860 Y861 Q865 V866 L867 N1198	G856-S863 VanDerWaalsContact C-OG 3.22Å; G856-S863 WeakPolarHBondContact CA-OG 3.34Å; G856-S863 WeakPolarHBondContact O-CB 3.29Å; G856-S863 PolarHBondContact O-OG 3.14Å; G856-S863 VanDerWaalsContact O-OG 3.08Å; E860-S863 VanDerWaalsContact CB-OG 3.25Å; E860-S863 WeakPolarHBondContact CB-OG 3.44Å; E860-S863 VanDerWaalsContact O-CB 3.31Å; E860-S863 WeakPolarHBondContact O-CB 3.49Å; E860-S863 PolarHBondContact O-N 3.35Å; E860-S863 PolarHBondContact O-OG 3.11Å; E860-S863 VanDerWaalsContact O-OG 3.09Å; Y861-S863 VanDerWaalsContact C-N 3.34Å; S863-Q865 PolarHBondContact O-N 3.13Å; S863-V866 VanDerWaalsContact O-CB 3.3Å; S863-V866 WeakPolarHBondContact O-CB 3.48Å; S863-V866 PolarHBondContact O-N 3.29Å; S863-V866 VanDerWaalsContact O-N 3.12Å; S863-L867 PolarHBondContact O-N 3.08Å; S863-N1198 PolarHBondContact N-OD1 3Å
864	W	89.5	Confident	89.9	Confident	22.75 Å²	22.75	28.5 Å²	28.5	9%	0.086	14%	0.144	C	C	.	.	H	α-helix	trans	-59.2	-28.8	167.4	69.2	-97.6	0	0	0	112.5	G862 V866 L867 V868 H1201 I1202 Y1205 R1274	G862-W864 PolarHBondContact O-N 3.17Å; W864-V866 VanDerWaalsContact C-N 3.34Å; W864-L867 WeakPolarHBondContact O-CB 3.32Å; W864-L867 PolarHBondContact O-N 3.07Å; W864-V868 HydrophobicContact CE3-CG2 4.14Å; W864-V868 HydrophobicContact CZ3-CG2 4.31Å; W864-V868 WeakPolarHBondContact O-CG2 2.82Å; W864-V868 PolarHBondContact O-N 3.14Å; W864-H1201 HydrophobicContact CB-CB 3.96Å; W864-H1201 VanDerWaalsContact CD1-CB 3.47Å; W864-H1201 AromaticContact CD1-CD2 3.61Å; W864-H1201 AromaticContact CD1-CG 3.58Å; W864-H1201 VanDerWaalsContact CD1-CG 3.45Å; W864-H1201 AromaticContact CD1-ND1 3.93Å; W864-H1201 HydrophobicContact CD2-CB 3.56Å; W864-H1201 VanDerWaalsContact CD2-CB 3.48Å; W864-H1201 AromaticContact CD2-CG 3.95Å; W864-H1201 AromaticContact CD2-ND1 4Å; W864-H1201 AromaticContact CE2-CD2 3.65Å; W864-H1201 AromaticContact CE2-CE1 3.89Å; W864-H1201 AromaticContact CE2-CG 3.55Å; W864-H1201 AromaticContact CE2-ND1 3.52Å; W864-H1201 VanDerWaalsContact CE2-ND1 3.32Å; W864-H1201 HydrophobicContact CE3-CB 4.24Å; W864-H1201 HydrophobicContact CG-CB 3.42Å; W864-H1201 AromaticContact CG-CG 3.85Å; W864-H1201 HydrophobicContact CH2-CB 4.29Å; W864-H1201 HydrophobicContact CZ2-CB 3.68Å; W864-H1201 AromaticContact CZ2-CG 3.53Å; W864-H1201 AromaticContact CZ2-ND1 3.55Å; W864-H1201 AromaticContact NE1-CD2 3.38Å; W864-H1201 PolarHBondContact NE1-CD2 2.78Å; W864-H1201 AromaticContact NE1-CE1 3.52Å; W864-H1201 AromaticContact NE1-CG 3.3Å; W864-H1201 VanDerWaalsContact NE1-CG 3.3Å; W864-H1201 AromaticContact NE1-ND1 3.27Å; W864-H1201 PolarHBondContact NE1-ND1 3.01Å; W864-H1201 AromaticContact NE1-NE2 3.72Å; W864-I1202 HydrophobicContact CB-CD1 4.37Å; W864-I1202 HydrophobicContact CB-CG1 3.82Å; W864-Y1205 HydrophobicContact CE3-CD2 4.34Å; W864-Y1205 AromaticContact CZ3-CD2 3.82Å; W864-Y1205 HydrophobicContact CZ3-CD2 3.99Å; W864-Y1205 HydrophobicContact CZ3-CE2 4.12Å; W864-R1274 HydrophobicContact CH2-CG 4.31Å; W864-R1274 VanDerWaalsContact CH2-NH2 3.32Å; W864-R1274 HydrophobicContact CZ2-CG 4.41Å; W864-R1274 VanDerWaalsContact CZ2-CZ 3.49Å
865	Q	91.7	Very high	89.8	Confident	96.25 Å²	96.25	28 Å²	28	45%	0.45	14%	0.141	S	C	.	.	H	α-helix	trans	-64	-42.4	173.5	-65	-178.9	-37.9	0	0	110.9	G862 S863 L867 V868 D869 R1274	G862-Q865 WeakPolarHBondContact O-CB 3.32Å; G862-Q865 WeakPolarHBondContact O-CG 3.43Å; G862-Q865 PolarHBondContact O-N 3.01Å; S863-Q865 PolarHBondContact O-N 3.13Å; Q865-L867 VanDerWaalsContact C-N 3.28Å; Q865-L867 PolarHBondContact O-N 3.18Å; Q865-L867 VanDerWaalsContact O-N 3.17Å; Q865-V868 CarbonylContact O-C 3.56Å; Q865-V868 WeakPolarHBondContact O-CA 3.44Å; Q865-V868 VanDerWaalsContact O-CB 3.31Å; Q865-V868 WeakPolarHBondContact O-CB 3.36Å; Q865-V868 PolarHBondContact O-N 3.23Å; Q865-D869 VanDerWaalsContact O-CG 3.23Å; Q865-D869 PolarHBondContact O-N 3.04Å; Q865-R1274 VanDerWaalsContact CG-NH2 3.26Å
866	V	91.7	Very high	89.7	Confident	30.25 Å²	30.25	28.4 Å²	28.4	18%	0.183	15%	0.145	C	C	.	.	H	α-helix	trans	-59.5	-34.9	178	-172.4	0	0	0	0	111.3	L816 W821 Q822 L853 S863 W864 T870	L816-V866 HydrophobicContact CD2-CG1 4.3Å; W821-V866 HydrophobicContact CZ2-CG1 3.77Å; Q822-V866 VanDerWaalsContact NE2-CG1 3.28Å; Q822-V866 PolarHBondContact NE2-O 3.23Å; L853-V866 HydrophobicContact CD2-CB 4.32Å; L853-V866 HydrophobicContact CD2-CG1 3.91Å; S863-V866 VanDerWaalsContact O-CB 3.3Å; S863-V866 WeakPolarHBondContact O-CB 3.48Å; S863-V866 PolarHBondContact O-N 3.29Å; S863-V866 VanDerWaalsContact O-N 3.12Å; W864-V866 VanDerWaalsContact C-N 3.34Å; V866-T870 WeakPolarHBondContact O-CB 3.34Å; V866-T870 PolarHBondContact O-N 2.99Å; V866-T870 PolarHBondContact O-OG1 3.16Å
867	L	92.2	Very high	89.5	Confident	5 Å²	5	29 Å²	29	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-65.1	-45.5	171.8	174.7	63.4	0	0	0	111.9	L853 S863 W864 Q865 D869 T870 L871 L1064 I1202	L853-L867 HydrophobicContact CD1-CD1 4Å; L853-L867 HydrophobicContact CD2-CB 4.35Å; S863-L867 PolarHBondContact O-N 3.08Å; W864-L867 WeakPolarHBondContact O-CB 3.32Å; W864-L867 PolarHBondContact O-N 3.07Å; Q865-L867 VanDerWaalsContact C-N 3.28Å; Q865-L867 PolarHBondContact O-N 3.18Å; Q865-L867 VanDerWaalsContact O-N 3.17Å; L867-D869 VanDerWaalsContact C-N 3.34Å; L867-D869 PolarHBondContact O-N 3.33Å; L867-T870 WeakPolarHBondContact O-CB 3.26Å; L867-T870 PolarHBondContact O-N 3.26Å; L867-L871 HydrophobicContact CD1-CD1 4.43Å; L867-L871 HydrophobicContact CD1-CG 4.4Å; L867-L871 HydrophobicContact CG-CD1 4.38Å; L867-L871 WeakPolarHBondContact O-CG 3.35Å; L867-L871 PolarHBondContact O-N 3.19Å; L867-L1064 HydrophobicContact CD1-CD1 3.89Å; L867-L1064 HydrophobicContact CD1-CD2 4.08Å; L867-L1064 HydrophobicContact CD2-CD1 4.47Å; L867-L1064 HydrophobicContact CD2-CD2 4.01Å; L867-L1064 HydrophobicContact CG-CD2 4.32Å; L867-I1202 HydrophobicContact CD2-CD1 3.9Å; L867-I1202 HydrophobicContact CD2-CG1 3.95Å; L867-I1202 HydrophobicContact CD2-CG2 4.01Å
868	V	90.9	Very high	89.1	Confident	16.5 Å²	16.5	29.3 Å²	29.3	10%	0.1	15%	0.149	C	C	.	.	H	α-helix	trans	-60	-46.8	177.3	172.5	0	0	0	0	110.8	W864 Q865 T870 L871 A872 Y1205 L1776	W864-V868 HydrophobicContact CE3-CG2 4.14Å; W864-V868 HydrophobicContact CZ3-CG2 4.31Å; W864-V868 WeakPolarHBondContact O-CG2 2.82Å; W864-V868 PolarHBondContact O-N 3.14Å; Q865-V868 CarbonylContact O-C 3.56Å; Q865-V868 WeakPolarHBondContact O-CA 3.44Å; Q865-V868 VanDerWaalsContact O-CB 3.31Å; Q865-V868 WeakPolarHBondContact O-CB 3.36Å; Q865-V868 PolarHBondContact O-N 3.23Å; V868-T870 VanDerWaalsContact C-N 3.3Å; V868-T870 PolarHBondContact O-N 3.08Å; V868-L871 PolarHBondContact O-N 3.18Å; V868-L871 VanDerWaalsContact O-N 3.17Å; V868-A872 WeakPolarHBondContact O-CB 3.1Å; V868-A872 PolarHBondContact O-N 2.96Å; V868-Y1205 HydrophobicContact CB-CE2 4.45Å; V868-Y1205 HydrophobicContact CG1-CD2 4.32Å; V868-Y1205 HydrophobicContact CG1-CE1 4.37Å; V868-Y1205 HydrophobicContact CG1-CE2 3.92Å; V868-Y1205 VanDerWaalsContact CG1-OH 3.31Å; V868-Y1205 WeakPolarHBondContact CG1-OH 3.37Å; V868-Y1205 HydrophobicContact CG2-CD1 3.96Å; V868-Y1205 HydrophobicContact CG2-CD2 3.79Å; V868-Y1205 HydrophobicContact CG2-CE1 3.83Å; V868-Y1205 HydrophobicContact CG2-CE2 3.64Å; V868-Y1205 VanDerWaalsContact CG2-CE2 3.48Å; V868-Y1205 HydrophobicContact CG2-CG 3.95Å; V868-Y1205 VanDerWaalsContact CG2-CZ 3.43Å; V868-L1776 HydrophobicContact CG1-CD1 3.94Å; V868-L1776 WeakPolarHBondContact O-CD1 3.16Å
869	D	91.5	Very high	88.8	Confident	71 Å²	71	32.5 Å²	32.5	38%	0.38	16%	0.161	S	C	.	.	H	α-helix	trans	-62.3	-38.3	176.9	-57.9	-24.7	0	0	0	111.2	Q865 L867 A872 L873	Q865-D869 VanDerWaalsContact O-CG 3.23Å; Q865-D869 PolarHBondContact O-N 3.04Å; L867-D869 VanDerWaalsContact C-N 3.34Å; L867-D869 PolarHBondContact O-N 3.33Å; D869-A872 PolarHBondContact O-N 3.01Å; D869-L873 WeakPolarHBondContact O-CB 3.24Å; D869-L873 WeakPolarHBondContact O-CD1 3.44Å; D869-L873 VanDerWaalsContact O-CG 3.27Å; D869-L873 WeakPolarHBondContact O-CG 3.17Å; D869-L873 PolarHBondContact O-N 3.18Å
870	T	92.5	Very high	88.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63	-44.6	175.6	-51.8	0	0	0	0	111.4	Q822 I849 L853 V866 L867 V868 A872 L873 I874 L1060	Q822-T870 HydrophobicContact CB-CG2 4.33Å; Q822-T870 HydrophobicContact CG-CG2 4.2Å; Q822-T870 WeakPolarHBondContact CG-OG1 3.34Å; Q822-T870 PolarHBondContact NE2-OG1 3.1Å; I849-T870 HydrophobicContact CG2-CG2 3.95Å; L853-T870 HydrophobicContact CD1-CG2 4.39Å; V866-T870 WeakPolarHBondContact O-CB 3.34Å; V866-T870 PolarHBondContact O-N 2.99Å; V866-T870 PolarHBondContact O-OG1 3.16Å; L867-T870 WeakPolarHBondContact O-CB 3.26Å; L867-T870 PolarHBondContact O-N 3.26Å; V868-T870 VanDerWaalsContact C-N 3.3Å; V868-T870 PolarHBondContact O-N 3.08Å; T870-A872 VanDerWaalsContact C-N 3.34Å; T870-A872 PolarHBondContact O-N 2.91Å; T870-L873 PolarHBondContact O-N 2.85Å; T870-I874 HydrophobicContact CG2-CD1 3.99Å; T870-I874 WeakPolarHBondContact O-CB 3.37Å; T870-I874 VanDerWaalsContact O-CG1 3.26Å; T870-I874 WeakPolarHBondContact O-CG1 3.28Å; T870-I874 PolarHBondContact O-N 3.06Å; T870-L1060 HydrophobicContact CG2-CD2 3.74Å
871	L	90.9	Very high	88.1	Confident	4.25 Å²	4.25	33.5 Å²	33.5	2%	0.022	17%	0.165	C	C	.	.	H	α-helix	trans	-65.8	-38.4	176.7	-67.6	171.6	0	0	0	111.5	L867 V868 I874 H875 H1057 L1060 L1206 L1776	L867-L871 HydrophobicContact CD1-CD1 4.43Å; L867-L871 HydrophobicContact CD1-CG 4.4Å; L867-L871 HydrophobicContact CG-CD1 4.38Å; L867-L871 WeakPolarHBondContact O-CG 3.35Å; L867-L871 PolarHBondContact O-N 3.19Å; V868-L871 PolarHBondContact O-N 3.18Å; V868-L871 VanDerWaalsContact O-N 3.17Å; L871-I874 PolarHBondContact O-N 3.09Å; L871-H875 WeakPolarHBondContact O-CB 3.37Å; L871-H875 PolarHBondContact O-CD2 2.63Å; L871-H875 PolarHBondContact O-N 3.36Å; L871-H1057 HydrophobicContact CD2-CB 4.4Å; L871-H1057 PolarHBondContact O-NE2 3.23Å; L871-H1057 VanDerWaalsContact O-NE2 3.15Å; L871-L1060 HydrophobicContact CD2-CD2 4.41Å; L871-L1206 HydrophobicContact CD1-CD2 4.31Å; L871-L1776 HydrophobicContact CB-CD1 4.09Å; L871-L1776 HydrophobicContact CB-CD2 4.35Å
872	A	90	Very high	87.6	Confident	27.25 Å²	27.25	32.7 Å²	32.7	23%	0.225	16%	0.162	C	C	.	.	H	α-helix	trans	-64.8	-43.1	175.7	0	0	0	0	0	112.4	V868 D869 T870 H875 L876 L1776 V1779 A1780	V868-A872 WeakPolarHBondContact O-CB 3.1Å; V868-A872 PolarHBondContact O-N 2.96Å; D869-A872 PolarHBondContact O-N 3.01Å; T870-A872 VanDerWaalsContact C-N 3.34Å; T870-A872 PolarHBondContact O-N 2.91Å; A872-H875 WeakPolarHBondContact O-CB 3.35Å; A872-H875 PolarHBondContact O-N 3.08Å; A872-L876 WeakPolarHBondContact O-CB 3.35Å; A872-L876 PolarHBondContact O-N 3.2Å; A872-L1776 HydrophobicContact CB-CD1 3.92Å; A872-V1779 HydrophobicContact CB-CB 4.06Å; A872-V1779 HydrophobicContact CB-CG1 3.65Å; A872-A1780 HydrophobicContact CB-CB 4.15Å
873	L	89.6	Confident	87.1	Confident	20 Å²	20	33.5 Å²	33.5	11%	0.105	17%	0.165	C	C	.	.	H	α-helix	trans	-68.3	-39.6	177.9	-73.1	166.5	0	0	0	112.5	V820 Q822 D823 L826 D869 T870 H875 L876 H877 L1787	V820-L873 HydrophobicContact CG1-CD1 3.71Å; V820-L873 HydrophobicContact CG1-CD2 4.22Å; Q822-L873 HydrophobicContact CB-CD1 3.91Å; Q822-L873 HydrophobicContact CG-CD1 4.38Å; D823-L873 HydrophobicContact CB-CD1 4.24Å; D823-L873 HydrophobicContact CB-CD2 4.21Å; L826-L873 HydrophobicContact CD1-CB 4.32Å; D869-L873 WeakPolarHBondContact O-CB 3.24Å; D869-L873 WeakPolarHBondContact O-CD1 3.44Å; D869-L873 VanDerWaalsContact O-CG 3.27Å; D869-L873 WeakPolarHBondContact O-CG 3.17Å; D869-L873 PolarHBondContact O-N 3.18Å; T870-L873 PolarHBondContact O-N 2.85Å; L873-H875 VanDerWaalsContact C-N 3.29Å; L873-H875 PolarHBondContact O-N 3.05Å; L873-L876 HydrophobicContact CD2-CD2 4.41Å; L873-L876 WeakPolarHBondContact O-CB 3.32Å; L873-L876 PolarHBondContact O-N 3.3Å; L873-H877 WeakPolarHBondContact O-CB 3.15Å; L873-H877 PolarHBondContact O-N 3.13Å; L873-H877 PolarHBondContact O-ND1 3.24Å; L873-L1787 HydrophobicContact CD2-CD1 4.38Å
874	I	88.9	Confident	86.4	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.8	-40	172.6	-66.8	167.6	0	0	0	110.3	L826 L831 T870 L871 L876 H877 I878 V1056 H1057 L1060	L826-I874 HydrophobicContact CD1-CG1 3.76Å; L826-I874 HydrophobicContact CD2-CG1 4.04Å; L826-I874 HydrophobicContact CG-CG1 4.41Å; L831-I874 HydrophobicContact CD1-CG2 4.28Å; T870-I874 HydrophobicContact CG2-CD1 3.99Å; T870-I874 WeakPolarHBondContact O-CB 3.37Å; T870-I874 VanDerWaalsContact O-CG1 3.26Å; T870-I874 WeakPolarHBondContact O-CG1 3.28Å; T870-I874 PolarHBondContact O-N 3.06Å; L871-I874 PolarHBondContact O-N 3.09Å; I874-L876 PolarHBondContact O-N 2.87Å; I874-H877 PolarHBondContact O-N 2.68Å; I874-I878 HydrophobicContact CG2-CD1 3.73Å; I874-I878 HydrophobicContact CG2-CG1 4.4Å; I874-I878 VanDerWaalsContact O-CB 3.32Å; I874-I878 WeakPolarHBondContact O-CB 3.44Å; I874-I878 VanDerWaalsContact O-CG1 3.23Å; I874-I878 WeakPolarHBondContact O-CG1 3.39Å; I874-I878 PolarHBondContact O-N 3.12Å; I874-I878 VanDerWaalsContact O-N 3.1Å; I874-V1056 HydrophobicContact CD1-CG1 4.45Å; I874-V1056 HydrophobicContact CG2-CB 4.01Å; I874-V1056 HydrophobicContact CG2-CG1 3.78Å; I874-H1057 WeakPolarHBondContact CB-NE2 3.41Å; I874-H1057 WeakPolarHBondContact CG2-CD2 3.46Å; I874-H1057 WeakPolarHBondContact CG2-NE2 3.4Å; I874-L1060 HydrophobicContact CD1-CD2 3.62Å
875	H	87.6	Confident	85.5	Confident	16.25 Å²	16.25	36.2 Å²	36.2	8%	0.075	19%	0.19	C	C	.	.	H	α-helix	trans	-62.9	-43.6	175.1	-156	-17.9	0	0	0	112.6	L871 A872 L873 I878 Y879 F1051 S1052 H1057	L871-H875 WeakPolarHBondContact O-CB 3.37Å; L871-H875 PolarHBondContact O-CD2 2.63Å; L871-H875 PolarHBondContact O-N 3.36Å; A872-H875 WeakPolarHBondContact O-CB 3.35Å; A872-H875 PolarHBondContact O-N 3.08Å; L873-H875 VanDerWaalsContact C-N 3.29Å; L873-H875 PolarHBondContact O-N 3.05Å; H875-I878 PolarHBondContact O-N 3.25Å; H875-Y879 WeakPolarHBondContact O-CB 3.34Å; H875-Y879 PolarHBondContact O-N 3.27Å; H875-Y879 VanDerWaalsContact O-N 3.11Å; H875-F1051 HydrophobicContact CB-CD2 4.06Å; H875-F1051 HydrophobicContact CB-CE2 3.88Å; H875-F1051 AromaticContact CD2-CD2 3.7Å; H875-F1051 AromaticContact CD2-CE2 3.43Å; H875-F1051 WeakPolarHBondContact CD2-CE2 3.49Å; H875-F1051 AromaticContact CD2-CZ 3.69Å; H875-F1051 AromaticContact CE1-CD2 3.4Å; H875-F1051 WeakPolarHBondContact CE1-CD2 3.36Å; H875-F1051 AromaticContact CE1-CE1 3.89Å; H875-F1051 AromaticContact CE1-CE2 3.32Å; H875-F1051 WeakPolarHBondContact CE1-CE2 3.2Å; H875-F1051 AromaticContact CE1-CG 3.78Å; H875-F1051 AromaticContact CE1-CZ 3.55Å; H875-F1051 AromaticContact CG-CD2 3.74Å; H875-F1051 AromaticContact CG-CE2 3.83Å; H875-F1051 AromaticContact ND1-CD2 3.7Å; H875-F1051 AromaticContact ND1-CE2 3.9Å; H875-F1051 WeakPolarHBondContact NE2-CA 3.41Å; H875-F1051 AromaticContact NE2-CD2 3.47Å; H875-F1051 WeakPolarHBondContact NE2-CD2 3.25Å; H875-F1051 AromaticContact NE2-CE1 3.68Å; H875-F1051 AromaticContact NE2-CE2 2.85Å; H875-F1051 WeakPolarHBondContact NE2-CE2 3.3Å; H875-F1051 AromaticContact NE2-CZ 2.96Å; H875-F1051 WeakPolarHBondContact NE2-CZ 3.42Å; H875-S1052 PolarHBondContact CD2-O 2.87Å; H875-S1052 VanDerWaalsContact CD2-O 3.31Å; H875-S1052 PolarHBondContact CE1-N 3.3Å; H875-S1052 PolarHBondContact CE1-O 2.88Å; H875-S1052 PolarHBondContact ND1-O 3.12Å; H875-S1052 PolarHBondContact NE2-N 3.27Å; H875-H1057 AromaticContact CD2-CD2 3.6Å; H875-H1057 AromaticContact CD2-CE1 3.5Å; H875-H1057 PolarHBondContact CD2-CE1 3.11Å; H875-H1057 AromaticContact CD2-ND1 3.85Å; H875-H1057 AromaticContact CD2-NE2 2.86Å; H875-H1057 PolarHBondContact CD2-NE2 3.5Å; H875-H1057 AromaticContact CE1-CE1 3.58Å; H875-H1057 AromaticContact CE1-ND1 4Å; H875-H1057 AromaticContact CG-CE1 3.45Å; H875-H1057 VanDerWaalsContact CG-CE1 3.45Å; H875-H1057 AromaticContact CG-NE2 3.52Å; H875-H1057 PolarHBondContact N-NE2 3.23Å; H875-H1057 VanDerWaalsContact N-NE2 3.19Å; H875-H1057 AromaticContact ND1-CE1 3.84Å; H875-H1057 AromaticContact NE2-CD2 3.75Å; H875-H1057 AromaticContact NE2-CE1 3.09Å; H875-H1057 PolarHBondContact NE2-CE1 3.29Å; H875-H1057 AromaticContact NE2-CG 3.86Å; H875-H1057 AromaticContact NE2-ND1 3.46Å; H875-H1057 PolarHBondContact NE2-ND1 3.24Å; H875-H1057 AromaticContact NE2-NE2 3.31Å; H875-H1057 PolarHBondContact NE2-NE2 3.12Å
876	L	87.4	Confident	84.5	Confident	41 Å²	41	36.4 Å²	36.4	22%	0.215	19%	0.194	C	C	.	.	H	α-helix	trans	-60.2	-52.8	176.6	-178.5	63.6	0	0	0	111.2	A872 L873 I874 I878 Y879 E880 L1048 A1780 D1784	A872-L876 WeakPolarHBondContact O-CB 3.35Å; A872-L876 PolarHBondContact O-N 3.2Å; L873-L876 HydrophobicContact CD2-CD2 4.41Å; L873-L876 WeakPolarHBondContact O-CB 3.32Å; L873-L876 PolarHBondContact O-N 3.3Å; I874-L876 PolarHBondContact O-N 2.87Å; L876-I878 VanDerWaalsContact C-N 3.29Å; L876-I878 PolarHBondContact O-N 3.18Å; L876-Y879 WeakPolarHBondContact O-CA 3.35Å; L876-Y879 WeakPolarHBondContact O-CB 3.34Å; L876-Y879 PolarHBondContact O-N 3.04Å; L876-Y879 VanDerWaalsContact O-N 3.12Å; L876-E880 WeakPolarHBondContact O-CG 3.4Å; L876-E880 PolarHBondContact O-N 3.01Å; L876-L1048 HydrophobicContact CD1-CD1 4.27Å; L876-L1048 HydrophobicContact CD1-CD2 4.12Å; L876-A1780 HydrophobicContact CB-CB 4.45Å; L876-D1784 HydrophobicContact CD1-CB 4.32Å; L876-D1784 HydrophobicContact CD2-CB 4.03Å
877	H	86	Confident	83.4	Confident	12.75 Å²	12.75	40.8 Å²	40.8	6%	0.059	21%	0.21	C	C	.	.	H	α-helix	trans	-62.1	-39	-178.2	-121.6	49.4	0	0	0	112.5	D823 L826 H827 L831 L873 I874 Y879 E880 E881	D823-H877 PolarHBondContact O-NE2 3.01Å; D823-H877 IonicContact OD1-CE1 3.7Å; D823-H877 PolarHBondContact OD1-CE1 2.95Å; D823-H877 IonicContact OD1-NE2 2.64Å; L826-H877 VanDerWaalsContact CB-CD2 3.46Å; L826-H877 WeakPolarHBondContact CB-CD2 3.27Å; L826-H877 WeakPolarHBondContact CB-NE2 3.23Å; H827-H877 AromaticContact CD2-CE1 3.59Å; H827-H877 PolarHBondContact CD2-CE1 3.29Å; H827-H877 VanDerWaalsContact CD2-CE1 3.49Å; H827-H877 AromaticContact CD2-NE2 3.75Å; H827-H877 AromaticContact CE1-CD2 3.88Å; H827-H877 AromaticContact CE1-CE1 3.64Å; H827-H877 PolarHBondContact CE1-CE1 2.88Å; H827-H877 AromaticContact CE1-ND1 3.71Å; H827-H877 AromaticContact CE1-NE2 3.47Å; H827-H877 PolarHBondContact CE1-NE2 3.37Å; H827-H877 AromaticContact CG-CE1 3.94Å; H827-H877 AromaticContact CG-NE2 3.44Å; H827-H877 PolarHBondContact N-NE2 3.31Å; H827-H877 AromaticContact ND1-CD2 3.81Å; H827-H877 AromaticContact ND1-CE1 3.68Å; H827-H877 PolarHBondContact ND1-CE1 2.66Å; H827-H877 AromaticContact ND1-NE2 3.23Å; H827-H877 PolarHBondContact ND1-NE2 3.09Å; H827-H877 VanDerWaalsContact ND1-NE2 3.14Å; H827-H877 AromaticContact NE2-CE1 3.66Å; H827-H877 PolarHBondContact NE2-CE1 3.27Å; H827-H877 VanDerWaalsContact NE2-CE1 3.32Å; H827-H877 AromaticContact NE2-ND1 3.73Å; H827-H877 AromaticContact NE2-NE2 3.85Å; L831-H877 HydrophobicContact CD1-CB 3.78Å; L831-H877 VanDerWaalsContact CD1-CD2 3.45Å; L831-H877 WeakPolarHBondContact CD1-CD2 3.42Å; L873-H877 WeakPolarHBondContact O-CB 3.15Å; L873-H877 PolarHBondContact O-N 3.13Å; L873-H877 PolarHBondContact O-ND1 3.24Å; I874-H877 PolarHBondContact O-N 2.68Å; H877-Y879 VanDerWaalsContact C-N 3.29Å; H877-Y879 PolarHBondContact O-N 2.92Å; H877-E880 IonicContact CG-OE2 3.21Å; H877-E880 IonicContact ND1-OE2 3.18Å; H877-E880 PolarHBondContact ND1-OE2 3.28Å; H877-E880 PolarHBondContact O-N 3.12Å; H877-E881 WeakPolarHBondContact O-CB 3.3Å; H877-E881 PolarHBondContact O-N 3.07Å
878	I	83.5	Confident	82	Confident	6.75 Å²	6.75	46.9 Å²	46.9	4%	0.035	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-35	175.2	-71.5	175	0	0	0	111.7	L831 Y832 I874 H875 L876 R882 S1054 V1056	L831-I878 HydrophobicContact CB-CG1 4.42Å; L831-I878 HydrophobicContact CD1-CD1 4.33Å; L831-I878 HydrophobicContact CD1-CG1 3.56Å; Y832-I878 HydrophobicContact CE2-CG2 4.35Å; I874-I878 HydrophobicContact CG2-CD1 3.73Å; I874-I878 HydrophobicContact CG2-CG1 4.4Å; I874-I878 VanDerWaalsContact O-CB 3.32Å; I874-I878 WeakPolarHBondContact O-CB 3.44Å; I874-I878 VanDerWaalsContact O-CG1 3.23Å; I874-I878 WeakPolarHBondContact O-CG1 3.39Å; I874-I878 PolarHBondContact O-N 3.12Å; I874-I878 VanDerWaalsContact O-N 3.1Å; H875-I878 PolarHBondContact O-N 3.25Å; L876-I878 VanDerWaalsContact C-N 3.29Å; L876-I878 PolarHBondContact O-N 3.18Å; I878-R882 HydrophobicContact CG2-CG 4.49Å; I878-R882 WeakPolarHBondContact O-CB 3.44Å; I878-R882 WeakPolarHBondContact O-CD 3.42Å; I878-R882 VanDerWaalsContact O-CG 3.28Å; I878-R882 WeakPolarHBondContact O-CG 3.4Å; I878-R882 PolarHBondContact O-N 3.13Å; I878-R882 VanDerWaalsContact O-N 3.13Å; I878-S1054 VanDerWaalsContact CD1-CB 3.44Å; I878-S1054 WeakPolarHBondContact CD1-OG 3.36Å; I878-V1056 HydrophobicContact CD1-CB 4.14Å; I878-V1056 HydrophobicContact CD1-CG2 4.17Å
879	Y	81.7	Confident	80.6	Confident	74.5 Å²	74.5	51.4 Å²	51.4	29%	0.292	26%	0.257	S	S	.	.	H	α-helix	trans	-69.8	-40.5	174.3	174.1	-105.3	0	0	0	111.8	H875 L876 H877 R882 S883 F1046 L1048 P1049	H875-Y879 WeakPolarHBondContact O-CB 3.34Å; H875-Y879 PolarHBondContact O-N 3.27Å; H875-Y879 VanDerWaalsContact O-N 3.11Å; L876-Y879 WeakPolarHBondContact O-CA 3.35Å; L876-Y879 WeakPolarHBondContact O-CB 3.34Å; L876-Y879 PolarHBondContact O-N 3.04Å; L876-Y879 VanDerWaalsContact O-N 3.12Å; H877-Y879 VanDerWaalsContact C-N 3.29Å; H877-Y879 PolarHBondContact O-N 2.92Å; Y879-R882 PolarHBondContact O-N 2.87Å; Y879-S883 VanDerWaalsContact O-CB 3.25Å; Y879-S883 WeakPolarHBondContact O-CB 3.28Å; Y879-S883 PolarHBondContact O-N 3.03Å; Y879-S883 PolarHBondContact O-OG 3.15Å; Y879-F1046 HydrophobicContact CE1-CB 4.43Å; Y879-F1046 HydrophobicContact CE1-CD1 4.19Å; Y879-L1048 HydrophobicContact CD1-CD1 3.55Å; Y879-L1048 HydrophobicContact CD1-CD2 4.36Å; Y879-L1048 HydrophobicContact CD1-CG 3.6Å; Y879-L1048 HydrophobicContact CD2-CD1 4.42Å; Y879-L1048 HydrophobicContact CE1-CD1 3.73Å; Y879-L1048 VanDerWaalsContact CE1-CD1 3.49Å; Y879-L1048 HydrophobicContact CE1-CG 3.74Å; Y879-L1048 HydrophobicContact CG-CD1 3.63Å; Y879-L1048 HydrophobicContact CG-CG 4.06Å; Y879-P1049 HydrophobicContact CD2-CG 3.69Å; Y879-P1049 HydrophobicContact CE2-CG 3.82Å; Y879-P1049 VanDerWaalsContact CE2-CG 3.46Å; Y879-P1049 HydrophobicContact CG-CG 4.33Å
880	E	82.3	Confident	79	Confident	80.25 Å²	80.25	54.3 Å²	54.3	38%	0.375	27%	0.268	S	S	.	.	H	α-helix	trans	-63.1	-49.9	176.8	-69.5	174.2	147.6	0	0	111.9	L876 H877 R882 S883 A884	L876-E880 WeakPolarHBondContact O-CG 3.4Å; L876-E880 PolarHBondContact O-N 3.01Å; H877-E880 IonicContact CG-OE2 3.21Å; H877-E880 IonicContact ND1-OE2 3.18Å; H877-E880 PolarHBondContact ND1-OE2 3.28Å; H877-E880 PolarHBondContact O-N 3.12Å; E880-R882 VanDerWaalsContact C-N 3.34Å; E880-R882 PolarHBondContact O-N 3.13Å; E880-S883 CarbonylContact O-C 3.57Å; E880-S883 WeakPolarHBondContact O-CA 3.42Å; E880-S883 WeakPolarHBondContact O-CB 3.43Å; E880-S883 PolarHBondContact O-N 3.05Å; E880-S883 VanDerWaalsContact O-N 3.12Å; E880-S883 PolarHBondContact O-OG 3.12Å; E880-A884 PolarHBondContact O-N 3.3Å
881	E	79.6	Confident	77	Confident	44.5 Å²	44.5	61.2 Å²	61.2	21%	0.208	30%	0.301	C	S	.	.	H	α-helix	trans	-61.3	-42.2	177.4	-94.2	-172.3	165.3	0	0	112.2	P830 L831 Y832 H877 S883 A884 C885	P830-E881 VanDerWaalsContact C-OE1 3.27Å; P830-E881 VanDerWaalsContact CA-OE1 3.28Å; P830-E881 WeakPolarHBondContact CA-OE1 3.41Å; P830-E881 WeakPolarHBondContact CB-OE1 3.38Å; L831-E881 WeakPolarHBondContact CA-OE2 3.34Å; L831-E881 VanDerWaalsContact CB-OE2 3.23Å; L831-E881 WeakPolarHBondContact CB-OE2 3.42Å; L831-E881 VanDerWaalsContact N-CD 3.29Å; L831-E881 PolarHBondContact N-OE1 3.24Å; L831-E881 PolarHBondContact N-OE2 3.13Å; Y832-E881 HydrophobicContact CD2-CB 4.19Å; Y832-E881 HydrophobicContact CD2-CG 4.07Å; Y832-E881 VanDerWaalsContact CD2-OE2 3.28Å; Y832-E881 WeakPolarHBondContact CD2-OE2 3.33Å; Y832-E881 HydrophobicContact CE2-CB 4.47Å; Y832-E881 PolarHBondContact N-OE1 3Å; Y832-E881 PolarHBondContact N-OE2 2.92Å; H877-E881 WeakPolarHBondContact O-CB 3.3Å; H877-E881 PolarHBondContact O-N 3.07Å; E881-S883 VanDerWaalsContact C-N 3.29Å; E881-S883 PolarHBondContact O-N 3.11Å; E881-A884 PolarHBondContact O-N 3.37Å; E881-C885 WeakPolarHBondContact O-CB 3.46Å; E881-C885 PolarHBondContact O-N 3.08Å
882	R	75.1	Confident	75.1	Confident	95.75 Å²	95.75	66.6 Å²	66.6	36%	0.361	33%	0.334	S	S	.	.	H	α-helix	trans	-62.3	-40	174	-96.1	176.9	179.6	155.8	3.3	111.6	Y832 I878 Y879 E880 A884 C885 L886 D1431	Y832-R882 HydrophobicContact CE2-CG 4.27Å; Y832-R882 PolarHBondContact OH-NE 3.04Å; Y832-R882 PolarHBondContact OH-NH2 3.16Å; Y832-R882 VanDerWaalsContact OH-NH2 3.09Å; I878-R882 HydrophobicContact CG2-CG 4.49Å; I878-R882 WeakPolarHBondContact O-CB 3.44Å; I878-R882 WeakPolarHBondContact O-CD 3.42Å; I878-R882 VanDerWaalsContact O-CG 3.28Å; I878-R882 WeakPolarHBondContact O-CG 3.4Å; I878-R882 PolarHBondContact O-N 3.13Å; I878-R882 VanDerWaalsContact O-N 3.13Å; Y879-R882 PolarHBondContact O-N 2.87Å; E880-R882 VanDerWaalsContact C-N 3.34Å; E880-R882 PolarHBondContact O-N 3.13Å; R882-A884 VanDerWaalsContact C-N 3.29Å; R882-A884 PolarHBondContact O-N 3.26Å; R882-C885 PolarHBondContact O-N 3.09Å; R882-L886 HydrophobicContact CG-CD1 4.47Å; R882-L886 WeakPolarHBondContact O-CD1 3.31Å; R882-L886 PolarHBondContact O-N 3.22Å; R882-L886 VanDerWaalsContact O-N 3.1Å; R882-D1431 IonicContact CZ-OD1 2.7Å; R882-D1431 IonicContact CZ-OD2 3.47Å; R882-D1431 VanDerWaalsContact CZ-OD2 3.31Å; R882-D1431 IonicContact NH1-OD1 3.51Å; R882-D1431 IonicContact NH1-OD2 3.74Å; R882-D1431 PolarHBondContact NH1-OD2 2.85Å; R882-D1431 IonicContact NH2-OD1 3.15Å; R882-D1431 PolarHBondContact NH2-OD1 3.15Å; R882-D1431 IonicContact NH2-OD2 2.72Å; R882-D1431 PolarHBondContact NH2-OD2 2.68Å
883	S	75.6	Confident	72.9	Confident	29.5 Å²	29.5	68.8 Å²	68.8	21%	0.206	35%	0.352	C	S	.	.	H	α-helix	trans	-68.6	-35	178.1	-49.1	0	0	0	0	112.5	Y879 E880 E881 L886 K887	Y879-S883 VanDerWaalsContact O-CB 3.25Å; Y879-S883 WeakPolarHBondContact O-CB 3.28Å; Y879-S883 PolarHBondContact O-N 3.03Å; Y879-S883 PolarHBondContact O-OG 3.15Å; E880-S883 CarbonylContact O-C 3.57Å; E880-S883 WeakPolarHBondContact O-CA 3.42Å; E880-S883 WeakPolarHBondContact O-CB 3.43Å; E880-S883 PolarHBondContact O-N 3.05Å; E880-S883 VanDerWaalsContact O-N 3.12Å; E880-S883 PolarHBondContact O-OG 3.12Å; E881-S883 VanDerWaalsContact C-N 3.29Å; E881-S883 PolarHBondContact O-N 3.11Å; S883-L886 PolarHBondContact O-N 2.91Å; S883-K887 VanDerWaalsContact O-CD 3.3Å; S883-K887 WeakPolarHBondContact O-CD 3.47Å; S883-K887 WeakPolarHBondContact O-CE 3.39Å; S883-K887 VanDerWaalsContact O-CG 3.26Å; S883-K887 WeakPolarHBondContact O-CG 3.34Å; S883-K887 PolarHBondContact O-N 3.2Å; S883-K887 VanDerWaalsContact O-N 3.11Å
884	A	77.1	Confident	70.2	Confident	54.25 Å²	54.25	75.8 Å²	75.8	45%	0.448	38%	0.382	S	S	.	.	H	α-helix	trans	-66.2	-49.7	172.9	0	0	0	0	0	111.1	E880 E881 R882 L886 K887 E888	E880-A884 PolarHBondContact O-N 3.3Å; E881-A884 PolarHBondContact O-N 3.37Å; R882-A884 VanDerWaalsContact C-N 3.29Å; R882-A884 PolarHBondContact O-N 3.26Å; A884-L886 VanDerWaalsContact C-N 3.27Å; A884-L886 PolarHBondContact O-N 3.1Å; A884-K887 WeakPolarHBondContact O-CB 3.35Å; A884-K887 PolarHBondContact O-N 2.93Å; A884-K887 VanDerWaalsContact O-N 3.09Å; A884-E888 PolarHBondContact O-N 3.32Å; A884-E888 VanDerWaalsContact O-N 3.11Å
885	C	69.7	Low	67.8	Low	34 Å²	34	81.1 Å²	81.1	23%	0.23	42%	0.416	C	S	.	.	H	α-helix	trans	-59.8	-34.4	177.3	-174.7	0	0	0	0	112.8	E881 R882 K889	E881-C885 WeakPolarHBondContact O-CB 3.46Å; E881-C885 PolarHBondContact O-N 3.08Å; R882-C885 PolarHBondContact O-N 3.09Å; C885-K889 WeakPolarHBondContact O-CB 3.36Å; C885-K889 VanDerWaalsContact O-CG 3.3Å; C885-K889 WeakPolarHBondContact O-CG 3.36Å; C885-K889 PolarHBondContact O-N 2.91Å; C885-K889 VanDerWaalsContact SG-CE 3.56Å; C885-K889 PolarHBondContact SG-NZ 2.95Å; C885-K889 VanDerWaalsContact SG-NZ 3.36Å
886	L	70	Confident	65	Low	101.5 Å²	101.5	88 Å²	88	53%	0.531	45%	0.454	S	S	.	.	H	α-helix	trans	-68	-38.6	174.4	-112.3	79	0	0	0	112.7	R882 S883 A884 K889 Q890	R882-L886 HydrophobicContact CG-CD1 4.47Å; R882-L886 WeakPolarHBondContact O-CD1 3.31Å; R882-L886 PolarHBondContact O-N 3.22Å; R882-L886 VanDerWaalsContact O-N 3.1Å; S883-L886 PolarHBondContact O-N 2.91Å; A884-L886 VanDerWaalsContact C-N 3.27Å; A884-L886 PolarHBondContact O-N 3.1Å; L886-K889 PolarHBondContact O-N 3.01Å; L886-Q890 WeakPolarHBondContact O-CG 3.38Å; L886-Q890 PolarHBondContact O-N 3.18Å; L886-Q890 VanDerWaalsContact O-N 3.14Å
887	K	69.5	Low	62.2	Low	120.75 Å²	120.75	91.8 Å²	91.8	53%	0.525	48%	0.482	S	S	.	.	H	α-helix	trans	-66.6	-46.5	177.6	-71.8	169.8	-175.8	173.8	0	111.3	S883 A884 K889 Q890 E891	S883-K887 VanDerWaalsContact O-CD 3.3Å; S883-K887 WeakPolarHBondContact O-CD 3.47Å; S883-K887 WeakPolarHBondContact O-CE 3.39Å; S883-K887 VanDerWaalsContact O-CG 3.26Å; S883-K887 WeakPolarHBondContact O-CG 3.34Å; S883-K887 PolarHBondContact O-N 3.2Å; S883-K887 VanDerWaalsContact O-N 3.11Å; A884-K887 WeakPolarHBondContact O-CB 3.35Å; A884-K887 PolarHBondContact O-N 2.93Å; A884-K887 VanDerWaalsContact O-N 3.09Å; K887-K889 VanDerWaalsContact C-N 3.29Å; K887-K889 PolarHBondContact O-N 3.36Å; K887-Q890 CarbonylContact O-C 3.6Å; K887-Q890 WeakPolarHBondContact O-CA 3.39Å; K887-Q890 PolarHBondContact O-N 3.19Å; K887-E891 PolarHBondContact O-N 3.07Å
888	E	63.1	Low	59.6	Low	133.5 Å²	133.5	97.3 Å²	97.3	62%	0.624	52%	0.516	S	S	*	.	H	α-helix	trans	-57.4	-41	176.8	-151.1	179.2	-163	0	0	111.8	A884 Q890 E891 T892	A884-E888 PolarHBondContact O-N 3.32Å; A884-E888 VanDerWaalsContact O-N 3.11Å; E888-Q890 VanDerWaalsContact C-N 3.32Å; E888-Q890 PolarHBondContact O-N 3.21Å; E888-E891 PolarHBondContact O-N 3.13Å; E888-T892 WeakPolarHBondContact O-CB 3.31Å; E888-T892 WeakPolarHBondContact O-CG2 3.24Å; E888-T892 PolarHBondContact O-N 3.15Å; E888-T892 PolarHBondContact O-OG1 3.08Å; E888-T892 VanDerWaalsContact O-OG1 3.09Å
889	K	60.8	Low	57.1	Low	111.5 Å²	111.5	102.8 Å²	102.8	49%	0.485	55%	0.55	S	S	.	*	H	α-helix	trans	-67.7	-27.3	173.6	-73.8	177.8	179.3	178.8	0	114.1	C885 L886 K887 T892 A893 L1428	C885-K889 WeakPolarHBondContact O-CB 3.36Å; C885-K889 VanDerWaalsContact O-CG 3.3Å; C885-K889 WeakPolarHBondContact O-CG 3.36Å; C885-K889 PolarHBondContact O-N 2.91Å; C885-K889 VanDerWaalsContact SG-CE 3.56Å; C885-K889 PolarHBondContact SG-NZ 2.95Å; C885-K889 VanDerWaalsContact SG-NZ 3.36Å; L886-K889 PolarHBondContact O-N 3.01Å; K887-K889 VanDerWaalsContact C-N 3.29Å; K887-K889 PolarHBondContact O-N 3.36Å; K889-T892 WeakPolarHBondContact CA-OG1 3.44Å; K889-T892 PolarHBondContact O-OG1 3.22Å; K889-T892 VanDerWaalsContact O-OG1 3.11Å; K889-A893 VanDerWaalsContact O-CB 3.28Å; K889-A893 WeakPolarHBondContact O-CB 3.14Å; K889-A893 PolarHBondContact O-N 3.2Å; K889-L1428 PolarHBondContact NZ-O 3.41Å
890	Q	57.1	Low	54.7	Low	131.25 Å²	131.25	106.2 Å²	106.2	61%	0.613	57%	0.574	S	S	*	*	H	α-helix	trans	-82.2	-33.5	176.3	-74.8	-179.8	9.5	0	0	112.8	L886 K887 E888 A893	L886-Q890 WeakPolarHBondContact O-CG 3.38Å; L886-Q890 PolarHBondContact O-N 3.18Å; L886-Q890 VanDerWaalsContact O-N 3.14Å; K887-Q890 CarbonylContact O-C 3.6Å; K887-Q890 WeakPolarHBondContact O-CA 3.39Å; K887-Q890 PolarHBondContact O-N 3.19Å; E888-Q890 VanDerWaalsContact C-N 3.32Å; E888-Q890 PolarHBondContact O-N 3.21Å; Q890-A893 PolarHBondContact O-N 2.96Å
891	E	52	Low	52.2	Low	146.5 Å²	146.5	109.7 Å²	109.7	69%	0.685	59%	0.59	S	S	*	*	H	α-helix	trans	-72.3	-37.7	176.9	-70.7	-177.1	168.3	0	0	111.7	K887 E888 A893 K894	K887-E891 PolarHBondContact O-N 3.07Å; E888-E891 PolarHBondContact O-N 3.13Å; E891-A893 PolarHBondContact O-N 3.19Å; E891-A893 VanDerWaalsContact O-N 3.16Å; E891-K894 PolarHBondContact O-N 3.49Å
892	T	49.5	Very low	49.8	Very low	117 Å²	117	115 Å²	115	72%	0.718	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-12.5	171.8	50.5	0	0	0	0	114.2	E888 K889	E888-T892 WeakPolarHBondContact O-CB 3.31Å; E888-T892 WeakPolarHBondContact O-CG2 3.24Å; E888-T892 PolarHBondContact O-N 3.15Å; E888-T892 PolarHBondContact O-OG1 3.08Å; E888-T892 VanDerWaalsContact O-OG1 3.09Å; K889-T892 WeakPolarHBondContact CA-OG1 3.44Å; K889-T892 PolarHBondContact O-OG1 3.22Å; K889-T892 VanDerWaalsContact O-OG1 3.11Å
893	A	43.8	Very low	47.7	Very low	72.25 Å²	72.25	117.8 Å²	117.8	60%	0.597	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	5.1	-178.2	0	0	0	0	0	115.1	K889 Q890 E891 P895	K889-A893 VanDerWaalsContact O-CB 3.28Å; K889-A893 WeakPolarHBondContact O-CB 3.14Å; K889-A893 PolarHBondContact O-N 3.2Å; Q890-A893 PolarHBondContact O-N 2.96Å; E891-A893 PolarHBondContact O-N 3.19Å; E891-A893 VanDerWaalsContact O-N 3.16Å; A893-P895 VanDerWaalsContact O-CD 3.3Å; A893-P895 WeakPolarHBondContact O-CD 3.34Å
894	K	33.2	Very low	45.6	Very low	168 Å²	168	120.8 Å²	120.8	73%	0.73	66%	0.655	S	S	*	*			trans	-90.4	114.5	174.4	-76	178.7	179.6	169.1	0	111.2	E891 N896	E891-K894 PolarHBondContact O-N 3.49Å; K894-N896 PolarHBondContact O-N 2.95Å
895	P	38.8	Very low	43.3	Very low	112.25 Å²	112.25	125.4 Å²	125.4	73%	0.729	67%	0.672	S	S	*	*			trans	-75.4	139.9	177.9	30.9	-33.9	0	0	0	111.5	A893 C897	A893-P895 VanDerWaalsContact O-CD 3.3Å; A893-P895 WeakPolarHBondContact O-CD 3.34Å; P895-C897 VanDerWaalsContact C-N 3.31Å; P895-C897 PolarHBondContact O-N 3.23Å
896	N	29	Very low	41.4	Very low	160.5 Å²	160.5	131.1 Å²	131.1	86%	0.858	70%	0.7	S	S	*	*			trans	-68.8	102.3	172.7	-75.2	-34.4	0	0	0	111.2	K894 T898	K894-N896 PolarHBondContact O-N 2.95Å; N896-T898 PolarHBondContact O-N 3.04Å
897	C	29.3	Very low	39.4	Very low	121 Å²	121	131.7 Å²	131.7	82%	0.818	71%	0.708	S	S	*	*			trans	-103.8	95.3	165.4	-86.2	0	0	0	0	110.5	P895 V899	P895-C897 VanDerWaalsContact C-N 3.31Å; P895-C897 PolarHBondContact O-N 3.23Å; C897-V899 PolarHBondContact O-N 3.22Å
898	T	30.3	Very low	37.6	Very low	126.75 Å²	126.75	133.7 Å²	133.7	78%	0.778	72%	0.719	S	S	*	*			trans	-95	136.1	169.7	50.3	0	0	0	0	109.5	N896 D900	N896-T898 PolarHBondContact O-N 3.04Å; T898-D900 PolarHBondContact O-N 3.34Å
899	V	31.7	Very low	35.8	Very low	123.5 Å²	123.5	133 Å²	133	75%	0.748	72%	0.724	S	S	*	*			trans	-130.5	124.9	147.2	-176.7	0	0	0	0	110.8	C897 E901	C897-V899 PolarHBondContact O-N 3.22Å; V899-E901 HydrophobicContact CG1-CG 4.36Å
900	D	30.9	Very low	34.2	Very low	146.5 Å²	146.5	134.6 Å²	134.6	78%	0.783	74%	0.738	S	S	*	*			trans	-145	125.2	152.7	-85.9	-35.7	0	0	0	114	T898	T898-D900 PolarHBondContact O-N 3.34Å
901	E	30.2	Very low	32.8	Very low	153.75 Å²	153.75	134.8 Å²	134.8	72%	0.718	75%	0.748	S	S	*	*			trans	133.6	124.5	136.6	-87.3	-158.9	151.5	0	0	116.2	V899	V899-E901 HydrophobicContact CG1-CG 4.36Å
902	K	29.4	Very low	31.5	Very low	155.25 Å²	155.25	133.1 Å²	133.1	68%	0.675	75%	0.753	S	S	*	*			trans	99.2	127.5	143.3	-70.4	170.1	-176.7	138.6	0	116
903	N	31.2	Very low	30.5	Very low	153.75 Å²	153.75	133.8 Å²	133.8	82%	0.822	76%	0.756	S	S	*	*			trans	125.3	138.5	131.1	-73	-28.3	0	0	0	116.1
904	S	30.7	Very low	29.5	Very low	92 Å²	92	137.1 Å²	137.1	64%	0.643	76%	0.763	S	S	*	*				114.8	129.6	72.6	56.4	0	0	0	0	117.2
905	N	29	Very low	29.3	Very low	151.25 Å²	151.25	138.1 Å²	138.1	81%	0.809	77%	0.768	S	S	*	*			trans	55.5	127.7	136.9	-53.5	-15.1	0	0	0	119.2
906	L	30.2	Very low	28.7	Very low	153.75 Å²	153.75	137.7 Å²	137.7	81%	0.805	77%	0.767	S	S	*	*				171.1	124.5	82.2	-155.3	76	0	0	0	113
907	T	27.7	Very low	28.5	Very low	113.75 Å²	113.75	137.3 Å²	137.3	70%	0.698	77%	0.766	S	S	*	*			trans	18.4	144.5	150.1	46.7	0	0	0	0	116.6
908	H	31.4	Very low	28.4	Very low	163.25 Å²	163.25	140.7 Å²	140.7	76%	0.756	77%	0.766	S	S	*	*				-136.4	134.4	100.7	-100	-74.2	0	0	0	111.6
909	T	25.8	Very low	28.1	Very low	120.25 Å²	120.25	140.1 Å²	140.1	74%	0.738	77%	0.767	S	S	*	*			trans	15.1	125.3	143.9	43.5	0	0	0	0	115.2
910	D	27	Very low	27.8	Very low	144.25 Å²	144.25	139.6 Å²	139.6	77%	0.771	77%	0.769	S	S	*	*				-135	142.8	91.3	-95.1	-40.5	0	0	0	112.3	S912	D910-S912 PolarHBondContact O-N 3.21Å
911	T	27.5	Very low	27.6	Very low	134.25 Å²	134.25	140.8 Å²	140.8	82%	0.824	77%	0.774	S	S	*	*			trans	37.8	114.4	165.4	-2.7	0	0	0	0	116.9
912	S	25.2	Very low	27.4	Very low	112.75 Å²	112.75	136.8 Å²	136.8	79%	0.788	77%	0.774	S	S	*	*				175.2	118.6	129.3	76.2	0	0	0	0	114.6	D910	D910-S912 PolarHBondContact O-N 3.21Å
913	V	27.1	Very low	27.2	Very low	129.75 Å²	129.75	136.9 Å²	136.9	79%	0.786	78%	0.781	S	S	*	*			trans	-136.1	141.2	-171.5	-178	0	0	0	0	110.9	F915	V913-F915 HydrophobicContact CG1-CD2 4.28Å
914	L	24.5	Very low	26.9	Very low	142.5 Å²	142.5	138.6 Å²	138.6	75%	0.746	78%	0.781	S	S	*	*			trans	179.8	108.4	154.1	-98.3	149.3	0	0	0	115
915	F	27.5	Very low	26.7	Very low	189.5 Å²	189.5	141 Å²	141	83%	0.831	79%	0.787	S	S	*	*				152.8	120.7	127.8	-78.8	-94.5	0	0	0	113.5	V913	V913-F915 HydrophobicContact CG1-CD2 4.28Å
916	S	26	Very low	26.6	Very low	102.5 Å²	102.5	139.4 Å²	139.4	72%	0.717	79%	0.787	S	S	*	*				143.1	116	114.4	-46.6	0	0	0	0	113
917	N	24.9	Very low	26.3	Very low	153.75 Å²	153.75	139.5 Å²	139.5	82%	0.822	79%	0.788	S	S	*	*			trans	-36.3	133.6	145.7	-88.1	-18.5	0	0	0	114.4
918	K	28	Very low	26.2	Very low	192.25 Å²	192.25	137.2 Å²	137.2	84%	0.836	79%	0.786	S	S	*	*			trans	-118.8	143.1	161.4	-89.8	178.4	179	174.2	0	110.9	E785	E785-K918 IonicContact OE2-NZ 2.66Å; E785-K918 PolarHBondContact OE2-NZ 2.84Å
919	S	24.4	Very low	26	Very low	112.75 Å²	112.75	134.7 Å²	134.7	79%	0.788	78%	0.783	S	S	*	*			trans	-137.9	143.5	176.6	52.1	0	0	0	0	110.7
920	S	25.6	Very low	25.9	Very low	113.25 Å²	113.25	135 Å²	135	79%	0.792	78%	0.78	S	S	*	*			trans	-122	136.5	179	51.1	0	0	0	0	113
921	I	27.2	Very low	25.9	Very low	172.25 Å²	172.25	134.3 Å²	134.3	88%	0.883	78%	0.775	S	S	*	*			trans	-151.8	135.8	162.1	-83.5	165.6	0	0	0	107.6
922	G	25.6	Very low	25.9	Very low	69.5 Å²	69.5	133.4 Å²	133.4	72%	0.716	77%	0.77	S	S	*	*			trans	160.6	144	176.1	0	0	0	0	0	115.3
923	L	25	Very low	25.9	Very low	158.5 Å²	158.5	136.1 Å²	136.1	83%	0.83	77%	0.77	S	S	*	*			trans	-93.7	136.1	-179.6	-93.8	79.5	0	0	0	112.9
924	K	25.2	Very low	25.8	Very low	188.75 Å²	188.75	140.2 Å²	140.2	82%	0.821	77%	0.773	S	S	*	*			trans	-178.1	143.1	133.4	-94.2	176.3	-177.7	-179.4	0	115.2
925	N	26.3	Very low	25.9	Very low	143 Å²	143	136.7 Å²	136.7	77%	0.765	77%	0.771	S	S	*	*			trans	69.7	123.7	164.4	-55.4	5.7	0	0	0	118
926	S	27	Very low	25.8	Very low	116 Å²	116	133.3 Å²	133.3	81%	0.811	77%	0.77	S	S	*	*				-147.5	129.4	117.3	-176.4	0	0	0	0	110
927	L	24.3	Very low	25.7	Very low	156.75 Å²	156.75	133.8 Å²	133.8	82%	0.821	77%	0.772	S	S	*	*				120	115.8	117	-90	160.2	0	0	0	111.6	K836	K836-L927 HydrophobicContact CB-CB 4.11Å; K836-L927 HydrophobicContact CB-CD1 4.36Å; K836-L927 HydrophobicContact CB-CD2 4.09Å; K836-L927 HydrophobicContact CB-CG 4.43Å; K836-L927 HydrophobicContact CD-CB 4.47Å; K836-L927 HydrophobicContact CD-CD2 3.96Å
928	G	25.3	Very low	25.7	Very low	64.75 Å²	64.75	134.8 Å²	134.8	67%	0.668	77%	0.773	S	S	*	*			trans	131.2	135.4	176.7	0	0	0	0	0	112.3	K836	K836-G928 PolarHBondContact NZ-O 3.02Å
929	V	27	Very low	25.6	Very low	112.25 Å²	112.25	132.2 Å²	132.2	68%	0.68	77%	0.766	S	S	*	*				-140.2	138.9	87.8	166.6	0	0	0	0	109.7	K836 N840 L931	K836-V929 HydrophobicContact CB-CG2 4.35Å; K836-V929 HydrophobicContact CD-CG2 3.69Å; K836-V929 HydrophobicContact CG-CG2 3.52Å; N840-V929 WeakPolarHBondContact OD1-CG1 3.26Å; V929-L931 HydrophobicContact CG1-CG 4.27Å
930	D	23.5	Very low	25.7	Very low	126.75 Å²	126.75	135.9 Å²	135.9	68%	0.678	77%	0.768	S	S	*	*			trans	-89.9	142.2	171.6	-154.7	-17.8	0	0	0	110.4	T932	D930-T932 PolarHBondContact OD1-N 2.86Å; D930-T932 PolarHBondContact OD1-OG1 3.33Å
931	L	26.5	Very low	25.8	Very low	128.5 Å²	128.5	136.7 Å²	136.7	67%	0.673	76%	0.763	S	S	*	*			trans	-148.4	95.1	162.1	-93.8	168.9	0	0	0	115.9	V843 V929 E933 Y997	V843-L931 HydrophobicContact CG1-CD1 4.17Å; V843-L931 HydrophobicContact CG2-CD1 4.17Å; V929-L931 HydrophobicContact CG1-CG 4.27Å; L931-E933 PolarHBondContact O-N 3.36Å; L931-Y997 HydrophobicContact CD1-CD2 3.92Å; L931-Y997 HydrophobicContact CD1-CG 3.87Å
932	T	27.4	Very low	25.8	Very low	116 Å²	116	135.3 Å²	135.3	71%	0.712	76%	0.758	S	S	*	*			trans	-79	91	167.7	47.6	0	0	0	0	115	D930	D930-T932 PolarHBondContact OD1-N 2.86Å; D930-T932 PolarHBondContact OD1-OG1 3.33Å
933	E	25.2	Very low	25.8	Very low	169 Å²	169	140.1 Å²	140.1	79%	0.79	76%	0.761	S	S	*	*			trans	-11.7	100	157.2	-103.7	-174.6	155	0	0	117.3	L931 G935	L931-E933 PolarHBondContact O-N 3.36Å; E933-G935 PolarHBondContact O-N 2.96Å
934	Y	25.4	Very low	26.3	Very low	216.25 Å²	216.25	137.9 Å²	137.9	85%	0.848	76%	0.757	S	S	*	*			trans	58.9	108.1	136.9	-91.4	-88.5	0	0	0	114.5
935	G	26.5	Very low	26.8	Very low	68.5 Å²	68.5	134.4 Å²	134.4	71%	0.706	75%	0.753	S	S	*	*			trans	-173.8	38.8	177.3	0	0	0	0	0	115.4	E933 C937	E933-G935 PolarHBondContact O-N 2.96Å; G935-C937 PolarHBondContact O-N 2.96Å; G935-C937 VanDerWaalsContact O-N 3.16Å
936	S	25.2	Very low	26.9	Very low	117.5 Å²	117.5	132.5 Å²	132.5	82%	0.822	75%	0.751	S	S	*	*			trans	-76	103.8	-177.5	-59.3	0	0	0	0	114.5	Q938	S936-Q938 PolarHBondContact O-N 3.31Å
937	C	24.3	Very low	26.9	Very low	112.5 Å²	112.5	134.1 Å²	134.1	76%	0.76	75%	0.751	S	S	*	*			trans	-127.6	127.6	166.3	-92.9	0	0	0	0	109.1	G935 I939	G935-C937 PolarHBondContact O-N 2.96Å; G935-C937 VanDerWaalsContact O-N 3.16Å; C937-I939 PolarHBondContact O-N 3.48Å
938	Q	25.3	Very low	27.1	Very low	176.25 Å²	176.25	131.7 Å²	131.7	82%	0.824	75%	0.747	S	S	*	*			trans	-77.9	122.2	144.8	-71	-174.6	-7.7	0	0	109.9	S936 K940	S936-Q938 PolarHBondContact O-N 3.31Å; Q938-K940 PolarHBondContact O-N 2.92Å
939	I	25.6	Very low	27.3	Very low	137.25 Å²	137.25	133.5 Å²	133.5	70%	0.704	75%	0.75	S	S	*	*				-76.9	117.9	123.1	-78.6	161.4	0	0	0	109.9	C937 D941	C937-I939 PolarHBondContact O-N 3.48Å; I939-D941 WeakPolarHBondContact CG2-OD2 3.5Å
940	K	26.8	Very low	27.3	Very low	189.75 Å²	189.75	132.9 Å²	132.9	83%	0.825	75%	0.751	S	S	*	*			trans	-136.5	119.6	149.7	-77.5	-171	173.4	-172.7	0	111.9	Q938	Q938-K940 PolarHBondContact O-N 2.92Å
941	D	27.1	Very low	27.4	Very low	130.5 Å²	130.5	135.6 Å²	135.6	70%	0.698	76%	0.761	S	S	*	*			trans	-90.9	149.4	157.8	-70.2	-51.8	0	0	0	107.9	I939	I939-D941 WeakPolarHBondContact CG2-OD2 3.5Å
942	D	27.4	Very low	27.5	Very low	142.75 Å²	142.75	132.6 Å²	132.6	76%	0.763	76%	0.762	S	S	*	*				-167.8	147.9	76.9	-102	-40.1	0	0	0	114.3
943	Q	26.4	Very low	27.5	Very low	169.75 Å²	169.75	134.1 Å²	134.1	79%	0.793	77%	0.765	S	S	*	*			trans	62.6	122.2	130.5	-67.5	-144.4	-13.5	0	0	120.7
944	P	34.5	Very low	27.7	Very low	114 Å²	114	132.9 Å²	132.9	74%	0.74	76%	0.764	S	S	*	*			trans	-95.1	-157	164.9	34.5	-24	0	0	0	112.3
945	P	36.2	Very low	27.9	Very low	113.75 Å²	113.75	127.2 Å²	127.2	74%	0.739	76%	0.756	S	S	*	*				-133.4	160.7	-53.7	36.2	-19.4	0	0	0	115.6
946	S	27.4	Very low	28	Very low	103.75 Å²	103.75	130.3 Å²	130.3	73%	0.726	76%	0.756	S	S	*	*			trans	176.1	132.2	141.2	54.7	0	0	0	0	114
947	N	27.9	Very low	28.2	Very low	150 Å²	150	130.9 Å²	130.9	80%	0.802	75%	0.75	S	S	*	*				83.2	141.9	102.6	-77.2	-16.5	0	0	0	115.6
948	S	28.8	Very low	28.4	Very low	105 Å²	105	132.2 Å²	132.2	73%	0.734	75%	0.749	S	S	*	*				138.2	138.7	60.5	59.1	0	0	0	0	115.6
949	S	28	Very low	28.7	Very low	103.5 Å²	103.5	128.4 Å²	128.4	72%	0.724	74%	0.743	S	S	*	*			trans	56.6	132.9	133.5	55.7	0	0	0	0	116.7
950	S	27.2	Very low	28.8	Very low	100.25 Å²	100.25	129.2 Å²	129.2	70%	0.701	75%	0.749	S	S	*	*				130.3	138.8	82.5	68.3	0	0	0	0	113.7
951	M	26.6	Very low	28.9	Very low	182.75 Å²	182.75	124.1 Å²	124.1	90%	0.9	74%	0.741	S	S	*	*				73.8	129.2	98.4	-131	73.2	96.8	0	0	114.1
952	G	28	Very low	29	Very low	66.25 Å²	66.25	124.5 Å²	124.5	68%	0.683	74%	0.743	S	S	*	*			trans	159.7	72.6	148.6	0	0	0	0	0	114.8	N954	G952-N954 PolarHBondContact O-N 2.88Å
953	N	27.4	Very low	29.1	Very low	146 Å²	146	123.2 Å²	123.2	78%	0.781	74%	0.736	S	S	*	*			trans	31.4	137.9	153.7	-69.6	-6.5	0	0	0	119.4
954	N	29.6	Very low	29.2	Very low	144.5 Å²	144.5	120.7 Å²	120.7	77%	0.773	73%	0.729	S	S	*	*				135.5	126.5	125.7	-93.2	-9.5	0	0	0	114	G952	G952-N954 PolarHBondContact O-N 2.88Å
955	S	30.1	Very low	29	Very low	96.25 Å²	96.25	123.4 Å²	123.4	67%	0.673	73%	0.729	S	S	*	*				90.3	119.5	107.3	-42.3	0	0	0	0	119.2
956	N	27.9	Very low	28.6	Very low	133.5 Å²	133.5	124.4 Å²	124.4	71%	0.714	73%	0.728	S	S	*	*			trans	71	132.6	133.3	-76	2.6	0	0	0	119.1
957	N	29.3	Very low	28.8	Very low	131.25 Å²	131.25	125.1 Å²	125.1	70%	0.702	73%	0.727	S	S	*	*			trans	93.1	120.9	136.6	-64.9	-7.4	0	0	0	119.7
958	N	28.7	Very low	28.9	Very low	138.5 Å²	138.5	123.8 Å²	123.8	74%	0.741	72%	0.721	S	S	*	*				96.3	125	115.4	-78.9	-11.5	0	0	0	116.8
959	S	31.6	Very low	29	Very low	97.75 Å²	97.75	124.9 Å²	124.9	68%	0.684	72%	0.718	S	S	*	*				122.8	123.4	120.8	58.8	0	0	0	0	115.6
960	N	27.9	Very low	29	Very low	154.25 Å²	154.25	127.2 Å²	127.2	83%	0.825	72%	0.723	S	S	*	*				60.8	126	118.2	-61.8	-1.7	0	0	0	117.6
961	A	28.2	Very low	29.1	Very low	81.25 Å²	81.25	126.2 Å²	126.2	67%	0.671	72%	0.72	S	S	*	*			cis	129.7	160.1	37.5	0	0	0	0	0	112.7
962	D	28.9	Very low	29.2	Very low	138.75 Å²	138.75	124.6 Å²	124.6	74%	0.742	72%	0.716	S	S	*	*			trans	93.2	129.8	142.1	-83.9	9.7	0	0	0	117.6
963	N	29.5	Very low	29.2	Very low	115.75 Å²	115.75	128.4 Å²	128.4	62%	0.619	72%	0.72	S	S	*	*				136.9	138.1	57	-103.9	-41.4	0	0	0	117.5
964	N	28.7	Very low	29.2	Very low	117.5 Å²	117.5	126.4 Å²	126.4	63%	0.628	72%	0.717	S	S	*	*			trans	67.5	124.3	139	-72.5	-48.6	0	0	0	119.7
965	K	31.7	Very low	28.9	Very low	170.75 Å²	170.75	125.5 Å²	125.5	74%	0.742	72%	0.721	S	S	*	*				103.3	129.7	110.5	-77.9	168	-169.7	168.3	0	115.7
966	N	27.9	Very low	28.6	Very low	134.25 Å²	134.25	126.1 Å²	126.1	72%	0.718	73%	0.725	S	S	*	*				121.7	151.9	56.2	-90.9	16.1	0	0	0	113.9
967	V	31.4	Very low	28.6	Very low	118.5 Å²	118.5	125 Å²	125	72%	0.718	73%	0.728	S	S	*	*				134.6	131.1	108.6	142.5	0	0	0	0	115.1
968	D	28.6	Very low	28.4	Very low	124 Å²	124	123.9 Å²	123.9	66%	0.663	73%	0.731	S	S	*	*			trans	78.6	140.8	134.4	-80	-7.2	0	0	0	120
969	N	31.2	Very low	28.3	Very low	126.5 Å²	126.5	122.5 Å²	122.5	68%	0.676	73%	0.727	S	S	*	*				74.6	108	122.7	-71.9	-29.4	0	0	0	120.8
970	N	28.9	Very low	28.1	Very low	153 Å²	153	123.2 Å²	123.2	82%	0.818	73%	0.731	S	S	*	*				96.5	139.2	121.9	-83.1	-25.5	0	0	0	120.5
971	A	29.4	Very low	28.1	Very low	79.25 Å²	79.25	122.2 Å²	122.2	66%	0.655	73%	0.725	S	S	*	*			trans	96.4	109.5	139.8	0	0	0	0	0	117.7
972	N	28	Very low	28.1	Very low	149.75 Å²	149.75	122.4 Å²	122.4	80%	0.801	72%	0.722	S	S	*	*				49.2	133.9	128.9	-67.4	-4.1	0	0	0	117.2
973	N	28.8	Very low	28.1	Very low	145.75 Å²	145.75	120.8 Å²	120.8	78%	0.779	71%	0.713	S	S	*	*			trans	143.8	128.2	144.6	-92.6	1.3	0	0	0	113.2
974	S	26.5	Very low	28.2	Very low	103.25 Å²	103.25	121.3 Å²	121.3	72%	0.722	71%	0.712	S	S	*	*				167.7	134.5	105.5	52.8	0	0	0	0	112	S976	S974-S976 PolarHBondContact O-N 3.44Å
975	C	23.7	Very low	28.2	Very low	126 Å²	126	121.3 Å²	121.3	85%	0.851	71%	0.71	S	S	*	*			trans	1.6	131.1	149.8	-57.7	0	0	0	0	114.9
976	S	24.4	Very low	28.1	Very low	109 Å²	109	119.4 Å²	119.4	76%	0.762	71%	0.708	S	S	*	*			trans	-149	126.5	154	49.4	0	0	0	0	111.6	S974 S978	S974-S976 PolarHBondContact O-N 3.44Å; S976-S978 PolarHBondContact O-N 3.25Å
977	S	26.4	Very low	28.1	Very low	109.25 Å²	109.25	118.9 Å²	118.9	76%	0.764	71%	0.705	S	S	*	*				101	140.1	80.4	59.5	0	0	0	0	112.3	V979	S977-V979 PolarHBondContact O-N 3.44Å
978	S	25.8	Very low	28	Very low	109 Å²	109	122.5 Å²	122.5	76%	0.762	71%	0.706	S	S	*	*				-115.5	127.9	94.1	55.8	0	0	0	0	110.7	S976	S976-S978 PolarHBondContact O-N 3.25Å
979	V	27.5	Very low	27.9	Very low	109 Å²	109	122.6 Å²	122.6	66%	0.661	71%	0.711	S	S	*	*				51.9	119.3	96.8	-176.3	0	0	0	0	110.7	S977 N981	S977-V979 PolarHBondContact O-N 3.44Å; V979-N981 WeakPolarHBondContact CG1-OD1 3.5Å; V979-N981 PolarHBondContact O-N 2.96Å
980	C	26.4	Very low	27.9	Very low	112.75 Å²	112.75	122.2 Å²	122.2	76%	0.762	72%	0.715	S	S	*	*			cis	-106.1	145.6	42.7	-56.4	0	0	0	0	112.4	S982	C980-S982 PolarHBondContact O-N 2.67Å
981	N	27.8	Very low	27.7	Very low	132.25 Å²	132.25	119.8 Å²	119.8	71%	0.707	71%	0.711	S	S	*	*				80.1	131.3	99.8	-64.2	-20.1	0	0	0	112.4	V979 D983 Q984	V979-N981 WeakPolarHBondContact CG1-OD1 3.5Å; V979-N981 PolarHBondContact O-N 2.96Å; N981-D983 PolarHBondContact O-N 2.78Å; N981-Q984 PolarHBondContact O-N 3.27Å
982	S	29.3	Very low	27.7	Very low	85.75 Å²	85.75	122.5 Å²	122.5	60%	0.6	71%	0.714	S	S	*	*				41.1	137.7	78.7	-0.5	0	0	0	0	116.5	C980 I985	C980-S982 PolarHBondContact O-N 2.67Å; S982-I985 WeakPolarHBondContact O-CB 3.41Å; S982-I985 WeakPolarHBondContact O-CG1 3.38Å
983	D	27.9	Very low	27.7	Very low	105.5 Å²	105.5	119.9 Å²	119.9	56%	0.564	71%	0.708	S	S	*	*				-155.7	175.9	84.6	-90.9	-38.5	0	0	0	115.3	N981 I985 P1016 N1017 S1018	N981-D983 PolarHBondContact O-N 2.78Å; D983-I985 PolarHBondContact O-N 3.19Å; D983-P1016 VanDerWaalsContact N-C 3.3Å; D983-N1017 VanDerWaalsContact N-N 3.17Å; D983-N1017 PolarHBondContact N-O 2.75Å; D983-N1017 CarbonylContact O-C 3.58Å; D983-N1017 VanDerWaalsContact O-C 3.22Å; D983-S1018 WeakPolarHBondContact O-CB 3.4Å
984	Q	31.3	Very low	27.7	Very low	127 Å²	127	119.7 Å²	119.7	59%	0.593	71%	0.705	S	S	*	*			trans	-112.1	153.8	164.5	-76.6	161.7	25.8	0	0	117.1	N981 L986 Q1015 N1017 S1018	N981-Q984 PolarHBondContact O-N 3.27Å; Q984-L986 PolarHBondContact O-N 3.24Å; Q984-Q1015 VanDerWaalsContact NE2-NE2 3.17Å; Q984-Q1015 VanDerWaalsContact OE1-CD 3.27Å; Q984-Q1015 VanDerWaalsContact OE1-CG 3.24Å; Q984-Q1015 VanDerWaalsContact OE1-NE2 3.1Å; Q984-N1017 WeakPolarHBondContact O-CA 3.39Å; Q984-N1017 PolarHBondContact O-OD1 2.97Å; Q984-S1018 PolarHBondContact O-N 2.71Å; Q984-S1018 PolarHBondContact O-OG 3.17Å
985	I	29.5	Very low	27.7	Very low	117 Å²	117	120.7 Å²	120.7	60%	0.6	70%	0.702	S	S	*	*			trans	32.5	118.3	137.7	-69.3	166.9	0	0	0	116.7	S982 D983 P1016 N1017 Q1074	S982-I985 WeakPolarHBondContact O-CB 3.41Å; S982-I985 WeakPolarHBondContact O-CG1 3.38Å; D983-I985 PolarHBondContact O-N 3.19Å; I985-P1016 HydrophobicContact CD1-CB 4.31Å; I985-N1017 WeakPolarHBondContact CD1-OD1 3.17Å; I985-N1017 WeakPolarHBondContact CG1-OD1 3.49Å; I985-Q1074 PolarHBondContact O-NE2 2.63Å
986	L	30.3	Very low	27.9	Very low	130.5 Å²	130.5	119.1 Å²	119.1	68%	0.683	69%	0.692	S	S	*	*			trans	-151.7	107.2	161.9	-73.9	153.9	0	0	0	116.8	Q984 R988	Q984-L986 PolarHBondContact O-N 3.24Å; L986-R988 PolarHBondContact O-N 3.26Å
987	D	26.2	Very low	28.2	Very low	124.25 Å²	124.25	121.6 Å²	121.6	66%	0.664	69%	0.686	S	S	*	*			trans	70.3	127.3	137.4	-107.6	10.8	0	0	0	118.9
988	R	29.2	Very low	28.2	Very low	194 Å²	194	123.5 Å²	123.5	73%	0.732	68%	0.683	S	S	*	*			trans	69.9	124.1	152.8	-74.5	173.4	-173.3	-143.7	-7.8	120.6	L986	L986-R988 PolarHBondContact O-N 3.26Å
989	T	28.3	Very low	28.4	Very low	126 Å²	126	125.1 Å²	125.1	77%	0.773	68%	0.683	S	S	*	*			trans	-5.2	145.5	151.1	49.6	0	0	0	0	114.7	S991	T989-S991 PolarHBondContact O-N 3.01Å
990	P	29.4	Very low	28.5	Very low	117 Å²	117	126.1 Å²	126.1	76%	0.76	68%	0.683	S	S	*	*			trans	-105	164.6	-161.6	26.3	-13.9	0	0	0	115.4
991	S	26.4	Very low	28.5	Very low	103.75 Å²	103.75	129.4 Å²	129.4	73%	0.726	69%	0.687	S	S	*	*			trans	-156.6	79.4	163.4	-6.7	0	0	0	0	115.2	T989	T989-S991 PolarHBondContact O-N 3.01Å
992	D	28.1	Very low	28.5	Very low	135.25 Å²	135.25	130 Å²	130	72%	0.723	69%	0.69	S	S	*	*			trans	-134	101	160.5	-67.6	-21.4	0	0	0	115.8
993	S	27.7	Very low	28.5	Very low	96 Å²	96	131 Å²	131	67%	0.671	69%	0.694	S	S	*	*			trans	157.9	101	141.6	67.5	0	0	0	0	114.2	L995	S993-L995 PolarHBondContact O-N 3.05Å; S993-L995 VanDerWaalsContact O-N 3.16Å
994	I	28.8	Very low	28.5	Very low	142 Å²	142	131.8 Å²	131.8	73%	0.728	71%	0.705	S	S	*	*			trans	-64.5	95.2	168.1	-59.9	171.6	0	0	0	111.2	S996	I994-S996 PolarHBondContact O-N 3.19Å
995	L	27.5	Very low	28.2	Very low	123 Å²	123	133.6 Å²	133.6	64%	0.644	72%	0.718	S	S	*	*			trans	-129.2	106.8	157.5	-81.8	172.4	0	0	0	111.1	S993 Y997 H1058 L1059	S993-L995 PolarHBondContact O-N 3.05Å; S993-L995 VanDerWaalsContact O-N 3.16Å; L995-Y997 HydrophobicContact CB-CD2 4.28Å; L995-Y997 HydrophobicContact CB-CE2 4.15Å; L995-Y997 HydrophobicContact CD1-CE2 3.75Å; L995-Y997 WeakPolarHBondContact CD1-OH 3.46Å; L995-Y997 HydrophobicContact CD2-CD1 4.17Å; L995-Y997 HydrophobicContact CD2-CD2 4.08Å; L995-Y997 HydrophobicContact CD2-CE1 3.76Å; L995-Y997 HydrophobicContact CD2-CE2 3.67Å; L995-Y997 HydrophobicContact CD2-CG 4.32Å; L995-Y997 HydrophobicContact CG-CE2 3.99Å; L995-H1058 HydrophobicContact CD1-CB 3.99Å; L995-L1059 HydrophobicContact CB-CD2 4.21Å
996	S	28.5	Very low	28.1	Very low	92.75 Å²	92.75	133.3 Å²	133.3	65%	0.649	73%	0.726	S	S	*	*			trans	-87	130.8	167.5	53.9	0	0	0	0	110.3	I994 E998	I994-S996 PolarHBondContact O-N 3.19Å; S996-E998 PolarHBondContact O-N 3.03Å; S996-E998 VanDerWaalsContact O-N 3.09Å
997	Y	30.7	Very low	28	Very low	160.75 Å²	160.75	134.9 Å²	134.9	63%	0.63	74%	0.735	S	S	*	*			trans	-81.6	75.9	179	-78.3	-82.3	0	0	0	112.8	V843 L931 L995 N999 L1059	V843-Y997 HydrophobicContact CB-CD1 4.43Å; V843-Y997 HydrophobicContact CB-CE1 4.18Å; V843-Y997 HydrophobicContact CG1-CD1 4.37Å; V843-Y997 HydrophobicContact CG1-CD2 4.25Å; V843-Y997 HydrophobicContact CG1-CE1 4.01Å; V843-Y997 HydrophobicContact CG1-CE2 3.87Å; V843-Y997 HydrophobicContact CG1-CG 4.48Å; V843-Y997 HydrophobicContact CG2-CD1 3.34Å; V843-Y997 HydrophobicContact CG2-CD2 4.47Å; V843-Y997 HydrophobicContact CG2-CE1 3.47Å; V843-Y997 VanDerWaalsContact CG2-CE1 3.47Å; V843-Y997 HydrophobicContact CG2-CG 3.89Å; L931-Y997 HydrophobicContact CD1-CD2 3.92Å; L931-Y997 HydrophobicContact CD1-CG 3.87Å; L995-Y997 HydrophobicContact CB-CD2 4.28Å; L995-Y997 HydrophobicContact CB-CE2 4.15Å; L995-Y997 HydrophobicContact CD1-CE2 3.75Å; L995-Y997 WeakPolarHBondContact CD1-OH 3.46Å; L995-Y997 HydrophobicContact CD2-CD1 4.17Å; L995-Y997 HydrophobicContact CD2-CD2 4.08Å; L995-Y997 HydrophobicContact CD2-CE1 3.76Å; L995-Y997 HydrophobicContact CD2-CE2 3.67Å; L995-Y997 HydrophobicContact CD2-CG 4.32Å; L995-Y997 HydrophobicContact CG-CE2 3.99Å; Y997-N999 VanDerWaalsContact C-N 3.35Å; Y997-N999 PolarHBondContact O-N 3.45Å; Y997-L1059 HydrophobicContact CD1-CD1 4.46Å; Y997-L1059 HydrophobicContact CD1-CD2 4.22Å; Y997-L1059 HydrophobicContact CE1-CD1 4.09Å; Y997-L1059 HydrophobicContact CE1-CD2 3.9Å
998	E	25.8	Very low	28.1	Very low	150 Å²	150	134.4 Å²	134.4	70%	0.701	74%	0.741	S	S	*	*			trans	-111.5	156.4	158.4	-79.8	-176.1	149.8	0	0	110.2	S996	S996-E998 PolarHBondContact O-N 3.03Å; S996-E998 VanDerWaalsContact O-N 3.09Å
999	N	28.9	Very low	28	Very low	143 Å²	143	134.7 Å²	134.7	77%	0.765	75%	0.747	S	S	*	*			trans	74.9	74.4	-174.1	-50	-57.6	0	0	0	115.6	Y997 E1001	Y997-N999 VanDerWaalsContact C-N 3.35Å; Y997-N999 PolarHBondContact O-N 3.45Å; N999-E1001 VanDerWaalsContact C-N 3.28Å; N999-E1001 PolarHBondContact O-N 3.03Å
1000	I	30.4	Very low	28	Very low	129.25 Å²	129.25	135.1 Å²	135.1	66%	0.663	75%	0.75	S	S	*	*			trans	-98.8	92.6	153.7	-59.2	178.2	0	0	0	107.7	L1002	I1000-L1002 HydrophobicContact CG2-CG 4.4Å; I1000-L1002 PolarHBondContact O-N 3.21Å
1001	E	26.7	Very low	27.9	Very low	182.6 Å²	182.6	134.8 Å²	134.8	85%	0.853	75%	0.751	S	S	*	*			trans	-77.8	122.3	168.1	-67.4	-172.2	138.4	0	0	109.5	N999 P1003	N999-E1001 VanDerWaalsContact C-N 3.28Å; N999-E1001 PolarHBondContact O-N 3.03Å; E1001-P1003 VanDerWaalsContact O-CD 3.24Å; E1001-P1003 WeakPolarHBondContact O-CD 3.48Å
1002	L	28.1	Very low	28.2	Very low	145.4 Å²	145.4	135.4 Å²	135.4	76%	0.761	75%	0.752	S	S	*	*			trans	-83.8	121	173.6	-79.3	157.9	0	0	0	109.8	Y832 I1000	Y832-L1002 HydrophobicContact CD1-CD2 3.99Å; I1000-L1002 HydrophobicContact CG2-CG 4.4Å; I1000-L1002 PolarHBondContact O-N 3.21Å
1003	P	28.6	Very low	28.1	Very low	106.4 Å²	106.4	135.9 Å²	135.9	69%	0.691	76%	0.755	S	S	*	*			trans	-70.1	136.6	177.3	10.8	-8.8	0	0	0	110.9	E1001 L1005	E1001-P1003 VanDerWaalsContact O-CD 3.24Å; E1001-P1003 WeakPolarHBondContact O-CD 3.48Å; P1003-L1005 PolarHBondContact O-N 3.22Å; P1003-L1005 VanDerWaalsContact O-N 3.11Å
1004	P	27.3	Very low	28.2	Very low	122.6 Å²	122.6	142.4 Å²	142.4	80%	0.796	77%	0.765	S	S	*	*			trans	-70.3	118.6	178.6	27.2	-33	0	0	0	111.2	S1006	P1004-S1006 PolarHBondContact O-N 3.17Å
1005	L	26.3	Very low	28.2	Very low	163.2 Å²	163.2	143.3 Å²	143.3	85%	0.854	77%	0.766	S	S	*	*			trans	-66.3	92.8	174.4	-82.5	159.7	0	0	0	111.1	P1003 L1007	P1003-L1005 PolarHBondContact O-N 3.22Å; P1003-L1005 VanDerWaalsContact O-N 3.11Å; L1005-L1007 PolarHBondContact O-N 3.17Å
1006	S	27.2	Very low	28.5	Very low	111.8 Å²	111.8	142.2 Å²	142.2	78%	0.782	77%	0.765	S	S	*	*			trans	-78.7	120.5	175.2	57.6	0	0	0	0	111.4	P1004 S1008	P1004-S1006 PolarHBondContact O-N 3.17Å; S1006-S1008 PolarHBondContact O-N 3.17Å
1007	L	28.2	Very low	28.6	Very low	164.4 Å²	164.4	144.7 Å²	144.7	86%	0.861	77%	0.772	S	S	*	*			trans	-65.7	127.8	174	-104.7	81.2	0	0	0	111.1	L1005 K1009	L1005-L1007 PolarHBondContact O-N 3.17Å; L1007-K1009 PolarHBondContact O-N 3.22Å
1008	S	27.1	Very low	28.5	Very low	113 Å²	113	142.1 Å²	142.1	79%	0.79	78%	0.777	S	S	*	*			trans	-70.7	124.5	176.5	51	0	0	0	0	111.7	S1006 T1010	S1006-S1008 PolarHBondContact O-N 3.17Å; S1008-T1010 PolarHBondContact O-N 3.1Å
1009	K	27.6	Very low	29	Very low	201 Å²	201	140.4 Å²	140.4	87%	0.874	78%	0.779	S	S	*	*			trans	-100.9	112.4	165.9	-75.5	-177.3	177.5	176.1	0	109.8	L1007 S1011	L1007-K1009 PolarHBondContact O-N 3.22Å; K1009-S1011 PolarHBondContact O-N 2.96Å
1010	T	27.8	Very low	28.9	Very low	133.4 Å²	133.4	138.6 Å²	138.6	82%	0.818	78%	0.777	S	S	*	*			trans	-62.8	114.2	160.1	39.9	0	0	0	0	111.8	S1008 P1012	S1008-T1010 PolarHBondContact O-N 3.1Å; T1010-P1012 WeakPolarHBondContact O-CD 3.4Å
1011	S	27.7	Very low	28.9	Very low	111.8 Å²	111.8	139.2 Å²	139.2	78%	0.782	78%	0.782	S	S	*	*			trans	-92.2	145.3	143.3	-56.3	0	0	0	0	112.7	K1009 N1013	K1009-S1011 PolarHBondContact O-N 2.96Å; S1011-N1013 PolarHBondContact O-N 3.01Å
1012	P	32.4	Very low	29.1	Very low	115.4 Å²	115.4	138.3 Å²	138.3	75%	0.749	78%	0.777	S	S	*	*			trans	-109.4	161.9	174.7	36	-29	0	0	0	114.3	T1010	T1010-P1012 WeakPolarHBondContact O-CD 3.4Å
1013	N	27.5	Very low	29.1	Very low	146.6 Å²	146.6	137.7 Å²	137.7	78%	0.784	78%	0.775	S	S	*	*			trans	92.9	120.4	170.2	-90	-29.9	0	0	0	116.7	S1011	S1011-N1013 PolarHBondContact O-N 3.01Å
1014	R	29.1	Very low	29.2	Very low	233 Å²	233	140.2 Å²	140.2	88%	0.879	78%	0.777	S	S	*	*			trans	176	130.5	130.9	-115.3	-178.2	-174.4	-167.2	1.1	114.1
1015	Q	29.3	Very low	29.3	Very low	160.8 Å²	160.8	141.4 Å²	141.4	75%	0.751	78%	0.777	S	S	*	*			trans	-97.6	169.2	167.4	-84.9	179.8	-27.7	0	0	110.8	Q984	Q984-Q1015 VanDerWaalsContact NE2-NE2 3.17Å; Q984-Q1015 VanDerWaalsContact OE1-CD 3.27Å; Q984-Q1015 VanDerWaalsContact OE1-CG 3.24Å; Q984-Q1015 VanDerWaalsContact OE1-NE2 3.1Å
1016	P	32.2	Very low	29.4	Very low	98.6 Å²	98.6	139 Å²	139	64%	0.64	77%	0.769	S	S	*	*			trans	-123	165	173.2	36.2	-22.6	0	0	0	115	D983 I985	D983-P1016 VanDerWaalsContact N-C 3.3Å; I985-P1016 HydrophobicContact CD1-CB 4.31Å
1017	N	31	Very low	29.4	Very low	145.6 Å²	145.6	141.7 Å²	141.7	78%	0.779	77%	0.769	S	S	*	*			trans	112.2	136.3	153.1	-68.7	-13.1	0	0	0	116.4	D983 Q984 I985	D983-N1017 VanDerWaalsContact N-N 3.17Å; D983-N1017 PolarHBondContact N-O 2.75Å; D983-N1017 CarbonylContact O-C 3.58Å; D983-N1017 VanDerWaalsContact O-C 3.22Å; Q984-N1017 WeakPolarHBondContact O-CA 3.39Å; Q984-N1017 PolarHBondContact O-OD1 2.97Å; I985-N1017 WeakPolarHBondContact CD1-OD1 3.17Å; I985-N1017 WeakPolarHBondContact CG1-OD1 3.49Å
1018	S	28.4	Very low	29.5	Very low	105.8 Å²	105.8	141.2 Å²	141.2	74%	0.74	77%	0.768	S	S	*	*			trans	-108.5	-177.2	172.6	55.3	0	0	0	0	112	D983 Q984	D983-S1018 WeakPolarHBondContact O-CB 3.4Å; Q984-S1018 PolarHBondContact O-N 2.71Å; Q984-S1018 PolarHBondContact O-OG 3.17Å
1019	P	36.2	Very low	29.5	Very low	114 Å²	114	144.2 Å²	144.2	74%	0.74	77%	0.766	S	S	*	*				-125.1	174.2	-69.8	40.1	-25.9	0	0	0	116.1
1020	S	28.8	Very low	29.6	Very low	105.2 Å²	105.2	140.9 Å²	140.9	74%	0.736	76%	0.763	S	S	*	*			trans	133	130.9	149.3	64.8	0	0	0	0	116.7
1021	N	28.6	Very low	29.6	Very low	142.2 Å²	142.2	140.4 Å²	140.4	76%	0.76	75%	0.754	S	S	*	*				-155.9	153.9	129.6	-86.1	-22.5	0	0	0	116
1022	H	31.3	Very low	29.6	Very low	163.2 Å²	163.2	141.1 Å²	141.1	76%	0.756	75%	0.754	S	S	*	*				-120.6	136.1	128.6	-97	-69.9	0	0	0	114.8
1023	N	29.4	Very low	29.4	Very low	133.6 Å²	133.6	142.5 Å²	142.5	71%	0.714	76%	0.755	S	S	*	*				-178.1	146.1	121.1	-83.6	-9.3	0	0	0	118
1024	H	29.2	Very low	29.4	Very low	159.4 Å²	159.4	141.8 Å²	141.8	74%	0.738	76%	0.756	S	S	*	*			trans	-36.4	140.7	142.3	-78.1	-79.9	0	0	0	116.9
1025	N	29.4	Very low	29.4	Very low	146.8 Å²	146.8	138.2 Å²	138.2	79%	0.785	75%	0.753	S	S	*	*				-161	144.6	125.1	-81.8	-14.2	0	0	0	114.4
1026	T	29.3	Very low	29.2	Very low	113.6 Å²	113.6	135.4 Å²	135.4	70%	0.697	75%	0.751	S	S	*	*			trans	-52.2	151.1	140.2	23.9	0	0	0	0	115.2
1027	E	26.6	Very low	29	Very low	167.4 Å²	167.4	138.6 Å²	138.6	78%	0.782	76%	0.762	S	S	*	*				-146.1	130.1	128.1	-69.2	168.8	158.2	0	0	117.1
1028	N	30.9	Very low	28.8	Very low	155 Å²	155	140.9 Å²	140.9	83%	0.829	77%	0.765	S	S	*	*				162.7	127.7	123.6	-88.6	-48.7	0	0	0	116.5
1029	K	26.8	Very low	28.8	Very low	175.2 Å²	175.2	145 Å²	145	76%	0.762	77%	0.769	S	S	*	*			trans	-89.1	113.4	163.6	-156.8	-176.3	-179.4	-177.3	0	113.3	I1031	K1029-I1031 HydrophobicContact CD-CD1 4.21Å; K1029-I1031 HydrophobicContact CD-CG1 4.44Å; K1029-I1031 VanDerWaalsContact CE-O 3.27Å; K1029-I1031 WeakPolarHBondContact CE-O 3.38Å; K1029-I1031 HydrophobicContact CG-CD1 4.43Å; K1029-I1031 HydrophobicContact CG-CG1 4.25Å; K1029-I1031 PolarHBondContact O-N 3.45Å
1030	V	28.7	Very low	28.3	Very low	133.2 Å²	133.2	147.2 Å²	147.2	81%	0.807	77%	0.77	S	S	*	*			trans	-119.6	130.1	149.5	175.5	0	0	0	0	109
1031	I	27.6	Very low	28.2	Very low	122 Å²	122	149.1 Å²	149.1	63%	0.626	77%	0.772	S	S	*	*			trans	-62.9	124.6	173.5	-57.4	171.2	0	0	0	111.4	K1029	K1029-I1031 HydrophobicContact CD-CD1 4.21Å; K1029-I1031 HydrophobicContact CD-CG1 4.44Å; K1029-I1031 VanDerWaalsContact CE-O 3.27Å; K1029-I1031 WeakPolarHBondContact CE-O 3.38Å; K1029-I1031 HydrophobicContact CG-CD1 4.43Å; K1029-I1031 HydrophobicContact CG-CG1 4.25Å; K1029-I1031 PolarHBondContact O-N 3.45Å
1032	T	29.1	Very low	28.2	Very low	126.6 Å²	126.6	151.8 Å²	151.8	78%	0.777	78%	0.777	S	S	*	*			trans	-129	119.1	153.2	34.1	0	0	0	0	109.8	T1034	T1032-T1034 PolarHBondContact O-N 2.87Å
1033	D	27.1	Very low	28.1	Very low	144 Å²	144	148.4 Å²	148.4	77%	0.77	77%	0.771	S	S	*	*			trans	-74.2	130.2	164.5	-69.9	-48.5	0	0	0	113.4
1034	T	28.2	Very low	28.1	Very low	132.6 Å²	132.6	149.9 Å²	149.9	81%	0.813	78%	0.776	S	S	*	*			trans	-107	138.5	158.1	28.6	0	0	0	0	111.3	T1032 S1036	T1032-T1034 PolarHBondContact O-N 2.87Å; T1034-S1036 PolarHBondContact O-N 3.38Å; T1034-S1036 PolarHBondContact O-OG 3.47Å
1035	I	29	Very low	28.4	Very low	157.8 Å²	157.8	151.2 Å²	151.2	81%	0.809	78%	0.779	S	S	*	*			trans	-86.6	120	178.3	-64.3	170.2	0	0	0	110.4	L1037	I1035-L1037 HydrophobicContact CG2-CD1 4.44Å; I1035-L1037 HydrophobicContact CG2-CG 4.13Å; I1035-L1037 PolarHBondContact O-N 3.25Å; I1035-L1037 VanDerWaalsContact O-N 3.13Å
1036	S	25.5	Very low	28.9	Very low	101 Å²	101	151.6 Å²	151.6	71%	0.706	77%	0.774	S	S	*	*			trans	-78.7	120.1	167.5	65.7	0	0	0	0	112.8	T1034 K1038	T1034-S1036 PolarHBondContact O-N 3.38Å; T1034-S1036 PolarHBondContact O-OG 3.47Å; S1036-K1038 PolarHBondContact O-N 3.22Å; S1036-K1038 VanDerWaalsContact O-N 3.11Å
1037	L	27.6	Very low	29.7	Very low	166.6 Å²	166.6	154.3 Å²	154.3	87%	0.872	78%	0.779	S	S	*	*			trans	-106.9	115.7	144.6	-80.7	169	0	0	0	109.7	I1035 K1039	I1035-L1037 HydrophobicContact CG2-CD1 4.44Å; I1035-L1037 HydrophobicContact CG2-CG 4.13Å; I1035-L1037 PolarHBondContact O-N 3.25Å; I1035-L1037 VanDerWaalsContact O-N 3.13Å; L1037-K1039 PolarHBondContact O-N 3.19Å; L1037-K1039 VanDerWaalsContact O-N 3.11Å
1038	K	27.1	Very low	31.1	Very low	194.2 Å²	194.2	149.2 Å²	149.2	84%	0.844	76%	0.757	S	S	*	*			trans	-72.4	120.1	167.1	-79.3	174.8	168.6	-178.2	0	110.6	S1036 E1040	S1036-K1038 PolarHBondContact O-N 3.22Å; S1036-K1038 VanDerWaalsContact O-N 3.11Å; K1038-E1040 HydrophobicContact CB-CG 4.08Å; K1038-E1040 WeakPolarHBondContact CD-OE1 3.37Å; K1038-E1040 WeakPolarHBondContact CE-OE1 3.44Å; K1038-E1040 IonicContact NZ-OE1 3.43Å; K1038-E1040 PolarHBondContact NZ-OE1 3.45Å; K1038-E1040 PolarHBondContact O-N 3.1Å; K1038-E1040 VanDerWaalsContact O-N 3.13Å
1039	K	27.4	Very low	32.5	Very low	191.8 Å²	191.8	144.7 Å²	144.7	83%	0.834	74%	0.736	S	S	*	*			trans	-96.2	108	160.8	-108.9	-179.5	178	-175.9	0	109	L1037 D1041	L1037-K1039 PolarHBondContact O-N 3.19Å; L1037-K1039 VanDerWaalsContact O-N 3.11Å; K1039-D1041 VanDerWaalsContact C-N 3.3Å; K1039-D1041 PolarHBondContact O-N 2.91Å; K1039-D1041 VanDerWaalsContact O-N 3.13Å
1040	E	25.8	Very low	34.6	Very low	160 Å²	160	142.9 Å²	142.9	75%	0.748	74%	0.735	S	S	*	*			trans	-65.5	105.6	161.2	-70.3	179	156.9	0	0	110.6	K1038 K1042	K1038-E1040 HydrophobicContact CB-CG 4.08Å; K1038-E1040 WeakPolarHBondContact CD-OE1 3.37Å; K1038-E1040 WeakPolarHBondContact CE-OE1 3.44Å; K1038-E1040 IonicContact NZ-OE1 3.43Å; K1038-E1040 PolarHBondContact NZ-OE1 3.45Å; K1038-E1040 PolarHBondContact O-N 3.1Å; K1038-E1040 VanDerWaalsContact O-N 3.13Å; E1040-K1042 VanDerWaalsContact C-N 3.35Å; E1040-K1042 PolarHBondContact O-N 3.02Å; E1040-K1042 VanDerWaalsContact O-N 3.11Å; E1040-K1042 VanDerWaalsContact OE2-CE 3.31Å; E1040-K1042 WeakPolarHBondContact OE2-CE 3.4Å; E1040-K1042 IonicContact OE2-NZ 3.62Å; E1040-K1042 PolarHBondContact OE2-NZ 3.44Å
1041	D	27.3	Very low	37	Very low	144.6 Å²	144.6	138 Å²	138	77%	0.773	70%	0.703	S	S	*	*			trans	-82.1	99.6	168.8	-82.2	-47.4	0	0	0	110.5	K1039 S1043	K1039-D1041 VanDerWaalsContact C-N 3.3Å; K1039-D1041 PolarHBondContact O-N 2.91Å; K1039-D1041 VanDerWaalsContact O-N 3.13Å; D1041-S1043 VanDerWaalsContact C-N 3.29Å; D1041-S1043 PolarHBondContact O-N 3.06Å
1042	K	28.8	Very low	39.4	Very low	199 Å²	199	133.7 Å²	133.7	87%	0.865	68%	0.683	S	S	*	*			trans	-74.2	67.8	164.5	-76.3	-177.4	174.8	173	0	109.7	E1040 M1044	E1040-K1042 VanDerWaalsContact C-N 3.35Å; E1040-K1042 PolarHBondContact O-N 3.02Å; E1040-K1042 VanDerWaalsContact O-N 3.11Å; E1040-K1042 VanDerWaalsContact OE2-CE 3.31Å; E1040-K1042 WeakPolarHBondContact OE2-CE 3.4Å; E1040-K1042 IonicContact OE2-NZ 3.62Å; E1040-K1042 PolarHBondContact OE2-NZ 3.44Å; K1042-M1044 PolarHBondContact O-N 2.97Å
1043	S	28.4	Very low	41.9	Very low	92.2 Å²	92.2	128 Å²	128	65%	0.645	65%	0.648	S	S	*	*			trans	-74.7	88.1	162.4	58	0	0	0	0	108.9	D1041 K1045	D1041-S1043 VanDerWaalsContact C-N 3.29Å; D1041-S1043 PolarHBondContact O-N 3.06Å; S1043-K1045 PolarHBondContact O-N 3.25Å
1044	M	31	Very low	44.5	Very low	164.2 Å²	164.2	121.4 Å²	121.4	81%	0.809	61%	0.613	S	S	*	*			trans	-66.7	87.5	166.5	-139.1	172.7	141.1	0	0	107.5	K1042 F1046	K1042-M1044 PolarHBondContact O-N 2.97Å; M1044-F1046 HydrophobicContact CB-CD2 4.05Å; M1044-F1046 HydrophobicContact CB-CE1 4.48Å; M1044-F1046 HydrophobicContact CB-CE2 3.72Å; M1044-F1046 HydrophobicContact CB-CZ 3.96Å; M1044-F1046 HydrophobicContact CE-CD1 4.34Å; M1044-F1046 HydrophobicContact CE-CE1 3.62Å; M1044-F1046 HydrophobicContact CE-CZ 3.82Å; M1044-F1046 WeakPolarHBondContact O-CD2 3.37Å; M1044-F1046 PolarHBondContact O-N 3.06Å; M1044-F1046 VanDerWaalsContact O-N 3.1Å; M1044-F1046 HydrophobicContact SD-CZ 4.11Å
1045	K	33.7	Very low	47	Very low	186.6 Å²	186.6	117.1 Å²	117.1	81%	0.811	58%	0.582	S	S	*	*			trans	-58	113.1	171.5	-77.4	-170.1	172.8	-171	0	107.5	S1043 Q1047	S1043-K1045 PolarHBondContact O-N 3.25Å; K1045-Q1047 VanDerWaalsContact C-N 3.31Å; K1045-Q1047 PolarHBondContact O-N 3.16Å; K1045-Q1047 VanDerWaalsContact O-N 3.14Å
1046	F	40	Very low	49.4	Very low	155.2 Å²	155.2	109.6 Å²	109.6	68%	0.681	54%	0.544	S	S	*	.			trans	-61	97.1	170.4	-87.3	-96.2	0	0	0	108.2	Y879 M1044 L1048	Y879-F1046 HydrophobicContact CE1-CB 4.43Å; Y879-F1046 HydrophobicContact CE1-CD1 4.19Å; M1044-F1046 HydrophobicContact CB-CD2 4.05Å; M1044-F1046 HydrophobicContact CB-CE1 4.48Å; M1044-F1046 HydrophobicContact CB-CE2 3.72Å; M1044-F1046 HydrophobicContact CB-CZ 3.96Å; M1044-F1046 HydrophobicContact CE-CD1 4.34Å; M1044-F1046 HydrophobicContact CE-CE1 3.62Å; M1044-F1046 HydrophobicContact CE-CZ 3.82Å; M1044-F1046 WeakPolarHBondContact O-CD2 3.37Å; M1044-F1046 PolarHBondContact O-N 3.06Å; M1044-F1046 VanDerWaalsContact O-N 3.1Å; M1044-F1046 HydrophobicContact SD-CZ 4.11Å; F1046-L1048 VanDerWaalsContact C-N 3.31Å; F1046-L1048 PolarHBondContact O-N 3.25Å; F1046-L1048 VanDerWaalsContact O-N 3.15Å
1047	Q	46.9	Very low	52.3	Low	170.6 Å²	170.6	104.8 Å²	104.8	80%	0.797	51%	0.51	S	S	*	.			trans	-79.2	104.5	168.7	-138.3	173	-12.2	0	0	106.6	K1045	K1045-Q1047 VanDerWaalsContact C-N 3.31Å; K1045-Q1047 PolarHBondContact O-N 3.16Å; K1045-Q1047 VanDerWaalsContact O-N 3.14Å
1048	L	56.9	Low	55	Low	61.8 Å²	61.8	97.6 Å²	97.6	32%	0.324	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-55.2	134.5	169	-121.7	75.1	0	0	0	107.7	L876 Y879 F1046 Y1777 A1780 V1781	L876-L1048 HydrophobicContact CD1-CD1 4.27Å; L876-L1048 HydrophobicContact CD1-CD2 4.12Å; Y879-L1048 HydrophobicContact CD1-CD1 3.55Å; Y879-L1048 HydrophobicContact CD1-CD2 4.36Å; Y879-L1048 HydrophobicContact CD1-CG 3.6Å; Y879-L1048 HydrophobicContact CD2-CD1 4.42Å; Y879-L1048 HydrophobicContact CE1-CD1 3.73Å; Y879-L1048 VanDerWaalsContact CE1-CD1 3.49Å; Y879-L1048 HydrophobicContact CE1-CG 3.74Å; Y879-L1048 HydrophobicContact CG-CD1 3.63Å; Y879-L1048 HydrophobicContact CG-CG 4.06Å; F1046-L1048 VanDerWaalsContact C-N 3.31Å; F1046-L1048 PolarHBondContact O-N 3.25Å; F1046-L1048 VanDerWaalsContact O-N 3.15Å; L1048-Y1777 HydrophobicContact CB-CD2 4.2Å; L1048-Y1777 HydrophobicContact CB-CE2 3.5Å; L1048-Y1777 HydrophobicContact CD2-CD2 3.96Å; L1048-Y1777 HydrophobicContact CD2-CE2 3.73Å; L1048-Y1777 HydrophobicContact CG-CD2 4.34Å; L1048-Y1777 HydrophobicContact CG-CE2 3.81Å; L1048-Y1777 VanDerWaalsContact O-CE2 3.26Å; L1048-Y1777 WeakPolarHBondContact O-CE2 3.45Å; L1048-Y1777 PolarHBondContact O-OH 3.41Å; L1048-A1780 HydrophobicContact CD2-CB 4.08Å; L1048-V1781 HydrophobicContact CB-CG2 4.43Å; L1048-V1781 HydrophobicContact CD2-CG2 3.93Å
1049	P	59.9	Low	57.6	Low	60.4 Å²	60.4	89.9 Å²	89.9	39%	0.392	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-67.6	155.6	175.8	29	-35.2	0	0	0	110.6	Y879 F1051 Y1777	Y879-P1049 HydrophobicContact CD2-CG 3.69Å; Y879-P1049 HydrophobicContact CE2-CG 3.82Å; Y879-P1049 VanDerWaalsContact CE2-CG 3.46Å; Y879-P1049 HydrophobicContact CG-CG 4.33Å; P1049-F1051 PolarHBondContact O-N 3.19Å; P1049-Y1777 VanDerWaalsContact O-CD2 3.31Å; P1049-Y1777 WeakPolarHBondContact O-CD2 3.41Å; P1049-Y1777 WeakPolarHBondContact O-CE2 3.39Å
1050	N	70.3	Confident	60.4	Low	136.8 Å²	136.8	80.9 Å²	80.9	73%	0.732	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-54.3	140.5	174.5	-67.3	-12.7	0	0	0	110.9	S1052	N1050-S1052 PolarHBondContact O-N 3.36Å
1051	F	78.7	Confident	63.4	Low	31 Å²	31	73.4 Å²	73.4	14%	0.136	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-52.3	129.4	-176.8	179.1	-85.8	0	0	0	112	H875 P1049 W1053 H1057 M1209 R1773 L1776	H875-F1051 HydrophobicContact CB-CD2 4.06Å; H875-F1051 HydrophobicContact CB-CE2 3.88Å; H875-F1051 AromaticContact CD2-CD2 3.7Å; H875-F1051 AromaticContact CD2-CE2 3.43Å; H875-F1051 WeakPolarHBondContact CD2-CE2 3.49Å; H875-F1051 AromaticContact CD2-CZ 3.69Å; H875-F1051 AromaticContact CE1-CD2 3.4Å; H875-F1051 WeakPolarHBondContact CE1-CD2 3.36Å; H875-F1051 AromaticContact CE1-CE1 3.89Å; H875-F1051 AromaticContact CE1-CE2 3.32Å; H875-F1051 WeakPolarHBondContact CE1-CE2 3.2Å; H875-F1051 AromaticContact CE1-CG 3.78Å; H875-F1051 AromaticContact CE1-CZ 3.55Å; H875-F1051 AromaticContact CG-CD2 3.74Å; H875-F1051 AromaticContact CG-CE2 3.83Å; H875-F1051 AromaticContact ND1-CD2 3.7Å; H875-F1051 AromaticContact ND1-CE2 3.9Å; H875-F1051 WeakPolarHBondContact NE2-CA 3.41Å; H875-F1051 AromaticContact NE2-CD2 3.47Å; H875-F1051 WeakPolarHBondContact NE2-CD2 3.25Å; H875-F1051 AromaticContact NE2-CE1 3.68Å; H875-F1051 AromaticContact NE2-CE2 2.85Å; H875-F1051 WeakPolarHBondContact NE2-CE2 3.3Å; H875-F1051 AromaticContact NE2-CZ 2.96Å; H875-F1051 WeakPolarHBondContact NE2-CZ 3.42Å; P1049-F1051 PolarHBondContact O-N 3.19Å; F1051-W1053 AromaticContact CE1-CD1 3.81Å; F1051-W1053 AromaticContact CE1-CD2 3.84Å; F1051-W1053 HydrophobicContact CE1-CD2 3.96Å; F1051-W1053 AromaticContact CE1-CE2 3.82Å; F1051-W1053 HydrophobicContact CE1-CE3 4.47Å; F1051-W1053 AromaticContact CE1-CG 3.92Å; F1051-W1053 HydrophobicContact CE1-CG 4.07Å; F1051-W1053 HydrophobicContact CE1-CZ2 4.33Å; F1051-W1053 AromaticContact CE1-NE1 3.74Å; F1051-W1053 HydrophobicContact CZ-CD2 4.31Å; F1051-W1053 AromaticContact CZ-CE2 3.9Å; F1051-W1053 HydrophobicContact CZ-CE3 4.43Å; F1051-W1053 HydrophobicContact CZ-CH2 4.35Å; F1051-W1053 HydrophobicContact CZ-CZ2 4.02Å; F1051-H1057 AromaticContact CE2-CE1 3.85Å; F1051-H1057 AromaticContact CE2-NE2 3.71Å; F1051-H1057 AromaticContact CZ-CE1 3.86Å; F1051-H1057 AromaticContact CZ-ND1 3.81Å; F1051-H1057 AromaticContact CZ-NE2 3.98Å; F1051-M1209 HydrophobicContact CB-CE 4.44Å; F1051-M1209 HydrophobicContact CD1-CE 3.83Å; F1051-M1209 VanDerWaalsContact CD1-CE 3.41Å; F1051-M1209 HydrophobicContact CE1-CE 3.77Å; F1051-M1209 HydrophobicContact CG-CE 3.95Å; F1051-R1773 HydrophobicContact CB-CB 4.31Å; F1051-R1773 HydrophobicContact CB-CG 4.44Å; F1051-R1773 HydrophobicContact CD1-CG 4.16Å; F1051-L1776 HydrophobicContact CD1-CD2 4.15Å; F1051-L1776 HydrophobicContact CD2-CD2 3.53Å; F1051-L1776 VanDerWaalsContact CD2-CD2 3.48Å; F1051-L1776 HydrophobicContact CD2-CG 3.94Å; F1051-L1776 HydrophobicContact CE1-CD2 4Å; F1051-L1776 HydrophobicContact CE2-CD2 3.33Å; F1051-L1776 HydrophobicContact CE2-CG 4.08Å; F1051-L1776 HydrophobicContact CG-CD2 3.94Å; F1051-L1776 HydrophobicContact CG-CG 4.43Å; F1051-L1776 HydrophobicContact CZ-CD2 3.59Å
1052	S	78.9	Confident	66	Low	30 Å²	30	68.5 Å²	68.5	21%	0.21	34%	0.339	C	S	.	.			trans	-132.4	135	176.7	48.2	0	0	0	0	110.5	H875 N1050 P1238	H875-S1052 PolarHBondContact CD2-O 2.87Å; H875-S1052 VanDerWaalsContact CD2-O 3.31Å; H875-S1052 PolarHBondContact CE1-N 3.3Å; H875-S1052 PolarHBondContact CE1-O 2.88Å; H875-S1052 PolarHBondContact ND1-O 3.12Å; H875-S1052 PolarHBondContact NE2-N 3.27Å; N1050-S1052 PolarHBondContact O-N 3.36Å; S1052-P1238 CarbonylContact C-O 3.48Å; S1052-P1238 VanDerWaalsContact CA-O 3.29Å; S1052-P1238 WeakPolarHBondContact CA-O 3.28Å
1053	W	82.2	Confident	68.5	Low	7.6 Å²	7.6	60.6 Å²	60.6	3%	0.029	31%	0.307	C	S	.	.			trans	-65.9	151.2	176.7	-70.8	96.5	0	0	0	110.4	F1051 H1057 H1058 L1061 L1206 M1209 P1238 G1239 M1240	F1051-W1053 AromaticContact CE1-CD1 3.81Å; F1051-W1053 AromaticContact CE1-CD2 3.84Å; F1051-W1053 HydrophobicContact CE1-CD2 3.96Å; F1051-W1053 AromaticContact CE1-CE2 3.82Å; F1051-W1053 HydrophobicContact CE1-CE3 4.47Å; F1051-W1053 AromaticContact CE1-CG 3.92Å; F1051-W1053 HydrophobicContact CE1-CG 4.07Å; F1051-W1053 HydrophobicContact CE1-CZ2 4.33Å; F1051-W1053 AromaticContact CE1-NE1 3.74Å; F1051-W1053 HydrophobicContact CZ-CD2 4.31Å; F1051-W1053 AromaticContact CZ-CE2 3.9Å; F1051-W1053 HydrophobicContact CZ-CE3 4.43Å; F1051-W1053 HydrophobicContact CZ-CH2 4.35Å; F1051-W1053 HydrophobicContact CZ-CZ2 4.02Å; W1053-H1057 HydrophobicContact CE3-CB 3.61Å; W1053-H1057 HydrophobicContact CZ3-CB 3.97Å; W1053-H1058 AromaticContact CE3-CE1 3.94Å; W1053-H1058 AromaticContact CE3-ND1 3.98Å; W1053-L1061 HydrophobicContact CH2-CD2 4.01Å; W1053-L1061 HydrophobicContact CZ3-CD2 3.92Å; W1053-L1206 HydrophobicContact CH2-CD2 4.31Å; W1053-M1209 HydrophobicContact CZ2-CB 4.03Å; W1053-M1209 HydrophobicContact CZ2-CE 3.78Å; W1053-M1209 HydrophobicContact CZ2-SD 4.3Å; W1053-P1238 PolarHBondContact N-O 3.33Å; W1053-G1239 WeakPolarHBondContact CB-O 3.32Å; W1053-G1239 WeakPolarHBondContact O-CA 3.35Å; W1053-M1240 HydrophobicContact CB-CB 4.06Å; W1053-M1240 HydrophobicContact CD2-CE 4.04Å; W1053-M1240 HydrophobicContact CD2-SD 4.41Å; W1053-M1240 HydrophobicContact CG-CB 3.98Å; W1053-M1240 HydrophobicContact CG-CE 4.24Å; W1053-M1240 HydrophobicContact CG-SD 4.48Å; W1053-M1240 HydrophobicContact CZ2-CE 4.05Å
1054	S	81.7	Confident	71.4	Confident	5.8 Å²	5.8	56.2 Å²	56.2	4%	0.041	28%	0.276	C	S	.	.			trans	-134.4	163.3	-179.8	80.2	0	0	0	0	109.8	I878 V1056 H1057 H1058	I878-S1054 VanDerWaalsContact CD1-CB 3.44Å; I878-S1054 WeakPolarHBondContact CD1-OG 3.36Å; S1054-V1056 PolarHBondContact O-N 3.16Å; S1054-V1056 PolarHBondContact OG-N 3.2Å; S1054-H1057 WeakPolarHBondContact CB-ND1 3.45Å; S1054-H1057 PolarHBondContact N-ND1 3.12Å; S1054-H1057 VanDerWaalsContact N-ND1 3.19Å; S1054-H1057 WeakPolarHBondContact O-CB 3.4Å; S1054-H1057 PolarHBondContact O-N 3.02Å; S1054-H1057 VanDerWaalsContact O-N 3.09Å; S1054-H1057 PolarHBondContact OG-CE1 3.25Å; S1054-H1057 VanDerWaalsContact OG-CG 3.3Å; S1054-H1057 PolarHBondContact OG-N 2.92Å; S1054-H1057 VanDerWaalsContact OG-N 3.1Å; S1054-H1057 PolarHBondContact OG-ND1 3.05Å; S1054-H1057 VanDerWaalsContact OG-ND1 3.1Å; S1054-H1058 PolarHBondContact O-CD2 2.95Å; S1054-H1058 VanDerWaalsContact O-CD2 3.28Å; S1054-H1058 PolarHBondContact O-N 3.07Å; S1054-H1058 VanDerWaalsContact O-N 3.14Å
1055	Y	78.9	Confident	74.2	Confident	42.8 Å²	42.8	48.4 Å²	48.4	17%	0.168	24%	0.238	C	C	.	.	H	α-helix	trans	-58.6	-30.4	175.4	86.7	-86.4	0	0	0	112.7	L831 Y832 P833 L842 H1058 L1059 L1420 L1423 S1424 Q1427	L831-Y1055 PolarHBondContact O-OH 3.12Å; Y832-Y1055 HydrophobicContact CD1-CE1 4.21Å; Y832-Y1055 VanDerWaalsContact CD1-OH 3.27Å; Y832-Y1055 WeakPolarHBondContact CD1-OH 3.42Å; Y832-Y1055 HydrophobicContact CE1-CD1 4.35Å; Y832-Y1055 AromaticContact CE1-CE1 3.87Å; Y832-Y1055 HydrophobicContact CE1-CE1 3.93Å; P833-Y1055 WeakPolarHBondContact CD-OH 3.47Å; L842-Y1055 WeakPolarHBondContact CD2-OH 3.36Å; Y1055-H1058 PolarHBondContact O-N 3.11Å; Y1055-L1059 HydrophobicContact CD2-CD1 3.72Å; Y1055-L1059 HydrophobicContact CD2-CG 4.38Å; Y1055-L1059 HydrophobicContact CE2-CD1 3.69Å; Y1055-L1059 WeakPolarHBondContact O-CB 3.43Å; Y1055-L1059 VanDerWaalsContact O-CG 3.29Å; Y1055-L1059 WeakPolarHBondContact O-CG 3.37Å; Y1055-L1059 PolarHBondContact O-N 3.27Å; Y1055-L1420 HydrophobicContact CE2-CD2 3.57Å; Y1055-L1420 HydrophobicContact CE2-CG 4.06Å; Y1055-L1420 VanDerWaalsContact OH-CD2 3.24Å; Y1055-L1420 WeakPolarHBondContact OH-CD2 3.34Å; Y1055-L1423 HydrophobicContact CD2-CB 3.98Å; Y1055-L1423 HydrophobicContact CD2-CD1 4.22Å; Y1055-L1423 HydrophobicContact CE2-CB 4.33Å; Y1055-L1423 HydrophobicContact CG-CB 4.37Å; Y1055-S1424 WeakPolarHBondContact OH-CB 3.45Å; Y1055-Q1427 HydrophobicContact CD1-CB 3.97Å; Y1055-Q1427 HydrophobicContact CD1-CG 3.86Å; Y1055-Q1427 HydrophobicContact CE1-CB 3.98Å; Y1055-Q1427 HydrophobicContact CE1-CG 4.02Å
1056	V	80.5	Confident	76.7	Confident	0.2 Å²	0.2	40.8 Å²	40.8	0%	0.001	21%	0.208	C	C	.	.	H	α-helix	trans	-71.8	-39.8	176	-172.8	0	0	0	0	111.5	L831 L846 I874 I878 S1054 H1058 L1059 L1060	L831-V1056 HydrophobicContact CB-CG2 4.39Å; L831-V1056 HydrophobicContact CD2-CG1 4.29Å; L831-V1056 HydrophobicContact CD2-CG2 4.46Å; L846-V1056 HydrophobicContact CD1-CG1 4.36Å; L846-V1056 HydrophobicContact CD2-CG1 3.97Å; I874-V1056 HydrophobicContact CD1-CG1 4.45Å; I874-V1056 HydrophobicContact CG2-CB 4.01Å; I874-V1056 HydrophobicContact CG2-CG1 3.78Å; I878-V1056 HydrophobicContact CD1-CB 4.14Å; I878-V1056 HydrophobicContact CD1-CG2 4.17Å; S1054-V1056 PolarHBondContact O-N 3.16Å; S1054-V1056 PolarHBondContact OG-N 3.2Å; V1056-H1058 VanDerWaalsContact C-N 3.31Å; V1056-H1058 PolarHBondContact O-N 3.26Å; V1056-L1059 WeakPolarHBondContact O-CB 3.35Å; V1056-L1059 PolarHBondContact O-N 2.97Å; V1056-L1060 WeakPolarHBondContact O-CB 3.46Å; V1056-L1060 PolarHBondContact O-N 3.24Å
1057	H	86.7	Confident	78.8	Confident	0.4 Å²	0.4	34 Å²	34	0%	0.002	18%	0.179	C	C	.	.	H	α-helix	trans	-61.6	-42.6	172.8	-62.6	123.2	0	0	0	111	L871 I874 H875 F1051 W1053 S1054 L1060 L1061	L871-H1057 HydrophobicContact CD2-CB 4.4Å; L871-H1057 PolarHBondContact O-NE2 3.23Å; L871-H1057 VanDerWaalsContact O-NE2 3.15Å; I874-H1057 WeakPolarHBondContact CB-NE2 3.41Å; I874-H1057 WeakPolarHBondContact CG2-CD2 3.46Å; I874-H1057 WeakPolarHBondContact CG2-NE2 3.4Å; H875-H1057 AromaticContact CD2-CD2 3.6Å; H875-H1057 AromaticContact CD2-CE1 3.5Å; H875-H1057 PolarHBondContact CD2-CE1 3.11Å; H875-H1057 AromaticContact CD2-ND1 3.85Å; H875-H1057 AromaticContact CD2-NE2 2.86Å; H875-H1057 PolarHBondContact CD2-NE2 3.5Å; H875-H1057 AromaticContact CE1-CE1 3.58Å; H875-H1057 AromaticContact CE1-ND1 4Å; H875-H1057 AromaticContact CG-CE1 3.45Å; H875-H1057 VanDerWaalsContact CG-CE1 3.45Å; H875-H1057 AromaticContact CG-NE2 3.52Å; H875-H1057 PolarHBondContact N-NE2 3.23Å; H875-H1057 VanDerWaalsContact N-NE2 3.19Å; H875-H1057 AromaticContact ND1-CE1 3.84Å; H875-H1057 AromaticContact NE2-CD2 3.75Å; H875-H1057 AromaticContact NE2-CE1 3.09Å; H875-H1057 PolarHBondContact NE2-CE1 3.29Å; H875-H1057 AromaticContact NE2-CG 3.86Å; H875-H1057 AromaticContact NE2-ND1 3.46Å; H875-H1057 PolarHBondContact NE2-ND1 3.24Å; H875-H1057 AromaticContact NE2-NE2 3.31Å; H875-H1057 PolarHBondContact NE2-NE2 3.12Å; F1051-H1057 AromaticContact CE2-CE1 3.85Å; F1051-H1057 AromaticContact CE2-NE2 3.71Å; F1051-H1057 AromaticContact CZ-CE1 3.86Å; F1051-H1057 AromaticContact CZ-ND1 3.81Å; F1051-H1057 AromaticContact CZ-NE2 3.98Å; W1053-H1057 HydrophobicContact CE3-CB 3.61Å; W1053-H1057 HydrophobicContact CZ3-CB 3.97Å; S1054-H1057 WeakPolarHBondContact CB-ND1 3.45Å; S1054-H1057 PolarHBondContact N-ND1 3.12Å; S1054-H1057 VanDerWaalsContact N-ND1 3.19Å; S1054-H1057 WeakPolarHBondContact O-CB 3.4Å; S1054-H1057 PolarHBondContact O-N 3.02Å; S1054-H1057 VanDerWaalsContact O-N 3.09Å; S1054-H1057 PolarHBondContact OG-CE1 3.25Å; S1054-H1057 VanDerWaalsContact OG-CG 3.3Å; S1054-H1057 PolarHBondContact OG-N 2.92Å; S1054-H1057 VanDerWaalsContact OG-N 3.1Å; S1054-H1057 PolarHBondContact OG-ND1 3.05Å; S1054-H1057 VanDerWaalsContact OG-ND1 3.1Å; H1057-L1060 PolarHBondContact O-N 3.07Å; H1057-L1061 VanDerWaalsContact O-CB 3.24Å; H1057-L1061 WeakPolarHBondContact O-CB 3.3Å; H1057-L1061 PolarHBondContact O-N 3.02Å
1058	H	84.1	Confident	80.9	Confident	15 Å²	15	25.9 Å²	25.9	7%	0.069	14%	0.141	C	C	.	.	H	α-helix	trans	-64.5	-45.5	176.4	-63.9	-40.5	0	0	0	111.9	L995 W1053 S1054 Y1055 V1056 L1060 L1061 D1062 G1239 M1240 Y1248 R1439 L1440	L995-H1058 HydrophobicContact CD1-CB 3.99Å; W1053-H1058 AromaticContact CE3-CE1 3.94Å; W1053-H1058 AromaticContact CE3-ND1 3.98Å; S1054-H1058 PolarHBondContact O-CD2 2.95Å; S1054-H1058 VanDerWaalsContact O-CD2 3.28Å; S1054-H1058 PolarHBondContact O-N 3.07Å; S1054-H1058 VanDerWaalsContact O-N 3.14Å; Y1055-H1058 PolarHBondContact O-N 3.11Å; V1056-H1058 VanDerWaalsContact C-N 3.31Å; V1056-H1058 PolarHBondContact O-N 3.26Å; H1058-L1060 VanDerWaalsContact C-N 3.32Å; H1058-L1060 PolarHBondContact O-N 3.1Å; H1058-L1061 PolarHBondContact O-N 3.08Å; H1058-D1062 VanDerWaalsContact O-CB 3.27Å; H1058-D1062 WeakPolarHBondContact O-CB 3.33Å; H1058-D1062 PolarHBondContact O-N 3Å; H1058-G1239 PolarHBondContact NE2-O 3.3Å; H1058-M1240 PolarHBondContact CE1-SD 3.16Å; H1058-M1240 VanDerWaalsContact CE1-SD 3.54Å; H1058-Y1248 WeakPolarHBondContact CA-OH 3.47Å; H1058-Y1248 WeakPolarHBondContact CB-OH 3.38Å; H1058-Y1248 AromaticContact ND1-CE2 3.82Å; H1058-Y1248 PolarHBondContact ND1-OH 3.14Å; H1058-Y1248 PolarHBondContact O-OH 3.28Å; H1058-R1439 PolarHBondContact CD2-NH1 3.03Å; H1058-L1440 HydrophobicContact CB-CD1 3.2Å
1059	L	81.3	Confident	82.4	Confident	32 Å²	32	23.4 Å²	23.4	17%	0.168	13%	0.128	C	C	.	.	H	α-helix	trans	-57.7	-44.8	176.6	-79	167.6	0	0	0	111.8	L846 L995 Y997 Y1055 V1056 D1063 L1416 L1420 L1423 L1440	L846-L1059 HydrophobicContact CD1-CB 4.37Å; L846-L1059 HydrophobicContact CD1-CD1 4.38Å; L995-L1059 HydrophobicContact CB-CD2 4.21Å; Y997-L1059 HydrophobicContact CD1-CD1 4.46Å; Y997-L1059 HydrophobicContact CD1-CD2 4.22Å; Y997-L1059 HydrophobicContact CE1-CD1 4.09Å; Y997-L1059 HydrophobicContact CE1-CD2 3.9Å; Y1055-L1059 HydrophobicContact CD2-CD1 3.72Å; Y1055-L1059 HydrophobicContact CD2-CG 4.38Å; Y1055-L1059 HydrophobicContact CE2-CD1 3.69Å; Y1055-L1059 WeakPolarHBondContact O-CB 3.43Å; Y1055-L1059 VanDerWaalsContact O-CG 3.29Å; Y1055-L1059 WeakPolarHBondContact O-CG 3.37Å; Y1055-L1059 PolarHBondContact O-N 3.27Å; V1056-L1059 WeakPolarHBondContact O-CB 3.35Å; V1056-L1059 PolarHBondContact O-N 2.97Å; L1059-D1063 VanDerWaalsContact O-CB 3.29Å; L1059-D1063 WeakPolarHBondContact O-CB 3.32Å; L1059-D1063 PolarHBondContact O-N 3.12Å; L1059-D1063 VanDerWaalsContact O-N 3.17Å; L1059-L1416 HydrophobicContact CD2-CD2 3.97Å; L1059-L1420 HydrophobicContact CD1-CD1 3.87Å; L1059-L1420 HydrophobicContact CD1-CG 4.09Å; L1059-L1423 HydrophobicContact CD1-CD1 4.06Å; L1059-L1423 HydrophobicContact CD2-CD1 4.31Å; L1059-L1423 HydrophobicContact CG-CD1 4.38Å; L1059-L1440 HydrophobicContact CB-CD1 4.49Å; L1059-L1440 HydrophobicContact CB-CD2 4.49Å; L1059-L1440 HydrophobicContact CD2-CD2 3.79Å; L1059-L1440 HydrophobicContact CG-CD1 4.2Å; L1059-L1440 HydrophobicContact CG-CD2 3.99Å; L1059-L1440 HydrophobicContact CG-CG 4.38Å; L1059-L1440 VanDerWaalsContact N-CD1 3.28Å
1060	L	86.2	Confident	83.6	Confident	3 Å²	3	23.2 Å²	23.2	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-68.8	-43.1	177.9	-177.3	63	0	0	0	111.9	I849 L853 T870 L871 I874 V1056 H1057 H1058 L1064	I849-L1060 HydrophobicContact CG2-CD1 4Å; I849-L1060 HydrophobicContact CG2-CD2 4.37Å; L853-L1060 HydrophobicContact CD1-CD1 4.25Å; L853-L1060 HydrophobicContact CD1-CD2 4.35Å; T870-L1060 HydrophobicContact CG2-CD2 3.74Å; L871-L1060 HydrophobicContact CD2-CD2 4.41Å; I874-L1060 HydrophobicContact CD1-CD2 3.62Å; V1056-L1060 WeakPolarHBondContact O-CB 3.46Å; V1056-L1060 PolarHBondContact O-N 3.24Å; H1057-L1060 PolarHBondContact O-N 3.07Å; H1058-L1060 VanDerWaalsContact C-N 3.32Å; H1058-L1060 PolarHBondContact O-N 3.1Å; L1060-L1064 WeakPolarHBondContact O-CB 3.31Å; L1060-L1064 PolarHBondContact O-N 3.03Å; L1060-L1064 VanDerWaalsContact O-N 3.1Å
1061	L	88	Confident	84.4	Confident	2.6 Å²	2.6	18 Å²	18	1%	0.014	10%	0.096	C	C	.	.	H	α-helix	trans	-70.2	-43.6	-176.5	-177.3	61.7	0	0	0	112.3	W1053 H1057 H1058 L1064 L1065 L1206 Y1248	W1053-L1061 HydrophobicContact CH2-CD2 4.01Å; W1053-L1061 HydrophobicContact CZ3-CD2 3.92Å; H1057-L1061 VanDerWaalsContact O-CB 3.24Å; H1057-L1061 WeakPolarHBondContact O-CB 3.3Å; H1057-L1061 PolarHBondContact O-N 3.02Å; H1058-L1061 PolarHBondContact O-N 3.08Å; L1061-L1064 PolarHBondContact O-N 3.07Å; L1061-L1065 HydrophobicContact CD1-CD1 3.84Å; L1061-L1065 HydrophobicContact CD1-CG 3.97Å; L1061-L1065 HydrophobicContact CG-CD1 3.88Å; L1061-L1065 HydrophobicContact CG-CG 4.38Å; L1061-L1065 VanDerWaalsContact O-CB 3.27Å; L1061-L1065 WeakPolarHBondContact O-CB 3.4Å; L1061-L1065 VanDerWaalsContact O-CG 3.27Å; L1061-L1065 WeakPolarHBondContact O-CG 3.45Å; L1061-L1065 PolarHBondContact O-N 2.99Å; L1061-L1206 HydrophobicContact CD1-CD1 3.76Å; L1061-L1206 HydrophobicContact CD1-CD2 4.49Å; L1061-Y1248 HydrophobicContact CB-CE1 4.47Å; L1061-Y1248 HydrophobicContact CD2-CD1 4.25Å; L1061-Y1248 HydrophobicContact CD2-CD2 4.32Å; L1061-Y1248 HydrophobicContact CD2-CE1 4.08Å; L1061-Y1248 HydrophobicContact CD2-CE2 4.15Å; L1061-Y1248 HydrophobicContact CD2-CG 4.36Å; L1061-Y1248 HydrophobicContact CG-CD1 4.36Å; L1061-Y1248 HydrophobicContact CG-CE1 4.01Å
1062	D	83.9	Confident	84.8	Confident	40.8 Å²	40.8	16.6 Å²	16.6	22%	0.218	9%	0.089	C	C	.	.	H	α-helix	trans	-60.5	-49.5	177.8	-176	49.4	0	0	0	111.5	H1058 L1064 L1065 C1066 Y1248 R1251 L1440	H1058-D1062 VanDerWaalsContact O-CB 3.27Å; H1058-D1062 WeakPolarHBondContact O-CB 3.33Å; H1058-D1062 PolarHBondContact O-N 3Å; D1062-L1064 PolarHBondContact O-N 3.17Å; D1062-L1065 PolarHBondContact O-N 3.46Å; D1062-C1066 VanDerWaalsContact O-CB 3.24Å; D1062-C1066 WeakPolarHBondContact O-CB 3.4Å; D1062-C1066 PolarHBondContact O-N 3.01Å; D1062-Y1248 HydrophobicContact CB-CE1 4.29Å; D1062-R1251 PolarHBondContact O-NH2 3.14Å; D1062-R1251 VanDerWaalsContact O-NH2 3.13Å; D1062-R1251 IonicContact OD1-CZ 3.14Å; D1062-R1251 IonicContact OD1-NH1 2.95Å; D1062-R1251 PolarHBondContact OD1-NH1 2.95Å; D1062-R1251 IonicContact OD1-NH2 3.47Å; D1062-R1251 PolarHBondContact OD1-NH2 3.07Å; D1062-L1440 HydrophobicContact CB-CD2 4.09Å; D1062-L1440 WeakPolarHBondContact OD2-CD2 3.39Å
1063	D	81.1	Confident	85	Confident	33.6 Å²	33.6	16.6 Å²	16.6	18%	0.18	9%	0.088	C	C	.	.	H	α-helix	trans	-70.4	-35.8	-179.4	-152	14.7	0	0	0	112.2	R850 L1059 S1067	R850-D1063 VanDerWaalsContact CD-CG 3.43Å; R850-D1063 VanDerWaalsContact CD-OD1 3.31Å; R850-D1063 WeakPolarHBondContact CD-OD1 3.33Å; R850-D1063 WeakPolarHBondContact CD-OD2 3.34Å; R850-D1063 IonicContact CZ-OD1 3.32Å; R850-D1063 IonicContact CZ-OD2 2.85Å; R850-D1063 IonicContact NE-OD1 3.7Å; R850-D1063 IonicContact NE-OD2 3.3Å; R850-D1063 PolarHBondContact NE-OD2 3.28Å; R850-D1063 VanDerWaalsContact NH1-CG 3.34Å; R850-D1063 IonicContact NH1-OD1 3.43Å; R850-D1063 PolarHBondContact NH1-OD1 3.07Å; R850-D1063 IonicContact NH1-OD2 3.25Å; R850-D1063 PolarHBondContact NH1-OD2 3.23Å; L1059-D1063 VanDerWaalsContact O-CB 3.29Å; L1059-D1063 WeakPolarHBondContact O-CB 3.32Å; L1059-D1063 PolarHBondContact O-N 3.12Å; L1059-D1063 VanDerWaalsContact O-N 3.17Å; D1063-S1067 VanDerWaalsContact O-CB 3.29Å; D1063-S1067 WeakPolarHBondContact O-CB 3.35Å; D1063-S1067 PolarHBondContact O-N 3.17Å; D1063-S1067 PolarHBondContact O-OG 3.36Å
1064	L	88.3	Confident	85	Confident	0.6 Å²	0.6	20.6 Å²	20.6	0%	0.003	11%	0.107	C	C	.	.	H	α-helix	trans	-67.5	-48.5	174.6	-177.2	114.1	0	0	0	111.5	L853 I854 I857 L867 L1060 L1061 D1062 C1066 S1067 L1068	L853-L1064 HydrophobicContact CB-CD1 3.86Å; L853-L1064 HydrophobicContact CD1-CD1 3.98Å; L853-L1064 HydrophobicContact CG-CD1 4.44Å; I854-L1064 HydrophobicContact CD1-CD1 3.67Å; I854-L1064 HydrophobicContact CD1-CG 4.35Å; I854-L1064 HydrophobicContact CG1-CD1 3.93Å; I857-L1064 HydrophobicContact CD1-CD1 4.19Å; I857-L1064 HydrophobicContact CD1-CD2 4.45Å; L867-L1064 HydrophobicContact CD1-CD1 3.89Å; L867-L1064 HydrophobicContact CD1-CD2 4.08Å; L867-L1064 HydrophobicContact CD2-CD1 4.47Å; L867-L1064 HydrophobicContact CD2-CD2 4.01Å; L867-L1064 HydrophobicContact CG-CD2 4.32Å; L1060-L1064 WeakPolarHBondContact O-CB 3.31Å; L1060-L1064 PolarHBondContact O-N 3.03Å; L1060-L1064 VanDerWaalsContact O-N 3.1Å; L1061-L1064 PolarHBondContact O-N 3.07Å; D1062-L1064 PolarHBondContact O-N 3.17Å; L1064-C1066 VanDerWaalsContact C-N 3.34Å; L1064-C1066 PolarHBondContact O-N 3.17Å; L1064-S1067 WeakPolarHBondContact O-CB 3.45Å; L1064-S1067 PolarHBondContact O-N 3.05Å; L1064-S1067 VanDerWaalsContact O-N 3.13Å; L1064-L1068 HydrophobicContact CD2-CD1 3.7Å; L1064-L1068 HydrophobicContact CD2-CG 4.39Å; L1064-L1068 HydrophobicContact CG-CD1 4.34Å; L1064-L1068 WeakPolarHBondContact O-CG 3.35Å; L1064-L1068 PolarHBondContact O-N 3.11Å
1065	L	89.1	Confident	84.9	Confident	0.4 Å²	0.4	21.6 Å²	21.6	0%	0.002	11%	0.11	C	C	.	.	H	α-helix	trans	-62	-43.8	176.9	-72.7	173.6	0	0	0	110.9	L1061 D1062 S1067 L1068 E1069 Y1248 L1252 L1255	L1061-L1065 HydrophobicContact CD1-CD1 3.84Å; L1061-L1065 HydrophobicContact CD1-CG 3.97Å; L1061-L1065 HydrophobicContact CG-CD1 3.88Å; L1061-L1065 HydrophobicContact CG-CG 4.38Å; L1061-L1065 VanDerWaalsContact O-CB 3.27Å; L1061-L1065 WeakPolarHBondContact O-CB 3.4Å; L1061-L1065 VanDerWaalsContact O-CG 3.27Å; L1061-L1065 WeakPolarHBondContact O-CG 3.45Å; L1061-L1065 PolarHBondContact O-N 2.99Å; D1062-L1065 PolarHBondContact O-N 3.46Å; L1065-S1067 VanDerWaalsContact C-N 3.28Å; L1065-S1067 PolarHBondContact O-N 3.21Å; L1065-L1068 PolarHBondContact O-N 3.12Å; L1065-L1068 VanDerWaalsContact O-N 3.11Å; L1065-E1069 WeakPolarHBondContact O-CB 3.26Å; L1065-E1069 VanDerWaalsContact O-CD 3.24Å; L1065-E1069 VanDerWaalsContact O-CG 3.23Å; L1065-E1069 WeakPolarHBondContact O-CG 3.29Å; L1065-E1069 PolarHBondContact O-N 3.33Å; L1065-Y1248 HydrophobicContact CD1-CD1 3.62Å; L1065-Y1248 HydrophobicContact CD1-CE1 4.18Å; L1065-Y1248 HydrophobicContact CD1-CG 4.48Å; L1065-L1252 HydrophobicContact CD2-CD2 3.92Å; L1065-L1255 HydrophobicContact CD2-CD1 3.65Å
1066	C	86.1	Confident	84.7	Confident	27 Å²	27	20.7 Å²	20.7	18%	0.182	11%	0.108	C	C	.	.	H	α-helix	trans	-58.6	-40.1	175.4	-173.9	0	0	0	0	111.5	D1062 L1064 E1069 N1070	D1062-C1066 VanDerWaalsContact O-CB 3.24Å; D1062-C1066 WeakPolarHBondContact O-CB 3.4Å; D1062-C1066 PolarHBondContact O-N 3.01Å; L1064-C1066 VanDerWaalsContact C-N 3.34Å; L1064-C1066 PolarHBondContact O-N 3.17Å; C1066-E1069 VanDerWaalsContact CA-OE2 3.24Å; C1066-E1069 WeakPolarHBondContact CA-OE2 3.15Å; C1066-E1069 PolarHBondContact N-OE1 3.37Å; C1066-E1069 WeakPolarHBondContact O-CB 3.37Å; C1066-E1069 PolarHBondContact O-N 2.94Å; C1066-N1070 PolarHBondContact O-N 3.33Å; C1066-N1070 VanDerWaalsContact O-N 3.08Å; C1066-N1070 PolarHBondContact O-ND2 2.92Å
1067	S	86	Confident	84.5	Confident	10.8 Å²	10.8	23.6 Å²	23.6	8%	0.076	13%	0.126	C	C	.	.	H	α-helix	trans	-68	-40	176	-58.9	0	0	0	0	112.8	R850 D1063 L1064 L1065 N1070 I1071	R850-S1067 WeakPolarHBondContact CD-OG 3.07Å; R850-S1067 PolarHBondContact NH1-OG 3.17Å; R850-S1067 VanDerWaalsContact NH1-OG 3.09Å; D1063-S1067 VanDerWaalsContact O-CB 3.29Å; D1063-S1067 WeakPolarHBondContact O-CB 3.35Å; D1063-S1067 PolarHBondContact O-N 3.17Å; D1063-S1067 PolarHBondContact O-OG 3.36Å; L1064-S1067 WeakPolarHBondContact O-CB 3.45Å; L1064-S1067 PolarHBondContact O-N 3.05Å; L1064-S1067 VanDerWaalsContact O-N 3.13Å; L1065-S1067 VanDerWaalsContact C-N 3.28Å; L1065-S1067 PolarHBondContact O-N 3.21Å; S1067-N1070 PolarHBondContact O-N 3.04Å; S1067-I1071 WeakPolarHBondContact O-CB 3.39Å; S1067-I1071 WeakPolarHBondContact O-CD1 3.41Å; S1067-I1071 VanDerWaalsContact O-CG1 3.26Å; S1067-I1071 WeakPolarHBondContact O-CG1 3.33Å; S1067-I1071 PolarHBondContact O-N 3.17Å; S1067-I1071 VanDerWaalsContact O-N 3.13Å
1068	L	89.6	Confident	83.6	Confident	0.8 Å²	0.8	28.1 Å²	28.1	0%	0.004	15%	0.147	C	C	.	.	H	α-helix	trans	-66.7	-39.6	175.5	-67	175	0	0	0	111.8	I854 I857 L1064 L1065 I1071 V1072 F1195 I1199 L1255	I854-L1068 HydrophobicContact CD1-CD2 3.53Å; I854-L1068 HydrophobicContact CD1-CG 3.76Å; I857-L1068 HydrophobicContact CD1-CD1 4.34Å; I857-L1068 HydrophobicContact CG2-CD2 3.89Å; L1064-L1068 HydrophobicContact CD2-CD1 3.7Å; L1064-L1068 HydrophobicContact CD2-CG 4.39Å; L1064-L1068 HydrophobicContact CG-CD1 4.34Å; L1064-L1068 WeakPolarHBondContact O-CG 3.35Å; L1064-L1068 PolarHBondContact O-N 3.11Å; L1065-L1068 PolarHBondContact O-N 3.12Å; L1065-L1068 VanDerWaalsContact O-N 3.11Å; L1068-I1071 PolarHBondContact O-N 3.27Å; L1068-V1072 WeakPolarHBondContact O-CG2 3.3Å; L1068-V1072 PolarHBondContact O-N 3.38Å; L1068-F1195 HydrophobicContact CD2-CE2 4.01Å; L1068-I1199 HydrophobicContact CB-CD1 4.42Å; L1068-I1199 HydrophobicContact CD1-CD1 4.35Å; L1068-I1199 HydrophobicContact CD1-CG1 4.37Å; L1068-I1199 HydrophobicContact CD2-CD1 4.24Å; L1068-I1199 HydrophobicContact CD2-CG1 4.42Å; L1068-I1199 HydrophobicContact CG-CD1 4.49Å; L1068-L1255 HydrophobicContact CB-CD1 4.36Å; L1068-L1255 HydrophobicContact CB-CD2 4.42Å; L1068-L1255 HydrophobicContact CD1-CD1 4.4Å
1069	E	88.2	Confident	82.8	Confident	10.2 Å²	10.2	30.3 Å²	30.3	5%	0.048	15%	0.154	C	C	.	.	H	α-helix	trans	-58.3	-49.7	173.2	-82.6	155.9	-156.6	0	0	111.2	L1065 C1066 I1071 V1072 V1073 R1251 Y1254 L1255 Y1493 F1502	L1065-E1069 WeakPolarHBondContact O-CB 3.26Å; L1065-E1069 VanDerWaalsContact O-CD 3.24Å; L1065-E1069 VanDerWaalsContact O-CG 3.23Å; L1065-E1069 WeakPolarHBondContact O-CG 3.29Å; L1065-E1069 PolarHBondContact O-N 3.33Å; C1066-E1069 VanDerWaalsContact CA-OE2 3.24Å; C1066-E1069 WeakPolarHBondContact CA-OE2 3.15Å; C1066-E1069 PolarHBondContact N-OE1 3.37Å; C1066-E1069 WeakPolarHBondContact O-CB 3.37Å; C1066-E1069 PolarHBondContact O-N 2.94Å; E1069-I1071 VanDerWaalsContact C-N 3.28Å; E1069-I1071 PolarHBondContact O-N 3.14Å; E1069-V1072 WeakPolarHBondContact O-CB 3.37Å; E1069-V1072 PolarHBondContact O-N 3.37Å; E1069-V1072 VanDerWaalsContact O-N 3.13Å; E1069-V1073 VanDerWaalsContact O-CG2 3.27Å; E1069-V1073 WeakPolarHBondContact O-CG2 3.32Å; E1069-V1073 PolarHBondContact O-N 3.16Å; E1069-R1251 VanDerWaalsContact OE1-CB 3.24Å; E1069-R1251 WeakPolarHBondContact OE1-CB 3.39Å; E1069-R1251 VanDerWaalsContact OE1-CG 3.29Å; E1069-R1251 WeakPolarHBondContact OE1-CG 3.34Å; E1069-R1251 IonicContact OE1-CZ 3.03Å; E1069-R1251 VanDerWaalsContact OE1-CZ 3.24Å; E1069-R1251 IonicContact OE1-NE 3.07Å; E1069-R1251 PolarHBondContact OE1-NE 3.16Å; E1069-R1251 IonicContact OE1-NH2 3.08Å; E1069-R1251 PolarHBondContact OE1-NH2 2.84Å; E1069-R1251 IonicContact OE2-CZ 3.66Å; E1069-R1251 IonicContact OE2-NE 2.78Å; E1069-R1251 PolarHBondContact OE2-NE 2.95Å; E1069-R1251 IonicContact OE2-NH2 3.29Å; E1069-R1251 PolarHBondContact OE2-NH2 2.78Å; E1069-Y1254 HydrophobicContact CG-CD1 4.39Å; E1069-L1255 HydrophobicContact CG-CD2 4.41Å; E1069-Y1493 PolarHBondContact OE2-OH 3.27Å; E1069-Y1493 VanDerWaalsContact OE2-OH 3.05Å; E1069-F1502 HydrophobicContact CB-CE2 4.22Å; E1069-F1502 HydrophobicContact CG-CE2 3.9Å
1070	N	86.3	Confident	82.3	Confident	56.6 Å²	56.6	34.4 Å²	34.4	30%	0.303	17%	0.171	S	C	.	.	H	α-helix	trans	-57.3	-41	175.9	-80.9	-69.2	0	0	0	112.1	C1066 S1067 V1072 V1073 Q1074 Y1497	C1066-N1070 PolarHBondContact O-N 3.33Å; C1066-N1070 VanDerWaalsContact O-N 3.08Å; C1066-N1070 PolarHBondContact O-ND2 2.92Å; S1067-N1070 PolarHBondContact O-N 3.04Å; N1070-V1072 VanDerWaalsContact C-N 3.33Å; N1070-V1072 PolarHBondContact O-N 3.1Å; N1070-V1073 PolarHBondContact O-N 3.36Å; N1070-Q1074 WeakPolarHBondContact O-CB 3.37Å; N1070-Q1074 VanDerWaalsContact O-CG 3.31Å; N1070-Q1074 WeakPolarHBondContact O-CG 3.38Å; N1070-Q1074 PolarHBondContact O-N 2.99Å; N1070-Y1497 PolarHBondContact ND2-OH 3.15Å
1071	I	86.4	Confident	81.2	Confident	27.4 Å²	27.4	39.6 Å²	39.6	14%	0.141	20%	0.195	C	C	.	.	H	α-helix	trans	-68.7	-37.4	178.7	-69.8	164.9	0	0	0	111.6	I854 S1067 L1068 E1069 Q1074 R1075 F1195	I854-I1071 HydrophobicContact CG2-CD1 3.49Å; I854-I1071 VanDerWaalsContact CG2-CD1 3.46Å; S1067-I1071 WeakPolarHBondContact O-CB 3.39Å; S1067-I1071 WeakPolarHBondContact O-CD1 3.41Å; S1067-I1071 VanDerWaalsContact O-CG1 3.26Å; S1067-I1071 WeakPolarHBondContact O-CG1 3.33Å; S1067-I1071 PolarHBondContact O-N 3.17Å; S1067-I1071 VanDerWaalsContact O-N 3.13Å; L1068-I1071 PolarHBondContact O-N 3.27Å; E1069-I1071 VanDerWaalsContact C-N 3.28Å; E1069-I1071 PolarHBondContact O-N 3.14Å; I1071-Q1074 PolarHBondContact O-N 3.4Å; I1071-R1075 HydrophobicContact CG2-CG 4.46Å; I1071-R1075 WeakPolarHBondContact O-CB 3.27Å; I1071-R1075 VanDerWaalsContact O-CG 3.29Å; I1071-R1075 WeakPolarHBondContact O-CG 3.34Å; I1071-R1075 PolarHBondContact O-N 3.27Å; I1071-R1075 VanDerWaalsContact O-N 3.16Å; I1071-F1195 HydrophobicContact CB-CZ 4.45Å; I1071-F1195 HydrophobicContact CG2-CE1 4.39Å; I1071-F1195 HydrophobicContact CG2-CE2 3.92Å; I1071-F1195 HydrophobicContact CG2-CZ 3.65Å
1072	V	86.6	Confident	79.8	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.4	-50.2	173.5	163.6	0	0	0	0	110.6	L1068 E1069 N1070 Q1074 R1075 D1076 F1195 I1199 Y1254 L1255 F1258	L1068-V1072 WeakPolarHBondContact O-CG2 3.3Å; L1068-V1072 PolarHBondContact O-N 3.38Å; E1069-V1072 WeakPolarHBondContact O-CB 3.37Å; E1069-V1072 PolarHBondContact O-N 3.37Å; E1069-V1072 VanDerWaalsContact O-N 3.13Å; N1070-V1072 VanDerWaalsContact C-N 3.33Å; N1070-V1072 PolarHBondContact O-N 3.1Å; V1072-Q1074 VanDerWaalsContact C-N 3.3Å; V1072-Q1074 PolarHBondContact O-N 3.22Å; V1072-R1075 WeakPolarHBondContact O-CA 3.03Å; V1072-R1075 WeakPolarHBondContact O-CB 3.49Å; V1072-R1075 PolarHBondContact O-N 3.25Å; V1072-R1075 VanDerWaalsContact O-N 3.12Å; V1072-D1076 PolarHBondContact O-N 3.23Å; V1072-F1195 HydrophobicContact CG2-CE1 4.2Å; V1072-F1195 HydrophobicContact CG2-CZ 4.17Å; V1072-I1199 HydrophobicContact CG2-CD1 4.45Å; V1072-Y1254 HydrophobicContact CB-CE1 4.3Å; V1072-Y1254 HydrophobicContact CG1-CD1 4.49Å; V1072-Y1254 HydrophobicContact CG1-CE1 3.74Å; V1072-L1255 HydrophobicContact CB-CD2 4.47Å; V1072-L1255 HydrophobicContact CG2-CD2 3.85Å; V1072-F1258 HydrophobicContact CB-CD2 4.47Å; V1072-F1258 HydrophobicContact CB-CG 4.44Å; V1072-F1258 HydrophobicContact CG1-CB 3.91Å; V1072-F1258 HydrophobicContact CG1-CD1 4.34Å; V1072-F1258 HydrophobicContact CG1-CD2 3.56Å; V1072-F1258 HydrophobicContact CG1-CE2 4.11Å; V1072-F1258 HydrophobicContact CG1-CG 3.67Å; V1072-F1258 HydrophobicContact CG2-CB 4.39Å; V1072-F1258 HydrophobicContact CG2-CD1 3.81Å; V1072-F1258 HydrophobicContact CG2-CD2 4.39Å; V1072-F1258 HydrophobicContact CG2-CE1 4.03Å; V1072-F1258 HydrophobicContact CG2-CE2 4.5Å; V1072-F1258 HydrophobicContact CG2-CG 4Å; V1072-F1258 HydrophobicContact CG2-CZ 4.33Å
1073	V	84.2	Confident	78.4	Confident	31.2 Å²	31.2	45.8 Å²	45.8	19%	0.189	23%	0.232	C	C	.	.	H	α-helix	trans	-55.9	-44.7	177.5	172.2	0	0	0	0	111.2	E1069 N1070 R1075 D1076 V1077 Y1254	E1069-V1073 VanDerWaalsContact O-CG2 3.27Å; E1069-V1073 WeakPolarHBondContact O-CG2 3.32Å; E1069-V1073 PolarHBondContact O-N 3.16Å; N1070-V1073 PolarHBondContact O-N 3.36Å; V1073-R1075 PolarHBondContact O-N 3.23Å; V1073-D1076 PolarHBondContact O-N 3.31Å; V1073-V1077 WeakPolarHBondContact O-CG2 3.42Å; V1073-V1077 PolarHBondContact O-N 3.1Å; V1073-V1077 VanDerWaalsContact O-N 3.08Å; V1073-Y1254 HydrophobicContact CG2-CE1 4.5Å; V1073-Y1254 VanDerWaalsContact CG2-OH 3.29Å; V1073-Y1254 WeakPolarHBondContact CG2-OH 3.33Å
1074	Q	81.4	Confident	77	Confident	90.4 Å²	90.4	46.9 Å²	46.9	42%	0.422	25%	0.245	S	C	.	.	H	α-helix	trans	-61.9	-44.5	175.5	-73.5	169.8	10	0	0	112.2	I985 N1070 I1071 V1072 D1076 V1077 H1078 L1398	I985-Q1074 PolarHBondContact O-NE2 2.63Å; N1070-Q1074 WeakPolarHBondContact O-CB 3.37Å; N1070-Q1074 VanDerWaalsContact O-CG 3.31Å; N1070-Q1074 WeakPolarHBondContact O-CG 3.38Å; N1070-Q1074 PolarHBondContact O-N 2.99Å; I1071-Q1074 PolarHBondContact O-N 3.4Å; V1072-Q1074 VanDerWaalsContact C-N 3.3Å; V1072-Q1074 PolarHBondContact O-N 3.22Å; Q1074-D1076 PolarHBondContact O-N 3.12Å; Q1074-V1077 PolarHBondContact O-N 3.29Å; Q1074-H1078 PolarHBondContact O-CD2 3.18Å; Q1074-H1078 PolarHBondContact O-N 3.11Å; Q1074-H1078 VanDerWaalsContact O-N 3.08Å; Q1074-L1398 HydrophobicContact CG-CD2 4.34Å; Q1074-L1398 PolarHBondContact NE2-O 3.32Å
1075	R	80.1	Confident	75.1	Confident	26.8 Å²	26.8	49.9 Å²	49.9	10%	0.101	27%	0.267	C	S	.	.	H	α-helix	trans	-64.8	-39.6	178.8	-78.5	177.7	168.6	145.9	1.2	112.6	I1071 V1072 V1073 H1078 R1079 M1187 F1195 F1258	I1071-R1075 HydrophobicContact CG2-CG 4.46Å; I1071-R1075 WeakPolarHBondContact O-CB 3.27Å; I1071-R1075 VanDerWaalsContact O-CG 3.29Å; I1071-R1075 WeakPolarHBondContact O-CG 3.34Å; I1071-R1075 PolarHBondContact O-N 3.27Å; I1071-R1075 VanDerWaalsContact O-N 3.16Å; V1072-R1075 WeakPolarHBondContact O-CA 3.03Å; V1072-R1075 WeakPolarHBondContact O-CB 3.49Å; V1072-R1075 PolarHBondContact O-N 3.25Å; V1072-R1075 VanDerWaalsContact O-N 3.12Å; V1073-R1075 PolarHBondContact O-N 3.23Å; R1075-H1078 WeakPolarHBondContact O-CB 3.05Å; R1075-H1078 PolarHBondContact O-N 3Å; R1075-R1079 WeakPolarHBondContact O-CB 3.3Å; R1075-R1079 WeakPolarHBondContact O-CG 3.34Å; R1075-R1079 PolarHBondContact O-N 3.15Å; R1075-M1187 HydrophobicContact CG-SD 3.96Å; R1075-M1187 PolarHBondContact NE-SD 3.15Å; R1075-M1187 PolarHBondContact NH2-SD 3.25Å; R1075-M1187 VanDerWaalsContact NH2-SD 3.38Å; R1075-F1195 VanDerWaalsContact NH1-CB 3.29Å; R1075-F1195 VanDerWaalsContact NH1-CD2 3.27Å; R1075-F1195 VanDerWaalsContact NH1-CE2 3.27Å; R1075-F1195 VanDerWaalsContact NH1-CZ 3.26Å; R1075-F1258 HydrophobicContact CB-CE2 4.32Å; R1075-F1258 HydrophobicContact CB-CZ 4.39Å
1076	D	75.6	Confident	72.9	Confident	24.6 Å²	24.6	56.9 Å²	56.9	13%	0.132	30%	0.299	C	S	.	.	H	α-helix	trans	-71.6	-32.5	177.5	-79.4	-27.7	0	0	0	112.9	V1072 V1073 Q1074 H1078 R1079 K1080 F1258	V1072-D1076 PolarHBondContact O-N 3.23Å; V1073-D1076 PolarHBondContact O-N 3.31Å; Q1074-D1076 PolarHBondContact O-N 3.12Å; D1076-H1078 VanDerWaalsContact C-N 3.33Å; D1076-R1079 PolarHBondContact O-N 2.97Å; D1076-R1079 VanDerWaalsContact OD1-CD 3.24Å; D1076-R1079 WeakPolarHBondContact OD1-CD 3.25Å; D1076-R1079 IonicContact OD1-CZ 2.67Å; D1076-R1079 IonicContact OD1-NH1 3.24Å; D1076-R1079 PolarHBondContact OD1-NH1 3.32Å; D1076-R1079 VanDerWaalsContact OD1-NH1 3.17Å; D1076-R1079 IonicContact OD1-NH2 2.69Å; D1076-K1080 VanDerWaalsContact O-CB 3.31Å; D1076-K1080 WeakPolarHBondContact O-CB 3.45Å; D1076-K1080 WeakPolarHBondContact O-CD 3.39Å; D1076-K1080 VanDerWaalsContact O-CG 3.28Å; D1076-K1080 WeakPolarHBondContact O-CG 3.27Å; D1076-K1080 PolarHBondContact O-N 3.01Å; D1076-F1258 WeakPolarHBondContact OD1-CE2 3.32Å; D1076-F1258 VanDerWaalsContact OD2-CD2 3.27Å; D1076-F1258 WeakPolarHBondContact OD2-CD2 3.37Å; D1076-F1258 WeakPolarHBondContact OD2-CE2 3.43Å
1077	V	74.4	Confident	70.8	Confident	62.2 Å²	62.2	59.7 Å²	59.7	38%	0.377	32%	0.319	S	S	.	.	H	α-helix	trans	-61.3	-46.2	168.7	169.8	0	0	0	0	110.6	V1073 Q1074 R1079 K1080 Q1081	V1073-V1077 WeakPolarHBondContact O-CG2 3.42Å; V1073-V1077 PolarHBondContact O-N 3.1Å; V1073-V1077 VanDerWaalsContact O-N 3.08Å; Q1074-V1077 PolarHBondContact O-N 3.29Å; V1077-R1079 PolarHBondContact O-N 3.16Å; V1077-K1080 PolarHBondContact O-N 3.22Å; V1077-Q1081 HydrophobicContact CG1-CG 4.5Å; V1077-Q1081 VanDerWaalsContact O-CG 3.31Å; V1077-Q1081 WeakPolarHBondContact O-CG 3.36Å; V1077-Q1081 PolarHBondContact O-N 2.98Å
1078	H	68.1	Low	68.4	Low	93.8 Å²	93.8	63.9 Å²	63.9	43%	0.434	35%	0.349	S	S	.	.	H	α-helix	trans	-63.4	-40.5	175.6	-81.1	-68.3	0	0	0	113.1	Q1074 R1075 D1076 K1080 Q1081 S1082	Q1074-H1078 PolarHBondContact O-CD2 3.18Å; Q1074-H1078 PolarHBondContact O-N 3.11Å; Q1074-H1078 VanDerWaalsContact O-N 3.08Å; R1075-H1078 WeakPolarHBondContact O-CB 3.05Å; R1075-H1078 PolarHBondContact O-N 3Å; D1076-H1078 VanDerWaalsContact C-N 3.33Å; H1078-K1080 VanDerWaalsContact C-N 3.32Å; H1078-K1080 PolarHBondContact O-N 3.41Å; H1078-Q1081 PolarHBondContact O-N 2.99Å; H1078-S1082 PolarHBondContact O-N 3.18Å; H1078-S1082 PolarHBondContact O-OG 2.58Å
1079	R	68.6	Low	65.6	Low	61 Å²	61	68.5 Å²	68.5	23%	0.23	38%	0.381	C	S	.	.	H	α-helix	trans	-63.2	-42.2	175.8	-134.1	-179.2	-112.3	170.1	-1.7	111.7	R1075 D1076 V1077 Q1081 S1082 L1083 E1192 D1262 K1263	R1075-R1079 WeakPolarHBondContact O-CB 3.3Å; R1075-R1079 WeakPolarHBondContact O-CG 3.34Å; R1075-R1079 PolarHBondContact O-N 3.15Å; D1076-R1079 PolarHBondContact O-N 2.97Å; D1076-R1079 VanDerWaalsContact OD1-CD 3.24Å; D1076-R1079 WeakPolarHBondContact OD1-CD 3.25Å; D1076-R1079 IonicContact OD1-CZ 2.67Å; D1076-R1079 IonicContact OD1-NH1 3.24Å; D1076-R1079 PolarHBondContact OD1-NH1 3.32Å; D1076-R1079 VanDerWaalsContact OD1-NH1 3.17Å; D1076-R1079 IonicContact OD1-NH2 2.69Å; V1077-R1079 PolarHBondContact O-N 3.16Å; R1079-Q1081 VanDerWaalsContact C-N 3.29Å; R1079-Q1081 PolarHBondContact O-N 2.85Å; R1079-S1082 PolarHBondContact O-N 3.09Å; R1079-S1082 PolarHBondContact O-OG 3.28Å; R1079-S1082 VanDerWaalsContact O-OG 3.1Å; R1079-L1083 HydrophobicContact CG-CD1 4.12Å; R1079-L1083 WeakPolarHBondContact O-CB 3.46Å; R1079-L1083 WeakPolarHBondContact O-CD1 3.38Å; R1079-L1083 WeakPolarHBondContact O-CG 3.29Å; R1079-L1083 PolarHBondContact O-N 3.17Å; R1079-L1083 VanDerWaalsContact O-N 3.1Å; R1079-E1192 IonicContact CZ-OE1 2.93Å; R1079-E1192 VanDerWaalsContact CZ-OE1 3.25Å; R1079-E1192 IonicContact NE-OE1 2.78Å; R1079-E1192 PolarHBondContact NE-OE1 3.12Å; R1079-E1192 IonicContact NH2-OE1 2.77Å; R1079-E1192 PolarHBondContact NH2-OE1 3.09Å; R1079-E1192 VanDerWaalsContact NH2-OE1 3.14Å; R1079-D1262 IonicContact CZ-OD2 3.15Å; R1079-D1262 IonicContact NH1-OD2 3.22Å; R1079-D1262 PolarHBondContact NH1-OD2 3.09Å; R1079-D1262 IonicContact NH2-OD2 3.41Å; R1079-D1262 PolarHBondContact NH2-OD2 3.24Å; R1079-K1263 VanDerWaalsContact NH2-CE 3.27Å
1080	K	69.6	Low	62.8	Low	118.4 Å²	118.4	72.9 Å²	72.9	52%	0.515	41%	0.412	S	S	.	.	H	α-helix	trans	-64.8	-38.2	175.5	-71	165.9	-173.5	171.2	0	111.4	D1076 V1077 H1078 A1084 D1499	D1076-K1080 VanDerWaalsContact O-CB 3.31Å; D1076-K1080 WeakPolarHBondContact O-CB 3.45Å; D1076-K1080 WeakPolarHBondContact O-CD 3.39Å; D1076-K1080 VanDerWaalsContact O-CG 3.28Å; D1076-K1080 WeakPolarHBondContact O-CG 3.27Å; D1076-K1080 PolarHBondContact O-N 3.01Å; V1077-K1080 PolarHBondContact O-N 3.22Å; H1078-K1080 VanDerWaalsContact C-N 3.32Å; H1078-K1080 PolarHBondContact O-N 3.41Å; K1080-A1084 WeakPolarHBondContact O-CB 3.43Å; K1080-A1084 PolarHBondContact O-N 3.21Å; K1080-A1084 VanDerWaalsContact O-N 3.12Å; K1080-D1499 IonicContact NZ-OD2 3.03Å; K1080-D1499 PolarHBondContact NZ-OD2 2.92Å; K1080-D1499 VanDerWaalsContact NZ-OD2 3.15Å
1081	Q	63.8	Low	60	Low	111.8 Å²	111.8	78.4 Å²	78.4	52%	0.522	44%	0.441	S	S	.	.	H	α-helix	trans	-68.2	-41.3	175.7	-73	174.3	5.6	0	0	113.5	V1077 H1078 R1079 A1084 S1085	V1077-Q1081 HydrophobicContact CG1-CG 4.5Å; V1077-Q1081 VanDerWaalsContact O-CG 3.31Å; V1077-Q1081 WeakPolarHBondContact O-CG 3.36Å; V1077-Q1081 PolarHBondContact O-N 2.98Å; H1078-Q1081 PolarHBondContact O-N 2.99Å; R1079-Q1081 VanDerWaalsContact C-N 3.29Å; R1079-Q1081 PolarHBondContact O-N 2.85Å; Q1081-A1084 PolarHBondContact O-N 3.1Å; Q1081-S1085 PolarHBondContact O-N 3.17Å
1082	S	57.4	Low	57.3	Low	54.6 Å²	54.6	82.2 Å²	82.2	38%	0.382	47%	0.47	S	S	.	.	H	α-helix	trans	-66.4	-41.7	179.3	68.8	0	0	0	0	111.9	H1078 R1079 A1084 S1085 H1086	H1078-S1082 PolarHBondContact O-N 3.18Å; H1078-S1082 PolarHBondContact O-OG 2.58Å; R1079-S1082 PolarHBondContact O-N 3.09Å; R1079-S1082 PolarHBondContact O-OG 3.28Å; R1079-S1082 VanDerWaalsContact O-OG 3.1Å; S1082-A1084 VanDerWaalsContact C-N 3.33Å; S1082-A1084 PolarHBondContact O-N 3.08Å; S1082-S1085 PolarHBondContact O-N 3.17Å; S1082-S1085 VanDerWaalsContact O-N 3.12Å; S1082-S1085 PolarHBondContact O-OG 3.23Å; S1082-H1086 PolarHBondContact O-CD2 2.91Å; S1082-H1086 VanDerWaalsContact O-CD2 3.29Å; S1082-H1086 PolarHBondContact O-N 3.15Å; S1082-H1086 VanDerWaalsContact O-N 3.11Å
1083	L	56.4	Low	54.6	Low	118.8 Å²	118.8	88.4 Å²	88.4	62%	0.622	51%	0.508	S	S	*	.	H	α-helix	trans	-61.1	-38.8	173	-76.3	151.1	0	0	0	112.6	R1079 S1085 H1086 S1087	R1079-L1083 HydrophobicContact CG-CD1 4.12Å; R1079-L1083 WeakPolarHBondContact O-CB 3.46Å; R1079-L1083 WeakPolarHBondContact O-CD1 3.38Å; R1079-L1083 WeakPolarHBondContact O-CG 3.29Å; R1079-L1083 PolarHBondContact O-N 3.17Å; R1079-L1083 VanDerWaalsContact O-N 3.1Å; L1083-S1085 PolarHBondContact O-N 3.34Å; L1083-H1086 PolarHBondContact O-N 3.22Å; L1083-S1087 WeakPolarHBondContact O-CB 3.27Å; L1083-S1087 PolarHBondContact O-N 3.14Å; L1083-S1087 VanDerWaalsContact O-N 3.11Å; L1083-S1087 PolarHBondContact O-OG 3.17Å; L1083-S1087 VanDerWaalsContact O-OG 3.13Å
1084	A	51.6	Low	52.1	Low	56.6 Å²	56.6	92.8 Å²	92.8	47%	0.468	54%	0.537	S	S	.	.	H	α-helix	trans	-65.7	-39.6	174.4	0	0	0	0	0	112.3	K1080 Q1081 S1082 H1086 S1087 S1088	K1080-A1084 WeakPolarHBondContact O-CB 3.43Å; K1080-A1084 PolarHBondContact O-N 3.21Å; K1080-A1084 VanDerWaalsContact O-N 3.12Å; Q1081-A1084 PolarHBondContact O-N 3.1Å; S1082-A1084 VanDerWaalsContact C-N 3.33Å; S1082-A1084 PolarHBondContact O-N 3.08Å; A1084-H1086 VanDerWaalsContact C-N 3.3Å; A1084-H1086 PolarHBondContact O-N 3.16Å; A1084-S1087 WeakPolarHBondContact CA-OG 3.33Å; A1084-S1087 PolarHBondContact O-N 3.14Å; A1084-S1087 PolarHBondContact O-OG 3.11Å; A1084-S1087 VanDerWaalsContact O-OG 3.08Å; A1084-S1088 PolarHBondContact O-N 2.88Å
1085	S	47.1	Very low	49.7	Very low	65.4 Å²	65.4	93.8 Å²	93.8	46%	0.457	55%	0.552	S	S	.	*	H	α-helix	trans	-63.9	-38.2	178.4	76.3	0	0	0	0	112.5	Q1081 S1082 L1083 S1087 S1088	Q1081-S1085 PolarHBondContact O-N 3.17Å; S1082-S1085 PolarHBondContact O-N 3.17Å; S1082-S1085 VanDerWaalsContact O-N 3.12Å; S1082-S1085 PolarHBondContact O-OG 3.23Å; L1083-S1085 PolarHBondContact O-N 3.34Å; S1085-S1087 VanDerWaalsContact C-N 3.32Å; S1085-S1087 PolarHBondContact O-N 3.13Å; S1085-S1088 PolarHBondContact O-N 3.14Å; S1085-S1088 PolarHBondContact O-OG 3.2Å
1086	H	44	Very low	47.3	Very low	146 Å²	146	104 Å²	104	68%	0.676	59%	0.592	S	S	*	*	H	α-helix	trans	-77.1	-17.8	178.6	-69	-53.5	0	0	0	114.7	S1082 L1083 A1084 S1089	S1082-H1086 PolarHBondContact O-CD2 2.91Å; S1082-H1086 VanDerWaalsContact O-CD2 3.29Å; S1082-H1086 PolarHBondContact O-N 3.15Å; S1082-H1086 VanDerWaalsContact O-N 3.11Å; L1083-H1086 PolarHBondContact O-N 3.22Å; A1084-H1086 VanDerWaalsContact C-N 3.3Å; A1084-H1086 PolarHBondContact O-N 3.16Å; H1086-S1089 PolarHBondContact O-OG 3.16Å
1087	S	40.6	Very low	45	Very low	87 Å²	87	106.1 Å²	106.1	61%	0.608	62%	0.619	S	S	*	*	H	α-helix	trans	-89.3	-6.9	177.1	51	0	0	0	0	113.9	L1083 A1084 S1085 S1089	L1083-S1087 WeakPolarHBondContact O-CB 3.27Å; L1083-S1087 PolarHBondContact O-N 3.14Å; L1083-S1087 VanDerWaalsContact O-N 3.11Å; L1083-S1087 PolarHBondContact O-OG 3.17Å; L1083-S1087 VanDerWaalsContact O-OG 3.13Å; A1084-S1087 WeakPolarHBondContact CA-OG 3.33Å; A1084-S1087 PolarHBondContact O-N 3.14Å; A1084-S1087 PolarHBondContact O-OG 3.11Å; A1084-S1087 VanDerWaalsContact O-OG 3.08Å; S1085-S1087 VanDerWaalsContact C-N 3.32Å; S1085-S1087 PolarHBondContact O-N 3.13Å; S1087-S1089 PolarHBondContact O-N 2.94Å
1088	S	36	Very low	42.8	Very low	99.2 Å²	99.2	111.2 Å²	111.2	69%	0.694	64%	0.644	S	S	*	*	S	Bend	trans	-88.5	-1.7	-179.7	63.4	0	0	0	0	115.2	A1084 S1085 S1090	A1084-S1088 PolarHBondContact O-N 2.88Å; S1085-S1088 PolarHBondContact O-N 3.14Å; S1085-S1088 PolarHBondContact O-OG 3.2Å; S1088-S1090 PolarHBondContact O-N 3.36Å
1089	S	31.6	Very low	40.9	Very low	95.8 Å²	95.8	117.2 Å²	117.2	67%	0.67	66%	0.662	S	S	*	*	S	Bend	trans	-109.9	34.5	-175.5	64.2	0	0	0	0	115	H1086 S1087	H1086-S1089 PolarHBondContact O-OG 3.16Å; S1087-S1089 PolarHBondContact O-N 2.94Å
1090	S	28.9	Very low	38.9	Very low	102.4 Å²	102.4	120.8 Å²	120.8	72%	0.716	69%	0.686	S	S	*	*			trans	-151.4	78.5	-178.4	61.3	0	0	0	0	114.5	S1088	S1088-S1090 PolarHBondContact O-N 3.36Å
1091	L	28.1	Very low	36.9	Very low	174 Å²	174	122.1 Å²	122.1	91%	0.911	70%	0.699	S	S	*	*			trans	-137.3	95.2	176.7	-153.1	81.2	0	0	0	113.1
1092	S	28.8	Very low	35.3	Very low	106.4 Å²	106.4	124.4 Å²	124.4	74%	0.744	71%	0.713	S	S	*	*			trans	-167.5	128	160.9	61.4	0	0	0	0	112.8
1093	T	30.2	Very low	33.8	Very low	130.2 Å²	130.2	129.3 Å²	129.3	80%	0.799	73%	0.734	S	S	*	*			trans	53.9	119.4	151.3	31.5	0	0	0	0	115
1094	P	31.1	Very low	32.5	Very low	122.4 Å²	122.4	132.7 Å²	132.7	80%	0.795	74%	0.744	S	S	*	*			trans	-86.6	150.9	166.6	34.9	-32.6	0	0	0	111.8
1095	P	32.2	Very low	31.3	Very low	112.4 Å²	112.4	138.8 Å²	138.8	73%	0.73	76%	0.763	S	S	*	*			trans	-123.2	141.1	139.7	34.1	-19.8	0	0	0	113.8
1096	Y	28.7	Very low	30.4	Very low	240.6 Å²	240.6	144.4 Å²	144.4	94%	0.944	78%	0.781	S	S	*	*			trans	-15	136.4	159.6	-74.3	-92.7	0	0	0	115.5
1097	G	27.7	Very low	29.6	Very low	68.6 Å²	68.6	143.6 Å²	143.6	71%	0.707	79%	0.787	S	S	*	*			trans	149.4	140	131.3	0	0	0	0	0	117.8
1098	L	28	Very low	29	Very low	170.8 Å²	170.8	148.6 Å²	148.6	89%	0.894	80%	0.798	S	S	*	*			trans	75.2	112	160.6	-119.3	83.4	0	0	0	117.6
1099	R	27.5	Very low	28.6	Very low	218.2 Å²	218.2	151.7 Å²	151.7	82%	0.823	81%	0.805	S	S	*	*			trans	-107.5	122.5	137	-92.7	-178.5	176.7	168.9	-1.1	115.6
1100	D	27.2	Very low	28.5	Very low	136.8 Å²	136.8	150.4 Å²	150.4	73%	0.732	81%	0.807	S	S	*	*			trans	-16.3	150.5	137.6	-74.6	-32.8	0	0	0	114.9
1101	N	28.3	Very low	28.5	Very low	146.2 Å²	146.2	154.4 Å²	154.4	78%	0.782	81%	0.811	S	S	*	*			trans	92.8	86.7	152.7	-68.9	-48.7	0	0	0	117.5
1102	I	29.2	Very low	28.5	Very low	160 Å²	160	153.9 Å²	153.9	82%	0.821	80%	0.804	S	S	*	*			trans	-162.9	101.4	135.3	-66.3	165.7	0	0	0	112.6
1103	L	26.6	Very low	28.3	Very low	156.6 Å²	156.6	153.7 Å²	153.7	82%	0.82	80%	0.803	S	S	*	*			trans	-134.2	113.8	164.7	-151.7	96	0	0	0	114.4
1104	K	27.9	Very low	28.2	Very low	190.4 Å²	190.4	153.8 Å²	153.8	83%	0.828	80%	0.803	S	S	*	*			trans	133	100.6	168.7	-82	175.7	-176.1	173.9	0	116.5
1105	Q	28.4	Very low	28.1	Very low	185 Å²	185	156.5 Å²	156.5	86%	0.864	81%	0.805	S	S	*	*			trans	-161.5	127.1	140.6	-112.3	168.5	27.4	0	0	112.8
1106	Q	27.3	Very low	27.7	Very low	182.4 Å²	182.4	155.7 Å²	155.7	85%	0.852	80%	0.802	S	S	*	*			trans	-146.6	104.2	163.5	-82	178.9	-6.6	0	0	113.7
1107	T	27.2	Very low	27.7	Very low	129.2 Å²	129.2	153 Å²	153	79%	0.793	80%	0.798	S	S	*	*			trans	163.4	130	147.3	47.4	0	0	0	0	114.4
1108	K	28	Very low	27.6	Very low	192 Å²	192	155 Å²	155	84%	0.835	80%	0.801	S	S	*	*			trans	154.5	140.9	138.9	-103.1	175.9	178.4	178.7	0	113
1109	I	28.4	Very low	27.4	Very low	164.6 Å²	164.6	152.1 Å²	152.1	84%	0.844	80%	0.795	S	S	*	*			trans	106.2	133.9	135.9	-70.1	160.3	0	0	0	112.8
1110	G	28.1	Very low	27.5	Very low	68.4 Å²	68.4	150 Å²	150	71%	0.705	80%	0.797	S	S	*	*			trans	135.1	136.1	161.9	0	0	0	0	0	113
1111	K	29	Very low	27.4	Very low	186.2 Å²	186.2	151.1 Å²	151.1	81%	0.81	80%	0.798	S	S	*	*			cis	167.1	144.1	36.3	-100.3	-178.6	176.4	-148.8	0	110.9
1112	E	27.7	Very low	27.3	Very low	163.8 Å²	163.8	151.3 Å²	151.3	77%	0.765	80%	0.798	S	S	*	*				155.1	120.2	111.4	-91.4	158.9	-158.6	0	0	115.9
1113	S	26.2	Very low	27.2	Very low	103.8 Å²	103.8	152.9 Å²	152.9	73%	0.726	80%	0.799	S	S	*	*				63.1	133.6	124.6	52	0	0	0	0	119
1114	V	28	Very low	27	Very low	131 Å²	131	150.1 Å²	150.1	79%	0.794	79%	0.792	S	S	*	*			trans	124.1	129.5	137	170.4	0	0	0	0	115.9
1115	Q	27.8	Very low	27.1	Very low	180.2 Å²	180.2	146.9 Å²	146.9	84%	0.842	79%	0.791	S	S	*	*			trans	-4.6	166.2	142.5	-81.9	167.8	-12.1	0	0	115.7
1116	S	25	Very low	26.9	Very low	95.4 Å²	95.4	143.8 Å²	143.8	67%	0.667	79%	0.785	S	S	*	*			cis	-163.7	161.3	-38.6	49.3	0	0	0	0	113.5
1117	Q	27	Very low	26.8	Very low	184.2 Å²	184.2	142.8 Å²	142.8	86%	0.861	79%	0.785	S	S	*	*			trans	79.3	136.2	153.3	-73.5	179.5	-10.4	0	0	120.3
1118	S	25.7	Very low	26.6	Very low	108.8 Å²	108.8	141.4 Å²	141.4	76%	0.761	78%	0.78	S	S	*	*			trans	141.4	137.1	159.2	60.2	0	0	0	0	116.8
1119	S	25.5	Very low	26.5	Very low	111 Å²	111	140.1 Å²	140.1	78%	0.776	78%	0.781	S	S	*	*			trans	121.6	135.7	149.5	60.5	0	0	0	0	117.4
1120	M	28.3	Very low	26.4	Very low	173.8 Å²	173.8	136.4 Å²	136.4	86%	0.856	78%	0.775	S	S	*	*			trans	-168.4	152.2	133.1	-81.7	-169.8	137	0	0	115.9
1121	Q	26.1	Very low	26.3	Very low	161 Å²	161	138.3 Å²	138.3	75%	0.752	78%	0.777	S	S	*	*			trans	-86	151.4	161.3	-69.3	-179	-26.1	0	0	116.3
1122	L	25.8	Very low	26.1	Very low	149.6 Å²	149.6	135.6 Å²	135.6	78%	0.783	78%	0.777	S	S	*	*				-158.8	131	123.5	-101.4	146.9	0	0	0	111.8
1123	K	26.5	Very low	26	Very low	194 Å²	194	136.3 Å²	136.3	84%	0.843	78%	0.78	S	S	*	*				-174	125.3	107.3	-83.2	177.8	177.1	178	0	113.6
1124	S	23.3	Very low	26.1	Very low	97 Å²	97	136.8 Å²	136.8	68%	0.678	78%	0.783	S	S	*	*			trans	-94.2	158.3	149.9	56.2	0	0	0	0	111.9	T1126	S1124-T1126 WeakPolarHBondContact CB-OG1 3.45Å; S1124-T1126 WeakPolarHBondContact OG-CB 3.34Å; S1124-T1126 PolarHBondContact OG-OG1 2.92Å
1125	P	30.2	Very low	25.9	Very low	122.6 Å²	122.6	135.4 Å²	135.4	80%	0.796	78%	0.78	S	S	*	*				-127.7	157.5	115.8	37.1	-26	0	0	0	114	L1127	P1125-L1127 PolarHBondContact O-N 3.4Å; P1125-L1127 VanDerWaalsContact O-N 3.14Å
1126	T	23.5	Very low	25.9	Very low	120.2 Å²	120.2	134.6 Å²	134.6	74%	0.737	78%	0.78	S	S	*	*			trans	-85.2	124.8	160.3	-34.7	0	0	0	0	114	S1124	S1124-T1126 WeakPolarHBondContact CB-OG1 3.45Å; S1124-T1126 WeakPolarHBondContact OG-CB 3.34Å; S1124-T1126 PolarHBondContact OG-OG1 2.92Å
1127	L	25.7	Very low	25.8	Very low	162.6 Å²	162.6	134.9 Å²	134.9	85%	0.851	78%	0.783	S	S	*	*			trans	152.8	137	150	-79.2	165.7	0	0	0	110.9	P1125 L1129	P1125-L1127 PolarHBondContact O-N 3.4Å; P1125-L1127 VanDerWaalsContact O-N 3.14Å; L1127-L1129 PolarHBondContact O-N 3.32Å
1128	S	23.3	Very low	25.7	Very low	98.4 Å²	98.4	131.3 Å²	131.3	69%	0.688	78%	0.778	S	S	*	*			cis	-163.5	138.5	22.4	56.6	0	0	0	0	111.6
1129	L	24.9	Very low	25.7	Very low	165.2 Å²	165.2	132.4 Å²	132.4	87%	0.865	78%	0.78	S	S	*	*			trans	149.7	138.2	148.5	-113.1	71.7	0	0	0	112.5	L1127	L1127-L1129 PolarHBondContact O-N 3.32Å
1130	A	25.9	Very low	25.7	Very low	86.4 Å²	86.4	133.3 Å²	133.3	71%	0.714	78%	0.781	S	S	*	*				163.6	133.9	120.9	0	0	0	0	0	112.2	T1132	A1130-T1132 PolarHBondContact O-N 3.18Å
1131	S	26.3	Very low	25.6	Very low	108.6 Å²	108.6	131.5 Å²	131.5	76%	0.759	78%	0.78	S	S	*	*				-98.1	136.9	89.1	32.4	0	0	0	0	113.9	E1133	S1131-E1133 PolarHBondContact O-N 3.24Å
1132	T	26.1	Very low	25.5	Very low	130.2 Å²	130.2	129.8 Å²	129.8	80%	0.799	78%	0.78	S	S	*	*			trans	-128.4	141.4	136.4	13.1	0	0	0	0	112.6	A1130 S1134	A1130-T1132 PolarHBondContact O-N 3.18Å; T1132-S1134 PolarHBondContact O-N 2.97Å
1133	E	25.4	Very low	25.5	Very low	178 Å²	178	127.9 Å²	127.9	83%	0.832	78%	0.78	S	S	*	*			trans	-67.1	140.5	165.5	-67.3	168.6	-178.5	0	0	115.4	S1131 S1135	S1131-E1133 PolarHBondContact O-N 3.24Å; E1133-S1135 PolarHBondContact O-N 3Å
1134	S	26.8	Very low	25.4	Very low	113.6 Å²	113.6	125 Å²	125	79%	0.794	78%	0.778	S	S	*	*			trans	-169.7	131.7	135.4	60.9	0	0	0	0	112.9	T1132	T1132-S1134 PolarHBondContact O-N 2.97Å
1135	S	25.3	Very low	25.6	Very low	102.6 Å²	102.6	124.9 Å²	124.9	72%	0.717	78%	0.783	S	S	*	*			trans	-94.2	154.6	172.4	55	0	0	0	0	114.1	E1133	E1133-S1135 PolarHBondContact O-N 3Å
1136	L	26.5	Very low	25.4	Very low	163 Å²	163	125.1 Å²	125.1	85%	0.853	78%	0.782	S	S	*	*			trans	160.8	135.4	148.4	-86.5	153.7	0	0	0	113.1
1137	S	24.2	Very low	25.6	Very low	102.8 Å²	102.8	126.7 Å²	126.7	72%	0.719	79%	0.786	S	S	*	*			trans	-92.2	146.8	177.3	55.7	0	0	0	0	115.1
1138	S	25.2	Very low	25.9	Very low	108 Å²	108	124.2 Å²	124.2	76%	0.755	78%	0.779	S	S	*	*				162	118.7	124.9	60.5	0	0	0	0	114.9
1139	T	25.4	Very low	26	Very low	132.8 Å²	132.8	128.6 Å²	128.6	82%	0.815	79%	0.787	S	S	*	*			trans	-120.4	126	148.8	-44	0	0	0	0	114.8	V1141	T1139-V1141 PolarHBondContact O-N 3.17Å
1140	T	24.1	Very low	26.1	Very low	128.8 Å²	128.8	127.3 Å²	127.3	79%	0.79	78%	0.779	S	S	*	*			trans	-77.3	136.9	162.7	41.6	0	0	0	0	114.7
1141	V	27.3	Very low	26.1	Very low	136.8 Å²	136.8	133 Å²	133	83%	0.829	79%	0.788	S	S	*	*			trans	-132.8	130.7	152.6	-161.9	0	0	0	0	110.4	T1139	T1139-V1141 PolarHBondContact O-N 3.17Å
1142	T	24.3	Very low	26	Very low	123.6 Å²	123.6	133.5 Å²	133.5	76%	0.758	79%	0.787	S	S	*	*			trans	-98.4	147.6	163	35.2	0	0	0	0	113.7
1143	S	24.6	Very low	26	Very low	111.2 Å²	111.2	132.4 Å²	132.4	78%	0.778	78%	0.784	S	S	*	*			trans	100.9	139.8	163.6	70.9	0	0	0	0	114.3
1144	V	25.9	Very low	26.2	Very low	132 Å²	132	132.5 Å²	132.5	80%	0.8	78%	0.784	S	S	*	*			cis	-137.4	136.1	29.4	169.2	0	0	0	0	108.4	T1146	V1144-T1146 HydrophobicContact CG1-CG2 4.25Å
1145	A	25.6	Very low	26.3	Very low	94.8 Å²	94.8	131.9 Å²	131.9	78%	0.783	78%	0.78	S	S	*	*			trans	-122.4	117	172.2	0	0	0	0	0	111.7
1146	T	28	Very low	26.4	Very low	127.6 Å²	127.6	133.8 Å²	133.8	78%	0.783	78%	0.782	S	S	*	*			trans	-145.5	130.8	150.3	40.1	0	0	0	0	113.1	V1144	V1144-T1146 HydrophobicContact CG1-CG2 4.25Å
1147	N	27.2	Very low	26.5	Very low	154.2 Å²	154.2	132.5 Å²	132.5	83%	0.825	78%	0.776	S	S	*	*			trans	-52.4	153.4	154.9	-71.2	-22.3	0	0	0	112.7
1148	P	31.4	Very low	26.6	Very low	109.4 Å²	109.4	135.3 Å²	135.3	71%	0.71	78%	0.778	S	S	*	*				-133.1	151	100.4	33.3	-16.8	0	0	0	113.7	I1150	P1148-I1150 PolarHBondContact O-N 2.95Å
1149	F	25.6	Very low	26.7	Very low	191.8 Å²	191.8	135.9 Å²	135.9	84%	0.841	78%	0.777	S	S	*	*			trans	-115.5	146.8	141.8	-100.2	-89.3	0	0	0	110.2	K1151	F1149-K1151 PolarHBondContact O-N 2.94Å
1150	I	26.9	Very low	26.7	Very low	137.8 Å²	137.8	139.4 Å²	139.4	71%	0.707	78%	0.776	S	S	*	*			trans	82.5	114.4	166.1	-67.6	168.2	0	0	0	112.6	P1148 T1152	P1148-I1150 PolarHBondContact O-N 2.95Å; I1150-T1152 PolarHBondContact O-N 3.13Å
1151	K	26	Very low	26.7	Very low	204.8 Å²	204.8	138.5 Å²	138.5	89%	0.89	78%	0.776	S	S	*	*			trans	-117.7	117	155.2	-86	174.7	179.5	177.9	0	111.8	F1149	F1149-K1151 PolarHBondContact O-N 2.94Å
1152	T	24.6	Very low	26.6	Very low	120.4 Å²	120.4	137.4 Å²	137.4	74%	0.739	77%	0.769	S	S	*	*			trans	-113.3	128.1	154.5	49.8	0	0	0	0	110.9	I1150	I1150-T1152 PolarHBondContact O-N 3.13Å
1153	S	25.6	Very low	26.8	Very low	106 Å²	106	138.2 Å²	138.2	74%	0.741	77%	0.769	S	S	*	*			trans	-110	130.5	157.4	48.2	0	0	0	0	112.5
1154	H	29	Very low	26.8	Very low	180.8 Å²	180.8	139.4 Å²	139.4	84%	0.837	77%	0.767	S	S	*	*			trans	-118.9	146.3	138.9	-78.1	-65.1	0	0	0	111.2
1155	S	28.9	Very low	27	Very low	100.6 Å²	100.6	140.4 Å²	140.4	70%	0.703	77%	0.768	S	S	*	*				-155.7	133.3	129.1	54	0	0	0	0	112.3
1156	N	28.2	Very low	27	Very low	142.4 Å²	142.4	142.9 Å²	142.9	76%	0.761	77%	0.767	S	S	*	*			trans	106.9	130.4	144.6	-82.6	22.2	0	0	0	116.6
1157	D	28	Very low	27	Very low	135.6 Å²	135.6	144.3 Å²	144.3	73%	0.725	77%	0.768	S	S	*	*				96.7	118.2	127.5	-70.1	-25.2	0	0	0	117	T1159	D1157-T1159 PolarHBondContact O-N 3.09Å
1158	Q	27.2	Very low	26.9	Very low	162.2 Å²	162.2	140.8 Å²	140.8	76%	0.758	76%	0.761	S	S	*	*				53	128.6	118.2	-72.1	-174.9	29.2	0	0	113.7	Y1160	Q1158-Y1160 HydrophobicContact CB-CE2 4.4Å
1159	T	26.2	Very low	26.8	Very low	120.2 Å²	120.2	142.7 Å²	142.7	74%	0.737	77%	0.765	S	S	*	*				-167.1	139.8	101.3	28.6	0	0	0	0	113.2	D1157	D1157-T1159 PolarHBondContact O-N 3.09Å
1160	Y	25.4	Very low	26.9	Very low	205.4 Å²	205.4	139.8 Å²	139.8	81%	0.805	76%	0.758	S	S	*	*			trans	-43.9	132.6	170.6	-63	-82.5	0	0	0	115.1	Q1158	Q1158-Y1160 HydrophobicContact CB-CE2 4.4Å
1161	S	25.7	Very low	26.9	Very low	111.8 Å²	111.8	140.1 Å²	140.1	78%	0.782	76%	0.761	S	S	*	*				162.4	136.7	120.2	166.1	0	0	0	0	113.2
1162	T	24.8	Very low	27	Very low	112.6 Å²	112.6	135.4 Å²	135.4	69%	0.691	75%	0.746	S	S	*	*			trans	-120.1	147.1	167.2	-5.8	0	0	0	0	113
1163	D	27.2	Very low	27.2	Very low	141.2 Å²	141.2	137 Å²	137	76%	0.755	75%	0.75	S	S	*	*			trans	126.3	109.2	142.8	-81.7	-27.3	0	0	0	118.1	N1165	D1163-N1165 PolarHBondContact O-N 3.29Å
1164	N	26.3	Very low	27.4	Very low	135.4 Å²	135.4	138.8 Å²	138.8	72%	0.724	75%	0.751	S	S	*	*			trans	20.2	127.2	142.2	-65.4	-50.7	0	0	0	116.7
1165	N	29.1	Very low	27.5	Very low	153.8 Å²	153.8	136.7 Å²	136.7	82%	0.822	74%	0.739	S	S	*	*			trans	179.9	122.5	138.6	-92.3	-37.6	0	0	0	114.2	D1163	D1163-N1165 PolarHBondContact O-N 3.29Å
1166	L	25.4	Very low	27.5	Very low	147.6 Å²	147.6	138.4 Å²	138.4	77%	0.773	74%	0.74	S	S	*	*			trans	-74.9	135.8	144.7	-89.5	121.5	0	0	0	114.7
1167	I	27.9	Very low	27.5	Very low	156.4 Å²	156.4	139.6 Å²	139.6	80%	0.802	74%	0.738	S	S	*	*			trans	122	129.3	136.4	-74.8	160.4	0	0	0	115.6
1168	A	26.3	Very low	27.5	Very low	81 Å²	81	136.9 Å²	136.9	67%	0.669	73%	0.73	S	S	*	*			trans	56.4	131.5	159.8	0	0	0	0	0	118.8
1169	N	27.7	Very low	27.5	Very low	148.4 Å²	148.4	136.1 Å²	136.1	79%	0.794	73%	0.726	S	S	*	*				174.7	131.9	128.3	-90.5	10.2	0	0	0	114.7	N1171	N1169-N1171 PolarHBondContact O-N 3.11Å
1170	D	27.6	Very low	27.6	Very low	131.2 Å²	131.2	135.9 Å²	135.9	70%	0.702	72%	0.721	S	S	*	*			trans	5.5	121.1	153.3	-60.9	-41.5	0	0	0	117.4
1171	N	27.5	Very low	27.8	Very low	144.8 Å²	144.8	133.7 Å²	133.7	77%	0.774	72%	0.718	S	S	*	*			trans	85.5	79.7	148.4	-56.5	-56.3	0	0	0	117.7	N1169	N1169-N1171 PolarHBondContact O-N 3.11Å
1172	D	29.5	Very low	27.9	Very low	105.8 Å²	105.8	131.8 Å²	131.8	57%	0.566	71%	0.709	S	S	*	*			trans	-142.6	25.3	154.1	-129.7	-3.6	0	0	0	116.5	N1174 K1175 I1176	D1172-N1174 PolarHBondContact O-N 3.27Å; D1172-N1174 VanDerWaalsContact O-N 3.15Å; D1172-K1175 PolarHBondContact O-N 3.03Å; D1172-K1175 VanDerWaalsContact OD1-CD 3.25Å; D1172-K1175 WeakPolarHBondContact OD1-CD 3.45Å; D1172-K1175 WeakPolarHBondContact OD1-CE 3.18Å; D1172-K1175 VanDerWaalsContact OD1-CG 3.27Å; D1172-K1175 WeakPolarHBondContact OD1-CG 3.45Å; D1172-K1175 IonicContact OD1-NZ 2.93Å; D1172-K1175 PolarHBondContact OD1-NZ 3.03Å; D1172-K1175 IonicContact OD2-NZ 3.2Å; D1172-K1175 PolarHBondContact OD2-NZ 3.1Å; D1172-I1176 PolarHBondContact O-N 2.77Å; D1172-I1176 VanDerWaalsContact O-N 3.14Å
1173	D	28.6	Very low	28.1	Very low	154 Å²	154	132.3 Å²	132.3	82%	0.824	71%	0.707	S	S	*	*			trans	-72.8	-4.6	175.9	-82.6	-41.8	0	0	0	114.3	K1175	D1173-K1175 PolarHBondContact O-N 3.23Å; D1173-K1175 VanDerWaalsContact O-N 3.1Å
1174	N	29.3	Very low	28.3	Very low	143.2 Å²	143.2	132.4 Å²	132.4	77%	0.766	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	11.6	179.5	-87.3	-26.8	0	0	0	114.3	D1172 S1178	D1172-N1174 PolarHBondContact O-N 3.27Å; D1172-N1174 VanDerWaalsContact O-N 3.15Å; N1174-S1178 PolarHBondContact O-OG 3.43Å
1175	K	30.7	Very low	28.7	Very low	136.6 Å²	136.6	131.6 Å²	131.6	59%	0.594	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	-9.3	-177.7	-96.3	-178.3	-173.1	125.5	0	115.9	D1172 D1173 F1177 S1178 Q1179	D1172-K1175 PolarHBondContact O-N 3.03Å; D1172-K1175 VanDerWaalsContact OD1-CD 3.25Å; D1172-K1175 WeakPolarHBondContact OD1-CD 3.45Å; D1172-K1175 WeakPolarHBondContact OD1-CE 3.18Å; D1172-K1175 VanDerWaalsContact OD1-CG 3.27Å; D1172-K1175 WeakPolarHBondContact OD1-CG 3.45Å; D1172-K1175 IonicContact OD1-NZ 2.93Å; D1172-K1175 PolarHBondContact OD1-NZ 3.03Å; D1172-K1175 IonicContact OD2-NZ 3.2Å; D1172-K1175 PolarHBondContact OD2-NZ 3.1Å; D1173-K1175 PolarHBondContact O-N 3.23Å; D1173-K1175 VanDerWaalsContact O-N 3.1Å; K1175-F1177 VanDerWaalsContact C-N 3.26Å; K1175-F1177 PolarHBondContact O-N 3.4Å; K1175-S1178 PolarHBondContact O-N 3.18Å; K1175-S1178 PolarHBondContact O-OG 2.89Å; K1175-Q1179 PolarHBondContact O-N 3.29Å
1176	I	29.1	Very low	29.1	Very low	137.6 Å²	137.6	130 Å²	130	71%	0.706	70%	0.696	S	S	*	*	S	Bend	trans	-89.8	-17.1	179.3	-65.8	176.7	0	0	0	112.5	D1172 S1178 N1180	D1172-I1176 PolarHBondContact O-N 2.77Å; D1172-I1176 VanDerWaalsContact O-N 3.14Å; I1176-S1178 VanDerWaalsContact C-N 3.34Å; I1176-S1178 PolarHBondContact O-N 3.14Å; I1176-N1180 PolarHBondContact O-N 3Å; I1176-N1180 PolarHBondContact O-ND2 3Å
1177	F	28.3	Very low	30.2	Very low	166.6 Å²	166.6	127.4 Å²	127.4	73%	0.731	68%	0.681	S	S	*	*	S	Bend	trans	-94.2	-19.1	178.1	-109.3	-90.3	0	0	0	115	K1175 Q1179 N1180	K1175-F1177 VanDerWaalsContact C-N 3.26Å; K1175-F1177 PolarHBondContact O-N 3.4Å; F1177-Q1179 VanDerWaalsContact C-N 3.33Å; F1177-Q1179 PolarHBondContact O-N 3.24Å; F1177-Q1179 VanDerWaalsContact O-N 3.12Å; F1177-N1180 PolarHBondContact O-N 2.8Å
1178	S	27.6	Very low	31.7	Very low	78.6 Å²	78.6	122.6 Å²	122.6	55%	0.55	66%	0.657	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	1.2	-175.3	45.5	0	0	0	0	115.3	N1174 K1175 I1176	N1174-S1178 PolarHBondContact O-OG 3.43Å; K1175-S1178 PolarHBondContact O-N 3.18Å; K1175-S1178 PolarHBondContact O-OG 2.89Å; I1176-S1178 VanDerWaalsContact C-N 3.34Å; I1176-S1178 PolarHBondContact O-N 3.14Å
1179	Q	27.1	Very low	33.5	Very low	145.2 Å²	145.2	123.2 Å²	123.2	68%	0.679	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-9.7	178	-82.3	-172	-20.4	0	0	114.6	K1175 F1177 N1183	K1175-Q1179 PolarHBondContact O-N 3.29Å; F1177-Q1179 VanDerWaalsContact C-N 3.33Å; F1177-Q1179 PolarHBondContact O-N 3.24Å; F1177-Q1179 VanDerWaalsContact O-N 3.12Å; Q1179-N1183 WeakPolarHBondContact O-CB 3.41Å; Q1179-N1183 PolarHBondContact O-N 2.76Å; Q1179-N1183 PolarHBondContact O-ND2 2.99Å
1180	N	28.7	Very low	35.5	Very low	117.2 Å²	117.2	124.2 Å²	124.2	63%	0.627	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-20.7	-178.9	-74.4	-23.7	0	0	0	114.2	I1176 F1177 A1182 M1184	I1176-N1180 PolarHBondContact O-N 3Å; I1176-N1180 PolarHBondContact O-ND2 3Å; F1177-N1180 PolarHBondContact O-N 2.8Å; N1180-A1182 VanDerWaalsContact C-N 3.3Å; N1180-A1182 PolarHBondContact O-N 3.41Å; N1180-M1184 WeakPolarHBondContact O-CG 3.5Å
1181	E	28.7	Very low	37.7	Very low	158.6 Å²	158.6	120.3 Å²	120.3	74%	0.741	63%	0.626	S	S	*	*	S	Bend	trans	-82.2	-25	178.2	-67.5	-179.2	147.9	0	0	112.7	N1183 N1185	E1181-N1183 VanDerWaalsContact C-N 3.3Å; E1181-N1183 PolarHBondContact O-N 2.87Å; E1181-N1183 VanDerWaalsContact O-N 3.16Å; E1181-N1185 PolarHBondContact O-ND2 2.76Å
1182	A	29	Very low	40.2	Very low	72.8 Å²	72.8	115.7 Å²	115.7	60%	0.602	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-76	-21.9	179.4	0	0	0	0	0	114.3	N1180 N1185	N1180-A1182 VanDerWaalsContact C-N 3.3Å; N1180-A1182 PolarHBondContact O-N 3.41Å; A1182-N1185 PolarHBondContact O-ND2 3.22Å
1183	N	28.6	Very low	42.7	Very low	122.2 Å²	122.2	113.6 Å²	113.6	65%	0.653	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-93.4	-0.3	-171.9	-80.9	-32.3	0	0	0	115.2	Q1179 E1181 N1185	Q1179-N1183 WeakPolarHBondContact O-CB 3.41Å; Q1179-N1183 PolarHBondContact O-N 2.76Å; Q1179-N1183 PolarHBondContact O-ND2 2.99Å; E1181-N1183 VanDerWaalsContact C-N 3.3Å; E1181-N1183 PolarHBondContact O-N 2.87Å; E1181-N1183 VanDerWaalsContact O-N 3.16Å; N1183-N1185 VanDerWaalsContact C-N 3.33Å; N1183-N1185 PolarHBondContact O-N 3.39Å
1184	M	31.8	Very low	45.4	Very low	144.2 Å²	144.2	107.7 Å²	107.7	71%	0.71	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-82.7	-13.5	174.9	-75.1	-70.9	-132.9	0	0	113.8	N1180 V1186	N1180-M1184 WeakPolarHBondContact O-CG 3.5Å; M1184-V1186 VanDerWaalsContact C-N 3.28Å; M1184-V1186 PolarHBondContact O-N 3.17Å
1185	N	34.3	Very low	48.3	Very low	117 Å²	117	100.9 Å²	100.9	63%	0.626	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	15	-174.5	-75	-22	0	0	0	114.9	E1181 A1182 N1183	E1181-N1185 PolarHBondContact O-ND2 2.76Å; A1182-N1185 PolarHBondContact O-ND2 3.22Å; N1183-N1185 VanDerWaalsContact C-N 3.33Å; N1183-N1185 PolarHBondContact O-N 3.39Å
1186	V	38.1	Very low	51	Low	122 Å²	122	94.5 Å²	94.5	74%	0.739	50%	0.498	S	S	*	.	S	Bend	trans	-118.7	97.5	162.7	-175.6	0	0	0	0	107.7	M1184 D1188	M1184-V1186 VanDerWaalsContact C-N 3.28Å; M1184-V1186 PolarHBondContact O-N 3.17Å; V1186-D1188 PolarHBondContact O-N 2.93Å; V1186-D1188 VanDerWaalsContact O-N 3.12Å
1187	M	48.3	Very low	53.8	Low	91.6 Å²	91.6	89 Å²	89	45%	0.451	47%	0.47	S	S	.	.			trans	-60.5	114.6	172.6	-82.5	-97.6	130.9	0	0	109.7	R1075 P1189 N1191 E1192	R1075-M1187 HydrophobicContact CG-SD 3.96Å; R1075-M1187 PolarHBondContact NE-SD 3.15Å; R1075-M1187 PolarHBondContact NH2-SD 3.25Å; R1075-M1187 VanDerWaalsContact NH2-SD 3.38Å; M1187-P1189 WeakPolarHBondContact O-CD 3.4Å; M1187-N1191 HydrophobicContact CE-CB 4.36Å; M1187-E1192 HydrophobicContact CE-CB 3.84Å; M1187-E1192 HydrophobicContact CE-CG 4.26Å
1188	D	58.7	Low	56.7	Low	55.2 Å²	55.2	81 Å²	81	30%	0.295	44%	0.436	S	S	.	.			trans	-61.6	122.8	167.5	-174.7	-32.1	0	0	0	108.1	V1186 R1190 N1191 E1192	V1186-D1188 PolarHBondContact O-N 2.93Å; V1186-D1188 VanDerWaalsContact O-N 3.12Å; D1188-R1190 PolarHBondContact O-N 2.95Å; D1188-R1190 VanDerWaalsContact O-N 3.09Å; D1188-R1190 VanDerWaalsContact OD1-CB 3.25Å; D1188-R1190 WeakPolarHBondContact OD1-CB 3.3Å; D1188-R1190 VanDerWaalsContact OD1-CG 3.31Å; D1188-R1190 WeakPolarHBondContact OD1-CG 3.22Å; D1188-R1190 IonicContact OD1-CZ 3.42Å; D1188-R1190 PolarHBondContact OD1-N 3.17Å; D1188-R1190 IonicContact OD1-NE 3.09Å; D1188-R1190 PolarHBondContact OD1-NE 3.03Å; D1188-R1190 VanDerWaalsContact OD1-NE 3.09Å; D1188-R1190 IonicContact OD1-NH2 3.38Å; D1188-R1190 IonicContact OD2-CZ 3.68Å; D1188-R1190 VanDerWaalsContact OD2-CZ 3.28Å; D1188-R1190 IonicContact OD2-NE 3.03Å; D1188-R1190 PolarHBondContact OD2-NE 3.08Å; D1188-R1190 VanDerWaalsContact OD2-NE 3.11Å; D1188-R1190 IonicContact OD2-NH2 3.56Å; D1188-R1190 PolarHBondContact OD2-NH2 3.06Å; D1188-N1191 HydrophobicContact CB-CB 4.38Å; D1188-N1191 WeakPolarHBondContact O-CB 3.33Å; D1188-N1191 PolarHBondContact O-N 3.09Å; D1188-E1192 PolarHBondContact O-N 3.25Å
1189	P	64.4	Low	59.8	Low	95.4 Å²	95.4	77.4 Å²	77.4	62%	0.619	41%	0.41	S	S	*	.	H	α-helix	trans	-59.3	-20	-178.7	23.7	-34.5	0	0	0	113.2	M1187 E1192 S1193	M1187-P1189 WeakPolarHBondContact O-CD 3.4Å; P1189-E1192 PolarHBondContact O-N 3.01Å; P1189-S1193 PolarHBondContact O-N 2.96Å; P1189-S1193 VanDerWaalsContact O-N 3.11Å; P1189-S1193 PolarHBondContact O-OG 2.98Å
1190	R	69.3	Low	62.8	Low	168.8 Å²	168.8	70.7 Å²	70.7	64%	0.637	38%	0.379	S	S	*	.	H	α-helix	trans	-67.1	-40.4	170.9	-82	174.5	-72.8	-173.6	-0.6	112.2	D1188 E1192 S1193 I1194	D1188-R1190 PolarHBondContact O-N 2.95Å; D1188-R1190 VanDerWaalsContact O-N 3.09Å; D1188-R1190 VanDerWaalsContact OD1-CB 3.25Å; D1188-R1190 WeakPolarHBondContact OD1-CB 3.3Å; D1188-R1190 VanDerWaalsContact OD1-CG 3.31Å; D1188-R1190 WeakPolarHBondContact OD1-CG 3.22Å; D1188-R1190 IonicContact OD1-CZ 3.42Å; D1188-R1190 PolarHBondContact OD1-N 3.17Å; D1188-R1190 IonicContact OD1-NE 3.09Å; D1188-R1190 PolarHBondContact OD1-NE 3.03Å; D1188-R1190 VanDerWaalsContact OD1-NE 3.09Å; D1188-R1190 IonicContact OD1-NH2 3.38Å; D1188-R1190 IonicContact OD2-CZ 3.68Å; D1188-R1190 VanDerWaalsContact OD2-CZ 3.28Å; D1188-R1190 IonicContact OD2-NE 3.03Å; D1188-R1190 PolarHBondContact OD2-NE 3.08Å; D1188-R1190 VanDerWaalsContact OD2-NE 3.11Å; D1188-R1190 IonicContact OD2-NH2 3.56Å; D1188-R1190 PolarHBondContact OD2-NH2 3.06Å; R1190-E1192 VanDerWaalsContact C-N 3.33Å; R1190-E1192 PolarHBondContact O-N 2.9Å; R1190-S1193 WeakPolarHBondContact CA-OG 3.4Å; R1190-S1193 PolarHBondContact O-N 2.95Å; R1190-S1193 PolarHBondContact O-OG 3.34Å; R1190-S1193 VanDerWaalsContact O-OG 3.11Å; R1190-I1194 HydrophobicContact CG-CD1 4Å; R1190-I1194 WeakPolarHBondContact O-CB 3.38Å; R1190-I1194 WeakPolarHBondContact O-CD1 3.31Å; R1190-I1194 VanDerWaalsContact O-CG1 3.28Å; R1190-I1194 WeakPolarHBondContact O-CG1 3.29Å; R1190-I1194 PolarHBondContact O-N 3.17Å
1191	N	74.5	Confident	65.7	Low	49.4 Å²	49.4	65.4 Å²	65.4	26%	0.264	35%	0.35	S	S	.	.	H	α-helix	trans	-68	-36.1	177.1	-68.5	-13.6	0	0	0	111.3	M1187 D1188 S1193 I1194 F1195	M1187-N1191 HydrophobicContact CE-CB 4.36Å; D1188-N1191 HydrophobicContact CB-CB 4.38Å; D1188-N1191 WeakPolarHBondContact O-CB 3.33Å; D1188-N1191 PolarHBondContact O-N 3.09Å; N1191-S1193 VanDerWaalsContact C-N 3.33Å; N1191-I1194 PolarHBondContact O-N 3.18Å; N1191-F1195 VanDerWaalsContact O-CB 3.32Å; N1191-F1195 WeakPolarHBondContact O-CB 3.3Å; N1191-F1195 PolarHBondContact O-N 3.15Å
1192	E	79.4	Confident	68.7	Low	48.2 Å²	48.2	58.5 Å²	58.5	23%	0.225	32%	0.318	C	S	.	.	H	α-helix	trans	-64.9	-43.1	174	-168.4	170.8	-164.9	0	0	111.5	R1079 M1187 D1188 P1189 R1190 I1194 F1195 T1196 K1263	R1079-E1192 IonicContact CZ-OE1 2.93Å; R1079-E1192 VanDerWaalsContact CZ-OE1 3.25Å; R1079-E1192 IonicContact NE-OE1 2.78Å; R1079-E1192 PolarHBondContact NE-OE1 3.12Å; R1079-E1192 IonicContact NH2-OE1 2.77Å; R1079-E1192 PolarHBondContact NH2-OE1 3.09Å; R1079-E1192 VanDerWaalsContact NH2-OE1 3.14Å; M1187-E1192 HydrophobicContact CE-CB 3.84Å; M1187-E1192 HydrophobicContact CE-CG 4.26Å; D1188-E1192 PolarHBondContact O-N 3.25Å; P1189-E1192 PolarHBondContact O-N 3.01Å; R1190-E1192 VanDerWaalsContact C-N 3.33Å; R1190-E1192 PolarHBondContact O-N 2.9Å; E1192-I1194 VanDerWaalsContact C-N 3.32Å; E1192-I1194 PolarHBondContact O-N 3Å; E1192-F1195 PolarHBondContact O-N 3.06Å; E1192-T1196 WeakPolarHBondContact O-CB 3.36Å; E1192-T1196 PolarHBondContact O-N 3.01Å; E1192-T1196 PolarHBondContact O-OG1 3.07Å; E1192-T1196 VanDerWaalsContact O-OG1 3.09Å; E1192-K1263 WeakPolarHBondContact OE1-CE 3.39Å; E1192-K1263 IonicContact OE1-NZ 2.95Å; E1192-K1263 PolarHBondContact OE1-NZ 3.33Å
1193	S	81.7	Confident	71.7	Confident	60.2 Å²	60.2	55.1 Å²	55.1	42%	0.421	29%	0.29	S	S	.	.	H	α-helix	trans	-65.3	-39.9	176.1	68.6	0	0	0	0	113.1	P1189 R1190 N1191 T1196 T1197	P1189-S1193 PolarHBondContact O-N 2.96Å; P1189-S1193 VanDerWaalsContact O-N 3.11Å; P1189-S1193 PolarHBondContact O-OG 2.98Å; R1190-S1193 WeakPolarHBondContact CA-OG 3.4Å; R1190-S1193 PolarHBondContact O-N 2.95Å; R1190-S1193 PolarHBondContact O-OG 3.34Å; R1190-S1193 VanDerWaalsContact O-OG 3.11Å; N1191-S1193 VanDerWaalsContact C-N 3.33Å; S1193-T1196 PolarHBondContact O-N 3.27Å; S1193-T1197 VanDerWaalsContact O-CB 3.3Å; S1193-T1197 WeakPolarHBondContact O-CB 3.34Å; S1193-T1197 PolarHBondContact O-N 3.18Å; S1193-T1197 PolarHBondContact O-OG1 2.97Å; S1193-T1197 VanDerWaalsContact O-OG1 3.14Å
1194	I	86.2	Confident	74.6	Confident	30.6 Å²	30.6	49.4 Å²	49.4	16%	0.157	26%	0.26	C	S	.	.	H	α-helix	trans	-61.4	-49.3	175	-70.4	164.5	0	0	0	110.6	Y861 R1190 N1191 E1192 T1196 T1197 N1198	Y861-I1194 HydrophobicContact CD2-CG1 4.4Å; R1190-I1194 HydrophobicContact CG-CD1 4Å; R1190-I1194 WeakPolarHBondContact O-CB 3.38Å; R1190-I1194 WeakPolarHBondContact O-CD1 3.31Å; R1190-I1194 VanDerWaalsContact O-CG1 3.28Å; R1190-I1194 WeakPolarHBondContact O-CG1 3.29Å; R1190-I1194 PolarHBondContact O-N 3.17Å; N1191-I1194 PolarHBondContact O-N 3.18Å; E1192-I1194 VanDerWaalsContact C-N 3.32Å; E1192-I1194 PolarHBondContact O-N 3Å; I1194-T1196 PolarHBondContact O-N 2.93Å; I1194-T1197 PolarHBondContact O-N 3.03Å; I1194-N1198 WeakPolarHBondContact O-CB 3.35Å; I1194-N1198 PolarHBondContact O-N 3.28Å; I1194-N1198 PolarHBondContact O-ND2 3.26Å
1195	F	88.9	Confident	77.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.6	-48	178.1	173.7	-106.2	0	0	0	112.5	I857 C858 L1068 I1071 V1072 R1075 N1191 E1192 T1197 N1198 I1199 F1258	I857-F1195 HydrophobicContact CG2-CD2 4.15Å; I857-F1195 HydrophobicContact CG2-CE2 4.36Å; I857-F1195 WeakPolarHBondContact O-CA 3.38Å; C858-F1195 HydrophobicContact CB-CD2 4.37Å; C858-F1195 VanDerWaalsContact SG-CD2 3.51Å; L1068-F1195 HydrophobicContact CD2-CE2 4.01Å; I1071-F1195 HydrophobicContact CB-CZ 4.45Å; I1071-F1195 HydrophobicContact CG2-CE1 4.39Å; I1071-F1195 HydrophobicContact CG2-CE2 3.92Å; I1071-F1195 HydrophobicContact CG2-CZ 3.65Å; V1072-F1195 HydrophobicContact CG2-CE1 4.2Å; V1072-F1195 HydrophobicContact CG2-CZ 4.17Å; R1075-F1195 VanDerWaalsContact NH1-CB 3.29Å; R1075-F1195 VanDerWaalsContact NH1-CD2 3.27Å; R1075-F1195 VanDerWaalsContact NH1-CE2 3.27Å; R1075-F1195 VanDerWaalsContact NH1-CZ 3.26Å; N1191-F1195 VanDerWaalsContact O-CB 3.32Å; N1191-F1195 WeakPolarHBondContact O-CB 3.3Å; N1191-F1195 PolarHBondContact O-N 3.15Å; E1192-F1195 PolarHBondContact O-N 3.06Å; F1195-T1197 VanDerWaalsContact C-N 3.28Å; F1195-T1197 PolarHBondContact O-N 3.19Å; F1195-N1198 PolarHBondContact O-N 3.1Å; F1195-I1199 HydrophobicContact CD1-CD1 4.29Å; F1195-I1199 HydrophobicContact CD2-CD1 4.23Å; F1195-I1199 HydrophobicContact CD2-CG1 4.42Å; F1195-I1199 HydrophobicContact CE1-CD1 3.63Å; F1195-I1199 HydrophobicContact CE1-CG1 4.41Å; F1195-I1199 HydrophobicContact CE2-CD1 3.56Å; F1195-I1199 HydrophobicContact CE2-CG1 4.14Å; F1195-I1199 HydrophobicContact CG-CD1 4.29Å; F1195-I1199 HydrophobicContact CZ-CD1 3.23Å; F1195-I1199 HydrophobicContact CZ-CG1 4.24Å; F1195-I1199 WeakPolarHBondContact O-CG1 3.47Å; F1195-I1199 PolarHBondContact O-N 2.95Å; F1195-F1258 HydrophobicContact CD1-CE1 4.31Å; F1195-F1258 AromaticContact CE1-CE1 3.84Å; F1195-F1258 HydrophobicContact CE1-CE1 3.84Å; F1195-F1258 HydrophobicContact CE1-CZ 4.3Å
1196	T	87.4	Confident	80.2	Confident	3.6 Å²	3.6	39.1 Å²	39.1	2%	0.022	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-41.9	-179.9	-58.7	0	0	0	0	111.2	E1192 S1193 I1194 I1199 L1200 C1259 K1263 I1265	E1192-T1196 WeakPolarHBondContact O-CB 3.36Å; E1192-T1196 PolarHBondContact O-N 3.01Å; E1192-T1196 PolarHBondContact O-OG1 3.07Å; E1192-T1196 VanDerWaalsContact O-OG1 3.09Å; S1193-T1196 PolarHBondContact O-N 3.27Å; I1194-T1196 PolarHBondContact O-N 2.93Å; T1196-I1199 PolarHBondContact O-N 2.83Å; T1196-L1200 VanDerWaalsContact O-CB 3.32Å; T1196-L1200 WeakPolarHBondContact O-CB 3.23Å; T1196-L1200 PolarHBondContact O-N 3.28Å; T1196-L1200 VanDerWaalsContact O-N 3.09Å; T1196-C1259 HydrophobicContact CG2-CB 4.32Å; T1196-K1263 HydrophobicContact CG2-CD 3.54Å; T1196-K1263 PolarHBondContact OG1-NZ 2.96Å; T1196-I1265 HydrophobicContact CG2-CD1 3.47Å; T1196-I1265 VanDerWaalsContact CG2-CD1 3.46Å; T1196-I1265 HydrophobicContact CG2-CG1 3.97Å
1197	T	87.8	Confident	82.8	Confident	20.8 Å²	20.8	33.3 Å²	33.3	13%	0.128	17%	0.17	C	C	.	.	H	α-helix	trans	-63.4	-49.6	175	-61.6	0	0	0	0	111.3	Y861 S1193 I1194 F1195 I1199 L1200 H1201 I1270	Y861-T1197 HydrophobicContact CE2-CG2 3.88Å; S1193-T1197 VanDerWaalsContact O-CB 3.3Å; S1193-T1197 WeakPolarHBondContact O-CB 3.34Å; S1193-T1197 PolarHBondContact O-N 3.18Å; S1193-T1197 PolarHBondContact O-OG1 2.97Å; S1193-T1197 VanDerWaalsContact O-OG1 3.14Å; I1194-T1197 PolarHBondContact O-N 3.03Å; F1195-T1197 VanDerWaalsContact C-N 3.28Å; F1195-T1197 PolarHBondContact O-N 3.19Å; T1197-I1199 PolarHBondContact O-N 3.21Å; T1197-L1200 WeakPolarHBondContact O-CB 3.42Å; T1197-L1200 PolarHBondContact O-N 3.04Å; T1197-H1201 WeakPolarHBondContact CG2-NE2 3.4Å; T1197-H1201 PolarHBondContact O-CD2 3.25Å; T1197-H1201 PolarHBondContact O-N 3.19Å; T1197-H1201 VanDerWaalsContact O-N 3.17Å; T1197-I1270 HydrophobicContact CG2-CD1 4.31Å; T1197-I1270 HydrophobicContact CG2-CG1 4.19Å; T1197-I1270 HydrophobicContact CG2-CG2 4.22Å; T1197-I1270 WeakPolarHBondContact OG1-CD1 3.47Å
1198	N	90.8	Very high	84.9	Confident	0.4 Å²	0.4	29.7 Å²	29.7	0%	0.002	15%	0.152	C	C	.	.	H	α-helix	trans	-58.3	-45.1	178.2	-78.5	-26.8	0	0	0	112.3	I857 E860 G862 S863 I1194 F1195 L1200 H1201 I1202	I857-N1198 HydrophobicContact CG2-CB 4.09Å; I857-N1198 PolarHBondContact O-ND2 3.22Å; E860-N1198 PolarHBondContact O-ND2 3.15Å; G862-N1198 PolarHBondContact N-OD1 3.3Å; G862-N1198 VanDerWaalsContact N-OD1 3.12Å; S863-N1198 PolarHBondContact N-OD1 3Å; I1194-N1198 WeakPolarHBondContact O-CB 3.35Å; I1194-N1198 PolarHBondContact O-N 3.28Å; I1194-N1198 PolarHBondContact O-ND2 3.26Å; F1195-N1198 PolarHBondContact O-N 3.1Å; N1198-L1200 VanDerWaalsContact C-N 3.33Å; N1198-L1200 PolarHBondContact O-N 3.29Å; N1198-H1201 PolarHBondContact O-N 3.08Å; N1198-I1202 WeakPolarHBondContact O-CG1 3.31Å; N1198-I1202 PolarHBondContact O-N 3.13Å; N1198-I1202 VanDerWaalsContact O-N 3.08Å
1199	I	91.5	Very high	86.4	Confident	1.6 Å²	1.6	27.5 Å²	27.5	1%	0.008	14%	0.14	C	C	.	.	H	α-helix	trans	-61.5	-42.9	175	-75.6	-169.5	0	0	0	111.2	I857 L1068 V1072 F1195 T1196 T1197 H1201 I1202 I1203 L1255 C1259	I857-I1199 HydrophobicContact CG2-CG1 4.24Å; L1068-I1199 HydrophobicContact CB-CD1 4.42Å; L1068-I1199 HydrophobicContact CD1-CD1 4.35Å; L1068-I1199 HydrophobicContact CD1-CG1 4.37Å; L1068-I1199 HydrophobicContact CD2-CD1 4.24Å; L1068-I1199 HydrophobicContact CD2-CG1 4.42Å; L1068-I1199 HydrophobicContact CG-CD1 4.49Å; V1072-I1199 HydrophobicContact CG2-CD1 4.45Å; F1195-I1199 HydrophobicContact CD1-CD1 4.29Å; F1195-I1199 HydrophobicContact CD2-CD1 4.23Å; F1195-I1199 HydrophobicContact CD2-CG1 4.42Å; F1195-I1199 HydrophobicContact CE1-CD1 3.63Å; F1195-I1199 HydrophobicContact CE1-CG1 4.41Å; F1195-I1199 HydrophobicContact CE2-CD1 3.56Å; F1195-I1199 HydrophobicContact CE2-CG1 4.14Å; F1195-I1199 HydrophobicContact CG-CD1 4.29Å; F1195-I1199 HydrophobicContact CZ-CD1 3.23Å; F1195-I1199 HydrophobicContact CZ-CG1 4.24Å; F1195-I1199 WeakPolarHBondContact O-CG1 3.47Å; F1195-I1199 PolarHBondContact O-N 2.95Å; T1196-I1199 PolarHBondContact O-N 2.83Å; T1197-I1199 PolarHBondContact O-N 3.21Å; I1199-H1201 VanDerWaalsContact C-N 3.32Å; I1199-H1201 PolarHBondContact O-N 3.11Å; I1199-I1202 CarbonylContact O-C 3.45Å; I1199-I1202 WeakPolarHBondContact O-CA 3.27Å; I1199-I1202 WeakPolarHBondContact O-CB 3.41Å; I1199-I1202 PolarHBondContact O-N 3.15Å; I1199-I1202 VanDerWaalsContact O-N 3.08Å; I1199-I1203 HydrophobicContact CG2-CD1 3.57Å; I1199-I1203 HydrophobicContact CG2-CG1 4.16Å; I1199-I1203 WeakPolarHBondContact O-CG1 3.3Å; I1199-I1203 PolarHBondContact O-N 3.03Å; I1199-L1255 HydrophobicContact CD1-CD2 4.48Å; I1199-L1255 HydrophobicContact CG2-CB 4.29Å; I1199-C1259 VanDerWaalsContact CG2-SG 3.57Å
1200	L	90	Very high	87.6	Confident	4 Å²	4	23 Å²	23	2%	0.021	11%	0.111	C	C	.	.	H	α-helix	trans	-65	-33.5	-179.3	-161	57.1	0	0	0	112.5	T1196 T1197 N1198 I1203 S1204 C1259 I1265 I1270 L1281 L1285	T1196-L1200 VanDerWaalsContact O-CB 3.32Å; T1196-L1200 WeakPolarHBondContact O-CB 3.23Å; T1196-L1200 PolarHBondContact O-N 3.28Å; T1196-L1200 VanDerWaalsContact O-N 3.09Å; T1197-L1200 WeakPolarHBondContact O-CB 3.42Å; T1197-L1200 PolarHBondContact O-N 3.04Å; N1198-L1200 VanDerWaalsContact C-N 3.33Å; N1198-L1200 PolarHBondContact O-N 3.29Å; L1200-I1203 HydrophobicContact CD1-CB 4.38Å; L1200-I1203 HydrophobicContact CD1-CD1 4.43Å; L1200-S1204 VanDerWaalsContact O-CB 3.25Å; L1200-S1204 WeakPolarHBondContact O-CB 3.39Å; L1200-S1204 PolarHBondContact O-N 3.11Å; L1200-C1259 HydrophobicContact CD1-CB 3.44Å; L1200-C1259 VanDerWaalsContact CD1-CB 3.44Å; L1200-I1265 HydrophobicContact CD1-CD1 4.33Å; L1200-I1265 HydrophobicContact CD2-CD1 3.72Å; L1200-I1265 HydrophobicContact CD2-CG2 3.99Å; L1200-I1270 HydrophobicContact CB-CD1 3.96Å; L1200-I1270 HydrophobicContact CD2-CD1 3.63Å; L1200-I1270 HydrophobicContact CD2-CG2 4.39Å; L1200-I1270 HydrophobicContact CG-CD1 3.8Å; L1200-L1281 HydrophobicContact CB-CD1 4.31Å; L1200-L1281 HydrophobicContact CD1-CD1 4.23Å; L1200-L1281 HydrophobicContact CD1-CD2 4.43Å; L1200-L1281 HydrophobicContact CD2-CD1 3.93Å; L1200-L1281 HydrophobicContact CD2-CD2 3.9Å; L1200-L1281 VanDerWaalsContact CD2-CD2 3.43Å; L1200-L1281 HydrophobicContact CD2-CG 4.32Å; L1200-L1281 HydrophobicContact CG-CD1 4.16Å; L1200-L1281 HydrophobicContact CG-CD2 4.06Å; L1200-L1281 HydrophobicContact CG-CG 4.35Å; L1200-L1285 HydrophobicContact CD1-CD1 4.4Å; L1200-L1285 HydrophobicContact CD1-CD2 4.45Å
1201	H	90.4	Very high	88.7	Confident	6.2 Å²	6.2	15.3 Å²	15.3	3%	0.029	8%	0.083	C	C	.	.	H	α-helix	trans	-66.2	-41.6	167.8	-76	-85.3	0	0	0	112.5	W864 T1197 N1198 I1199 I1203 S1204 Y1205 I1270 E1273 R1274	W864-H1201 HydrophobicContact CB-CB 3.96Å; W864-H1201 VanDerWaalsContact CD1-CB 3.47Å; W864-H1201 AromaticContact CD1-CD2 3.61Å; W864-H1201 AromaticContact CD1-CG 3.58Å; W864-H1201 VanDerWaalsContact CD1-CG 3.45Å; W864-H1201 AromaticContact CD1-ND1 3.93Å; W864-H1201 HydrophobicContact CD2-CB 3.56Å; W864-H1201 VanDerWaalsContact CD2-CB 3.48Å; W864-H1201 AromaticContact CD2-CG 3.95Å; W864-H1201 AromaticContact CD2-ND1 4Å; W864-H1201 AromaticContact CE2-CD2 3.65Å; W864-H1201 AromaticContact CE2-CE1 3.89Å; W864-H1201 AromaticContact CE2-CG 3.55Å; W864-H1201 AromaticContact CE2-ND1 3.52Å; W864-H1201 VanDerWaalsContact CE2-ND1 3.32Å; W864-H1201 HydrophobicContact CE3-CB 4.24Å; W864-H1201 HydrophobicContact CG-CB 3.42Å; W864-H1201 AromaticContact CG-CG 3.85Å; W864-H1201 HydrophobicContact CH2-CB 4.29Å; W864-H1201 HydrophobicContact CZ2-CB 3.68Å; W864-H1201 AromaticContact CZ2-CG 3.53Å; W864-H1201 AromaticContact CZ2-ND1 3.55Å; W864-H1201 AromaticContact NE1-CD2 3.38Å; W864-H1201 PolarHBondContact NE1-CD2 2.78Å; W864-H1201 AromaticContact NE1-CE1 3.52Å; W864-H1201 AromaticContact NE1-CG 3.3Å; W864-H1201 VanDerWaalsContact NE1-CG 3.3Å; W864-H1201 AromaticContact NE1-ND1 3.27Å; W864-H1201 PolarHBondContact NE1-ND1 3.01Å; W864-H1201 AromaticContact NE1-NE2 3.72Å; T1197-H1201 WeakPolarHBondContact CG2-NE2 3.4Å; T1197-H1201 PolarHBondContact O-CD2 3.25Å; T1197-H1201 PolarHBondContact O-N 3.19Å; T1197-H1201 VanDerWaalsContact O-N 3.17Å; N1198-H1201 PolarHBondContact O-N 3.08Å; I1199-H1201 VanDerWaalsContact C-N 3.32Å; I1199-H1201 PolarHBondContact O-N 3.11Å; H1201-I1203 VanDerWaalsContact C-N 3.32Å; H1201-I1203 PolarHBondContact O-N 3.39Å; H1201-S1204 CarbonylContact O-C 3.5Å; H1201-S1204 WeakPolarHBondContact O-CB 3.25Å; H1201-S1204 PolarHBondContact O-N 3.08Å; H1201-Y1205 VanDerWaalsContact O-CB 3.29Å; H1201-Y1205 WeakPolarHBondContact O-CB 3.28Å; H1201-Y1205 WeakPolarHBondContact O-CD2 3.37Å; H1201-Y1205 PolarHBondContact O-N 3.18Å; H1201-I1270 VanDerWaalsContact CE1-CG2 3.44Å; H1201-I1270 WeakPolarHBondContact CE1-CG2 3.2Å; H1201-I1270 WeakPolarHBondContact NE2-CG2 3.49Å; H1201-E1273 IonicContact CE1-OE2 3.57Å; H1201-E1273 PolarHBondContact CE1-OE2 3.12Å; H1201-E1273 VanDerWaalsContact CE1-OE2 3.31Å; H1201-E1273 IonicContact NE2-OE2 3.22Å; H1201-E1273 PolarHBondContact NE2-OE2 3.27Å; H1201-R1274 PolarHBondContact ND1-NE 3.29Å; H1201-R1274 PolarHBondContact ND1-NH2 3.4Å; H1201-R1274 VanDerWaalsContact ND1-NH2 3.19Å; H1201-R1274 PolarHBondContact O-NH2 3.3Å
1202	I	91.7	Very high	89.4	Confident	13.8 Å²	13.8	13.6 Å²	13.6	7%	0.071	8%	0.077	C	C	.	.	H	α-helix	trans	-62.6	-45.5	177	-66.7	168.9	0	0	0	110.7	I857 W864 L867 N1198 I1199 S1204 Y1205 L1206	I857-I1202 HydrophobicContact CD1-CD1 3.6Å; I857-I1202 HydrophobicContact CG1-CD1 3.92Å; I857-I1202 HydrophobicContact CG2-CD1 4.34Å; W864-I1202 HydrophobicContact CB-CD1 4.37Å; W864-I1202 HydrophobicContact CB-CG1 3.82Å; L867-I1202 HydrophobicContact CD2-CD1 3.9Å; L867-I1202 HydrophobicContact CD2-CG1 3.95Å; L867-I1202 HydrophobicContact CD2-CG2 4.01Å; N1198-I1202 WeakPolarHBondContact O-CG1 3.31Å; N1198-I1202 PolarHBondContact O-N 3.13Å; N1198-I1202 VanDerWaalsContact O-N 3.08Å; I1199-I1202 CarbonylContact O-C 3.45Å; I1199-I1202 WeakPolarHBondContact O-CA 3.27Å; I1199-I1202 WeakPolarHBondContact O-CB 3.41Å; I1199-I1202 PolarHBondContact O-N 3.15Å; I1199-I1202 VanDerWaalsContact O-N 3.08Å; I1202-S1204 VanDerWaalsContact C-N 3.35Å; I1202-S1204 PolarHBondContact O-N 3.07Å; I1202-Y1205 PolarHBondContact O-N 3.19Å; I1202-Y1205 VanDerWaalsContact O-N 3.16Å; I1202-L1206 HydrophobicContact CG2-CD1 3.7Å; I1202-L1206 HydrophobicContact CG2-CG 4.39Å; I1202-L1206 WeakPolarHBondContact O-CB 3.38Å; I1202-L1206 WeakPolarHBondContact O-CG 3.27Å; I1202-L1206 PolarHBondContact O-N 3.25Å
1203	I	91.8	Very high	89.7	Confident	1.2 Å²	1.2	11.4 Å²	11.4	1%	0.006	7%	0.067	C	C	.	.	H	α-helix	trans	-59.5	-48.2	174.6	-64.8	164.5	0	0	0	110.3	I1199 L1200 H1201 Y1205 L1206 S1207 L1252 L1255 A1256 L1285 L1288	I1199-I1203 HydrophobicContact CG2-CD1 3.57Å; I1199-I1203 HydrophobicContact CG2-CG1 4.16Å; I1199-I1203 WeakPolarHBondContact O-CG1 3.3Å; I1199-I1203 PolarHBondContact O-N 3.03Å; L1200-I1203 HydrophobicContact CD1-CB 4.38Å; L1200-I1203 HydrophobicContact CD1-CD1 4.43Å; H1201-I1203 VanDerWaalsContact C-N 3.32Å; H1201-I1203 PolarHBondContact O-N 3.39Å; I1203-Y1205 VanDerWaalsContact C-N 3.28Å; I1203-Y1205 PolarHBondContact O-N 3.01Å; I1203-L1206 PolarHBondContact O-N 3.24Å; I1203-S1207 WeakPolarHBondContact CG2-OG 3.44Å; I1203-S1207 VanDerWaalsContact O-CB 3.27Å; I1203-S1207 WeakPolarHBondContact O-CB 3.38Å; I1203-S1207 PolarHBondContact O-N 3.19Å; I1203-S1207 PolarHBondContact O-OG 3.1Å; I1203-L1252 HydrophobicContact CB-CD1 4.33Å; I1203-L1252 HydrophobicContact CG1-CD1 3.82Å; I1203-L1252 HydrophobicContact CG1-CD2 4.25Å; I1203-L1252 HydrophobicContact CG1-CG 4.32Å; I1203-L1252 HydrophobicContact CG2-CG 4.31Å; I1203-L1255 HydrophobicContact CD1-CB 3.98Å; I1203-L1255 HydrophobicContact CG1-CB 4.45Å; I1203-A1256 HydrophobicContact CD1-CB 4.16Å; I1203-A1256 HydrophobicContact CG2-CB 4.36Å; I1203-L1285 HydrophobicContact CG2-CD2 4Å; I1203-L1288 HydrophobicContact CG2-CD2 4.27Å
1204	S	90.2	Very high	90	Very high	3 Å²	3	8.6 Å²	8.6	2%	0.021	5%	0.047	C	C	.	.	H	α-helix	trans	-60.3	-35	177.4	179.2	0	0	0	0	112.6	L1200 H1201 I1202 R1274 Q1284	L1200-S1204 VanDerWaalsContact O-CB 3.25Å; L1200-S1204 WeakPolarHBondContact O-CB 3.39Å; L1200-S1204 PolarHBondContact O-N 3.11Å; H1201-S1204 CarbonylContact O-C 3.5Å; H1201-S1204 WeakPolarHBondContact O-CB 3.25Å; H1201-S1204 PolarHBondContact O-N 3.08Å; I1202-S1204 VanDerWaalsContact C-N 3.35Å; I1202-S1204 PolarHBondContact O-N 3.07Å; S1204-R1274 PolarHBondContact O-NH1 3.06Å; S1204-R1274 PolarHBondContact OG-NH1 3.26Å; S1204-Q1284 PolarHBondContact O-NE2 3.19Å; S1204-Q1284 PolarHBondContact O-OE1 2.77Å; S1204-Q1284 PolarHBondContact OG-OE1 3.17Å
1205	Y	91.1	Very high	89.8	Confident	38.4 Å²	38.4	7.3 Å²	7.3	15%	0.151	4%	0.042	C	C	.	.	H	α-helix	trans	-75.1	-39.9	177.1	-152	-79.9	0	0	0	112.7	W864 V868 H1201 I1202 I1203 S1207 R1274 I1772 H1775	W864-Y1205 HydrophobicContact CE3-CD2 4.34Å; W864-Y1205 AromaticContact CZ3-CD2 3.82Å; W864-Y1205 HydrophobicContact CZ3-CD2 3.99Å; W864-Y1205 HydrophobicContact CZ3-CE2 4.12Å; V868-Y1205 HydrophobicContact CB-CE2 4.45Å; V868-Y1205 HydrophobicContact CG1-CD2 4.32Å; V868-Y1205 HydrophobicContact CG1-CE1 4.37Å; V868-Y1205 HydrophobicContact CG1-CE2 3.92Å; V868-Y1205 VanDerWaalsContact CG1-OH 3.31Å; V868-Y1205 WeakPolarHBondContact CG1-OH 3.37Å; V868-Y1205 HydrophobicContact CG2-CD1 3.96Å; V868-Y1205 HydrophobicContact CG2-CD2 3.79Å; V868-Y1205 HydrophobicContact CG2-CE1 3.83Å; V868-Y1205 HydrophobicContact CG2-CE2 3.64Å; V868-Y1205 VanDerWaalsContact CG2-CE2 3.48Å; V868-Y1205 HydrophobicContact CG2-CG 3.95Å; V868-Y1205 VanDerWaalsContact CG2-CZ 3.43Å; H1201-Y1205 VanDerWaalsContact O-CB 3.29Å; H1201-Y1205 WeakPolarHBondContact O-CB 3.28Å; H1201-Y1205 WeakPolarHBondContact O-CD2 3.37Å; H1201-Y1205 PolarHBondContact O-N 3.18Å; I1202-Y1205 PolarHBondContact O-N 3.19Å; I1202-Y1205 VanDerWaalsContact O-N 3.16Å; I1203-Y1205 VanDerWaalsContact C-N 3.28Å; I1203-Y1205 PolarHBondContact O-N 3.01Å; Y1205-S1207 PolarHBondContact O-N 3.03Å; Y1205-R1274 VanDerWaalsContact CD2-CZ 3.44Å; Y1205-I1772 HydrophobicContact CD1-CG1 4.43Å; Y1205-I1772 HydrophobicContact CD1-CG2 3.88Å; Y1205-I1772 HydrophobicContact CE1-CG2 3.42Å; Y1205-I1772 VanDerWaalsContact CE1-CG2 3.46Å; Y1205-I1772 HydrophobicContact CE2-CG2 4.23Å; Y1205-I1772 HydrophobicContact CG-CG2 4.45Å; Y1205-H1775 AromaticContact CE2-ND1 3.9Å; Y1205-H1775 AromaticContact CZ-ND1 3.85Å; Y1205-H1775 PolarHBondContact OH-ND1 3.32Å; Y1205-H1775 VanDerWaalsContact OH-ND1 3.08Å
1206	L	92.1	Very high	89.7	Confident	6.6 Å²	6.6	7.9 Å²	7.9	4%	0.035	5%	0.047	C	C	.	.	H	α-helix	trans	-89.7	-26.3	-172.5	-65.7	176.7	0	0	0	114.3	L871 W1053 L1061 I1202 I1203 D1208 M1209 I1210 L1252	L871-L1206 HydrophobicContact CD1-CD2 4.31Å; W1053-L1206 HydrophobicContact CH2-CD2 4.31Å; L1061-L1206 HydrophobicContact CD1-CD1 3.76Å; L1061-L1206 HydrophobicContact CD1-CD2 4.49Å; I1202-L1206 HydrophobicContact CG2-CD1 3.7Å; I1202-L1206 HydrophobicContact CG2-CG 4.39Å; I1202-L1206 WeakPolarHBondContact O-CB 3.38Å; I1202-L1206 WeakPolarHBondContact O-CG 3.27Å; I1202-L1206 PolarHBondContact O-N 3.25Å; I1203-L1206 PolarHBondContact O-N 3.24Å; L1206-D1208 VanDerWaalsContact C-N 3.31Å; L1206-D1208 PolarHBondContact O-N 3.31Å; L1206-M1209 WeakPolarHBondContact O-CB 3.4Å; L1206-M1209 PolarHBondContact O-N 3.17Å; L1206-I1210 HydrophobicContact CB-CD1 4.08Å; L1206-I1210 HydrophobicContact CB-CG1 4.32Å; L1206-I1210 WeakPolarHBondContact O-CG1 3.4Å; L1206-I1210 PolarHBondContact O-N 3.31Å; L1206-L1252 HydrophobicContact CB-CD1 3.96Å; L1206-L1252 HydrophobicContact CB-CD2 4.07Å; L1206-L1252 HydrophobicContact CD1-CD1 4.32Å; L1206-L1252 HydrophobicContact CD1-CD2 4.36Å
1207	S	92.7	Very high	89.9	Confident	0.2 Å²	0.2	8.2 Å²	8.2	0%	0.001	5%	0.049	C	C	.	.	H	α-helix	trans	-53.1	-55.8	-170.5	-55.2	0	0	0	0	113.4	I1203 Y1205 M1209 I1210 I1211 Q1284	I1203-S1207 WeakPolarHBondContact CG2-OG 3.44Å; I1203-S1207 VanDerWaalsContact O-CB 3.27Å; I1203-S1207 WeakPolarHBondContact O-CB 3.38Å; I1203-S1207 PolarHBondContact O-N 3.19Å; I1203-S1207 PolarHBondContact O-OG 3.1Å; Y1205-S1207 PolarHBondContact O-N 3.03Å; S1207-M1209 VanDerWaalsContact C-N 3.27Å; S1207-M1209 PolarHBondContact O-N 3.35Å; S1207-I1210 PolarHBondContact O-N 3.05Å; S1207-I1210 VanDerWaalsContact O-N 3.15Å; S1207-I1211 VanDerWaalsContact O-CB 3.22Å; S1207-I1211 WeakPolarHBondContact O-CB 3.29Å; S1207-I1211 WeakPolarHBondContact O-CD1 3.43Å; S1207-I1211 VanDerWaalsContact O-CG1 3.23Å; S1207-I1211 WeakPolarHBondContact O-CG1 3.28Å; S1207-I1211 PolarHBondContact O-N 3.36Å; S1207-Q1284 PolarHBondContact OG-NE2 2.68Å
1208	D	91.2	Very high	90	Very high	16.6 Å²	16.6	11.1 Å²	11.1	9%	0.089	6%	0.063	C	C	.	.	H	α-helix	trans	-69.2	-24.8	-177.1	-70.8	-65.5	0	0	0	112.9	L1206 G1212 Q1284 R1287 G1765 L1768 S1769	L1206-D1208 VanDerWaalsContact C-N 3.31Å; L1206-D1208 PolarHBondContact O-N 3.31Å; D1208-G1212 PolarHBondContact O-N 3.17Å; D1208-G1212 VanDerWaalsContact O-N 3.1Å; D1208-Q1284 WeakPolarHBondContact OD2-CG 3.32Å; D1208-Q1284 PolarHBondContact OD2-NE2 3.09Å; D1208-R1287 IonicContact OD1-CZ 3.66Å; D1208-R1287 IonicContact OD1-NE 3.41Å; D1208-R1287 PolarHBondContact OD1-NE 3.28Å; D1208-R1287 IonicContact OD1-NH1 3.28Å; D1208-R1287 PolarHBondContact OD1-NH1 2.88Å; D1208-R1287 IonicContact OD1-NH2 3.44Å; D1208-R1287 PolarHBondContact OD1-NH2 3.16Å; D1208-R1287 IonicContact OD2-CZ 3.24Å; D1208-R1287 IonicContact OD2-NE 3.11Å; D1208-R1287 IonicContact OD2-NH1 2.7Å; D1208-R1287 PolarHBondContact OD2-NH1 3.41Å; D1208-R1287 IonicContact OD2-NH2 3.21Å; D1208-R1287 PolarHBondContact OD2-NH2 3.44Å; D1208-R1287 VanDerWaalsContact OD2-NH2 3.12Å; D1208-G1765 WeakPolarHBondContact CB-O 3.39Å; D1208-G1765 VanDerWaalsContact OD1-CA 3.29Å; D1208-G1765 WeakPolarHBondContact OD1-CA 3.35Å; D1208-L1768 WeakPolarHBondContact OD2-CD2 3.48Å; D1208-S1769 WeakPolarHBondContact O-CB 3.25Å; D1208-S1769 PolarHBondContact O-OG 3.05Å; D1208-S1769 VanDerWaalsContact O-OG 3.04Å
1209	M	90.2	Very high	89.8	Confident	8.2 Å²	8.2	12.3 Å²	12.3	4%	0.04	7%	0.071	C	C	.	.	H	α-helix	trans	-73.2	-42.7	172.2	-68.1	-169.4	71.2	0	0	112	F1051 W1053 L1206 S1207 G1212 A1213 L1237 S1769 I1772 R1773 L1776	F1051-M1209 HydrophobicContact CB-CE 4.44Å; F1051-M1209 HydrophobicContact CD1-CE 3.83Å; F1051-M1209 VanDerWaalsContact CD1-CE 3.41Å; F1051-M1209 HydrophobicContact CE1-CE 3.77Å; F1051-M1209 HydrophobicContact CG-CE 3.95Å; W1053-M1209 HydrophobicContact CZ2-CB 4.03Å; W1053-M1209 HydrophobicContact CZ2-CE 3.78Å; W1053-M1209 HydrophobicContact CZ2-SD 4.3Å; L1206-M1209 WeakPolarHBondContact O-CB 3.4Å; L1206-M1209 PolarHBondContact O-N 3.17Å; S1207-M1209 VanDerWaalsContact C-N 3.27Å; S1207-M1209 PolarHBondContact O-N 3.35Å; M1209-G1212 PolarHBondContact O-N 3.06Å; M1209-A1213 WeakPolarHBondContact O-CB 3.41Å; M1209-A1213 PolarHBondContact O-N 3.33Å; M1209-L1237 HydrophobicContact CB-CD2 4.33Å; M1209-L1237 HydrophobicContact CE-CD2 4.14Å; M1209-S1769 WeakPolarHBondContact CA-OG 3.47Å; M1209-I1772 HydrophobicContact CG-CB 4.45Å; M1209-I1772 HydrophobicContact CG-CG2 4.06Å; M1209-I1772 HydrophobicContact SD-CB 4.38Å; M1209-I1772 HydrophobicContact SD-CG2 3.7Å; M1209-I1772 WeakPolarHBondContact SD-CG2 3.36Å; M1209-R1773 HydrophobicContact CE-CG 3.67Å; M1209-R1773 HydrophobicContact SD-CG 4.17Å; M1209-L1776 HydrophobicContact SD-CD1 4.01Å
1210	I	91.6	Very high	89.7	Confident	0.4 Å²	0.4	12.3 Å²	12.3	0%	0.002	7%	0.071	C	C	.	.	H	α-helix	trans	-71.3	-40.3	178.5	-72	-162.5	0	0	0	111.2	L1206 S1207 G1212 A1213 C1214 M1240 G1245 Y1248 L1249 L1252	L1206-I1210 HydrophobicContact CB-CD1 4.08Å; L1206-I1210 HydrophobicContact CB-CG1 4.32Å; L1206-I1210 WeakPolarHBondContact O-CG1 3.4Å; L1206-I1210 PolarHBondContact O-N 3.31Å; S1207-I1210 PolarHBondContact O-N 3.05Å; S1207-I1210 VanDerWaalsContact O-N 3.15Å; I1210-G1212 VanDerWaalsContact C-N 3.27Å; I1210-G1212 PolarHBondContact O-N 3.12Å; I1210-A1213 CarbonylContact O-C 3.55Å; I1210-A1213 WeakPolarHBondContact O-CA 3.22Å; I1210-A1213 WeakPolarHBondContact O-CB 3.41Å; I1210-A1213 PolarHBondContact O-N 3.14Å; I1210-A1213 VanDerWaalsContact O-N 3.09Å; I1210-C1214 PolarHBondContact O-N 3.08Å; I1210-C1214 PolarHBondContact O-SG 3.25Å; I1210-M1240 HydrophobicContact CD1-CE 3.67Å; I1210-M1240 VanDerWaalsContact CD1-CE 3.46Å; I1210-M1240 HydrophobicContact CD1-SD 4.34Å; I1210-M1240 HydrophobicContact CG1-CE 4.11Å; I1210-G1245 WeakPolarHBondContact CG2-O 3.3Å; I1210-Y1248 HydrophobicContact CD1-CD2 4.18Å; I1210-Y1248 HydrophobicContact CD1-CG 4.42Å; I1210-L1249 HydrophobicContact CG2-CB 4Å; I1210-L1249 HydrophobicContact CG2-CD1 4.47Å; I1210-L1252 HydrophobicContact CB-CD1 4.14Å; I1210-L1252 HydrophobicContact CD1-CD1 3.48Å; I1210-L1252 VanDerWaalsContact CD1-CD1 3.47Å; I1210-L1252 HydrophobicContact CD1-CG 4.18Å; I1210-L1252 HydrophobicContact CG1-CD1 3.63Å; I1210-L1252 HydrophobicContact CG2-CD1 4.48Å
1211	I	92.1	Very high	89.7	Confident	8.6 Å²	8.6	12.7 Å²	12.7	4%	0.044	7%	0.073	C	C	.	.	H	α-helix	trans	-60.8	-38.9	173.1	-66.5	163.4	0	0	0	110.6	S1207 A1213 C1214 G1216 L1217 L1249 R1287 L1288 T1291	S1207-I1211 VanDerWaalsContact O-CB 3.22Å; S1207-I1211 WeakPolarHBondContact O-CB 3.29Å; S1207-I1211 WeakPolarHBondContact O-CD1 3.43Å; S1207-I1211 VanDerWaalsContact O-CG1 3.23Å; S1207-I1211 WeakPolarHBondContact O-CG1 3.28Å; S1207-I1211 PolarHBondContact O-N 3.36Å; I1211-A1213 VanDerWaalsContact C-N 3.31Å; I1211-A1213 PolarHBondContact O-N 3.42Å; I1211-C1214 WeakPolarHBondContact O-CB 3.46Å; I1211-C1214 PolarHBondContact O-N 3.05Å; I1211-G1216 VanDerWaalsContact O-CA 3.24Å; I1211-G1216 WeakPolarHBondContact O-CA 3.23Å; I1211-G1216 PolarHBondContact O-N 3.03Å; I1211-G1216 VanDerWaalsContact O-N 3.11Å; I1211-L1217 HydrophobicContact CG2-CB 4.33Å; I1211-L1249 HydrophobicContact CG1-CD1 4.18Å; I1211-R1287 HydrophobicContact CD1-CB 3.86Å; I1211-L1288 HydrophobicContact CD1-CB 4.32Å; I1211-L1288 HydrophobicContact CD1-CD1 4.35Å; I1211-L1288 HydrophobicContact CG1-CD1 4.43Å; I1211-T1291 HydrophobicContact CG1-CG2 4.42Å; I1211-T1291 HydrophobicContact CG2-CG2 4.31Å; I1211-T1291 WeakPolarHBondContact CG2-OG1 3.23Å
1212	G	88.5	Confident	89.5	Confident	14 Å²	14	14.4 Å²	14.4	14%	0.144	9%	0.088	C	C	.	.	H	α-helix	trans	-60.1	-47.6	170	0	0	0	0	0	112.3	D1208 M1209 I1210 C1214 G1215 G1216	D1208-G1212 PolarHBondContact O-N 3.17Å; D1208-G1212 VanDerWaalsContact O-N 3.1Å; M1209-G1212 PolarHBondContact O-N 3.06Å; I1210-G1212 VanDerWaalsContact C-N 3.27Å; I1210-G1212 PolarHBondContact O-N 3.12Å; G1212-C1214 VanDerWaalsContact C-N 3.28Å; G1212-C1214 PolarHBondContact O-N 3.15Å; G1212-C1214 VanDerWaalsContact O-N 3.1Å; G1212-G1215 WeakPolarHBondContact O-CA 3.35Å; G1212-G1215 PolarHBondContact O-N 3.13Å; G1212-G1215 VanDerWaalsContact O-N 3.14Å; G1212-G1216 PolarHBondContact O-N 3.34Å
1213	A	86	Confident	89.2	Confident	1.4 Å²	1.4	13.8 Å²	13.8	1%	0.012	9%	0.085	C	C	.	.	H	α-helix	trans	-65.9	-24.4	178.7	0	0	0	0	0	114.1	M1209 I1210 I1211 G1215 S1236 L1237 M1240 L1242	M1209-A1213 WeakPolarHBondContact O-CB 3.41Å; M1209-A1213 PolarHBondContact O-N 3.33Å; I1210-A1213 CarbonylContact O-C 3.55Å; I1210-A1213 WeakPolarHBondContact O-CA 3.22Å; I1210-A1213 WeakPolarHBondContact O-CB 3.41Å; I1210-A1213 PolarHBondContact O-N 3.14Å; I1210-A1213 VanDerWaalsContact O-N 3.09Å; I1211-A1213 VanDerWaalsContact C-N 3.31Å; I1211-A1213 PolarHBondContact O-N 3.42Å; A1213-G1215 PolarHBondContact O-N 3.09Å; A1213-G1215 VanDerWaalsContact O-N 3.14Å; A1213-S1236 WeakPolarHBondContact O-CB 3.28Å; A1213-L1237 HydrophobicContact CB-CB 4.29Å; A1213-L1237 HydrophobicContact CB-CD1 3.99Å; A1213-M1240 HydrophobicContact CB-CB 4.28Å; A1213-M1240 HydrophobicContact CB-CE 3.32Å; A1213-M1240 VanDerWaalsContact CB-CE 3.42Å; A1213-M1240 HydrophobicContact CB-CG 4.02Å; A1213-M1240 HydrophobicContact CB-SD 4.31Å; A1213-L1242 WeakPolarHBondContact O-CD1 3.46Å
1214	C	86.9	Confident	88.9	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	4.6	169.6	-62.6	0	0	0	0	113.6	I1210 I1211 G1212 G1216 L1220 L1242 G1245 I1246 T1291	I1210-C1214 PolarHBondContact O-N 3.08Å; I1210-C1214 PolarHBondContact O-SG 3.25Å; I1211-C1214 WeakPolarHBondContact O-CB 3.46Å; I1211-C1214 PolarHBondContact O-N 3.05Å; G1212-C1214 VanDerWaalsContact C-N 3.28Å; G1212-C1214 PolarHBondContact O-N 3.15Å; G1212-C1214 VanDerWaalsContact O-N 3.1Å; C1214-G1216 VanDerWaalsContact C-N 3.29Å; C1214-L1220 HydrophobicContact CB-CD1 4.08Å; C1214-L1220 VanDerWaalsContact O-CD1 3.31Å; C1214-L1220 WeakPolarHBondContact O-CD1 3.45Å; C1214-L1242 VanDerWaalsContact C-CD1 3.42Å; C1214-L1242 VanDerWaalsContact O-CD1 3.27Å; C1214-L1242 WeakPolarHBondContact O-CD1 3.42Å; C1214-G1245 PolarHBondContact SG-O 3.21Å; C1214-G1245 VanDerWaalsContact SG-O 3.38Å; C1214-I1246 HydrophobicContact CB-CG1 4.37Å; C1214-T1291 HydrophobicContact CB-CG2 4.37Å
1215	G	82.9	Confident	88.7	Confident	5.2 Å²	5.2	14.9 Å²	14.9	5%	0.054	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	3.4	-173.6	0	0	0	0	0	114.2	G1212 A1213 P1219 E1235	G1212-G1215 WeakPolarHBondContact O-CA 3.35Å; G1212-G1215 PolarHBondContact O-N 3.13Å; G1212-G1215 VanDerWaalsContact O-N 3.14Å; A1213-G1215 PolarHBondContact O-N 3.09Å; A1213-G1215 VanDerWaalsContact O-N 3.14Å; G1215-P1219 WeakPolarHBondContact O-CB 3.44Å; G1215-P1219 VanDerWaalsContact O-CG 3.27Å; G1215-P1219 WeakPolarHBondContact O-CG 3.37Å; G1215-E1235 VanDerWaalsContact CA-O 3.24Å; G1215-E1235 WeakPolarHBondContact CA-O 3.49Å; G1215-E1235 PolarHBondContact N-O 2.84Å; G1215-E1235 WeakPolarHBondContact O-CB 3.43Å; G1215-E1235 PolarHBondContact O-N 3.17Å; G1215-E1235 VanDerWaalsContact O-N 3.16Å
1216	G	87.6	Confident	88.2	Confident	10.8 Å²	10.8	14.1 Å²	14.1	11%	0.111	9%	0.093	C	C	.	.			trans	83.6	147.3	178.9	0	0	0	0	0	114.6	I1211 G1212 C1214 L1218 P1219 L1220	I1211-G1216 VanDerWaalsContact O-CA 3.24Å; I1211-G1216 WeakPolarHBondContact O-CA 3.23Å; I1211-G1216 PolarHBondContact O-N 3.03Å; I1211-G1216 VanDerWaalsContact O-N 3.11Å; G1212-G1216 PolarHBondContact O-N 3.34Å; C1214-G1216 VanDerWaalsContact C-N 3.29Å; G1216-L1218 VanDerWaalsContact C-N 3.31Å; G1216-L1218 PolarHBondContact O-N 3.14Å; G1216-P1219 WeakPolarHBondContact O-CD 3.31Å; G1216-L1220 WeakPolarHBondContact O-CB 3.3Å; G1216-L1220 VanDerWaalsContact O-CG 3.3Å; G1216-L1220 WeakPolarHBondContact O-CG 3.3Å; G1216-L1220 PolarHBondContact O-N 3.18Å; G1216-L1220 VanDerWaalsContact O-N 3.16Å
1217	L	91.5	Very high	87	Confident	10.6 Å²	10.6	15.9 Å²	15.9	6%	0.055	11%	0.107	C	C	.	.	H	α-helix	trans	-60.2	-38.3	-178.9	177.3	56.8	0	0	0	113.1	I1211 L1221 R1287 L1290 V1294 F1758 V1762	I1211-L1217 HydrophobicContact CG2-CB 4.33Å; L1217-L1221 VanDerWaalsContact O-CB 3.28Å; L1217-L1221 WeakPolarHBondContact O-CB 3.37Å; L1217-L1221 PolarHBondContact O-N 3.35Å; L1217-R1287 HydrophobicContact CD2-CG 4.38Å; L1217-L1290 HydrophobicContact CD1-CB 4.09Å; L1217-L1290 HydrophobicContact CD2-CB 4.01Å; L1217-L1290 HydrophobicContact CD2-CD1 4.33Å; L1217-V1294 HydrophobicContact CD1-CG2 4.01Å; L1217-F1758 HydrophobicContact CD2-CE2 4.36Å; L1217-F1758 HydrophobicContact CD2-CZ 4.08Å; L1217-F1758 HydrophobicContact CG-CZ 4.21Å; L1217-V1762 HydrophobicContact CD2-CG2 4.08Å; L1217-V1762 HydrophobicContact CG-CG2 4.41Å
1218	L	89.4	Confident	85.7	Confident	81.4 Å²	81.4	19.1 Å²	19.1	43%	0.426	13%	0.126	S	C	.	.	H	α-helix	trans	-72.7	-47	-177.1	-157	86.5	0	0	0	113.1	G1216 L1220 L1221 A1222 F1758 I1759 V1762	G1216-L1218 VanDerWaalsContact C-N 3.31Å; G1216-L1218 PolarHBondContact O-N 3.14Å; L1218-L1220 VanDerWaalsContact C-N 3.34Å; L1218-L1220 PolarHBondContact O-N 3.07Å; L1218-L1221 PolarHBondContact O-N 3.21Å; L1218-A1222 WeakPolarHBondContact O-CB 3.26Å; L1218-A1222 PolarHBondContact O-N 3.29Å; L1218-F1758 HydrophobicContact CD1-CE1 4.35Å; L1218-I1759 HydrophobicContact CD1-CD1 4.06Å; L1218-I1759 HydrophobicContact CD2-CD1 4.43Å; L1218-V1762 HydrophobicContact CB-CG1 4.21Å
1219	P	86.8	Confident	84.3	Confident	26.6 Å²	26.6	19.1 Å²	19.1	17%	0.173	13%	0.127	C	C	.	.	H	α-helix	trans	-61.2	-38.9	172.3	-27.9	38.4	0	0	0	113.6	G1215 G1216 A1222 A1223 I1231 L1234	G1215-P1219 WeakPolarHBondContact O-CB 3.44Å; G1215-P1219 VanDerWaalsContact O-CG 3.27Å; G1215-P1219 WeakPolarHBondContact O-CG 3.37Å; G1216-P1219 WeakPolarHBondContact O-CD 3.31Å; P1219-A1222 PolarHBondContact O-N 3.2Å; P1219-A1223 PolarHBondContact O-N 3.3Å; P1219-I1231 HydrophobicContact CB-CG2 4.32Å; P1219-I1231 WeakPolarHBondContact O-CG2 3.2Å; P1219-L1234 HydrophobicContact CB-CD1 4.03Å; P1219-L1234 HydrophobicContact CB-CD2 4.14Å
1220	L	88.6	Confident	82.9	Confident	1.8 Å²	1.8	25.7 Å²	25.7	1%	0.009	16%	0.158	C	C	.	.	H	α-helix	trans	-65	-41.8	174.4	-70.7	175.5	0	0	0	112.2	C1214 G1216 L1218 A1222 A1223 A1224 L1234 T1291 V1294 L1298 L1483	C1214-L1220 HydrophobicContact CB-CD1 4.08Å; C1214-L1220 VanDerWaalsContact O-CD1 3.31Å; C1214-L1220 WeakPolarHBondContact O-CD1 3.45Å; G1216-L1220 WeakPolarHBondContact O-CB 3.3Å; G1216-L1220 VanDerWaalsContact O-CG 3.3Å; G1216-L1220 WeakPolarHBondContact O-CG 3.3Å; G1216-L1220 PolarHBondContact O-N 3.18Å; G1216-L1220 VanDerWaalsContact O-N 3.16Å; L1218-L1220 VanDerWaalsContact C-N 3.34Å; L1218-L1220 PolarHBondContact O-N 3.07Å; L1220-A1222 VanDerWaalsContact C-N 3.34Å; L1220-A1222 PolarHBondContact O-N 3.15Å; L1220-A1223 WeakPolarHBondContact O-CB 3.39Å; L1220-A1223 PolarHBondContact O-N 3.08Å; L1220-A1224 WeakPolarHBondContact O-CB 3.36Å; L1220-A1224 PolarHBondContact O-N 3.34Å; L1220-L1234 HydrophobicContact CD2-CD2 4.18Å; L1220-L1234 HydrophobicContact CG-CD2 4.49Å; L1220-T1291 HydrophobicContact CD1-CG2 3.85Å; L1220-V1294 VanDerWaalsContact C-CG1 3.47Å; L1220-V1294 HydrophobicContact CB-CG1 3.67Å; L1220-V1294 WeakPolarHBondContact O-CG1 3.35Å; L1220-L1298 HydrophobicContact CB-CD1 4.4Å; L1220-L1298 HydrophobicContact CD2-CD1 3.96Å; L1220-L1483 HydrophobicContact CD2-CD1 3.86Å; L1220-L1483 HydrophobicContact CD2-CD2 4.37Å
1221	L	90	Very high	81.6	Confident	11.6 Å²	11.6	26.5 Å²	26.5	6%	0.061	16%	0.162	C	C	.	.	H	α-helix	trans	-65.2	-38.2	176.1	-178.4	64	0	0	0	111.5	L1217 L1218 A1223 A1224 S1225 V1294 F1549 V1552 M1553 F1758	L1217-L1221 VanDerWaalsContact O-CB 3.28Å; L1217-L1221 WeakPolarHBondContact O-CB 3.37Å; L1217-L1221 PolarHBondContact O-N 3.35Å; L1218-L1221 PolarHBondContact O-N 3.21Å; L1221-A1223 VanDerWaalsContact C-N 3.35Å; L1221-A1224 PolarHBondContact O-N 2.9Å; L1221-S1225 VanDerWaalsContact O-CB 3.28Å; L1221-S1225 WeakPolarHBondContact O-CB 3.38Å; L1221-S1225 PolarHBondContact O-N 2.94Å; L1221-S1225 VanDerWaalsContact O-N 3.12Å; L1221-S1225 PolarHBondContact O-OG 2.92Å; L1221-V1294 HydrophobicContact CB-CG2 4.39Å; L1221-V1294 HydrophobicContact CD1-CG2 4.03Å; L1221-F1549 HydrophobicContact CD1-CD2 4Å; L1221-F1549 HydrophobicContact CD1-CE2 3.96Å; L1221-V1552 HydrophobicContact CD1-CG1 4.39Å; L1221-M1553 HydrophobicContact CD1-CG 4.17Å; L1221-M1553 HydrophobicContact CD1-SD 3.46Å; L1221-M1553 WeakPolarHBondContact CD1-SD 3.36Å; L1221-F1758 HydrophobicContact CD2-CE1 3.72Å; L1221-F1758 HydrophobicContact CD2-CE2 4.42Å; L1221-F1758 HydrophobicContact CD2-CZ 3.56Å; L1221-F1758 VanDerWaalsContact CD2-CZ 3.45Å
1222	A	87.4	Confident	80.2	Confident	42.4 Å²	42.4	28.3 Å²	28.3	35%	0.35	18%	0.183	S	C	.	.	H	α-helix	trans	-61.9	-45.9	172.9	0	0	0	0	0	111.2	L1218 P1219 L1220 A1224 S1225 S1226	L1218-A1222 WeakPolarHBondContact O-CB 3.26Å; L1218-A1222 PolarHBondContact O-N 3.29Å; P1219-A1222 PolarHBondContact O-N 3.2Å; L1220-A1222 VanDerWaalsContact C-N 3.34Å; L1220-A1222 PolarHBondContact O-N 3.15Å; A1222-A1224 VanDerWaalsContact C-N 3.29Å; A1222-A1224 PolarHBondContact O-N 3.16Å; A1222-S1225 PolarHBondContact O-N 3.02Å; A1222-S1225 VanDerWaalsContact O-N 3.12Å; A1222-S1225 PolarHBondContact O-OG 2.9Å; A1222-S1226 VanDerWaalsContact O-CB 3.23Å; A1222-S1226 WeakPolarHBondContact O-CB 3.36Å; A1222-S1226 PolarHBondContact O-N 3.17Å; A1222-S1226 PolarHBondContact O-OG 3.16Å; A1222-S1226 VanDerWaalsContact O-OG 3.08Å
1223	A	84.7	Confident	79.1	Confident	1.2 Å²	1.2	32.5 Å²	32.5	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-60.1	-36.1	174.6	0	0	0	0	0	112.8	P1219 L1220 L1221 S1225 S1226 I1231 L1298 F1480 L1483	P1219-A1223 PolarHBondContact O-N 3.3Å; L1220-A1223 WeakPolarHBondContact O-CB 3.39Å; L1220-A1223 PolarHBondContact O-N 3.08Å; L1221-A1223 VanDerWaalsContact C-N 3.35Å; A1223-S1225 VanDerWaalsContact C-N 3.33Å; A1223-S1226 PolarHBondContact O-OG 3.32Å; A1223-I1231 HydrophobicContact CB-CB 4.5Å; A1223-I1231 HydrophobicContact CB-CD1 3.66Å; A1223-I1231 HydrophobicContact CB-CG1 3.83Å; A1223-I1231 HydrophobicContact CB-CG2 4.1Å; A1223-L1298 HydrophobicContact CB-CD1 4.45Å; A1223-L1298 HydrophobicContact CB-CD2 4.08Å; A1223-F1480 HydrophobicContact CB-CE2 4.36Å; A1223-L1483 HydrophobicContact CB-CD2 3.95Å
1224	A	85.6	Confident	78.4	Confident	2 Å²	2	33.5 Å²	33.5	2%	0.017	22%	0.215	C	C	.	.	H	α-helix	trans	-75.5	-26.9	179.2	0	0	0	0	0	113.5	L1220 L1221 A1222 V1294 L1298 R1301 M1553	L1220-A1224 WeakPolarHBondContact O-CB 3.36Å; L1220-A1224 PolarHBondContact O-N 3.34Å; L1221-A1224 PolarHBondContact O-N 2.9Å; A1222-A1224 VanDerWaalsContact C-N 3.29Å; A1222-A1224 PolarHBondContact O-N 3.16Å; A1224-V1294 HydrophobicContact CB-CG1 4.08Å; A1224-L1298 HydrophobicContact CB-CD1 4.5Å; A1224-L1298 HydrophobicContact CB-CD2 3.98Å; A1224-L1298 HydrophobicContact CB-CG 3.95Å; A1224-R1301 PolarHBondContact O-NH1 2.99Å; A1224-M1553 HydrophobicContact CB-CE 4.11Å; A1224-M1553 HydrophobicContact CB-SD 4.25Å
1225	S	85.8	Confident	77.3	Confident	25.6 Å²	25.6	39.2 Å²	39.2	18%	0.179	24%	0.242	C	C	.	.	H	α-helix	trans	-109	-10.8	-173.4	60.2	0	0	0	0	115.3	L1221 A1222 A1223 S1556 R1559	L1221-S1225 VanDerWaalsContact O-CB 3.28Å; L1221-S1225 WeakPolarHBondContact O-CB 3.38Å; L1221-S1225 PolarHBondContact O-N 2.94Å; L1221-S1225 VanDerWaalsContact O-N 3.12Å; L1221-S1225 PolarHBondContact O-OG 2.92Å; A1222-S1225 PolarHBondContact O-N 3.02Å; A1222-S1225 VanDerWaalsContact O-N 3.12Å; A1222-S1225 PolarHBondContact O-OG 2.9Å; A1223-S1225 VanDerWaalsContact C-N 3.33Å; S1225-S1556 VanDerWaalsContact CA-OG 3.32Å; S1225-S1556 WeakPolarHBondContact CA-OG 3.33Å; S1225-S1556 WeakPolarHBondContact CB-OG 3.4Å; S1225-S1556 PolarHBondContact O-OG 3.14Å; S1225-R1559 PolarHBondContact O-NH1 3.08Å; S1225-R1559 PolarHBondContact O-NH2 3.31Å
1226	S	80.6	Confident	76.5	Confident	21.4 Å²	21.4	42.1 Å²	42.1	15%	0.15	26%	0.261	C	S	.	.			trans	-72.7	145.2	176.5	81.4	0	0	0	0	112.4	A1222 A1223 T1228 S1229 R1301 R1559	A1222-S1226 VanDerWaalsContact O-CB 3.23Å; A1222-S1226 WeakPolarHBondContact O-CB 3.36Å; A1222-S1226 PolarHBondContact O-N 3.17Å; A1222-S1226 PolarHBondContact O-OG 3.16Å; A1222-S1226 VanDerWaalsContact O-OG 3.08Å; A1223-S1226 PolarHBondContact O-OG 3.32Å; S1226-T1228 VanDerWaalsContact CB-O 3.27Å; S1226-T1228 WeakPolarHBondContact CB-O 3.29Å; S1226-T1228 PolarHBondContact OG-N 3.43Å; S1226-T1228 VanDerWaalsContact OG-N 3.13Å; S1226-T1228 PolarHBondContact OG-O 3.45Å; S1226-T1228 PolarHBondContact OG-OG1 3.33Å; S1226-S1229 WeakPolarHBondContact OG-CA 3.33Å; S1226-S1229 PolarHBondContact OG-N 3.03Å; S1226-R1301 PolarHBondContact O-NH1 3.21Å; S1226-R1301 PolarHBondContact O-NH2 2.98Å; S1226-R1559 PolarHBondContact O-NH2 3.14Å
1227	S	67.3	Low	75.8	Confident	44.2 Å²	44.2	42.4 Å²	42.4	31%	0.309	26%	0.26	S	S	.	.	S	Bend	trans	-83.7	-36.8	166.8	48.9	0	0	0	0	111.5	S1229 N1565	S1227-S1229 VanDerWaalsContact C-N 3.3Å; S1227-S1229 PolarHBondContact O-N 3.06Å; S1227-N1565 VanDerWaalsContact O-CG 3.29Å; S1227-N1565 PolarHBondContact O-ND2 3.35Å; S1227-N1565 PolarHBondContact O-OD1 2.85Å
1228	T	64.7	Low	74.9	Confident	67.8 Å²	67.8	45.3 Å²	45.3	42%	0.416	28%	0.28	S	S	.	.	S	Bend	trans	-79.9	0.3	-174.3	55.5	0	0	0	0	114.4	S1226 E1230	S1226-T1228 VanDerWaalsContact CB-O 3.27Å; S1226-T1228 WeakPolarHBondContact CB-O 3.29Å; S1226-T1228 PolarHBondContact OG-N 3.43Å; S1226-T1228 VanDerWaalsContact OG-N 3.13Å; S1226-T1228 PolarHBondContact OG-O 3.45Å; S1226-T1228 PolarHBondContact OG-OG1 3.33Å; T1228-E1230 VanDerWaalsContact CB-OE2 3.31Å; T1228-E1230 WeakPolarHBondContact CB-OE2 3.5Å; T1228-E1230 PolarHBondContact O-N 3.06Å; T1228-E1230 PolarHBondContact OG1-OE2 3.29Å
1229	S	61.3	Low	74.1	Confident	15.8 Å²	15.8	43.6 Å²	43.6	11%	0.11	28%	0.282	C	S	.	.			trans	51.2	12.8	-174.8	51.2	0	0	0	0	115	S1226 S1227 I1231 S1477 F1480	S1226-S1229 WeakPolarHBondContact OG-CA 3.33Å; S1226-S1229 PolarHBondContact OG-N 3.03Å; S1227-S1229 VanDerWaalsContact C-N 3.3Å; S1227-S1229 PolarHBondContact O-N 3.06Å; S1229-I1231 PolarHBondContact O-N 3.16Å; S1229-I1231 VanDerWaalsContact O-N 3.08Å; S1229-S1477 PolarHBondContact O-OG 3.43Å; S1229-S1477 VanDerWaalsContact O-OG 3.08Å; S1229-F1480 VanDerWaalsContact O-CD2 3.28Å; S1229-F1480 WeakPolarHBondContact O-CD2 3.33Å
1230	E	61.3	Low	73.7	Confident	146.6 Å²	146.6	42.7 Å²	42.7	69%	0.685	28%	0.275	S	S	*	.			trans	-76.8	104.9	175.3	-67.8	175.5	160	0	0	109.9	T1228	T1228-E1230 VanDerWaalsContact CB-OE2 3.31Å; T1228-E1230 WeakPolarHBondContact CB-OE2 3.5Å; T1228-E1230 PolarHBondContact O-N 3.06Å; T1228-E1230 PolarHBondContact OG1-OE2 3.29Å
1231	I	65.1	Low	73.1	Confident	16.8 Å²	16.8	46.9 Å²	46.9	9%	0.086	30%	0.295	C	S	.	.			trans	-93.3	134.9	169.4	-42.4	175.7	0	0	0	107.9	P1219 A1223 S1229 L1234 T1479 F1480 L1483	P1219-I1231 HydrophobicContact CB-CG2 4.32Å; P1219-I1231 WeakPolarHBondContact O-CG2 3.2Å; A1223-I1231 HydrophobicContact CB-CB 4.5Å; A1223-I1231 HydrophobicContact CB-CD1 3.66Å; A1223-I1231 HydrophobicContact CB-CG1 3.83Å; A1223-I1231 HydrophobicContact CB-CG2 4.1Å; S1229-I1231 PolarHBondContact O-N 3.16Å; S1229-I1231 VanDerWaalsContact O-N 3.08Å; I1231-L1234 HydrophobicContact CB-CD1 4.4Å; I1231-L1234 HydrophobicContact CD1-CD1 4.2Å; I1231-L1234 HydrophobicContact CG2-CD1 3.8Å; I1231-L1234 HydrophobicContact CG2-CD2 4.27Å; I1231-L1234 HydrophobicContact CG2-CG 3.97Å; I1231-T1479 PolarHBondContact O-OG1 2.82Å; I1231-F1480 HydrophobicContact CD1-CB 4.08Å; I1231-F1480 HydrophobicContact CD1-CD2 3.42Å; I1231-F1480 VanDerWaalsContact CD1-CD2 3.48Å; I1231-F1480 HydrophobicContact CD1-CE2 3.99Å; I1231-F1480 HydrophobicContact CD1-CG 4.02Å; I1231-F1480 HydrophobicContact CG1-CB 4.35Å; I1231-F1480 HydrophobicContact CG1-CD2 3.82Å; I1231-F1480 HydrophobicContact CG1-CE2 4.19Å; I1231-F1480 HydrophobicContact CG1-CG 4.3Å; I1231-L1483 HydrophobicContact CD1-CB 4.4Å; I1231-L1483 HydrophobicContact CD1-CD2 3.73Å
1232	G	61.9	Low	72.7	Confident	47.4 Å²	47.4	46.9 Å²	46.9	49%	0.489	30%	0.295	S	S	.	.			trans	-59.3	176.2	164	0	0	0	0	0	112.3	L1234	G1232-L1234 PolarHBondContact O-N 3.2Å; G1232-L1234 VanDerWaalsContact O-N 3.12Å
1233	S	65.6	Low	72.4	Confident	102.4 Å²	102.4	45.9 Å²	45.9	72%	0.716	28%	0.284	S	S	*	.			trans	-58.3	111.5	177.7	49.8	0	0	0	0	111.4	E1235	S1233-E1235 PolarHBondContact O-N 3.17Å; S1233-E1235 VanDerWaalsContact O-N 3.08Å
1234	L	70.9	Confident	72.2	Confident	22.2 Å²	22.2	47.5 Å²	47.5	12%	0.116	29%	0.292	C	S	.	.			trans	-70.3	99.3	171.4	-85	147.8	0	0	0	108.9	P1219 L1220 I1231 G1232 S1236 L1242 T1479 L1483	P1219-L1234 HydrophobicContact CB-CD1 4.03Å; P1219-L1234 HydrophobicContact CB-CD2 4.14Å; L1220-L1234 HydrophobicContact CD2-CD2 4.18Å; L1220-L1234 HydrophobicContact CG-CD2 4.49Å; I1231-L1234 HydrophobicContact CB-CD1 4.4Å; I1231-L1234 HydrophobicContact CD1-CD1 4.2Å; I1231-L1234 HydrophobicContact CG2-CD1 3.8Å; I1231-L1234 HydrophobicContact CG2-CD2 4.27Å; I1231-L1234 HydrophobicContact CG2-CG 3.97Å; G1232-L1234 PolarHBondContact O-N 3.2Å; G1232-L1234 VanDerWaalsContact O-N 3.12Å; L1234-S1236 VanDerWaalsContact C-N 3.34Å; L1234-S1236 PolarHBondContact O-N 3.31Å; L1234-L1242 HydrophobicContact CD1-CD2 4.18Å; L1234-L1242 HydrophobicContact CD2-CD1 3.69Å; L1234-L1242 HydrophobicContact CD2-CD2 3.35Å; L1234-L1242 HydrophobicContact CD2-CG 4.16Å; L1234-T1479 HydrophobicContact CD1-CG2 4.43Å; L1234-L1483 HydrophobicContact CD1-CB 4.31Å
1235	E	64.8	Low	72.2	Confident	120 Å²	120	47.4 Å²	47.4	56%	0.561	29%	0.291	S	S	*	.			trans	-77.8	93.1	179.4	-149.4	177.8	162.1	0	0	110.1	G1215 S1233 L1237 R1766	G1215-E1235 VanDerWaalsContact CA-O 3.24Å; G1215-E1235 WeakPolarHBondContact CA-O 3.49Å; G1215-E1235 PolarHBondContact N-O 2.84Å; G1215-E1235 WeakPolarHBondContact O-CB 3.43Å; G1215-E1235 PolarHBondContact O-N 3.17Å; G1215-E1235 VanDerWaalsContact O-N 3.16Å; S1233-E1235 PolarHBondContact O-N 3.17Å; S1233-E1235 VanDerWaalsContact O-N 3.08Å; E1235-L1237 PolarHBondContact O-N 3.33Å; E1235-R1766 IonicContact OE1-NE 2.71Å; E1235-R1766 IonicContact OE2-CZ 3.71Å; E1235-R1766 IonicContact OE2-NE 3.69Å; E1235-R1766 PolarHBondContact OE2-NE 3.46Å; E1235-R1766 IonicContact OE2-NH2 3.83Å; E1235-R1766 PolarHBondContact OE2-NH2 2.9Å
1236	S	66.3	Low	72.3	Confident	65.4 Å²	65.4	46.2 Å²	46.2	46%	0.457	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-74.6	134.6	174.2	61.3	0	0	0	0	111.2	A1213 L1234 M1240	A1213-S1236 WeakPolarHBondContact O-CB 3.28Å; L1234-S1236 VanDerWaalsContact C-N 3.34Å; L1234-S1236 PolarHBondContact O-N 3.31Å; S1236-M1240 WeakPolarHBondContact CB-O 3.25Å; S1236-M1240 PolarHBondContact OG-O 2.92Å
1237	L	72.7	Confident	72.7	Confident	17.8 Å²	17.8	45.5 Å²	45.5	9%	0.093	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-62.5	136.2	172.6	-101.2	75	0	0	0	110.7	M1209 A1213 E1235 G1239 M1240	M1209-L1237 HydrophobicContact CB-CD2 4.33Å; M1209-L1237 HydrophobicContact CE-CD2 4.14Å; A1213-L1237 HydrophobicContact CB-CB 4.29Å; A1213-L1237 HydrophobicContact CB-CD1 3.99Å; E1235-L1237 PolarHBondContact O-N 3.33Å; L1237-G1239 PolarHBondContact O-N 3.14Å; L1237-G1239 VanDerWaalsContact O-N 3.13Å; L1237-M1240 PolarHBondContact O-N 2.93Å; L1237-M1240 VanDerWaalsContact O-N 3.15Å
1238	P	72.6	Confident	73.8	Confident	71 Å²	71	43.9 Å²	43.9	46%	0.461	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	124	-178.8	-18.1	23	0	0	0	112.3	S1052 W1053	S1052-P1238 CarbonylContact C-O 3.48Å; S1052-P1238 VanDerWaalsContact CA-O 3.29Å; S1052-P1238 WeakPolarHBondContact CA-O 3.28Å; W1053-P1238 PolarHBondContact N-O 3.33Å
1239	G	71.5	Confident	75.2	Confident	45.6 Å²	45.6	40.6 Å²	40.6	47%	0.47	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	4	175.4	0	0	0	0	0	116.5	W1053 H1058 L1237 R1439	W1053-G1239 WeakPolarHBondContact CB-O 3.32Å; W1053-G1239 WeakPolarHBondContact O-CA 3.35Å; H1058-G1239 PolarHBondContact NE2-O 3.3Å; L1237-G1239 PolarHBondContact O-N 3.14Å; L1237-G1239 VanDerWaalsContact O-N 3.13Å; G1239-R1439 PolarHBondContact O-NH1 3.42Å
1240	M	78.6	Confident	76.7	Confident	7 Å²	7	40.1 Å²	40.1	3%	0.034	24%	0.242	C	C	.	.			trans	-118.8	128.3	169.3	-175.5	142	60.5	0	0	109.7	W1053 H1058 I1210 A1213 S1236 L1237 D1244 Y1248	W1053-M1240 HydrophobicContact CB-CB 4.06Å; W1053-M1240 HydrophobicContact CD2-CE 4.04Å; W1053-M1240 HydrophobicContact CD2-SD 4.41Å; W1053-M1240 HydrophobicContact CG-CB 3.98Å; W1053-M1240 HydrophobicContact CG-CE 4.24Å; W1053-M1240 HydrophobicContact CG-SD 4.48Å; W1053-M1240 HydrophobicContact CZ2-CE 4.05Å; H1058-M1240 PolarHBondContact CE1-SD 3.16Å; H1058-M1240 VanDerWaalsContact CE1-SD 3.54Å; I1210-M1240 HydrophobicContact CD1-CE 3.67Å; I1210-M1240 VanDerWaalsContact CD1-CE 3.46Å; I1210-M1240 HydrophobicContact CD1-SD 4.34Å; I1210-M1240 HydrophobicContact CG1-CE 4.11Å; A1213-M1240 HydrophobicContact CB-CB 4.28Å; A1213-M1240 HydrophobicContact CB-CE 3.32Å; A1213-M1240 VanDerWaalsContact CB-CE 3.42Å; A1213-M1240 HydrophobicContact CB-CG 4.02Å; A1213-M1240 HydrophobicContact CB-SD 4.31Å; S1236-M1240 WeakPolarHBondContact CB-O 3.25Å; S1236-M1240 PolarHBondContact OG-O 2.92Å; L1237-M1240 PolarHBondContact O-N 2.93Å; L1237-M1240 VanDerWaalsContact O-N 3.15Å; M1240-D1244 HydrophobicContact CG-CB 4.23Å; M1240-D1244 HydrophobicContact SD-CB 4.43Å; M1240-Y1248 HydrophobicContact SD-CD2 3.69Å; M1240-Y1248 HydrophobicContact SD-CE2 3.69Å; M1240-Y1248 VanDerWaalsContact SD-CE2 3.54Å
1241	E	76.4	Confident	78.2	Confident	91.2 Å²	91.2	33.3 Å²	33.3	43%	0.426	21%	0.21	S	C	.	.			trans	-80.2	153.4	178.4	-63.3	-165.7	-179.4	0	0	111.1	N1243 D1244 G1245 K1436 R1439	E1241-N1243 VanDerWaalsContact C-N 3.27Å; E1241-N1243 PolarHBondContact O-N 3.02Å; E1241-D1244 WeakPolarHBondContact CB-OD2 3.48Å; E1241-D1244 WeakPolarHBondContact CG-OD2 3.48Å; E1241-D1244 PolarHBondContact N-OD2 2.77Å; E1241-D1244 WeakPolarHBondContact O-CB 3.34Å; E1241-D1244 PolarHBondContact O-N 3.03Å; E1241-D1244 VanDerWaalsContact O-N 3.08Å; E1241-G1245 PolarHBondContact O-N 3.04Å; E1241-K1436 WeakPolarHBondContact OE1-CE 3.49Å; E1241-K1436 IonicContact OE1-NZ 3.14Å; E1241-K1436 PolarHBondContact OE1-NZ 3.3Å; E1241-R1439 IonicContact OE1-CZ 2.71Å; E1241-R1439 IonicContact OE1-NH1 2.68Å; E1241-R1439 IonicContact OE1-NH2 3.54Å; E1241-R1439 PolarHBondContact OE1-NH2 3.11Å; E1241-R1439 IonicContact OE2-CZ 3.47Å; E1241-R1439 IonicContact OE2-NH1 2.99Å; E1241-R1439 PolarHBondContact OE2-NH1 2.92Å; E1241-R1439 IonicContact OE2-NH2 3.18Å; E1241-R1439 PolarHBondContact OE2-NH2 3.49Å
1242	L	81.5	Confident	79.6	Confident	11.2 Å²	11.2	32.5 Å²	32.5	6%	0.059	21%	0.206	C	C	.	.	H	α-helix	trans	-58.9	-36.5	-179	-177.5	60.7	0	0	0	112	A1213 C1214 L1234 G1245 I1246 Q1482 L1483 S1486	A1213-L1242 WeakPolarHBondContact O-CD1 3.46Å; C1214-L1242 VanDerWaalsContact C-CD1 3.42Å; C1214-L1242 VanDerWaalsContact O-CD1 3.27Å; C1214-L1242 WeakPolarHBondContact O-CD1 3.42Å; L1234-L1242 HydrophobicContact CD1-CD2 4.18Å; L1234-L1242 HydrophobicContact CD2-CD1 3.69Å; L1234-L1242 HydrophobicContact CD2-CD2 3.35Å; L1234-L1242 HydrophobicContact CD2-CG 4.16Å; L1242-G1245 PolarHBondContact O-N 3.14Å; L1242-I1246 HydrophobicContact CD1-CD1 4.17Å; L1242-I1246 HydrophobicContact CD1-CG1 4.41Å; L1242-I1246 HydrophobicContact CG-CD1 4.15Å; L1242-I1246 WeakPolarHBondContact O-CD1 3.47Å; L1242-I1246 VanDerWaalsContact O-CG1 3.28Å; L1242-I1246 WeakPolarHBondContact O-CG1 3.3Å; L1242-I1246 PolarHBondContact O-N 3.06Å; L1242-I1246 VanDerWaalsContact O-N 3.13Å; L1242-Q1482 HydrophobicContact CD2-CG 4.31Å; L1242-L1483 HydrophobicContact CD2-CB 4.42Å; L1242-L1483 HydrophobicContact CD2-CD1 4.1Å; L1242-S1486 WeakPolarHBondContact CB-OG 3.38Å; L1242-S1486 VanDerWaalsContact CD2-OG 3.29Å; L1242-S1486 WeakPolarHBondContact CD2-OG 3.42Å; L1242-S1486 VanDerWaalsContact CG-OG 3.29Å; L1242-S1486 WeakPolarHBondContact CG-OG 3.15Å
1243	N	80.2	Confident	81.1	Confident	22 Å²	22	30.3 Å²	30.3	12%	0.118	18%	0.183	C	C	.	.	H	α-helix	trans	-60.4	-46.8	173.8	176.1	78.4	0	0	0	112	E1241 I1246 G1247 K1316 E1444 Q1445 S1486 P1489	E1241-N1243 VanDerWaalsContact C-N 3.27Å; E1241-N1243 PolarHBondContact O-N 3.02Å; N1243-I1246 PolarHBondContact O-N 3.14Å; N1243-G1247 PolarHBondContact O-N 3.24Å; N1243-K1316 PolarHBondContact OD1-NZ 3.5Å; N1243-E1444 PolarHBondContact ND2-N 3.04Å; N1243-Q1445 PolarHBondContact ND2-NE2 2.88Å; N1243-Q1445 PolarHBondContact ND2-OE1 3.37Å; N1243-S1486 PolarHBondContact N-OG 2.93Å; N1243-P1489 WeakPolarHBondContact OD1-CA 3.29Å
1244	D	80.8	Confident	82.4	Confident	34.6 Å²	34.6	25.6 Å²	25.6	19%	0.185	15%	0.149	C	C	.	.	H	α-helix	trans	-69.6	-41.7	-178.7	-56.3	-22.4	0	0	0	110.6	M1240 E1241 I1246 G1247 Y1248 F1442 Q1445 W1447	M1240-D1244 HydrophobicContact CG-CB 4.23Å; M1240-D1244 HydrophobicContact SD-CB 4.43Å; E1241-D1244 WeakPolarHBondContact CB-OD2 3.48Å; E1241-D1244 WeakPolarHBondContact CG-OD2 3.48Å; E1241-D1244 PolarHBondContact N-OD2 2.77Å; E1241-D1244 WeakPolarHBondContact O-CB 3.34Å; E1241-D1244 PolarHBondContact O-N 3.03Å; E1241-D1244 VanDerWaalsContact O-N 3.08Å; D1244-I1246 VanDerWaalsContact C-N 3.34Å; D1244-I1246 PolarHBondContact O-N 3.1Å; D1244-G1247 CarbonylContact O-C 3.55Å; D1244-G1247 WeakPolarHBondContact O-CA 3.38Å; D1244-G1247 PolarHBondContact O-N 3.21Å; D1244-G1247 VanDerWaalsContact O-N 3.1Å; D1244-Y1248 HydrophobicContact CB-CD2 4.42Å; D1244-Y1248 HydrophobicContact CB-CE2 4.14Å; D1244-Y1248 WeakPolarHBondContact O-CD2 3.32Å; D1244-Y1248 PolarHBondContact O-N 3.39Å; D1244-F1442 VanDerWaalsContact OD1-CB 3.32Å; D1244-F1442 WeakPolarHBondContact OD1-CB 3.26Å; D1244-Q1445 PolarHBondContact OD1-NE2 3.36Å; D1244-Q1445 PolarHBondContact OD1-OE1 3.26Å; D1244-W1447 WeakPolarHBondContact OD1-CZ2 3.3Å
1245	G	87	Confident	83.4	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-55.9	-48.5	174	0	0	0	0	0	112.1	I1210 C1214 E1241 L1242 G1247 Y1248 L1249	I1210-G1245 WeakPolarHBondContact CG2-O 3.3Å; C1214-G1245 PolarHBondContact SG-O 3.21Å; C1214-G1245 VanDerWaalsContact SG-O 3.38Å; E1241-G1245 PolarHBondContact O-N 3.04Å; L1242-G1245 PolarHBondContact O-N 3.14Å; G1245-G1247 VanDerWaalsContact C-N 3.31Å; G1245-G1247 PolarHBondContact O-N 3.37Å; G1245-Y1248 PolarHBondContact O-N 2.97Å; G1245-L1249 WeakPolarHBondContact O-CB 3.4Å; G1245-L1249 PolarHBondContact O-N 3.21Å
1246	I	87.7	Confident	84.6	Confident	0.8 Å²	0.8	18.9 Å²	18.9	0%	0.004	12%	0.118	C	C	.	.	H	α-helix	trans	-66.5	-35.5	176	-66.2	169.7	0	0	0	111	C1214 L1242 N1243 D1244 Y1248 L1249 L1250 R1295 S1486 P1489	C1214-I1246 HydrophobicContact CB-CG1 4.37Å; L1242-I1246 HydrophobicContact CD1-CD1 4.17Å; L1242-I1246 HydrophobicContact CD1-CG1 4.41Å; L1242-I1246 HydrophobicContact CG-CD1 4.15Å; L1242-I1246 WeakPolarHBondContact O-CD1 3.47Å; L1242-I1246 VanDerWaalsContact O-CG1 3.28Å; L1242-I1246 WeakPolarHBondContact O-CG1 3.3Å; L1242-I1246 PolarHBondContact O-N 3.06Å; L1242-I1246 VanDerWaalsContact O-N 3.13Å; N1243-I1246 PolarHBondContact O-N 3.14Å; D1244-I1246 VanDerWaalsContact C-N 3.34Å; D1244-I1246 PolarHBondContact O-N 3.1Å; I1246-Y1248 PolarHBondContact O-N 2.83Å; I1246-L1249 WeakPolarHBondContact O-CB 3.33Å; I1246-L1249 PolarHBondContact O-N 3.29Å; I1246-L1250 WeakPolarHBondContact O-CG 3.33Å; I1246-L1250 PolarHBondContact O-N 3.26Å; I1246-R1295 HydrophobicContact CD1-CG 4.36Å; I1246-R1295 HydrophobicContact CG1-CG 4.4Å; I1246-R1295 HydrophobicContact CG2-CG 3.89Å; I1246-S1486 WeakPolarHBondContact CD1-O 3.29Å; I1246-P1489 HydrophobicContact CG2-CG 4.01Å
1247	G	87.5	Confident	85.7	Confident	4.8 Å²	4.8	16.8 Å²	16.8	5%	0.049	10%	0.101	C	C	.	.	H	α-helix	trans	-58	-50.3	172.1	0	0	0	0	0	112.9	N1243 D1244 G1245 L1249 L1250 R1251	N1243-G1247 PolarHBondContact O-N 3.24Å; D1244-G1247 CarbonylContact O-C 3.55Å; D1244-G1247 WeakPolarHBondContact O-CA 3.38Å; D1244-G1247 PolarHBondContact O-N 3.21Å; D1244-G1247 VanDerWaalsContact O-N 3.1Å; G1245-G1247 VanDerWaalsContact C-N 3.31Å; G1245-G1247 PolarHBondContact O-N 3.37Å; G1247-L1249 VanDerWaalsContact C-N 3.33Å; G1247-L1249 PolarHBondContact O-N 3.21Å; G1247-L1250 PolarHBondContact O-N 2.94Å; G1247-R1251 VanDerWaalsContact O-CD 3.3Å; G1247-R1251 WeakPolarHBondContact O-CD 3.33Å; G1247-R1251 VanDerWaalsContact O-CG 3.31Å; G1247-R1251 WeakPolarHBondContact O-CG 3.4Å; G1247-R1251 PolarHBondContact O-N 3.35Å
1248	Y	91.4	Very high	86.4	Confident	10.8 Å²	10.8	16.4 Å²	16.4	4%	0.042	10%	0.099	C	C	.	.	H	α-helix	trans	-69.1	-31.9	177.2	-61.9	-53.7	0	0	0	113	H1058 L1061 D1062 L1065 I1210 M1240 D1244 G1245 I1246 L1250 R1251 L1252	H1058-Y1248 WeakPolarHBondContact CA-OH 3.47Å; H1058-Y1248 WeakPolarHBondContact CB-OH 3.38Å; H1058-Y1248 AromaticContact ND1-CE2 3.82Å; H1058-Y1248 PolarHBondContact ND1-OH 3.14Å; H1058-Y1248 PolarHBondContact O-OH 3.28Å; L1061-Y1248 HydrophobicContact CB-CE1 4.47Å; L1061-Y1248 HydrophobicContact CD2-CD1 4.25Å; L1061-Y1248 HydrophobicContact CD2-CD2 4.32Å; L1061-Y1248 HydrophobicContact CD2-CE1 4.08Å; L1061-Y1248 HydrophobicContact CD2-CE2 4.15Å; L1061-Y1248 HydrophobicContact CD2-CG 4.36Å; L1061-Y1248 HydrophobicContact CG-CD1 4.36Å; L1061-Y1248 HydrophobicContact CG-CE1 4.01Å; D1062-Y1248 HydrophobicContact CB-CE1 4.29Å; L1065-Y1248 HydrophobicContact CD1-CD1 3.62Å; L1065-Y1248 HydrophobicContact CD1-CE1 4.18Å; L1065-Y1248 HydrophobicContact CD1-CG 4.48Å; I1210-Y1248 HydrophobicContact CD1-CD2 4.18Å; I1210-Y1248 HydrophobicContact CD1-CG 4.42Å; M1240-Y1248 HydrophobicContact SD-CD2 3.69Å; M1240-Y1248 HydrophobicContact SD-CE2 3.69Å; M1240-Y1248 VanDerWaalsContact SD-CE2 3.54Å; D1244-Y1248 HydrophobicContact CB-CD2 4.42Å; D1244-Y1248 HydrophobicContact CB-CE2 4.14Å; D1244-Y1248 WeakPolarHBondContact O-CD2 3.32Å; D1244-Y1248 PolarHBondContact O-N 3.39Å; G1245-Y1248 PolarHBondContact O-N 2.97Å; I1246-Y1248 PolarHBondContact O-N 2.83Å; Y1248-L1250 VanDerWaalsContact C-N 3.32Å; Y1248-L1250 PolarHBondContact O-N 3.12Å; Y1248-R1251 PolarHBondContact O-N 3.18Å; Y1248-L1252 VanDerWaalsContact O-CB 3.25Å; Y1248-L1252 WeakPolarHBondContact O-CB 3.22Å; Y1248-L1252 WeakPolarHBondContact O-CG 3.49Å; Y1248-L1252 PolarHBondContact O-N 3.14Å
1249	L	94	Very high	86.9	Confident	0.2 Å²	0.2	13.1 Å²	13.1	0%	0.001	8%	0.077	C	C	.	.	H	α-helix	trans	-56.6	-48.1	176.9	177.8	73.6	0	0	0	111.7	I1210 I1211 G1245 I1246 G1247 R1251 T1253 L1288 T1291 R1295	I1210-L1249 HydrophobicContact CG2-CB 4Å; I1210-L1249 HydrophobicContact CG2-CD1 4.47Å; I1211-L1249 HydrophobicContact CG1-CD1 4.18Å; G1245-L1249 WeakPolarHBondContact O-CB 3.4Å; G1245-L1249 PolarHBondContact O-N 3.21Å; I1246-L1249 WeakPolarHBondContact O-CB 3.33Å; I1246-L1249 PolarHBondContact O-N 3.29Å; G1247-L1249 VanDerWaalsContact C-N 3.33Å; G1247-L1249 PolarHBondContact O-N 3.21Å; L1249-R1251 VanDerWaalsContact C-N 3.33Å; L1249-R1251 PolarHBondContact O-N 2.95Å; L1249-T1253 WeakPolarHBondContact O-CB 3.33Å; L1249-T1253 PolarHBondContact O-N 3.34Å; L1249-T1253 PolarHBondContact O-OG1 3.18Å; L1249-L1288 HydrophobicContact CD1-CD1 3.7Å; L1249-L1288 HydrophobicContact CD1-CG 4.46Å; L1249-T1291 HydrophobicContact CD1-CG2 4.04Å; L1249-T1291 HydrophobicContact CD2-CG2 3.82Å; L1249-R1295 HydrophobicContact CD2-CB 4.43Å
1250	L	93	Very high	87.2	Confident	3.8 Å²	3.8	11.5 Å²	11.5	2%	0.02	6%	0.058	C	C	.	.	H	α-helix	trans	-67.8	-37.7	-179.2	-59.7	178.5	0	0	0	111.8	I1246 G1247 Y1248 T1253 Y1254 R1295 P1489 F1491 V1506 P1509	I1246-L1250 WeakPolarHBondContact O-CG 3.33Å; I1246-L1250 PolarHBondContact O-N 3.26Å; G1247-L1250 PolarHBondContact O-N 2.94Å; Y1248-L1250 VanDerWaalsContact C-N 3.32Å; Y1248-L1250 PolarHBondContact O-N 3.12Å; L1250-T1253 VanDerWaalsContact O-CB 3.3Å; L1250-T1253 WeakPolarHBondContact O-CB 3.33Å; L1250-T1253 PolarHBondContact O-N 3.13Å; L1250-Y1254 PolarHBondContact O-N 3.14Å; L1250-R1295 VanDerWaalsContact CD1-NH2 3.31Å; L1250-P1489 HydrophobicContact CD1-CG 4.04Å; L1250-F1491 HydrophobicContact CD1-CE2 4.36Å; L1250-F1491 HydrophobicContact CD1-CZ 4.32Å; L1250-V1506 HydrophobicContact CB-CG2 4.47Å; L1250-P1509 HydrophobicContact CD1-CG 4.31Å; L1250-P1509 HydrophobicContact CD2-CG 4.45Å
1251	R	93.1	Very high	86.6	Confident	3.4 Å²	3.4	15.7 Å²	15.7	1%	0.013	8%	0.08	C	C	.	.	H	α-helix	trans	-69.1	-42.5	178.8	-65.8	169.3	68.1	-178.4	15.6	112.1	D1062 E1069 G1247 Y1248 L1249 T1253 Y1254 L1255 F1491 Y1493 V1506	D1062-R1251 PolarHBondContact O-NH2 3.14Å; D1062-R1251 VanDerWaalsContact O-NH2 3.13Å; D1062-R1251 IonicContact OD1-CZ 3.14Å; D1062-R1251 IonicContact OD1-NH1 2.95Å; D1062-R1251 PolarHBondContact OD1-NH1 2.95Å; D1062-R1251 IonicContact OD1-NH2 3.47Å; D1062-R1251 PolarHBondContact OD1-NH2 3.07Å; E1069-R1251 VanDerWaalsContact OE1-CB 3.24Å; E1069-R1251 WeakPolarHBondContact OE1-CB 3.39Å; E1069-R1251 VanDerWaalsContact OE1-CG 3.29Å; E1069-R1251 WeakPolarHBondContact OE1-CG 3.34Å; E1069-R1251 IonicContact OE1-CZ 3.03Å; E1069-R1251 VanDerWaalsContact OE1-CZ 3.24Å; E1069-R1251 IonicContact OE1-NE 3.07Å; E1069-R1251 PolarHBondContact OE1-NE 3.16Å; E1069-R1251 IonicContact OE1-NH2 3.08Å; E1069-R1251 PolarHBondContact OE1-NH2 2.84Å; E1069-R1251 IonicContact OE2-CZ 3.66Å; E1069-R1251 IonicContact OE2-NE 2.78Å; E1069-R1251 PolarHBondContact OE2-NE 2.95Å; E1069-R1251 IonicContact OE2-NH2 3.29Å; E1069-R1251 PolarHBondContact OE2-NH2 2.78Å; G1247-R1251 VanDerWaalsContact O-CD 3.3Å; G1247-R1251 WeakPolarHBondContact O-CD 3.33Å; G1247-R1251 VanDerWaalsContact O-CG 3.31Å; G1247-R1251 WeakPolarHBondContact O-CG 3.4Å; G1247-R1251 PolarHBondContact O-N 3.35Å; Y1248-R1251 PolarHBondContact O-N 3.18Å; L1249-R1251 VanDerWaalsContact C-N 3.33Å; L1249-R1251 PolarHBondContact O-N 2.95Å; R1251-T1253 VanDerWaalsContact C-N 3.3Å; R1251-T1253 PolarHBondContact O-N 3.15Å; R1251-Y1254 WeakPolarHBondContact O-CB 3.33Å; R1251-Y1254 PolarHBondContact O-N 3.19Å; R1251-L1255 WeakPolarHBondContact O-CG 3.35Å; R1251-L1255 PolarHBondContact O-N 3.21Å; R1251-L1255 VanDerWaalsContact O-N 3.11Å; R1251-F1491 HydrophobicContact CG-CE1 4.19Å; R1251-Y1493 PolarHBondContact NE-OH 3.01Å; R1251-Y1493 PolarHBondContact NH2-OH 3.29Å; R1251-V1506 HydrophobicContact CG-CG1 3.88Å; R1251-V1506 HydrophobicContact CG-CG2 4.37Å
1252	L	93.9	Very high	86.1	Confident	0.6 Å²	0.6	13.9 Å²	13.9	0%	0.003	7%	0.073	C	C	.	.	H	α-helix	trans	-64.5	-34.9	170.4	-85.7	174.6	0	0	0	112.2	L1065 I1203 L1206 I1210 Y1248 Y1254 L1255 A1256 L1288	L1065-L1252 HydrophobicContact CD2-CD2 3.92Å; I1203-L1252 HydrophobicContact CB-CD1 4.33Å; I1203-L1252 HydrophobicContact CG1-CD1 3.82Å; I1203-L1252 HydrophobicContact CG1-CD2 4.25Å; I1203-L1252 HydrophobicContact CG1-CG 4.32Å; I1203-L1252 HydrophobicContact CG2-CG 4.31Å; L1206-L1252 HydrophobicContact CB-CD1 3.96Å; L1206-L1252 HydrophobicContact CB-CD2 4.07Å; L1206-L1252 HydrophobicContact CD1-CD1 4.32Å; L1206-L1252 HydrophobicContact CD1-CD2 4.36Å; I1210-L1252 HydrophobicContact CB-CD1 4.14Å; I1210-L1252 HydrophobicContact CD1-CD1 3.48Å; I1210-L1252 VanDerWaalsContact CD1-CD1 3.47Å; I1210-L1252 HydrophobicContact CD1-CG 4.18Å; I1210-L1252 HydrophobicContact CG1-CD1 3.63Å; I1210-L1252 HydrophobicContact CG2-CD1 4.48Å; Y1248-L1252 VanDerWaalsContact O-CB 3.25Å; Y1248-L1252 WeakPolarHBondContact O-CB 3.22Å; Y1248-L1252 WeakPolarHBondContact O-CG 3.49Å; Y1248-L1252 PolarHBondContact O-N 3.14Å; L1252-Y1254 VanDerWaalsContact C-N 3.34Å; L1252-Y1254 PolarHBondContact O-N 3.02Å; L1252-L1255 PolarHBondContact O-N 3.13Å; L1252-A1256 VanDerWaalsContact O-CB 3.24Å; L1252-A1256 WeakPolarHBondContact O-CB 3.26Å; L1252-A1256 PolarHBondContact O-N 3.15Å; L1252-L1288 HydrophobicContact CB-CD1 4.27Å; L1252-L1288 HydrophobicContact CB-CD2 4.36Å; L1252-L1288 HydrophobicContact CD1-CD1 4.42Å; L1252-L1288 HydrophobicContact CD2-CD1 4.02Å; L1252-L1288 HydrophobicContact CD2-CD2 4.32Å; L1252-L1288 HydrophobicContact CG-CD2 4.29Å
1253	T	93.5	Very high	85.2	Confident	0.6 Å²	0.6	19.3 Å²	19.3	0%	0.004	10%	0.096	C	C	.	.	H	α-helix	trans	-62	-43.4	174.7	-60.1	0	0	0	0	111.1	L1249 L1250 R1251 A1256 D1257 Y1289 A1292 T1505	L1249-T1253 WeakPolarHBondContact O-CB 3.33Å; L1249-T1253 PolarHBondContact O-N 3.34Å; L1249-T1253 PolarHBondContact O-OG1 3.18Å; L1250-T1253 VanDerWaalsContact O-CB 3.3Å; L1250-T1253 WeakPolarHBondContact O-CB 3.33Å; L1250-T1253 PolarHBondContact O-N 3.13Å; R1251-T1253 VanDerWaalsContact C-N 3.3Å; R1251-T1253 PolarHBondContact O-N 3.15Å; T1253-A1256 WeakPolarHBondContact O-CB 3.38Å; T1253-A1256 PolarHBondContact O-N 3.06Å; T1253-D1257 VanDerWaalsContact O-CG 3.27Å; T1253-D1257 PolarHBondContact O-N 3.09Å; T1253-Y1289 HydrophobicContact CG2-CD1 3.99Å; T1253-Y1289 HydrophobicContact CG2-CE1 3.94Å; T1253-A1292 HydrophobicContact CG2-CB 4.4Å; T1253-T1505 HydrophobicContact CG2-CG2 3.99Å
1254	Y	92.6	Very high	84.3	Confident	4.6 Å²	4.6	25.4 Å²	25.4	2%	0.018	13%	0.128	C	C	.	.	H	α-helix	trans	-61.8	-46.7	174.4	174.5	-105.2	0	0	0	112.8	E1069 V1072 V1073 L1250 R1251 L1252 A1256 D1257 F1258 D1499 A1501 F1502 V1506	E1069-Y1254 HydrophobicContact CG-CD1 4.39Å; V1072-Y1254 HydrophobicContact CB-CE1 4.3Å; V1072-Y1254 HydrophobicContact CG1-CD1 4.49Å; V1072-Y1254 HydrophobicContact CG1-CE1 3.74Å; V1073-Y1254 HydrophobicContact CG2-CE1 4.5Å; V1073-Y1254 VanDerWaalsContact CG2-OH 3.29Å; V1073-Y1254 WeakPolarHBondContact CG2-OH 3.33Å; L1250-Y1254 PolarHBondContact O-N 3.14Å; R1251-Y1254 WeakPolarHBondContact O-CB 3.33Å; R1251-Y1254 PolarHBondContact O-N 3.19Å; L1252-Y1254 VanDerWaalsContact C-N 3.34Å; L1252-Y1254 PolarHBondContact O-N 3.02Å; Y1254-A1256 VanDerWaalsContact C-N 3.28Å; Y1254-A1256 PolarHBondContact O-N 3.09Å; Y1254-D1257 WeakPolarHBondContact O-CB 3.41Å; Y1254-D1257 PolarHBondContact O-N 3.18Å; Y1254-F1258 PolarHBondContact O-N 3.17Å; Y1254-F1258 VanDerWaalsContact O-N 3.12Å; Y1254-D1499 WeakPolarHBondContact CE2-OD1 3.41Å; Y1254-D1499 PolarHBondContact OH-OD1 3.19Å; Y1254-D1499 VanDerWaalsContact OH-OD1 3.07Å; Y1254-A1501 HydrophobicContact CE2-CB 4.07Å; Y1254-F1502 AromaticContact CD1-CD2 3.71Å; Y1254-F1502 HydrophobicContact CD1-CD2 3.71Å; Y1254-F1502 HydrophobicContact CD1-CE2 4.25Å; Y1254-F1502 HydrophobicContact CD2-CB 4.19Å; Y1254-F1502 HydrophobicContact CD2-CD2 4.14Å; Y1254-F1502 AromaticContact CE1-CD2 3.66Å; Y1254-F1502 HydrophobicContact CE1-CD2 3.66Å; Y1254-F1502 HydrophobicContact CE1-CE2 4.44Å; Y1254-F1502 VanDerWaalsContact CE2-CA 3.47Å; Y1254-F1502 HydrophobicContact CE2-CB 3.67Å; Y1254-F1502 HydrophobicContact CE2-CD2 4.09Å; Y1254-F1502 HydrophobicContact CE2-CG 4.41Å; Y1254-F1502 VanDerWaalsContact CE2-N 3.31Å; Y1254-F1502 AromaticContact CG-CD2 3.94Å; Y1254-F1502 HydrophobicContact CG-CD2 3.94Å; Y1254-F1502 AromaticContact CZ-CD2 3.83Å; Y1254-V1506 HydrophobicContact CG-CG2 4.44Å
1255	L	91.7	Very high	83.8	Confident	1.8 Å²	1.8	24.9 Å²	24.9	1%	0.009	13%	0.126	C	C	.	.	H	α-helix	trans	-65.5	-32.5	177.2	-64	177.6	0	0	0	112.1	L1065 L1068 E1069 V1072 I1199 I1203 R1251 L1252 F1258 C1259	L1065-L1255 HydrophobicContact CD2-CD1 3.65Å; L1068-L1255 HydrophobicContact CB-CD1 4.36Å; L1068-L1255 HydrophobicContact CB-CD2 4.42Å; L1068-L1255 HydrophobicContact CD1-CD1 4.4Å; E1069-L1255 HydrophobicContact CG-CD2 4.41Å; V1072-L1255 HydrophobicContact CB-CD2 4.47Å; V1072-L1255 HydrophobicContact CG2-CD2 3.85Å; I1199-L1255 HydrophobicContact CD1-CD2 4.48Å; I1199-L1255 HydrophobicContact CG2-CB 4.29Å; I1203-L1255 HydrophobicContact CD1-CB 3.98Å; I1203-L1255 HydrophobicContact CG1-CB 4.45Å; R1251-L1255 WeakPolarHBondContact O-CG 3.35Å; R1251-L1255 PolarHBondContact O-N 3.21Å; R1251-L1255 VanDerWaalsContact O-N 3.11Å; L1252-L1255 PolarHBondContact O-N 3.13Å; L1255-F1258 PolarHBondContact O-N 3.46Å; L1255-C1259 PolarHBondContact O-N 3.03Å; L1255-C1259 VanDerWaalsContact O-N 3.14Å; L1255-C1259 PolarHBondContact O-SG 3.37Å
1256	A	90.9	Very high	83	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.8	-43.4	173.1	0	0	0	0	0	111.8	I1203 L1252 T1253 Y1254 F1258 C1259 I1260 L1285 L1288 Y1289	I1203-A1256 HydrophobicContact CD1-CB 4.16Å; I1203-A1256 HydrophobicContact CG2-CB 4.36Å; L1252-A1256 VanDerWaalsContact O-CB 3.24Å; L1252-A1256 WeakPolarHBondContact O-CB 3.26Å; L1252-A1256 PolarHBondContact O-N 3.15Å; T1253-A1256 WeakPolarHBondContact O-CB 3.38Å; T1253-A1256 PolarHBondContact O-N 3.06Å; Y1254-A1256 VanDerWaalsContact C-N 3.28Å; Y1254-A1256 PolarHBondContact O-N 3.09Å; A1256-F1258 VanDerWaalsContact C-N 3.33Å; A1256-F1258 PolarHBondContact O-N 3.3Å; A1256-C1259 PolarHBondContact O-N 3.2Å; A1256-C1259 VanDerWaalsContact O-N 3.12Å; A1256-I1260 HydrophobicContact CB-CD1 3.96Å; A1256-I1260 VanDerWaalsContact O-CB 3.3Å; A1256-I1260 WeakPolarHBondContact O-CB 3.23Å; A1256-I1260 VanDerWaalsContact O-CD1 3.31Å; A1256-I1260 WeakPolarHBondContact O-CD1 3.34Å; A1256-I1260 VanDerWaalsContact O-CG1 3.27Å; A1256-I1260 WeakPolarHBondContact O-CG1 3.31Å; A1256-I1260 PolarHBondContact O-N 3Å; A1256-L1285 HydrophobicContact CB-CD2 4.06Å; A1256-L1288 HydrophobicContact CB-CD2 3.97Å; A1256-Y1289 HydrophobicContact CB-CE1 4.14Å
1257	D	89.2	Confident	82.4	Confident	20.8 Å²	20.8	29.9 Å²	29.9	11%	0.111	15%	0.153	C	C	.	.	H	α-helix	trans	-58.6	-46	176.4	-69.4	-20.8	0	0	0	111.4	T1253 Y1254 C1259 I1260 L1261 Y1289 R1524	T1253-D1257 VanDerWaalsContact O-CG 3.27Å; T1253-D1257 PolarHBondContact O-N 3.09Å; Y1254-D1257 WeakPolarHBondContact O-CB 3.41Å; Y1254-D1257 PolarHBondContact O-N 3.18Å; D1257-C1259 VanDerWaalsContact C-N 3.33Å; D1257-C1259 PolarHBondContact O-N 3.12Å; D1257-I1260 PolarHBondContact O-N 3.25Å; D1257-L1261 HydrophobicContact CB-CD1 3.88Å; D1257-L1261 HydrophobicContact CB-CG 4.39Å; D1257-L1261 WeakPolarHBondContact O-CB 3.3Å; D1257-L1261 WeakPolarHBondContact O-CD1 3.36Å; D1257-L1261 VanDerWaalsContact O-CG 3.23Å; D1257-L1261 WeakPolarHBondContact O-CG 3.39Å; D1257-L1261 PolarHBondContact O-N 3.27Å; D1257-L1261 VanDerWaalsContact O-N 3.1Å; D1257-Y1289 PolarHBondContact N-OH 2.97Å; D1257-Y1289 VanDerWaalsContact OD1-CE1 3.29Å; D1257-Y1289 WeakPolarHBondContact OD1-CE1 3.47Å; D1257-Y1289 VanDerWaalsContact OD1-CZ 3.29Å; D1257-Y1289 PolarHBondContact OD1-OH 3.17Å; D1257-Y1289 VanDerWaalsContact OD1-OH 3.1Å; D1257-R1524 WeakPolarHBondContact OD1-CG 3.19Å; D1257-R1524 IonicContact OD1-NE 3.23Å; D1257-R1524 PolarHBondContact OD1-NE 3.16Å; D1257-R1524 IonicContact OD2-CZ 3.26Å; D1257-R1524 VanDerWaalsContact OD2-CZ 3.26Å; D1257-R1524 IonicContact OD2-NE 3.28Å; D1257-R1524 PolarHBondContact OD2-NE 3.31Å; D1257-R1524 IonicContact OD2-NH2 3.01Å; D1257-R1524 PolarHBondContact OD2-NH2 3.33Å
1258	F	86.4	Confident	81.8	Confident	10.6 Å²	10.6	35.2 Å²	35.2	5%	0.046	18%	0.175	C	C	.	.	H	α-helix	trans	-57.5	-43	175.1	172.1	-98.8	0	0	0	112.9	V1072 R1075 D1076 F1195 Y1254 L1255 A1256 K1263	V1072-F1258 HydrophobicContact CB-CD2 4.47Å; V1072-F1258 HydrophobicContact CB-CG 4.44Å; V1072-F1258 HydrophobicContact CG1-CB 3.91Å; V1072-F1258 HydrophobicContact CG1-CD1 4.34Å; V1072-F1258 HydrophobicContact CG1-CD2 3.56Å; V1072-F1258 HydrophobicContact CG1-CE2 4.11Å; V1072-F1258 HydrophobicContact CG1-CG 3.67Å; V1072-F1258 HydrophobicContact CG2-CB 4.39Å; V1072-F1258 HydrophobicContact CG2-CD1 3.81Å; V1072-F1258 HydrophobicContact CG2-CD2 4.39Å; V1072-F1258 HydrophobicContact CG2-CE1 4.03Å; V1072-F1258 HydrophobicContact CG2-CE2 4.5Å; V1072-F1258 HydrophobicContact CG2-CG 4Å; V1072-F1258 HydrophobicContact CG2-CZ 4.33Å; R1075-F1258 HydrophobicContact CB-CE2 4.32Å; R1075-F1258 HydrophobicContact CB-CZ 4.39Å; D1076-F1258 WeakPolarHBondContact OD1-CE2 3.32Å; D1076-F1258 VanDerWaalsContact OD2-CD2 3.27Å; D1076-F1258 WeakPolarHBondContact OD2-CD2 3.37Å; D1076-F1258 WeakPolarHBondContact OD2-CE2 3.43Å; F1195-F1258 HydrophobicContact CD1-CE1 4.31Å; F1195-F1258 AromaticContact CE1-CE1 3.84Å; F1195-F1258 HydrophobicContact CE1-CE1 3.84Å; F1195-F1258 HydrophobicContact CE1-CZ 4.3Å; Y1254-F1258 PolarHBondContact O-N 3.17Å; Y1254-F1258 VanDerWaalsContact O-N 3.12Å; L1255-F1258 PolarHBondContact O-N 3.46Å; A1256-F1258 VanDerWaalsContact C-N 3.33Å; A1256-F1258 PolarHBondContact O-N 3.3Å; F1258-K1263 VanDerWaalsContact CE1-NZ 3.32Å
1259	C	84.2	Confident	81.2	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-70.3	-45.4	177.7	-72.8	0	0	0	0	112.2	T1196 I1199 L1200 L1255 A1256 D1257 L1261 D1262 I1265	T1196-C1259 HydrophobicContact CG2-CB 4.32Å; I1199-C1259 VanDerWaalsContact CG2-SG 3.57Å; L1200-C1259 HydrophobicContact CD1-CB 3.44Å; L1200-C1259 VanDerWaalsContact CD1-CB 3.44Å; L1255-C1259 PolarHBondContact O-N 3.03Å; L1255-C1259 VanDerWaalsContact O-N 3.14Å; L1255-C1259 PolarHBondContact O-SG 3.37Å; A1256-C1259 PolarHBondContact O-N 3.2Å; A1256-C1259 VanDerWaalsContact O-N 3.12Å; D1257-C1259 VanDerWaalsContact C-N 3.33Å; D1257-C1259 PolarHBondContact O-N 3.12Å; C1259-L1261 VanDerWaalsContact C-N 3.28Å; C1259-L1261 PolarHBondContact O-N 3.11Å; C1259-D1262 VanDerWaalsContact O-CB 3.24Å; C1259-D1262 WeakPolarHBondContact O-CB 3.37Å; C1259-D1262 PolarHBondContact O-N 3.26Å; C1259-I1265 VanDerWaalsContact C-CD1 3.41Å; C1259-I1265 HydrophobicContact CB-CD1 4.07Å; C1259-I1265 WeakPolarHBondContact O-CD1 3.38Å
1260	I	77.3	Confident	80.6	Confident	13.2 Å²	13.2	38.2 Å²	38.2	7%	0.068	19%	0.191	C	C	.	.	H	α-helix	trans	-78.2	-35.3	-169.2	-64.8	170.8	0	0	0	112.2	A1256 D1257 D1262 L1285 Y1289 H1527 L1528 K1531	A1256-I1260 HydrophobicContact CB-CD1 3.96Å; A1256-I1260 VanDerWaalsContact O-CB 3.3Å; A1256-I1260 WeakPolarHBondContact O-CB 3.23Å; A1256-I1260 VanDerWaalsContact O-CD1 3.31Å; A1256-I1260 WeakPolarHBondContact O-CD1 3.34Å; A1256-I1260 VanDerWaalsContact O-CG1 3.27Å; A1256-I1260 WeakPolarHBondContact O-CG1 3.31Å; A1256-I1260 PolarHBondContact O-N 3Å; D1257-I1260 PolarHBondContact O-N 3.25Å; I1260-D1262 PolarHBondContact O-N 3.06Å; I1260-L1285 HydrophobicContact CD1-CB 4.38Å; I1260-L1285 HydrophobicContact CD1-CD1 3.64Å; I1260-L1285 VanDerWaalsContact CD1-CD1 3.49Å; I1260-L1285 HydrophobicContact CD1-CD2 3.97Å; I1260-L1285 HydrophobicContact CD1-CG 4.2Å; I1260-L1285 HydrophobicContact CG1-CD1 4.22Å; I1260-Y1289 HydrophobicContact CD1-CE2 3.88Å; I1260-Y1289 VanDerWaalsContact CD1-OH 3.24Å; I1260-Y1289 WeakPolarHBondContact CD1-OH 3.33Å; I1260-H1527 PolarHBondContact O-NE2 2.87Å; I1260-L1528 HydrophobicContact CD1-CD1 4.11Å; I1260-K1531 HydrophobicContact CG2-CD 4.16Å; I1260-K1531 PolarHBondContact O-NZ 3.36Å
1261	L	67.4	Low	80.2	Confident	95.2 Å²	95.2	38.3 Å²	38.3	50%	0.498	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-22.1	-178.6	-64.6	173.4	0	0	0	113.3	D1257 C1259 K1263 H1527	D1257-L1261 HydrophobicContact CB-CD1 3.88Å; D1257-L1261 HydrophobicContact CB-CG 4.39Å; D1257-L1261 WeakPolarHBondContact O-CB 3.3Å; D1257-L1261 WeakPolarHBondContact O-CD1 3.36Å; D1257-L1261 VanDerWaalsContact O-CG 3.23Å; D1257-L1261 WeakPolarHBondContact O-CG 3.39Å; D1257-L1261 PolarHBondContact O-N 3.27Å; D1257-L1261 VanDerWaalsContact O-N 3.1Å; C1259-L1261 VanDerWaalsContact C-N 3.28Å; C1259-L1261 PolarHBondContact O-N 3.11Å; L1261-K1263 PolarHBondContact O-N 3.07Å; L1261-H1527 HydrophobicContact CD2-CB 3.81Å; L1261-H1527 PolarHBondContact O-CE1 3.17Å
1262	D	64.4	Low	79.6	Confident	52.4 Å²	52.4	41.6 Å²	41.6	28%	0.28	22%	0.215	S	C	.	.			trans	-85.4	89.2	-178.8	-131.5	-20.8	0	0	0	113.2	R1079 C1259 I1260 N1264 I1265 K1531	R1079-D1262 IonicContact CZ-OD2 3.15Å; R1079-D1262 IonicContact NH1-OD2 3.22Å; R1079-D1262 PolarHBondContact NH1-OD2 3.09Å; R1079-D1262 IonicContact NH2-OD2 3.41Å; R1079-D1262 PolarHBondContact NH2-OD2 3.24Å; C1259-D1262 VanDerWaalsContact O-CB 3.24Å; C1259-D1262 WeakPolarHBondContact O-CB 3.37Å; C1259-D1262 PolarHBondContact O-N 3.26Å; I1260-D1262 PolarHBondContact O-N 3.06Å; D1262-N1264 VanDerWaalsContact C-N 3.31Å; D1262-N1264 PolarHBondContact O-N 3.16Å; D1262-N1264 PolarHBondContact OD1-N 3.02Å; D1262-I1265 HydrophobicContact CB-CD1 4.26Å; D1262-I1265 HydrophobicContact CB-CG1 4.25Å; D1262-K1531 PolarHBondContact O-NZ 3.06Å
1263	K	62.7	Low	79	Confident	125.2 Å²	125.2	45.5 Å²	45.5	54%	0.544	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	17.1	-168.6	-66.9	-177.4	177.7	-179.4	0	114.2	R1079 E1192 T1196 F1258 L1261 I1265 K1531	R1079-K1263 VanDerWaalsContact NH2-CE 3.27Å; E1192-K1263 WeakPolarHBondContact OE1-CE 3.39Å; E1192-K1263 IonicContact OE1-NZ 2.95Å; E1192-K1263 PolarHBondContact OE1-NZ 3.33Å; T1196-K1263 HydrophobicContact CG2-CD 3.54Å; T1196-K1263 PolarHBondContact OG1-NZ 2.96Å; F1258-K1263 VanDerWaalsContact CE1-NZ 3.32Å; L1261-K1263 PolarHBondContact O-N 3.07Å; K1263-I1265 VanDerWaalsContact C-N 3.34Å; K1263-I1265 HydrophobicContact CB-CD1 4.42Å; K1263-I1265 HydrophobicContact CB-CG1 3.99Å; K1263-I1265 PolarHBondContact O-N 3.2Å; K1263-K1531 WeakPolarHBondContact O-CE 3.39Å; K1263-K1531 PolarHBondContact O-NZ 3Å
1264	N	62.3	Low	78.3	Confident	149 Å²	149	47.8 Å²	47.8	80%	0.797	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.2	33.3	-175.4	-68.9	-19.9	0	0	0	113.9	D1262 N1266	D1262-N1264 VanDerWaalsContact C-N 3.31Å; D1262-N1264 PolarHBondContact O-N 3.16Å; D1262-N1264 PolarHBondContact OD1-N 3.02Å; N1264-N1266 PolarHBondContact O-N 3.22Å
1265	I	69.3	Low	77.8	Confident	24.8 Å²	24.8	54.4 Å²	54.4	13%	0.127	28%	0.277	C	S	.	.			trans	-76.8	124.5	-180	-58	-176.9	0	0	0	111.2	T1196 L1200 C1259 D1262 K1263 T1267 I1270	T1196-I1265 HydrophobicContact CG2-CD1 3.47Å; T1196-I1265 VanDerWaalsContact CG2-CD1 3.46Å; T1196-I1265 HydrophobicContact CG2-CG1 3.97Å; L1200-I1265 HydrophobicContact CD1-CD1 4.33Å; L1200-I1265 HydrophobicContact CD2-CD1 3.72Å; L1200-I1265 HydrophobicContact CD2-CG2 3.99Å; C1259-I1265 VanDerWaalsContact C-CD1 3.41Å; C1259-I1265 HydrophobicContact CB-CD1 4.07Å; C1259-I1265 WeakPolarHBondContact O-CD1 3.38Å; D1262-I1265 HydrophobicContact CB-CD1 4.26Å; D1262-I1265 HydrophobicContact CB-CG1 4.25Å; K1263-I1265 VanDerWaalsContact C-N 3.34Å; K1263-I1265 HydrophobicContact CB-CD1 4.42Å; K1263-I1265 HydrophobicContact CB-CG1 3.99Å; K1263-I1265 PolarHBondContact O-N 3.2Å; I1265-T1267 VanDerWaalsContact C-N 3.31Å; I1265-T1267 HydrophobicContact CG2-CG2 4.02Å; I1265-T1267 PolarHBondContact O-N 3.22Å; I1265-T1267 VanDerWaalsContact O-N 3.12Å; I1265-I1270 HydrophobicContact CG2-CD1 4.03Å
1266	N	71.4	Confident	77.3	Confident	95.2 Å²	95.2	55.8 Å²	55.8	51%	0.509	29%	0.285	S	S	.	.			trans	-83.6	82.8	168.9	-174	4.5	0	0	0	110.7	N1264 K1268 L1269	N1264-N1266 PolarHBondContact O-N 3.22Å; N1266-K1268 PolarHBondContact O-N 3.2Å; N1266-K1268 VanDerWaalsContact O-N 3.13Å; N1266-K1268 WeakPolarHBondContact OD1-CB 3.17Å; N1266-K1268 PolarHBondContact OD1-N 2.84Å; N1266-L1269 HydrophobicContact CB-CB 4.43Å; N1266-L1269 WeakPolarHBondContact O-CB 3.36Å; N1266-L1269 PolarHBondContact O-N 2.88Å
1267	T	74.9	Confident	76.9	Confident	11 Å²	11	59.8 Å²	59.8	7%	0.067	31%	0.31	C	S	.	.	H	α-helix	trans	-55.4	-32.2	-177.3	53.2	0	0	0	0	113.4	I1265 L1269 I1270 E1271 L1281 Y1532	I1265-T1267 VanDerWaalsContact C-N 3.31Å; I1265-T1267 HydrophobicContact CG2-CG2 4.02Å; I1265-T1267 PolarHBondContact O-N 3.22Å; I1265-T1267 VanDerWaalsContact O-N 3.12Å; T1267-L1269 VanDerWaalsContact C-N 3.3Å; T1267-L1269 PolarHBondContact O-N 3.21Å; T1267-I1270 PolarHBondContact O-N 3.24Å; T1267-E1271 WeakPolarHBondContact O-CG 3.38Å; T1267-E1271 PolarHBondContact O-N 3.1Å; T1267-E1271 VanDerWaalsContact O-N 3.09Å; T1267-L1281 HydrophobicContact CG2-CD2 4.4Å; T1267-Y1532 HydrophobicContact CG2-CE1 4.21Å; T1267-Y1532 HydrophobicContact CG2-CE2 4.37Å; T1267-Y1532 VanDerWaalsContact CG2-OH 3.27Å; T1267-Y1532 WeakPolarHBondContact CG2-OH 3.37Å
1268	K	75.4	Confident	76.4	Confident	116.2 Å²	116.2	63.4 Å²	63.4	51%	0.505	34%	0.338	S	S	.	.	H	α-helix	trans	-63.7	-31.7	178.5	-73	173.8	178.1	167.5	0	113.3	N1266 S1272 T1535	N1266-K1268 PolarHBondContact O-N 3.2Å; N1266-K1268 VanDerWaalsContact O-N 3.13Å; N1266-K1268 WeakPolarHBondContact OD1-CB 3.17Å; N1266-K1268 PolarHBondContact OD1-N 2.84Å; K1268-S1272 WeakPolarHBondContact O-CB 3.44Å; K1268-S1272 PolarHBondContact O-N 2.99Å; K1268-S1272 PolarHBondContact O-OG 3.01Å; K1268-T1535 VanDerWaalsContact CE-O 3.24Å; K1268-T1535 WeakPolarHBondContact CE-O 3.28Å; K1268-T1535 PolarHBondContact NZ-O 2.92Å
1269	L	78.7	Confident	76.2	Confident	71.2 Å²	71.2	63 Å²	63	37%	0.373	34%	0.337	S	S	.	.	H	α-helix	trans	-65.8	-50.3	177.5	-173.9	78	0	0	0	110	Y861 N1266 T1267 E1271 S1272 E1273	Y861-L1269 VanDerWaalsContact OH-CD2 3.32Å; Y861-L1269 WeakPolarHBondContact OH-CD2 3.42Å; N1266-L1269 HydrophobicContact CB-CB 4.43Å; N1266-L1269 WeakPolarHBondContact O-CB 3.36Å; N1266-L1269 PolarHBondContact O-N 2.88Å; T1267-L1269 VanDerWaalsContact C-N 3.3Å; T1267-L1269 PolarHBondContact O-N 3.21Å; L1269-E1271 VanDerWaalsContact C-N 3.33Å; L1269-E1271 PolarHBondContact O-N 3.19Å; L1269-S1272 CarbonylContact O-C 3.55Å; L1269-S1272 WeakPolarHBondContact O-CA 3.26Å; L1269-S1272 PolarHBondContact O-N 3.1Å; L1269-S1272 VanDerWaalsContact O-N 3.12Å; L1269-S1272 PolarHBondContact O-OG 3.2Å; L1269-E1273 HydrophobicContact CD1-CG 4.45Å; L1269-E1273 HydrophobicContact CD2-CG 4.47Å; L1269-E1273 WeakPolarHBondContact CD2-OE1 3.3Å; L1269-E1273 HydrophobicContact CG-CG 4.43Å; L1269-E1273 VanDerWaalsContact O-CG 3.3Å; L1269-E1273 WeakPolarHBondContact O-CG 3.31Å; L1269-E1273 PolarHBondContact O-N 3.18Å
1270	I	80.8	Confident	76.3	Confident	2.6 Å²	2.6	63.3 Å²	63.3	1%	0.013	34%	0.338	C	S	.	.	H	α-helix	trans	-61.3	-41.3	179.5	-59.5	176.6	0	0	0	111.3	T1197 L1200 H1201 I1265 T1267 S1272 E1273 R1274 L1281	T1197-I1270 HydrophobicContact CG2-CD1 4.31Å; T1197-I1270 HydrophobicContact CG2-CG1 4.19Å; T1197-I1270 HydrophobicContact CG2-CG2 4.22Å; T1197-I1270 WeakPolarHBondContact OG1-CD1 3.47Å; L1200-I1270 HydrophobicContact CB-CD1 3.96Å; L1200-I1270 HydrophobicContact CD2-CD1 3.63Å; L1200-I1270 HydrophobicContact CD2-CG2 4.39Å; L1200-I1270 HydrophobicContact CG-CD1 3.8Å; H1201-I1270 VanDerWaalsContact CE1-CG2 3.44Å; H1201-I1270 WeakPolarHBondContact CE1-CG2 3.2Å; H1201-I1270 WeakPolarHBondContact NE2-CG2 3.49Å; I1265-I1270 HydrophobicContact CG2-CD1 4.03Å; T1267-I1270 PolarHBondContact O-N 3.24Å; I1270-S1272 VanDerWaalsContact C-N 3.33Å; I1270-S1272 PolarHBondContact O-N 3.01Å; I1270-E1273 WeakPolarHBondContact CA-OE2 3.2Å; I1270-E1273 PolarHBondContact O-N 3.45Å; I1270-R1274 WeakPolarHBondContact O-CG 3.31Å; I1270-R1274 PolarHBondContact O-N 3.12Å; I1270-R1274 VanDerWaalsContact O-N 3.15Å; I1270-L1281 HydrophobicContact CB-CD2 4.3Å; I1270-L1281 HydrophobicContact CD1-CD2 4.37Å; I1270-L1281 HydrophobicContact CG2-CD2 4.15Å
1271	E	84.5	Confident	76.8	Confident	5.2 Å²	5.2	62.7 Å²	62.7	2%	0.024	34%	0.336	C	S	.	.	H	α-helix	trans	-63.8	-42.8	174.5	-70.3	-179.5	162.8	0	0	111.5	T1267 L1269 R1274 N1275 L1276 S1278 G1279 S1280 L1281	T1267-E1271 WeakPolarHBondContact O-CG 3.38Å; T1267-E1271 PolarHBondContact O-N 3.1Å; T1267-E1271 VanDerWaalsContact O-N 3.09Å; L1269-E1271 VanDerWaalsContact C-N 3.33Å; L1269-E1271 PolarHBondContact O-N 3.19Å; E1271-R1274 PolarHBondContact O-N 2.97Å; E1271-N1275 PolarHBondContact O-N 3.22Å; E1271-L1276 HydrophobicContact CB-CB 4.39Å; E1271-L1276 PolarHBondContact O-N 3.14Å; E1271-S1278 WeakPolarHBondContact OE2-CA 3.38Å; E1271-G1279 VanDerWaalsContact CD-N 3.27Å; E1271-G1279 VanDerWaalsContact OE1-C 3.26Å; E1271-G1279 VanDerWaalsContact OE1-CA 3.22Å; E1271-G1279 WeakPolarHBondContact OE1-CA 3.42Å; E1271-G1279 PolarHBondContact OE1-N 3.11Å; E1271-G1279 VanDerWaalsContact OE1-N 3.13Å; E1271-G1279 PolarHBondContact OE2-N 3.23Å; E1271-G1279 VanDerWaalsContact OE2-N 3.08Å; E1271-S1280 PolarHBondContact OE1-N 3.19Å; E1271-S1280 VanDerWaalsContact OE1-N 3.14Å; E1271-L1281 HydrophobicContact CG-CB 4.08Å; E1271-L1281 WeakPolarHBondContact OE1-CB 3.36Å; E1271-L1281 PolarHBondContact OE1-N 3.25Å
1272	S	80.8	Confident	77.7	Confident	73.4 Å²	73.4	58.3 Å²	58.3	51%	0.513	31%	0.312	S	S	.	.	H	α-helix	trans	-67.2	-40.1	177.9	70.7	0	0	0	0	113.8	K1268 L1269 I1270 R1274 N1275	K1268-S1272 WeakPolarHBondContact O-CB 3.44Å; K1268-S1272 PolarHBondContact O-N 2.99Å; K1268-S1272 PolarHBondContact O-OG 3.01Å; L1269-S1272 CarbonylContact O-C 3.55Å; L1269-S1272 WeakPolarHBondContact O-CA 3.26Å; L1269-S1272 PolarHBondContact O-N 3.1Å; L1269-S1272 VanDerWaalsContact O-N 3.12Å; L1269-S1272 PolarHBondContact O-OG 3.2Å; I1270-S1272 VanDerWaalsContact C-N 3.33Å; I1270-S1272 PolarHBondContact O-N 3.01Å; S1272-R1274 VanDerWaalsContact C-N 3.3Å; S1272-R1274 PolarHBondContact O-N 3.02Å; S1272-N1275 PolarHBondContact O-N 3.22Å
1273	E	80.2	Confident	78.9	Confident	82.2 Å²	82.2	58.4 Å²	58.4	38%	0.384	31%	0.309	S	S	.	.	H	α-helix	trans	-68	-27.3	180	-74.8	-179	178.2	0	0	112.9	Y861 H1201 L1269 I1270 N1275	Y861-E1273 VanDerWaalsContact CE1-OE1 3.3Å; Y861-E1273 WeakPolarHBondContact CE1-OE1 3.31Å; Y861-E1273 VanDerWaalsContact OH-CD 3.28Å; Y861-E1273 PolarHBondContact OH-OE1 3.16Å; Y861-E1273 PolarHBondContact OH-OE2 3.12Å; Y861-E1273 VanDerWaalsContact OH-OE2 3.13Å; H1201-E1273 IonicContact CE1-OE2 3.57Å; H1201-E1273 PolarHBondContact CE1-OE2 3.12Å; H1201-E1273 VanDerWaalsContact CE1-OE2 3.31Å; H1201-E1273 IonicContact NE2-OE2 3.22Å; H1201-E1273 PolarHBondContact NE2-OE2 3.27Å; L1269-E1273 HydrophobicContact CD1-CG 4.45Å; L1269-E1273 HydrophobicContact CD2-CG 4.47Å; L1269-E1273 WeakPolarHBondContact CD2-OE1 3.3Å; L1269-E1273 HydrophobicContact CG-CG 4.43Å; L1269-E1273 VanDerWaalsContact O-CG 3.3Å; L1269-E1273 WeakPolarHBondContact O-CG 3.31Å; L1269-E1273 PolarHBondContact O-N 3.18Å; I1270-E1273 WeakPolarHBondContact CA-OE2 3.2Å; I1270-E1273 PolarHBondContact O-N 3.45Å; E1273-N1275 VanDerWaalsContact C-N 3.3Å
1274	R	80.2	Confident	80.3	Confident	48.8 Å²	48.8	52.8 Å²	52.8	18%	0.184	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	4.1	175.9	-65.3	-144.7	85.2	-150.2	-4	114.1	W864 Q865 H1201 S1204 Y1205 I1270 E1271 S1272 L1276	W864-R1274 HydrophobicContact CH2-CG 4.31Å; W864-R1274 VanDerWaalsContact CH2-NH2 3.32Å; W864-R1274 HydrophobicContact CZ2-CG 4.41Å; W864-R1274 VanDerWaalsContact CZ2-CZ 3.49Å; Q865-R1274 VanDerWaalsContact CG-NH2 3.26Å; H1201-R1274 PolarHBondContact ND1-NE 3.29Å; H1201-R1274 PolarHBondContact ND1-NH2 3.4Å; H1201-R1274 VanDerWaalsContact ND1-NH2 3.19Å; H1201-R1274 PolarHBondContact O-NH2 3.3Å; S1204-R1274 PolarHBondContact O-NH1 3.06Å; S1204-R1274 PolarHBondContact OG-NH1 3.26Å; Y1205-R1274 VanDerWaalsContact CD2-CZ 3.44Å; I1270-R1274 WeakPolarHBondContact O-CG 3.31Å; I1270-R1274 PolarHBondContact O-N 3.12Å; I1270-R1274 VanDerWaalsContact O-N 3.15Å; E1271-R1274 PolarHBondContact O-N 2.97Å; S1272-R1274 VanDerWaalsContact C-N 3.3Å; S1272-R1274 PolarHBondContact O-N 3.02Å; R1274-L1276 HydrophobicContact CB-CD1 3.87Å; R1274-L1276 HydrophobicContact CB-CG 3.75Å; R1274-L1276 PolarHBondContact O-N 3.24Å; R1274-L1276 VanDerWaalsContact O-N 3.13Å
1275	N	81.5	Confident	81.7	Confident	144 Å²	144	45.8 Å²	45.8	77%	0.77	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.8	32.9	-171.4	-60.3	-65.8	0	0	0	113.3	E1271 S1272 E1273	E1271-N1275 PolarHBondContact O-N 3.22Å; S1272-N1275 PolarHBondContact O-N 3.22Å; E1273-N1275 VanDerWaalsContact C-N 3.3Å
1276	L	81.3	Confident	82.8	Confident	30.8 Å²	30.8	44.8 Å²	44.8	16%	0.161	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-82.8	140.5	177.9	-67	172	0	0	0	110.2	E1271 R1274 S1278 L1768	E1271-L1276 HydrophobicContact CB-CB 4.39Å; E1271-L1276 PolarHBondContact O-N 3.14Å; R1274-L1276 HydrophobicContact CB-CD1 3.87Å; R1274-L1276 HydrophobicContact CB-CG 3.75Å; R1274-L1276 PolarHBondContact O-N 3.24Å; R1274-L1276 VanDerWaalsContact O-N 3.13Å; L1276-S1278 PolarHBondContact O-N 2.83Å; L1276-L1768 HydrophobicContact CD2-CD1 4.15Å; L1276-L1768 HydrophobicContact CD2-CD2 4.41Å
1277	P	82.1	Confident	83.9	Confident	83.4 Å²	83.4	41.2 Å²	41.2	54%	0.542	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-63.1	148.6	172.2	14.7	-16.7	0	0	0	110.9	G1279 S1280 R1283	P1277-G1279 PolarHBondContact O-N 3.4Å; P1277-S1280 VanDerWaalsContact CD-OG 3.28Å; P1277-S1280 WeakPolarHBondContact CD-OG 3.38Å; P1277-S1280 VanDerWaalsContact CG-OG 3.29Å; P1277-S1280 WeakPolarHBondContact CG-OG 3.37Å; P1277-S1280 VanDerWaalsContact O-CB 3.27Å; P1277-S1280 WeakPolarHBondContact O-CB 3.42Å; P1277-S1280 PolarHBondContact O-N 3.21Å; P1277-S1280 PolarHBondContact O-OG 3.18Å; P1277-S1280 VanDerWaalsContact O-OG 3.06Å; P1277-R1283 PolarHBondContact O-NH2 2.95Å
1278	S	78.7	Confident	84.8	Confident	97.6 Å²	97.6	40.7 Å²	40.7	68%	0.683	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	135.8	-174.1	-55.7	0	0	0	0	113	E1271 L1276 S1280 R1283	E1271-S1278 WeakPolarHBondContact OE2-CA 3.38Å; L1276-S1278 PolarHBondContact O-N 2.83Å; S1278-S1280 VanDerWaalsContact C-N 3.31Å; S1278-S1280 PolarHBondContact O-N 3.2Å; S1278-R1283 PolarHBondContact O-NH1 3.09Å; S1278-R1283 VanDerWaalsContact O-NH1 3.09Å; S1278-R1283 PolarHBondContact O-NH2 3.02Å
1279	G	82	Confident	85.8	Confident	2.6 Å²	2.6	35.4 Å²	35.4	3%	0.027	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	76	4.6	-176.3	0	0	0	0	0	115	E1271 P1277 L1281 A1282 R1283	E1271-G1279 VanDerWaalsContact CD-N 3.27Å; E1271-G1279 VanDerWaalsContact OE1-C 3.26Å; E1271-G1279 VanDerWaalsContact OE1-CA 3.22Å; E1271-G1279 WeakPolarHBondContact OE1-CA 3.42Å; E1271-G1279 PolarHBondContact OE1-N 3.11Å; E1271-G1279 VanDerWaalsContact OE1-N 3.13Å; E1271-G1279 PolarHBondContact OE2-N 3.23Å; E1271-G1279 VanDerWaalsContact OE2-N 3.08Å; P1277-G1279 PolarHBondContact O-N 3.4Å; G1279-L1281 VanDerWaalsContact C-N 3.26Å; G1279-L1281 PolarHBondContact O-N 3.06Å; G1279-A1282 VanDerWaalsContact O-CB 3.28Å; G1279-A1282 WeakPolarHBondContact O-CB 3.36Å; G1279-A1282 PolarHBondContact O-N 3.13Å; G1279-A1282 VanDerWaalsContact O-N 3.14Å; G1279-R1283 VanDerWaalsContact C-NH1 3.3Å; G1279-R1283 WeakPolarHBondContact O-CG 3.33Å; G1279-R1283 PolarHBondContact O-N 3.07Å; G1279-R1283 VanDerWaalsContact O-N 3.12Å; G1279-R1283 PolarHBondContact O-NH1 3.35Å
1280	S	86.2	Confident	86.6	Confident	5.2 Å²	5.2	32.1 Å²	32.1	4%	0.036	18%	0.178	C	C	.	.	H	α-helix	trans	-59.1	-39	174.7	-76.7	0	0	0	0	112.1	E1271 P1277 S1278 A1282 R1283 Q1284 E1764	E1271-S1280 PolarHBondContact OE1-N 3.19Å; E1271-S1280 VanDerWaalsContact OE1-N 3.14Å; P1277-S1280 VanDerWaalsContact CD-OG 3.28Å; P1277-S1280 WeakPolarHBondContact CD-OG 3.38Å; P1277-S1280 VanDerWaalsContact CG-OG 3.29Å; P1277-S1280 WeakPolarHBondContact CG-OG 3.37Å; P1277-S1280 VanDerWaalsContact O-CB 3.27Å; P1277-S1280 WeakPolarHBondContact O-CB 3.42Å; P1277-S1280 PolarHBondContact O-N 3.21Å; P1277-S1280 PolarHBondContact O-OG 3.18Å; P1277-S1280 VanDerWaalsContact O-OG 3.06Å; S1278-S1280 VanDerWaalsContact C-N 3.31Å; S1278-S1280 PolarHBondContact O-N 3.2Å; S1280-A1282 VanDerWaalsContact C-N 3.29Å; S1280-A1282 PolarHBondContact O-N 3.19Å; S1280-R1283 VanDerWaalsContact CA-NH2 3.3Å; S1280-R1283 CarbonylContact O-C 3.51Å; S1280-R1283 PolarHBondContact O-N 3.21Å; S1280-R1283 VanDerWaalsContact O-N 3.14Å; S1280-R1283 PolarHBondContact OG-NH2 3.09Å; S1280-Q1284 VanDerWaalsContact O-CG 3.29Å; S1280-Q1284 WeakPolarHBondContact O-CG 3.35Å; S1280-Q1284 PolarHBondContact O-N 3.12Å; S1280-Q1284 VanDerWaalsContact O-N 3.1Å; S1280-E1764 PolarHBondContact OG-OE1 3.38Å; S1280-E1764 VanDerWaalsContact OG-OE1 3.07Å
1281	L	87.7	Confident	87.2	Confident	1.2 Å²	1.2	32 Å²	32	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-65.9	-38.1	179.2	-174.4	71.5	0	0	0	110.7	L1200 T1267 I1270 E1271 G1279 R1283 Q1284 L1285	L1200-L1281 HydrophobicContact CB-CD1 4.31Å; L1200-L1281 HydrophobicContact CD1-CD1 4.23Å; L1200-L1281 HydrophobicContact CD1-CD2 4.43Å; L1200-L1281 HydrophobicContact CD2-CD1 3.93Å; L1200-L1281 HydrophobicContact CD2-CD2 3.9Å; L1200-L1281 VanDerWaalsContact CD2-CD2 3.43Å; L1200-L1281 HydrophobicContact CD2-CG 4.32Å; L1200-L1281 HydrophobicContact CG-CD1 4.16Å; L1200-L1281 HydrophobicContact CG-CD2 4.06Å; L1200-L1281 HydrophobicContact CG-CG 4.35Å; T1267-L1281 HydrophobicContact CG2-CD2 4.4Å; I1270-L1281 HydrophobicContact CB-CD2 4.3Å; I1270-L1281 HydrophobicContact CD1-CD2 4.37Å; I1270-L1281 HydrophobicContact CG2-CD2 4.15Å; E1271-L1281 HydrophobicContact CG-CB 4.08Å; E1271-L1281 WeakPolarHBondContact OE1-CB 3.36Å; E1271-L1281 PolarHBondContact OE1-N 3.25Å; G1279-L1281 VanDerWaalsContact C-N 3.26Å; G1279-L1281 PolarHBondContact O-N 3.06Å; L1281-R1283 VanDerWaalsContact C-N 3.33Å; L1281-R1283 PolarHBondContact O-N 3.2Å; L1281-Q1284 PolarHBondContact O-N 3.17Å; L1281-L1285 HydrophobicContact CD1-CD1 4.24Å; L1281-L1285 HydrophobicContact CD1-CG 4.39Å; L1281-L1285 HydrophobicContact CD2-CD1 3.52Å; L1281-L1285 HydrophobicContact CD2-CG 4.46Å; L1281-L1285 HydrophobicContact CG-CD1 4.02Å; L1281-L1285 WeakPolarHBondContact O-CB 3.31Å; L1281-L1285 WeakPolarHBondContact O-CD1 3.32Å; L1281-L1285 VanDerWaalsContact O-CG 3.28Å; L1281-L1285 WeakPolarHBondContact O-CG 3.39Å; L1281-L1285 PolarHBondContact O-N 3.19Å
1282	A	87	Confident	87.6	Confident	1.6 Å²	1.6	31.8 Å²	31.8	1%	0.013	18%	0.177	C	C	.	.	H	α-helix	trans	-59.3	-44.4	172.3	0	0	0	0	0	111.7	G1279 S1280 L1285 L1286 Y1532 L1542	G1279-A1282 VanDerWaalsContact O-CB 3.28Å; G1279-A1282 WeakPolarHBondContact O-CB 3.36Å; G1279-A1282 PolarHBondContact O-N 3.13Å; G1279-A1282 VanDerWaalsContact O-N 3.14Å; S1280-A1282 VanDerWaalsContact C-N 3.29Å; S1280-A1282 PolarHBondContact O-N 3.19Å; A1282-L1285 PolarHBondContact O-N 3.2Å; A1282-L1286 VanDerWaalsContact O-CB 3.24Å; A1282-L1286 WeakPolarHBondContact O-CB 3.29Å; A1282-L1286 PolarHBondContact O-N 3.14Å; A1282-Y1532 HydrophobicContact CB-CD1 3.58Å; A1282-Y1532 HydrophobicContact CB-CD2 3.61Å; A1282-Y1532 HydrophobicContact CB-CE1 3.52Å; A1282-Y1532 VanDerWaalsContact CB-CE1 3.43Å; A1282-Y1532 HydrophobicContact CB-CE2 3.55Å; A1282-Y1532 HydrophobicContact CB-CG 3.61Å; A1282-Y1532 VanDerWaalsContact CB-CZ 3.44Å; A1282-Y1532 PolarHBondContact N-OH 3.17Å; A1282-L1542 HydrophobicContact CB-CD1 4.15Å; A1282-L1542 HydrophobicContact CB-CD2 3.91Å
1283	R	89.6	Confident	88.3	Confident	55.4 Å²	55.4	28.3 Å²	28.3	21%	0.209	15%	0.153	C	C	.	.	H	α-helix	trans	-67.4	-39.3	179.1	-71	-172.7	-60.6	-89.6	3	112.5	P1277 S1278 G1279 S1280 L1281 L1286 R1287 F1541 L1542 L1761 E1764	P1277-R1283 PolarHBondContact O-NH2 2.95Å; S1278-R1283 PolarHBondContact O-NH1 3.09Å; S1278-R1283 VanDerWaalsContact O-NH1 3.09Å; S1278-R1283 PolarHBondContact O-NH2 3.02Å; G1279-R1283 VanDerWaalsContact C-NH1 3.3Å; G1279-R1283 WeakPolarHBondContact O-CG 3.33Å; G1279-R1283 PolarHBondContact O-N 3.07Å; G1279-R1283 VanDerWaalsContact O-N 3.12Å; G1279-R1283 PolarHBondContact O-NH1 3.35Å; S1280-R1283 VanDerWaalsContact CA-NH2 3.3Å; S1280-R1283 CarbonylContact O-C 3.51Å; S1280-R1283 PolarHBondContact O-N 3.21Å; S1280-R1283 VanDerWaalsContact O-N 3.14Å; S1280-R1283 PolarHBondContact OG-NH2 3.09Å; L1281-R1283 VanDerWaalsContact C-N 3.33Å; L1281-R1283 PolarHBondContact O-N 3.2Å; R1283-L1286 PolarHBondContact O-N 2.94Å; R1283-R1287 WeakPolarHBondContact O-CB 3.28Å; R1283-R1287 VanDerWaalsContact O-CG 3.32Å; R1283-R1287 WeakPolarHBondContact O-CG 3.35Å; R1283-R1287 PolarHBondContact O-N 3.2Å; R1283-F1541 VanDerWaalsContact CD-CE1 3.47Å; R1283-F1541 HydrophobicContact CG-CD1 4.28Å; R1283-F1541 HydrophobicContact CG-CE1 4.14Å; R1283-L1542 HydrophobicContact CG-CD1 4.25Å; R1283-L1761 HydrophobicContact CB-CD1 3.59Å; R1283-L1761 HydrophobicContact CG-CD1 3.84Å; R1283-E1764 VanDerWaalsContact CB-OE2 3.25Å; R1283-E1764 WeakPolarHBondContact CB-OE2 3.27Å; R1283-E1764 VanDerWaalsContact CD-OE2 3.29Å; R1283-E1764 WeakPolarHBondContact CD-OE2 3.46Å; R1283-E1764 IonicContact CZ-OE1 3.04Å; R1283-E1764 VanDerWaalsContact CZ-OE1 3.27Å; R1283-E1764 IonicContact CZ-OE2 3.94Å; R1283-E1764 VanDerWaalsContact NE-CD 3.3Å; R1283-E1764 IonicContact NE-OE1 3.13Å; R1283-E1764 PolarHBondContact NE-OE1 2.78Å; R1283-E1764 IonicContact NE-OE2 2.96Å; R1283-E1764 PolarHBondContact NE-OE2 2.96Å; R1283-E1764 IonicContact NH2-OE1 2.93Å; R1283-E1764 PolarHBondContact NH2-OE1 3.23Å
1284	Q	91.4	Very high	88.9	Confident	7 Å²	7	24.4 Å²	24.4	3%	0.033	13%	0.134	C	C	.	.	H	α-helix	trans	-62.9	-46.7	173.1	-70.8	-175.1	-49.5	0	0	112	S1204 S1207 D1208 S1280 L1281 L1286 R1287 L1288 L1768	S1204-Q1284 PolarHBondContact O-NE2 3.19Å; S1204-Q1284 PolarHBondContact O-OE1 2.77Å; S1204-Q1284 PolarHBondContact OG-OE1 3.17Å; S1207-Q1284 PolarHBondContact OG-NE2 2.68Å; D1208-Q1284 WeakPolarHBondContact OD2-CG 3.32Å; D1208-Q1284 PolarHBondContact OD2-NE2 3.09Å; S1280-Q1284 VanDerWaalsContact O-CG 3.29Å; S1280-Q1284 WeakPolarHBondContact O-CG 3.35Å; S1280-Q1284 PolarHBondContact O-N 3.12Å; S1280-Q1284 VanDerWaalsContact O-N 3.1Å; L1281-Q1284 PolarHBondContact O-N 3.17Å; Q1284-L1286 VanDerWaalsContact C-N 3.32Å; Q1284-L1286 PolarHBondContact O-N 3.06Å; Q1284-R1287 WeakPolarHBondContact O-CB 3.23Å; Q1284-R1287 PolarHBondContact O-N 3.19Å; Q1284-L1288 WeakPolarHBondContact O-CB 3.47Å; Q1284-L1288 PolarHBondContact O-N 3.3Å; Q1284-L1768 VanDerWaalsContact CD-CD2 3.4Å; Q1284-L1768 HydrophobicContact CG-CD2 3.9Å
1285	L	91.8	Very high	89.4	Confident	3.2 Å²	3.2	22.3 Å²	22.3	2%	0.017	13%	0.126	C	C	.	.	H	α-helix	trans	-66.6	-36.7	178.7	-67.4	166.4	0	0	0	111.6	L1200 I1203 A1256 I1260 L1281 A1282 L1288 Y1289 L1528	L1200-L1285 HydrophobicContact CD1-CD1 4.4Å; L1200-L1285 HydrophobicContact CD1-CD2 4.45Å; I1203-L1285 HydrophobicContact CG2-CD2 4Å; A1256-L1285 HydrophobicContact CB-CD2 4.06Å; I1260-L1285 HydrophobicContact CD1-CB 4.38Å; I1260-L1285 HydrophobicContact CD1-CD1 3.64Å; I1260-L1285 VanDerWaalsContact CD1-CD1 3.49Å; I1260-L1285 HydrophobicContact CD1-CD2 3.97Å; I1260-L1285 HydrophobicContact CD1-CG 4.2Å; I1260-L1285 HydrophobicContact CG1-CD1 4.22Å; L1281-L1285 HydrophobicContact CD1-CD1 4.24Å; L1281-L1285 HydrophobicContact CD1-CG 4.39Å; L1281-L1285 HydrophobicContact CD2-CD1 3.52Å; L1281-L1285 HydrophobicContact CD2-CG 4.46Å; L1281-L1285 HydrophobicContact CG-CD1 4.02Å; L1281-L1285 WeakPolarHBondContact O-CB 3.31Å; L1281-L1285 WeakPolarHBondContact O-CD1 3.32Å; L1281-L1285 VanDerWaalsContact O-CG 3.28Å; L1281-L1285 WeakPolarHBondContact O-CG 3.39Å; L1281-L1285 PolarHBondContact O-N 3.19Å; A1282-L1285 PolarHBondContact O-N 3.2Å; L1285-L1288 HydrophobicContact CD2-CD2 4.45Å; L1285-L1288 WeakPolarHBondContact O-CB 3.38Å; L1285-L1288 PolarHBondContact O-N 3.01Å; L1285-Y1289 WeakPolarHBondContact O-CB 3.33Å; L1285-Y1289 WeakPolarHBondContact O-CD2 3.48Å; L1285-Y1289 PolarHBondContact O-N 3.18Å; L1285-L1528 HydrophobicContact CB-CD1 3.97Å; L1285-L1528 HydrophobicContact CB-CD2 4.16Å; L1285-L1528 HydrophobicContact CD1-CD1 4.26Å
1286	L	92.8	Very high	89.9	Confident	3 Å²	3	15.5 Å²	15.5	2%	0.016	9%	0.09	C	C	.	.	H	α-helix	trans	-61.4	-47.4	171.6	-178.8	61.6	0	0	0	110.5	A1282 R1283 Q1284 L1288 Y1289 L1290 L1525 L1528 L1542 A1545 L1761	A1282-L1286 VanDerWaalsContact O-CB 3.24Å; A1282-L1286 WeakPolarHBondContact O-CB 3.29Å; A1282-L1286 PolarHBondContact O-N 3.14Å; R1283-L1286 PolarHBondContact O-N 2.94Å; Q1284-L1286 VanDerWaalsContact C-N 3.32Å; Q1284-L1286 PolarHBondContact O-N 3.06Å; L1286-L1288 VanDerWaalsContact C-N 3.31Å; L1286-L1288 PolarHBondContact O-N 3.35Å; L1286-Y1289 PolarHBondContact O-N 3.2Å; L1286-L1290 HydrophobicContact CD1-CD1 3.91Å; L1286-L1290 HydrophobicContact CD1-CD2 4.35Å; L1286-L1290 HydrophobicContact CD1-CG 3.86Å; L1286-L1290 HydrophobicContact CD2-CD1 4.33Å; L1286-L1290 HydrophobicContact CG-CD1 3.71Å; L1286-L1290 HydrophobicContact CG-CG 4.11Å; L1286-L1290 VanDerWaalsContact O-CB 3.27Å; L1286-L1290 WeakPolarHBondContact O-CB 3.27Å; L1286-L1290 VanDerWaalsContact O-CG 3.22Å; L1286-L1290 WeakPolarHBondContact O-CG 3.35Å; L1286-L1290 PolarHBondContact O-N 3.08Å; L1286-L1525 HydrophobicContact CD1-CD2 3.54Å; L1286-L1525 VanDerWaalsContact CD1-CD2 3.46Å; L1286-L1528 VanDerWaalsContact CA-CD2 3.47Å; L1286-L1528 HydrophobicContact CB-CD2 3.73Å; L1286-L1528 HydrophobicContact CD1-CD2 4.26Å; L1286-L1528 HydrophobicContact CG-CD2 4.43Å; L1286-L1528 VanDerWaalsContact N-CD2 3.34Å; L1286-L1542 HydrophobicContact CB-CD1 3.89Å; L1286-L1542 HydrophobicContact CB-CD2 4.46Å; L1286-L1542 HydrophobicContact CD2-CB 4.1Å; L1286-L1542 HydrophobicContact CD2-CD1 3.54Å; L1286-L1542 HydrophobicContact CD2-CD2 4.45Å; L1286-L1542 HydrophobicContact CD2-CG 3.92Å; L1286-L1542 HydrophobicContact CG-CD1 4.27Å; L1286-A1545 HydrophobicContact CD2-CB 4.39Å; L1286-L1761 HydrophobicContact CD2-CD1 4.3Å; L1286-L1761 HydrophobicContact CD2-CD2 3.74Å; L1286-L1761 HydrophobicContact CG-CD2 4.06Å
1287	R	94.2	Very high	90.3	Very high	20 Å²	20	14.5 Å²	14.5	8%	0.075	9%	0.085	C	C	.	.	H	α-helix	trans	-59.2	-41	175.6	-74.6	-175.5	-61.9	-94.8	1	112.4	D1208 I1211 L1217 R1283 Q1284 L1290 T1291 L1761 E1764 G1765	D1208-R1287 IonicContact OD1-CZ 3.66Å; D1208-R1287 IonicContact OD1-NE 3.41Å; D1208-R1287 PolarHBondContact OD1-NE 3.28Å; D1208-R1287 IonicContact OD1-NH1 3.28Å; D1208-R1287 PolarHBondContact OD1-NH1 2.88Å; D1208-R1287 IonicContact OD1-NH2 3.44Å; D1208-R1287 PolarHBondContact OD1-NH2 3.16Å; D1208-R1287 IonicContact OD2-CZ 3.24Å; D1208-R1287 IonicContact OD2-NE 3.11Å; D1208-R1287 IonicContact OD2-NH1 2.7Å; D1208-R1287 PolarHBondContact OD2-NH1 3.41Å; D1208-R1287 IonicContact OD2-NH2 3.21Å; D1208-R1287 PolarHBondContact OD2-NH2 3.44Å; D1208-R1287 VanDerWaalsContact OD2-NH2 3.12Å; I1211-R1287 HydrophobicContact CD1-CB 3.86Å; L1217-R1287 HydrophobicContact CD2-CG 4.38Å; R1283-R1287 WeakPolarHBondContact O-CB 3.28Å; R1283-R1287 VanDerWaalsContact O-CG 3.32Å; R1283-R1287 WeakPolarHBondContact O-CG 3.35Å; R1283-R1287 PolarHBondContact O-N 3.2Å; Q1284-R1287 WeakPolarHBondContact O-CB 3.23Å; Q1284-R1287 PolarHBondContact O-N 3.19Å; R1287-L1290 PolarHBondContact O-N 3.11Å; R1287-T1291 WeakPolarHBondContact O-CB 3.36Å; R1287-T1291 PolarHBondContact O-N 3.21Å; R1287-T1291 PolarHBondContact O-OG1 3.05Å; R1287-L1761 VanDerWaalsContact CD-O 3.28Å; R1287-L1761 WeakPolarHBondContact CD-O 3.32Å; R1287-L1761 HydrophobicContact CG-CD1 4.12Å; R1287-L1761 HydrophobicContact CG-CD2 4.19Å; R1287-L1761 HydrophobicContact CG-CG 3.8Å; R1287-L1761 PolarHBondContact NH1-O 3.1Å; R1287-E1764 IonicContact CZ-OE2 3.3Å; R1287-E1764 IonicContact NH1-OE2 3.49Å; R1287-E1764 PolarHBondContact NH1-OE2 3.21Å; R1287-E1764 IonicContact NH2-OE2 3.16Å; R1287-E1764 PolarHBondContact NH2-OE2 2.91Å; R1287-E1764 VanDerWaalsContact NH2-OE2 3.13Å; R1287-G1765 VanDerWaalsContact CZ-CA 3.45Å; R1287-G1765 VanDerWaalsContact NE-CA 3.32Å
1288	L	94.9	Very high	90.6	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60	-53.4	176.6	-172.8	73.3	0	0	0	111	I1203 I1211 L1249 L1252 A1256 Q1284 L1285 L1286 L1290 T1291 A1292	I1203-L1288 HydrophobicContact CG2-CD2 4.27Å; I1211-L1288 HydrophobicContact CD1-CB 4.32Å; I1211-L1288 HydrophobicContact CD1-CD1 4.35Å; I1211-L1288 HydrophobicContact CG1-CD1 4.43Å; L1249-L1288 HydrophobicContact CD1-CD1 3.7Å; L1249-L1288 HydrophobicContact CD1-CG 4.46Å; L1252-L1288 HydrophobicContact CB-CD1 4.27Å; L1252-L1288 HydrophobicContact CB-CD2 4.36Å; L1252-L1288 HydrophobicContact CD1-CD1 4.42Å; L1252-L1288 HydrophobicContact CD2-CD1 4.02Å; L1252-L1288 HydrophobicContact CD2-CD2 4.32Å; L1252-L1288 HydrophobicContact CG-CD2 4.29Å; A1256-L1288 HydrophobicContact CB-CD2 3.97Å; Q1284-L1288 WeakPolarHBondContact O-CB 3.47Å; Q1284-L1288 PolarHBondContact O-N 3.3Å; L1285-L1288 HydrophobicContact CD2-CD2 4.45Å; L1285-L1288 WeakPolarHBondContact O-CB 3.38Å; L1285-L1288 PolarHBondContact O-N 3.01Å; L1286-L1288 VanDerWaalsContact C-N 3.31Å; L1286-L1288 PolarHBondContact O-N 3.35Å; L1288-L1290 PolarHBondContact O-N 3.21Å; L1288-T1291 PolarHBondContact O-N 3.11Å; L1288-A1292 PolarHBondContact O-N 3.25Å
1289	Y	94.6	Very high	91	Very high	4.4 Å²	4.4	6.5 Å²	6.5	2%	0.017	3%	0.03	C	C	.	.	H	α-helix	trans	-66.4	-37.7	180	-66.6	-25.8	0	0	0	113.4	T1253 A1256 D1257 I1260 L1285 L1286 T1291 A1292 A1293 R1524 L1528	T1253-Y1289 HydrophobicContact CG2-CD1 3.99Å; T1253-Y1289 HydrophobicContact CG2-CE1 3.94Å; A1256-Y1289 HydrophobicContact CB-CE1 4.14Å; D1257-Y1289 PolarHBondContact N-OH 2.97Å; D1257-Y1289 VanDerWaalsContact OD1-CE1 3.29Å; D1257-Y1289 WeakPolarHBondContact OD1-CE1 3.47Å; D1257-Y1289 VanDerWaalsContact OD1-CZ 3.29Å; D1257-Y1289 PolarHBondContact OD1-OH 3.17Å; D1257-Y1289 VanDerWaalsContact OD1-OH 3.1Å; I1260-Y1289 HydrophobicContact CD1-CE2 3.88Å; I1260-Y1289 VanDerWaalsContact CD1-OH 3.24Å; I1260-Y1289 WeakPolarHBondContact CD1-OH 3.33Å; L1285-Y1289 WeakPolarHBondContact O-CB 3.33Å; L1285-Y1289 WeakPolarHBondContact O-CD2 3.48Å; L1285-Y1289 PolarHBondContact O-N 3.18Å; L1286-Y1289 PolarHBondContact O-N 3.2Å; Y1289-T1291 VanDerWaalsContact C-N 3.34Å; Y1289-T1291 PolarHBondContact O-N 3.06Å; Y1289-A1292 PolarHBondContact O-N 3.09Å; Y1289-A1293 VanDerWaalsContact O-CB 3.24Å; Y1289-A1293 WeakPolarHBondContact O-CB 3.23Å; Y1289-A1293 PolarHBondContact O-N 3.11Å; Y1289-R1524 HydrophobicContact CD1-CB 4.29Å; Y1289-R1524 HydrophobicContact CD1-CG 4.33Å; Y1289-R1524 HydrophobicContact CD2-CB 3.83Å; Y1289-R1524 HydrophobicContact CD2-CG 4.4Å; Y1289-R1524 HydrophobicContact CE1-CB 4.39Å; Y1289-R1524 HydrophobicContact CE1-CG 4.14Å; Y1289-R1524 HydrophobicContact CE2-CB 3.97Å; Y1289-R1524 HydrophobicContact CE2-CG 4.35Å; Y1289-R1524 HydrophobicContact CG-CB 4.01Å; Y1289-R1524 HydrophobicContact CG-CG 4.44Å; Y1289-L1528 HydrophobicContact CD2-CB 4.47Å; Y1289-L1528 HydrophobicContact CD2-CD2 4.01Å; Y1289-L1528 HydrophobicContact CE2-CB 4.36Å; Y1289-L1528 HydrophobicContact CE2-CD2 4.36Å
1290	L	95.2	Very high	91.1	Very high	3.4 Å²	3.4	6.9 Å²	6.9	2%	0.018	3%	0.033	C	C	.	.	H	α-helix	trans	-64.1	-40.3	172.9	-70.9	176	0	0	0	111.5	L1217 L1286 R1287 L1288 A1293 V1294 L1525 F1549 F1758 L1761	L1217-L1290 HydrophobicContact CD1-CB 4.09Å; L1217-L1290 HydrophobicContact CD2-CB 4.01Å; L1217-L1290 HydrophobicContact CD2-CD1 4.33Å; L1286-L1290 HydrophobicContact CD1-CD1 3.91Å; L1286-L1290 HydrophobicContact CD1-CD2 4.35Å; L1286-L1290 HydrophobicContact CD1-CG 3.86Å; L1286-L1290 HydrophobicContact CD2-CD1 4.33Å; L1286-L1290 HydrophobicContact CG-CD1 3.71Å; L1286-L1290 HydrophobicContact CG-CG 4.11Å; L1286-L1290 VanDerWaalsContact O-CB 3.27Å; L1286-L1290 WeakPolarHBondContact O-CB 3.27Å; L1286-L1290 VanDerWaalsContact O-CG 3.22Å; L1286-L1290 WeakPolarHBondContact O-CG 3.35Å; L1286-L1290 PolarHBondContact O-N 3.08Å; R1287-L1290 PolarHBondContact O-N 3.11Å; L1288-L1290 PolarHBondContact O-N 3.21Å; L1290-A1293 PolarHBondContact O-N 2.98Å; L1290-V1294 WeakPolarHBondContact O-CB 3.35Å; L1290-V1294 VanDerWaalsContact O-CG2 3.26Å; L1290-V1294 WeakPolarHBondContact O-CG2 3.4Å; L1290-V1294 PolarHBondContact O-N 3.23Å; L1290-L1525 HydrophobicContact CD2-CD1 4.34Å; L1290-L1525 HydrophobicContact CD2-CD2 3.96Å; L1290-L1525 HydrophobicContact CG-CD2 4.35Å; L1290-F1549 HydrophobicContact CD2-CB 4.05Å; L1290-F1549 HydrophobicContact CD2-CD1 3.25Å; L1290-F1549 HydrophobicContact CD2-CD2 4.06Å; L1290-F1549 HydrophobicContact CD2-CE1 3.59Å; L1290-F1549 HydrophobicContact CD2-CE2 4.35Å; L1290-F1549 HydrophobicContact CD2-CG 3.5Å; L1290-F1549 VanDerWaalsContact CD2-CG 3.48Å; L1290-F1549 HydrophobicContact CD2-CZ 4.13Å; L1290-F1758 HydrophobicContact CD1-CE2 4.09Å; L1290-L1761 HydrophobicContact CD1-CD2 3.88Å
1291	T	94.5	Very high	90.9	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-66.9	-42	177.4	-53	0	0	0	0	110.9	I1211 C1214 L1220 L1249 R1287 L1288 Y1289 V1294 R1295	I1211-T1291 HydrophobicContact CG1-CG2 4.42Å; I1211-T1291 HydrophobicContact CG2-CG2 4.31Å; I1211-T1291 WeakPolarHBondContact CG2-OG1 3.23Å; C1214-T1291 HydrophobicContact CB-CG2 4.37Å; L1220-T1291 HydrophobicContact CD1-CG2 3.85Å; L1249-T1291 HydrophobicContact CD1-CG2 4.04Å; L1249-T1291 HydrophobicContact CD2-CG2 3.82Å; R1287-T1291 WeakPolarHBondContact O-CB 3.36Å; R1287-T1291 PolarHBondContact O-N 3.21Å; R1287-T1291 PolarHBondContact O-OG1 3.05Å; L1288-T1291 PolarHBondContact O-N 3.11Å; Y1289-T1291 VanDerWaalsContact C-N 3.34Å; Y1289-T1291 PolarHBondContact O-N 3.06Å; T1291-V1294 PolarHBondContact O-N 3.14Å; T1291-R1295 VanDerWaalsContact O-CB 3.29Å; T1291-R1295 WeakPolarHBondContact O-CB 3.3Å; T1291-R1295 PolarHBondContact O-N 2.88Å
1292	A	93.6	Very high	90.5	Very high	1 Å²	1	8.8 Å²	8.8	1%	0.008	4%	0.039	C	C	.	.	H	α-helix	trans	-61.8	-45.1	173.3	0	0	0	0	0	112.1	T1253 L1288 Y1289 V1294 R1295 N1296	T1253-A1292 HydrophobicContact CG2-CB 4.4Å; L1288-A1292 PolarHBondContact O-N 3.25Å; Y1289-A1292 PolarHBondContact O-N 3.09Å; A1292-V1294 PolarHBondContact O-N 3.04Å; A1292-R1295 WeakPolarHBondContact O-CB 3.43Å; A1292-R1295 PolarHBondContact O-N 3.18Å; A1292-N1296 WeakPolarHBondContact O-CB 3.36Å; A1292-N1296 PolarHBondContact O-N 3.22Å; A1292-N1296 PolarHBondContact O-ND2 3.1Å; A1292-N1296 PolarHBondContact O-OD1 3.23Å
1293	A	93.7	Very high	90.1	Very high	0.4 Å²	0.4	13.1 Å²	13.1	0%	0.003	6%	0.062	C	C	.	.	H	α-helix	trans	-63.2	-42.7	177.7	0	0	0	0	0	112.8	Y1289 L1290 R1295 N1296 C1297 L1517 D1521 F1549	Y1289-A1293 VanDerWaalsContact O-CB 3.24Å; Y1289-A1293 WeakPolarHBondContact O-CB 3.23Å; Y1289-A1293 PolarHBondContact O-N 3.11Å; L1290-A1293 PolarHBondContact O-N 2.98Å; A1293-R1295 VanDerWaalsContact C-N 3.33Å; A1293-R1295 PolarHBondContact O-N 2.87Å; A1293-N1296 PolarHBondContact O-N 3.1Å; A1293-C1297 WeakPolarHBondContact O-CB 3.43Å; A1293-C1297 PolarHBondContact O-N 2.93Å; A1293-L1517 HydrophobicContact CB-CD2 4.01Å; A1293-D1521 HydrophobicContact CB-CB 4.11Å; A1293-F1549 HydrophobicContact CB-CE1 4.42Å; A1293-F1549 HydrophobicContact CB-CZ 4.18Å
1294	V	93.3	Very high	89.3	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-61.4	-43.1	173.2	169.8	0	0	0	0	110.8	L1217 L1220 L1221 A1224 L1290 T1291 A1292 C1297 L1298 F1549	L1217-V1294 HydrophobicContact CD1-CG2 4.01Å; L1220-V1294 VanDerWaalsContact C-CG1 3.47Å; L1220-V1294 HydrophobicContact CB-CG1 3.67Å; L1220-V1294 WeakPolarHBondContact O-CG1 3.35Å; L1221-V1294 HydrophobicContact CB-CG2 4.39Å; L1221-V1294 HydrophobicContact CD1-CG2 4.03Å; A1224-V1294 HydrophobicContact CB-CG1 4.08Å; L1290-V1294 WeakPolarHBondContact O-CB 3.35Å; L1290-V1294 VanDerWaalsContact O-CG2 3.26Å; L1290-V1294 WeakPolarHBondContact O-CG2 3.4Å; L1290-V1294 PolarHBondContact O-N 3.23Å; T1291-V1294 PolarHBondContact O-N 3.14Å; A1292-V1294 PolarHBondContact O-N 3.04Å; V1294-C1297 WeakPolarHBondContact O-CB 3.25Å; V1294-C1297 PolarHBondContact O-N 3.06Å; V1294-L1298 HydrophobicContact CG1-CD1 4.02Å; V1294-L1298 HydrophobicContact CG1-CG 4.47Å; V1294-L1298 WeakPolarHBondContact O-CB 3.29Å; V1294-L1298 WeakPolarHBondContact O-CG 3.41Å; V1294-L1298 PolarHBondContact O-N 2.88Å; V1294-F1549 HydrophobicContact CG2-CD2 4.46Å; V1294-F1549 HydrophobicContact CG2-CE2 3.49Å; V1294-F1549 VanDerWaalsContact CG2-CE2 3.44Å; V1294-F1549 HydrophobicContact CG2-CZ 4.08Å
1295	R	92	Very high	88.4	Confident	4.2 Å²	4.2	19.8 Å²	19.8	2%	0.016	9%	0.087	C	C	.	.	H	α-helix	trans	-63.7	-42.1	176.9	-166.3	-75.9	-62.8	-160.5	7.6	111.7	I1246 L1249 L1250 T1291 A1292 A1293 C1297 L1298 E1299 I1487	I1246-R1295 HydrophobicContact CD1-CG 4.36Å; I1246-R1295 HydrophobicContact CG1-CG 4.4Å; I1246-R1295 HydrophobicContact CG2-CG 3.89Å; L1249-R1295 HydrophobicContact CD2-CB 4.43Å; L1250-R1295 VanDerWaalsContact CD1-NH2 3.31Å; T1291-R1295 VanDerWaalsContact O-CB 3.29Å; T1291-R1295 WeakPolarHBondContact O-CB 3.3Å; T1291-R1295 PolarHBondContact O-N 2.88Å; A1292-R1295 WeakPolarHBondContact O-CB 3.43Å; A1292-R1295 PolarHBondContact O-N 3.18Å; A1293-R1295 VanDerWaalsContact C-N 3.33Å; A1293-R1295 PolarHBondContact O-N 2.87Å; R1295-C1297 VanDerWaalsContact C-N 3.32Å; R1295-C1297 PolarHBondContact O-N 3.35Å; R1295-L1298 WeakPolarHBondContact O-CB 3.48Å; R1295-L1298 PolarHBondContact O-N 3.1Å; R1295-E1299 IonicContact CZ-OE2 3.39Å; R1295-E1299 IonicContact NH1-OE2 3.14Å; R1295-E1299 PolarHBondContact NH1-OE2 3.17Å; R1295-E1299 IonicContact NH2-OE2 3.08Å; R1295-E1299 PolarHBondContact NH2-OE2 3.23Å; R1295-E1299 PolarHBondContact O-N 3.11Å; R1295-I1487 VanDerWaalsContact CD-O 3.28Å; R1295-I1487 WeakPolarHBondContact CD-O 3.36Å; R1295-I1487 HydrophobicContact CG-CG1 4.42Å; R1295-I1487 PolarHBondContact NH1-O 3.09Å
1296	N	91.8	Very high	87.6	Confident	1.6 Å²	1.6	20.5 Å²	20.5	1%	0.009	9%	0.091	C	C	.	.	H	α-helix	trans	-63.8	-40.6	174.9	-65.9	-10.7	0	0	0	111.8	A1292 A1293 E1299 S1300 V1510 Q1518 D1521	A1292-N1296 WeakPolarHBondContact O-CB 3.36Å; A1292-N1296 PolarHBondContact O-N 3.22Å; A1292-N1296 PolarHBondContact O-ND2 3.1Å; A1292-N1296 PolarHBondContact O-OD1 3.23Å; A1293-N1296 PolarHBondContact O-N 3.1Å; N1296-E1299 PolarHBondContact O-N 3.36Å; N1296-S1300 WeakPolarHBondContact O-CB 3.3Å; N1296-S1300 PolarHBondContact O-N 3.03Å; N1296-S1300 PolarHBondContact O-OG 3.04Å; N1296-V1510 HydrophobicContact CB-CG2 4.08Å; N1296-V1510 WeakPolarHBondContact O-CG2 3.4Å; N1296-Q1518 HydrophobicContact CB-CG 4.38Å; N1296-D1521 VanDerWaalsContact ND2-CG 3.34Å; N1296-D1521 PolarHBondContact ND2-OD1 3.19Å; N1296-D1521 VanDerWaalsContact ND2-OD1 3.16Å; N1296-D1521 PolarHBondContact ND2-OD2 3.14Å
1297	C	89.7	Confident	86.3	Confident	9.6 Å²	9.6	21.4 Å²	21.4	7%	0.065	10%	0.097	C	C	.	.	H	α-helix	trans	-66	-40.7	174.2	-176.6	0	0	0	0	112.1	A1293 V1294 R1295 E1299 S1300 R1301 L1516 M1553	A1293-C1297 WeakPolarHBondContact O-CB 3.43Å; A1293-C1297 PolarHBondContact O-N 2.93Å; V1294-C1297 WeakPolarHBondContact O-CB 3.25Å; V1294-C1297 PolarHBondContact O-N 3.06Å; R1295-C1297 VanDerWaalsContact C-N 3.32Å; R1295-C1297 PolarHBondContact O-N 3.35Å; C1297-E1299 VanDerWaalsContact C-N 3.32Å; C1297-E1299 PolarHBondContact O-N 3.41Å; C1297-S1300 WeakPolarHBondContact O-CB 3.3Å; C1297-S1300 PolarHBondContact O-N 3Å; C1297-R1301 VanDerWaalsContact O-CB 3.26Å; C1297-R1301 WeakPolarHBondContact O-CB 3.43Å; C1297-R1301 WeakPolarHBondContact O-CG 3.33Å; C1297-R1301 PolarHBondContact O-N 3.13Å; C1297-L1516 PolarHBondContact SG-O 3.28Å; C1297-M1553 HydrophobicContact CB-CE 3.64Å; C1297-M1553 WeakPolarHBondContact SG-CE 3.33Å
1298	L	87.6	Confident	84.8	Confident	0.6 Å²	0.6	22.9 Å²	22.9	0%	0.003	11%	0.109	C	C	.	.	H	α-helix	trans	-61.9	-45.2	174.3	-79.6	166.6	0	0	0	111.5	L1220 A1223 A1224 V1294 R1295 S1300 R1301 L1302 L1483 I1487	L1220-L1298 HydrophobicContact CB-CD1 4.4Å; L1220-L1298 HydrophobicContact CD2-CD1 3.96Å; A1223-L1298 HydrophobicContact CB-CD1 4.45Å; A1223-L1298 HydrophobicContact CB-CD2 4.08Å; A1224-L1298 HydrophobicContact CB-CD1 4.5Å; A1224-L1298 HydrophobicContact CB-CD2 3.98Å; A1224-L1298 HydrophobicContact CB-CG 3.95Å; V1294-L1298 HydrophobicContact CG1-CD1 4.02Å; V1294-L1298 HydrophobicContact CG1-CG 4.47Å; V1294-L1298 WeakPolarHBondContact O-CB 3.29Å; V1294-L1298 WeakPolarHBondContact O-CG 3.41Å; V1294-L1298 PolarHBondContact O-N 2.88Å; R1295-L1298 WeakPolarHBondContact O-CB 3.48Å; R1295-L1298 PolarHBondContact O-N 3.1Å; L1298-S1300 VanDerWaalsContact C-N 3.3Å; L1298-S1300 PolarHBondContact O-N 3.19Å; L1298-R1301 PolarHBondContact O-N 3.33Å; L1298-L1302 HydrophobicContact CB-CD1 4.34Å; L1298-L1302 HydrophobicContact CD2-CD1 4.27Å; L1298-L1302 VanDerWaalsContact O-CB 3.23Å; L1298-L1302 WeakPolarHBondContact O-CB 3.35Å; L1298-L1302 WeakPolarHBondContact O-CD1 3.46Å; L1298-L1302 VanDerWaalsContact O-CG 3.25Å; L1298-L1302 WeakPolarHBondContact O-CG 3.39Å; L1298-L1302 PolarHBondContact O-N 3.17Å; L1298-L1483 HydrophobicContact CD1-CD2 4.37Å; L1298-L1483 HydrophobicContact CD2-CD2 4.48Å; L1298-I1487 HydrophobicContact CB-CD1 3.71Å; L1298-I1487 VanDerWaalsContact CB-CD1 3.45Å; L1298-I1487 HydrophobicContact CD1-CD1 4.41Å; L1298-I1487 HydrophobicContact CG-CD1 4.48Å
1299	E	87	Confident	83.1	Confident	11.2 Å²	11.2	27.1 Å²	27.1	5%	0.052	14%	0.139	C	C	.	.	H	α-helix	trans	-59.5	-43.6	174.6	-177.5	170.8	-169.1	0	0	111.4	R1295 N1296 C1297 L1302 N1303 L1306 I1487 K1488 V1510	R1295-E1299 IonicContact CZ-OE2 3.39Å; R1295-E1299 IonicContact NH1-OE2 3.14Å; R1295-E1299 PolarHBondContact NH1-OE2 3.17Å; R1295-E1299 IonicContact NH2-OE2 3.08Å; R1295-E1299 PolarHBondContact NH2-OE2 3.23Å; R1295-E1299 PolarHBondContact O-N 3.11Å; N1296-E1299 PolarHBondContact O-N 3.36Å; C1297-E1299 VanDerWaalsContact C-N 3.32Å; C1297-E1299 PolarHBondContact O-N 3.41Å; E1299-L1302 CarbonylContact O-C 3.57Å; E1299-L1302 PolarHBondContact O-N 3.13Å; E1299-N1303 WeakPolarHBondContact O-CA 3.44Å; E1299-N1303 WeakPolarHBondContact O-CB 3.49Å; E1299-N1303 PolarHBondContact O-N 3.22Å; E1299-N1303 VanDerWaalsContact O-N 3.1Å; E1299-L1306 HydrophobicContact CB-CD1 4.47Å; E1299-L1306 HydrophobicContact CG-CD1 4.04Å; E1299-I1487 HydrophobicContact CB-CD1 4.14Å; E1299-I1487 HydrophobicContact CB-CG1 4.22Å; E1299-I1487 HydrophobicContact CB-CG2 3.78Å; E1299-I1487 HydrophobicContact CG-CG2 4.2Å; E1299-K1488 WeakPolarHBondContact OE1-CD 3.35Å; E1299-K1488 WeakPolarHBondContact OE1-CG 3.43Å; E1299-K1488 IonicContact OE1-NZ 3.25Å; E1299-K1488 PolarHBondContact OE1-NZ 3.26Å; E1299-V1510 HydrophobicContact CB-CG2 4.03Å; E1299-V1510 HydrophobicContact CG-CG2 4.05Å
1300	S	85.2	Confident	81.2	Confident	12.8 Å²	12.8	32.2 Å²	32.2	9%	0.09	16%	0.159	C	C	.	.	H	α-helix	trans	-62.8	-47.2	176.1	-59.9	0	0	0	0	112.4	N1296 C1297 L1298 L1302 N1303 V1510 P1513	N1296-S1300 WeakPolarHBondContact O-CB 3.3Å; N1296-S1300 PolarHBondContact O-N 3.03Å; N1296-S1300 PolarHBondContact O-OG 3.04Å; C1297-S1300 WeakPolarHBondContact O-CB 3.3Å; C1297-S1300 PolarHBondContact O-N 3Å; L1298-S1300 VanDerWaalsContact C-N 3.3Å; L1298-S1300 PolarHBondContact O-N 3.19Å; S1300-L1302 VanDerWaalsContact C-N 3.3Å; S1300-L1302 PolarHBondContact O-N 3.16Å; S1300-N1303 WeakPolarHBondContact O-CB 3.45Å; S1300-N1303 PolarHBondContact O-N 2.89Å; S1300-V1510 VanDerWaalsContact OG-CG1 3.25Å; S1300-V1510 WeakPolarHBondContact OG-CG1 3.34Å; S1300-P1513 WeakPolarHBondContact CB-O 3.17Å
1301	R	80.5	Confident	79.5	Confident	44.6 Å²	44.6	32.3 Å²	32.3	17%	0.168	16%	0.159	C	C	.	.	H	α-helix	trans	-61.6	-39.6	177	-163.3	-178.1	166.8	106.5	17.9	111.8	A1224 S1226 C1297 L1298 N1303 D1560 W1568	A1224-R1301 PolarHBondContact O-NH1 2.99Å; S1226-R1301 PolarHBondContact O-NH1 3.21Å; S1226-R1301 PolarHBondContact O-NH2 2.98Å; C1297-R1301 VanDerWaalsContact O-CB 3.26Å; C1297-R1301 WeakPolarHBondContact O-CB 3.43Å; C1297-R1301 WeakPolarHBondContact O-CG 3.33Å; C1297-R1301 PolarHBondContact O-N 3.13Å; L1298-R1301 PolarHBondContact O-N 3.33Å; R1301-N1303 VanDerWaalsContact C-N 3.29Å; R1301-N1303 PolarHBondContact O-N 3.3Å; R1301-D1560 IonicContact CZ-OD1 2.89Å; R1301-D1560 IonicContact CZ-OD2 2.89Å; R1301-D1560 IonicContact NE-OD2 2.68Å; R1301-D1560 VanDerWaalsContact NH1-CG 3.34Å; R1301-D1560 IonicContact NH1-OD1 3.07Å; R1301-D1560 PolarHBondContact NH1-OD1 3.32Å; R1301-D1560 IonicContact NH1-OD2 3.53Å; R1301-D1560 PolarHBondContact NH1-OD2 3.06Å; R1301-D1560 VanDerWaalsContact NH2-CG 3.27Å; R1301-D1560 IonicContact NH2-OD1 3.24Å; R1301-D1560 PolarHBondContact NH2-OD1 2.85Å; R1301-D1560 IonicContact NH2-OD2 3.56Å; R1301-D1560 PolarHBondContact NH2-OD2 3.08Å; R1301-W1568 WeakPolarHBondContact O-CH2 3.46Å; R1301-W1568 WeakPolarHBondContact O-CZ2 3.26Å
1302	L	80.3	Confident	77.8	Confident	1.6 Å²	1.6	34.2 Å²	34.2	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-94.8	4.1	-172.4	-62.4	171.4	0	0	0	113.9	L1298 E1299 S1300 R1304 L1305 L1306 F1480 L1484 I1487 W1568	L1298-L1302 HydrophobicContact CB-CD1 4.34Å; L1298-L1302 HydrophobicContact CD2-CD1 4.27Å; L1298-L1302 VanDerWaalsContact O-CB 3.23Å; L1298-L1302 WeakPolarHBondContact O-CB 3.35Å; L1298-L1302 WeakPolarHBondContact O-CD1 3.46Å; L1298-L1302 VanDerWaalsContact O-CG 3.25Å; L1298-L1302 WeakPolarHBondContact O-CG 3.39Å; L1298-L1302 PolarHBondContact O-N 3.17Å; E1299-L1302 CarbonylContact O-C 3.57Å; E1299-L1302 PolarHBondContact O-N 3.13Å; S1300-L1302 VanDerWaalsContact C-N 3.3Å; S1300-L1302 PolarHBondContact O-N 3.16Å; L1302-R1304 PolarHBondContact O-N 2.94Å; L1302-L1305 HydrophobicContact CD2-CB 4.4Å; L1302-L1305 HydrophobicContact CD2-CD1 4.14Å; L1302-L1305 CarbonylContact O-C 3.5Å; L1302-L1305 WeakPolarHBondContact O-CA 3.31Å; L1302-L1305 PolarHBondContact O-N 3Å; L1302-L1306 HydrophobicContact CB-CD1 4.46Å; L1302-L1306 HydrophobicContact CB-CG 4.23Å; L1302-L1306 WeakPolarHBondContact O-CG 3.31Å; L1302-L1306 PolarHBondContact O-N 3.1Å; L1302-F1480 HydrophobicContact CD1-CE1 3.78Å; L1302-F1480 HydrophobicContact CD1-CE2 3.83Å; L1302-F1480 HydrophobicContact CD1-CZ 3.94Å; L1302-F1480 HydrophobicContact CD2-CE1 3.77Å; L1302-F1480 HydrophobicContact CD2-CE2 3.91Å; L1302-F1480 HydrophobicContact CD2-CZ 3.68Å; L1302-F1480 HydrophobicContact CG-CE1 4.36Å; L1302-F1480 HydrophobicContact CG-CZ 4.4Å; L1302-L1484 HydrophobicContact CB-CD1 4.02Å; L1302-L1484 HydrophobicContact CB-CD2 4Å; L1302-L1484 HydrophobicContact CD1-CD1 4.07Å; L1302-L1484 HydrophobicContact CD1-CD2 3.86Å; L1302-L1484 HydrophobicContact CD2-CD1 4.4Å; L1302-L1484 HydrophobicContact CG-CD1 4.4Å; L1302-L1484 HydrophobicContact CG-CD2 4.38Å; L1302-I1487 HydrophobicContact CD1-CD1 3.72Å; L1302-W1568 HydrophobicContact CD2-CE3 3.85Å; L1302-W1568 HydrophobicContact CD2-CH2 4.36Å; L1302-W1568 HydrophobicContact CD2-CZ3 3.47Å; L1302-W1568 VanDerWaalsContact CD2-CZ3 3.45Å
1303	N	78.4	Confident	75.7	Confident	91.8 Å²	91.8	39.6 Å²	39.6	49%	0.491	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-27	-176.6	-165.1	27.7	0	0	0	114.5	E1299 S1300 R1301	E1299-N1303 WeakPolarHBondContact O-CA 3.44Å; E1299-N1303 WeakPolarHBondContact O-CB 3.49Å; E1299-N1303 PolarHBondContact O-N 3.22Å; E1299-N1303 VanDerWaalsContact O-N 3.1Å; S1300-N1303 WeakPolarHBondContact O-CB 3.45Å; S1300-N1303 PolarHBondContact O-N 2.89Å; R1301-N1303 VanDerWaalsContact C-N 3.29Å; R1301-N1303 PolarHBondContact O-N 3.3Å
1304	R	72.5	Confident	73.6	Confident	191 Å²	191	41.6 Å²	41.6	72%	0.721	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-20.1	175.1	-66.6	-176.9	177.8	-173.1	-1.2	114.8	L1302 K1472 W1568	L1302-R1304 PolarHBondContact O-N 2.94Å; R1304-K1472 PolarHBondContact O-NZ 3.2Å; R1304-W1568 HydrophobicContact CB-CE3 4.25Å; R1304-W1568 HydrophobicContact CB-CH2 4.22Å; R1304-W1568 HydrophobicContact CB-CZ3 3.51Å; R1304-W1568 HydrophobicContact CG-CZ3 4.38Å
1305	L	73.7	Confident	71.6	Confident	11 Å²	11	42.8 Å²	42.8	6%	0.058	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-23	179.5	-67.5	177.5	0	0	0	112.8	L1302 Y1469 L1476 F1480 L1484 I1567 W1568 P1570	L1302-L1305 HydrophobicContact CD2-CB 4.4Å; L1302-L1305 HydrophobicContact CD2-CD1 4.14Å; L1302-L1305 CarbonylContact O-C 3.5Å; L1302-L1305 WeakPolarHBondContact O-CA 3.31Å; L1302-L1305 PolarHBondContact O-N 3Å; L1305-Y1469 VanDerWaalsContact O-CE2 3.24Å; L1305-Y1469 WeakPolarHBondContact O-CE2 3.47Å; L1305-Y1469 PolarHBondContact O-OH 3.08Å; L1305-L1476 HydrophobicContact CD1-CD1 4.08Å; L1305-F1480 HydrophobicContact CD1-CE1 4.12Å; L1305-L1484 HydrophobicContact CB-CD1 4.31Å; L1305-L1484 HydrophobicContact CB-CD2 4.07Å; L1305-I1567 HydrophobicContact CD1-CG2 3.89Å; L1305-W1568 HydrophobicContact CD1-CE3 3.6Å; L1305-W1568 HydrophobicContact CD1-CH2 4.21Å; L1305-W1568 HydrophobicContact CD1-CZ3 3.97Å; L1305-W1568 HydrophobicContact CD2-CZ3 4.46Å; L1305-W1568 HydrophobicContact CG-CH2 4.14Å; L1305-W1568 HydrophobicContact CG-CZ3 3.71Å; L1305-P1570 HydrophobicContact CD2-CG 4Å
1306	L	73.3	Confident	69.4	Low	17.8 Å²	17.8	45.8 Å²	45.8	9%	0.093	23%	0.227	C	C	.	.	S	Bend	trans	-55.4	153.1	175.8	-79.9	169.5	0	0	0	112	E1299 L1302 P1308 Y1469 L1484 I1487 K1488	E1299-L1306 HydrophobicContact CB-CD1 4.47Å; E1299-L1306 HydrophobicContact CG-CD1 4.04Å; L1302-L1306 HydrophobicContact CB-CD1 4.46Å; L1302-L1306 HydrophobicContact CB-CG 4.23Å; L1302-L1306 WeakPolarHBondContact O-CG 3.31Å; L1302-L1306 PolarHBondContact O-N 3.1Å; L1306-P1308 VanDerWaalsContact O-CD 3.26Å; L1306-P1308 WeakPolarHBondContact O-CD 3.36Å; L1306-P1308 VanDerWaalsContact O-N 3.08Å; L1306-Y1469 VanDerWaalsContact C-OH 3.24Å; L1306-L1484 HydrophobicContact CD2-CD1 3.93Å; L1306-L1484 HydrophobicContact CD2-CD2 4.42Å; L1306-L1484 WeakPolarHBondContact CD2-O 3.45Å; L1306-L1484 HydrophobicContact CG-CD1 3.95Å; L1306-I1487 HydrophobicContact CD1-CG2 4.36Å; L1306-I1487 HydrophobicContact CD2-CB 4.32Å; L1306-I1487 HydrophobicContact CD2-CG2 3.83Å; L1306-K1488 HydrophobicContact CD2-CB 4.37Å
1307	P	66.3	Low	67.2	Low	22.6 Å²	22.6	51.8 Å²	51.8	15%	0.147	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-59.9	124.6	-179.6	-3.3	7.2	0	0	0	110.3	S1309 V1312 L1421 P1446 Y1469 Y1485	P1307-S1309 PolarHBondContact O-N 3.06Å; P1307-V1312 HydrophobicContact CB-CG2 3.83Å; P1307-V1312 HydrophobicContact CG-CG2 3.51Å; P1307-V1312 WeakPolarHBondContact O-CG2 3.34Å; P1307-L1421 HydrophobicContact CB-CD1 3.96Å; P1307-L1421 HydrophobicContact CG-CD1 4.3Å; P1307-P1446 HydrophobicContact CG-CG 4.19Å; P1307-Y1469 VanDerWaalsContact CA-CE2 3.47Å; P1307-Y1469 HydrophobicContact CB-CD1 4.49Å; P1307-Y1469 HydrophobicContact CB-CD2 4.49Å; P1307-Y1469 HydrophobicContact CB-CE1 3.92Å; P1307-Y1469 HydrophobicContact CB-CE2 4.17Å; P1307-Y1469 VanDerWaalsContact CD-OH 3.26Å; P1307-Y1469 WeakPolarHBondContact CD-OH 3.31Å; P1307-Y1469 HydrophobicContact CG-CE1 4.34Å; P1307-Y1469 HydrophobicContact CG-CE2 4.26Å; P1307-Y1469 WeakPolarHBondContact CG-OH 3.37Å; P1307-Y1485 HydrophobicContact CG-CD1 4.42Å
1308	P	62.4	Low	64.9	Low	51.2 Å²	51.2	53.3 Å²	53.3	33%	0.332	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-54.4	139.1	177.3	-18.5	22.8	0	0	0	110.9	L1306 Y1310 I1311 V1312	L1306-P1308 VanDerWaalsContact O-CD 3.26Å; L1306-P1308 WeakPolarHBondContact O-CD 3.36Å; L1306-P1308 VanDerWaalsContact O-N 3.08Å; P1308-Y1310 HydrophobicContact CB-CD1 3.7Å; P1308-Y1310 HydrophobicContact CB-CE1 3.57Å; P1308-Y1310 VanDerWaalsContact CB-CE1 3.48Å; P1308-Y1310 HydrophobicContact CG-CD1 3.84Å; P1308-Y1310 HydrophobicContact CG-CE1 4.13Å; P1308-Y1310 CarbonylContact O-C 3.53Å; P1308-Y1310 PolarHBondContact O-N 3.26Å; P1308-I1311 HydrophobicContact CB-CG1 4.41Å; P1308-I1311 HydrophobicContact CG-CD1 4.28Å; P1308-I1311 HydrophobicContact CG-CG1 4.35Å; P1308-I1311 WeakPolarHBondContact O-CB 3.39Å; P1308-I1311 PolarHBondContact O-N 3.06Å; P1308-V1312 WeakPolarHBondContact O-CG2 3.33Å; P1308-V1312 PolarHBondContact O-N 3.18Å
1309	S	59.2	Low	62.7	Low	87.4 Å²	87.4	55.5 Å²	55.5	61%	0.611	28%	0.278	S	S	*	.	H	α-helix	trans	-51.8	-32.4	-175.5	52.7	0	0	0	0	113.3	P1307 I1311 V1312 Q1313	P1307-S1309 PolarHBondContact O-N 3.06Å; S1309-I1311 VanDerWaalsContact C-N 3.33Å; S1309-I1311 PolarHBondContact O-N 3.27Å; S1309-V1312 WeakPolarHBondContact O-CB 3.39Å; S1309-V1312 PolarHBondContact O-N 2.96Å; S1309-Q1313 VanDerWaalsContact O-CB 3.32Å; S1309-Q1313 WeakPolarHBondContact O-CB 3.36Å; S1309-Q1313 WeakPolarHBondContact O-CG 3.31Å; S1309-Q1313 PolarHBondContact O-N 3.21Å; S1309-Q1313 PolarHBondContact O-OE1 2.92Å
1310	Y	55.3	Low	60.3	Low	112.6 Å²	112.6	58.1 Å²	58.1	44%	0.442	30%	0.297	S	S	.	.	H	α-helix	trans	-63.3	-39.2	175.3	93.2	-93.8	0	0	0	112.9	P1308 V1312 Q1313 T1314 L1465	P1308-Y1310 HydrophobicContact CB-CD1 3.7Å; P1308-Y1310 HydrophobicContact CB-CE1 3.57Å; P1308-Y1310 VanDerWaalsContact CB-CE1 3.48Å; P1308-Y1310 HydrophobicContact CG-CD1 3.84Å; P1308-Y1310 HydrophobicContact CG-CE1 4.13Å; P1308-Y1310 CarbonylContact O-C 3.53Å; P1308-Y1310 PolarHBondContact O-N 3.26Å; Y1310-V1312 VanDerWaalsContact C-N 3.33Å; Y1310-V1312 PolarHBondContact O-N 3.39Å; Y1310-Q1313 CarbonylContact O-C 3.48Å; Y1310-Q1313 PolarHBondContact O-N 3.23Å; Y1310-Q1313 VanDerWaalsContact O-N 3.15Å; Y1310-T1314 WeakPolarHBondContact CD2-OG1 3.47Å; Y1310-T1314 VanDerWaalsContact O-CB 3.29Å; Y1310-T1314 WeakPolarHBondContact O-CB 3.34Å; Y1310-T1314 PolarHBondContact O-N 3.05Å; Y1310-T1314 PolarHBondContact O-OG1 2.91Å; Y1310-L1465 HydrophobicContact CE2-CD1 3.43Å; Y1310-L1465 VanDerWaalsContact CE2-CD1 3.43Å; Y1310-L1465 HydrophobicContact CE2-CD2 4.14Å; Y1310-L1465 HydrophobicContact CE2-CG 4.41Å; Y1310-L1465 WeakPolarHBondContact OH-CD1 3.46Å; Y1310-L1465 WeakPolarHBondContact OH-CD2 3.38Å; Y1310-L1465 WeakPolarHBondContact OH-CG 3.45Å
1311	I	59.3	Low	57.9	Low	6.2 Å²	6.2	59.9 Å²	59.9	3%	0.032	32%	0.318	C	S	.	.	H	α-helix	trans	-64.3	-46.5	178.1	-60.8	-173.4	0	0	0	109.4	P1308 S1309 Q1313 T1314 M1315 L1421 F1442 W1447 L1465 Y1469	P1308-I1311 HydrophobicContact CB-CG1 4.41Å; P1308-I1311 HydrophobicContact CG-CD1 4.28Å; P1308-I1311 HydrophobicContact CG-CG1 4.35Å; P1308-I1311 WeakPolarHBondContact O-CB 3.39Å; P1308-I1311 PolarHBondContact O-N 3.06Å; S1309-I1311 VanDerWaalsContact C-N 3.33Å; S1309-I1311 PolarHBondContact O-N 3.27Å; I1311-Q1313 VanDerWaalsContact C-N 3.31Å; I1311-Q1313 PolarHBondContact O-N 3.03Å; I1311-T1314 PolarHBondContact O-N 3.23Å; I1311-T1314 VanDerWaalsContact O-N 3.14Å; I1311-M1315 HydrophobicContact CG2-CE 3.75Å; I1311-M1315 VanDerWaalsContact CG2-CE 3.43Å; I1311-M1315 HydrophobicContact CG2-CG 4.33Å; I1311-M1315 HydrophobicContact CG2-SD 3.94Å; I1311-M1315 WeakPolarHBondContact O-CB 3.25Å; I1311-M1315 VanDerWaalsContact O-CG 3.3Å; I1311-M1315 WeakPolarHBondContact O-CG 3.35Å; I1311-M1315 PolarHBondContact O-N 3.25Å; I1311-M1315 VanDerWaalsContact O-SD 3.36Å; I1311-L1421 HydrophobicContact CG2-CD1 4.06Å; I1311-L1421 HydrophobicContact CG2-CD2 4.08Å; I1311-F1442 HydrophobicContact CG2-CD1 4.1Å; I1311-F1442 HydrophobicContact CG2-CE1 4.05Å; I1311-W1447 HydrophobicContact CD1-CH2 4.12Å; I1311-W1447 HydrophobicContact CG2-CH2 3.54Å; I1311-W1447 HydrophobicContact CG2-CZ3 3.65Å; I1311-L1465 HydrophobicContact CD1-CB 4.08Å; I1311-L1465 HydrophobicContact CG1-CB 4.34Å; I1311-Y1469 HydrophobicContact CD1-CD2 4Å
1312	V	57.8	Low	55.5	Low	38.4 Å²	38.4	64.5 Å²	64.5	23%	0.233	35%	0.346	C	S	.	.	H	α-helix	trans	-60.2	-42.9	176.8	-176.8	0	0	0	0	110.9	P1307 P1308 S1309 Y1310 T1314 K1316 E1414 T1417 Y1490	P1307-V1312 HydrophobicContact CB-CG2 3.83Å; P1307-V1312 HydrophobicContact CG-CG2 3.51Å; P1307-V1312 WeakPolarHBondContact O-CG2 3.34Å; P1308-V1312 WeakPolarHBondContact O-CG2 3.33Å; P1308-V1312 PolarHBondContact O-N 3.18Å; S1309-V1312 WeakPolarHBondContact O-CB 3.39Å; S1309-V1312 PolarHBondContact O-N 2.96Å; Y1310-V1312 VanDerWaalsContact C-N 3.33Å; Y1310-V1312 PolarHBondContact O-N 3.39Å; V1312-T1314 PolarHBondContact O-N 2.91Å; V1312-K1316 HydrophobicContact CG1-CD 3.92Å; V1312-K1316 VanDerWaalsContact CG1-CE 3.46Å; V1312-K1316 VanDerWaalsContact O-CB 3.27Å; V1312-K1316 WeakPolarHBondContact O-CB 3.33Å; V1312-K1316 WeakPolarHBondContact O-CD 3.48Å; V1312-K1316 VanDerWaalsContact O-CG 3.25Å; V1312-K1316 WeakPolarHBondContact O-CG 3.13Å; V1312-K1316 PolarHBondContact O-N 2.89Å; V1312-E1414 HydrophobicContact CG1-CB 4.5Å; V1312-E1414 HydrophobicContact CG1-CG 4.03Å; V1312-T1417 HydrophobicContact CB-CG2 4.24Å; V1312-T1417 HydrophobicContact CG1-CG2 4.11Å; V1312-T1417 HydrophobicContact CG2-CG2 4.3Å; V1312-Y1490 HydrophobicContact CG1-CD1 4.31Å; V1312-Y1490 HydrophobicContact CG1-CD2 4.41Å; V1312-Y1490 HydrophobicContact CG1-CE1 3.66Å; V1312-Y1490 HydrophobicContact CG2-CE1 4.1Å
1313	Q	50.4	Low	53	Low	114.6 Å²	114.6	71.6 Å²	71.6	54%	0.536	38%	0.383	S	S	.	.	H	α-helix	trans	-70.4	-35.3	176.8	-92.3	175.5	-36.1	0	0	113.1	S1309 Y1310 I1311 K1316 Q1317	S1309-Q1313 VanDerWaalsContact O-CB 3.32Å; S1309-Q1313 WeakPolarHBondContact O-CB 3.36Å; S1309-Q1313 WeakPolarHBondContact O-CG 3.31Å; S1309-Q1313 PolarHBondContact O-N 3.21Å; S1309-Q1313 PolarHBondContact O-OE1 2.92Å; Y1310-Q1313 CarbonylContact O-C 3.48Å; Y1310-Q1313 PolarHBondContact O-N 3.23Å; Y1310-Q1313 VanDerWaalsContact O-N 3.15Å; I1311-Q1313 VanDerWaalsContact C-N 3.31Å; I1311-Q1313 PolarHBondContact O-N 3.03Å; Q1313-K1316 CarbonylContact O-C 3.59Å; Q1313-K1316 WeakPolarHBondContact O-CB 3.46Å; Q1313-K1316 PolarHBondContact O-N 3.06Å; Q1313-Q1317 VanDerWaalsContact O-CB 3.29Å; Q1313-Q1317 WeakPolarHBondContact O-CB 3.43Å; Q1313-Q1317 VanDerWaalsContact O-CG 3.27Å; Q1313-Q1317 WeakPolarHBondContact O-CG 3.41Å; Q1313-Q1317 PolarHBondContact O-N 3.18Å
1314	T	50.2	Low	50.7	Low	43.2 Å²	43.2	73.1 Å²	73.1	27%	0.265	40%	0.396	S	S	.	.	H	α-helix	trans	-69.4	-44.2	177.7	-50.4	0	0	0	0	110.4	Y1310 I1311 V1312 K1316 Q1317 L1318 I1462 L1465	Y1310-T1314 WeakPolarHBondContact CD2-OG1 3.47Å; Y1310-T1314 VanDerWaalsContact O-CB 3.29Å; Y1310-T1314 WeakPolarHBondContact O-CB 3.34Å; Y1310-T1314 PolarHBondContact O-N 3.05Å; Y1310-T1314 PolarHBondContact O-OG1 2.91Å; I1311-T1314 PolarHBondContact O-N 3.23Å; I1311-T1314 VanDerWaalsContact O-N 3.14Å; V1312-T1314 PolarHBondContact O-N 2.91Å; T1314-K1316 VanDerWaalsContact C-N 3.28Å; T1314-K1316 PolarHBondContact O-N 3.08Å; T1314-Q1317 PolarHBondContact O-N 3.06Å; T1314-Q1317 VanDerWaalsContact O-N 3.12Å; T1314-L1318 HydrophobicContact CG2-CD1 4.22Å; T1314-L1318 WeakPolarHBondContact O-CB 3.44Å; T1314-L1318 VanDerWaalsContact O-CD1 3.23Å; T1314-L1318 WeakPolarHBondContact O-CD1 3.41Å; T1314-L1318 VanDerWaalsContact O-CG 3.31Å; T1314-L1318 WeakPolarHBondContact O-CG 3.36Å; T1314-L1318 PolarHBondContact O-N 3.19Å; T1314-L1318 VanDerWaalsContact O-N 3.08Å; T1314-I1462 HydrophobicContact CG2-CD1 3.33Å; T1314-I1462 HydrophobicContact CG2-CG1 3.66Å; T1314-L1465 HydrophobicContact CG2-CD1 4.06Å
1315	M	49.8	Very low	48.7	Very low	24.8 Å²	24.8	70.7 Å²	70.7	12%	0.122	40%	0.402	C	S	.	.	H	α-helix	trans	-60.9	-37.1	171.6	-68.4	179.5	-179.6	0	0	112	I1311 Q1317 L1318 S1319 T1417 L1420 L1421 F1442 L1443 P1446 W1447 L1449 I1462 L1465 K1466	I1311-M1315 HydrophobicContact CG2-CE 3.75Å; I1311-M1315 VanDerWaalsContact CG2-CE 3.43Å; I1311-M1315 HydrophobicContact CG2-CG 4.33Å; I1311-M1315 HydrophobicContact CG2-SD 3.94Å; I1311-M1315 WeakPolarHBondContact O-CB 3.25Å; I1311-M1315 VanDerWaalsContact O-CG 3.3Å; I1311-M1315 WeakPolarHBondContact O-CG 3.35Å; I1311-M1315 PolarHBondContact O-N 3.25Å; I1311-M1315 VanDerWaalsContact O-SD 3.36Å; M1315-Q1317 VanDerWaalsContact C-N 3.3Å; M1315-Q1317 PolarHBondContact O-N 3.34Å; M1315-L1318 PolarHBondContact O-N 3.4Å; M1315-S1319 VanDerWaalsContact O-CB 3.24Å; M1315-S1319 WeakPolarHBondContact O-CB 3.34Å; M1315-S1319 PolarHBondContact O-N 3.03Å; M1315-S1319 VanDerWaalsContact O-N 3.17Å; M1315-S1319 PolarHBondContact O-OG 3.28Å; M1315-T1417 HydrophobicContact CB-CG2 3.95Å; M1315-T1417 WeakPolarHBondContact CB-OG1 3.34Å; M1315-T1417 HydrophobicContact CG-CG2 4.09Å; M1315-T1417 HydrophobicContact SD-CG2 3.52Å; M1315-T1417 VanDerWaalsContact SD-CG2 3.52Å; M1315-L1420 HydrophobicContact SD-CB 4.39Å; M1315-L1420 HydrophobicContact SD-CD1 4.05Å; M1315-L1421 HydrophobicContact CE-CD2 3.88Å; M1315-L1421 HydrophobicContact CE-CG 4.25Å; M1315-F1442 HydrophobicContact CE-CB 3.59Å; M1315-F1442 HydrophobicContact CE-CD1 3.59Å; M1315-F1442 HydrophobicContact CE-CE1 4.5Å; M1315-F1442 HydrophobicContact CE-CG 3.83Å; M1315-F1442 HydrophobicContact SD-CB 3.85Å; M1315-L1443 HydrophobicContact SD-CD2 4.22Å; M1315-L1443 HydrophobicContact SD-CG 4.2Å; M1315-P1446 HydrophobicContact CE-CB 3.87Å; M1315-P1446 WeakPolarHBondContact CE-O 3.43Å; M1315-P1446 HydrophobicContact SD-CB 3.65Å; M1315-W1447 HydrophobicContact CE-CD2 3.61Å; M1315-W1447 HydrophobicContact CE-CE3 2.98Å; M1315-W1447 HydrophobicContact CE-CG 4.41Å; M1315-W1447 HydrophobicContact CE-CH2 3.86Å; M1315-W1447 HydrophobicContact CE-CZ2 4.36Å; M1315-W1447 HydrophobicContact CE-CZ3 3.13Å; M1315-L1449 HydrophobicContact CB-CD1 4.17Å; M1315-L1449 HydrophobicContact CG-CD1 4.44Å; M1315-I1462 HydrophobicContact CE-CG1 4.35Å; M1315-I1462 HydrophobicContact CE-CG2 4.16Å; M1315-I1462 HydrophobicContact CG-CD1 4.44Å; M1315-I1462 HydrophobicContact CG-CG1 4.25Å; M1315-I1462 HydrophobicContact CG-CG2 3.91Å; M1315-I1462 HydrophobicContact SD-CG1 4.49Å; M1315-I1462 HydrophobicContact SD-CG2 4.38Å; M1315-L1465 HydrophobicContact CE-CB 4.15Å; M1315-L1465 HydrophobicContact CE-CD1 4.13Å; M1315-L1465 HydrophobicContact CG-CD1 4.17Å; M1315-K1466 HydrophobicContact CE-CB 3.14Å; M1315-K1466 HydrophobicContact CE-CD 3.63Å; M1315-K1466 HydrophobicContact CE-CG 3.28Å; M1315-K1466 HydrophobicContact SD-CD 4.37Å; M1315-K1466 HydrophobicContact SD-CG 4.42Å
1316	K	46.8	Very low	46.5	Very low	66.8 Å²	66.8	73.3 Å²	73.3	29%	0.29	43%	0.432	S	S	.	.	H	α-helix	trans	-70.3	-35.4	176.1	-130.3	171.4	-177.6	173.3	0	112.8	N1243 V1312 Q1313 T1314 L1318 S1319 S1320 E1410 M1413 E1414 Y1490	N1243-K1316 PolarHBondContact OD1-NZ 3.5Å; V1312-K1316 HydrophobicContact CG1-CD 3.92Å; V1312-K1316 VanDerWaalsContact CG1-CE 3.46Å; V1312-K1316 VanDerWaalsContact O-CB 3.27Å; V1312-K1316 WeakPolarHBondContact O-CB 3.33Å; V1312-K1316 WeakPolarHBondContact O-CD 3.48Å; V1312-K1316 VanDerWaalsContact O-CG 3.25Å; V1312-K1316 WeakPolarHBondContact O-CG 3.13Å; V1312-K1316 PolarHBondContact O-N 2.89Å; Q1313-K1316 CarbonylContact O-C 3.59Å; Q1313-K1316 WeakPolarHBondContact O-CB 3.46Å; Q1313-K1316 PolarHBondContact O-N 3.06Å; T1314-K1316 VanDerWaalsContact C-N 3.28Å; T1314-K1316 PolarHBondContact O-N 3.08Å; K1316-L1318 PolarHBondContact O-N 3.38Å; K1316-S1319 CarbonylContact O-C 3.56Å; K1316-S1319 WeakPolarHBondContact O-CA 3.28Å; K1316-S1319 VanDerWaalsContact O-CB 3.26Å; K1316-S1319 WeakPolarHBondContact O-CB 3.4Å; K1316-S1319 PolarHBondContact O-N 3.24Å; K1316-S1319 VanDerWaalsContact O-N 3.08Å; K1316-S1320 WeakPolarHBondContact O-CB 3.45Å; K1316-S1320 PolarHBondContact O-N 3.28Å; K1316-S1320 VanDerWaalsContact O-N 3.14Å; K1316-S1320 PolarHBondContact O-OG 3.22Å; K1316-S1320 VanDerWaalsContact O-OG 3.05Å; K1316-E1410 WeakPolarHBondContact CE-OE1 3.26Å; K1316-E1410 IonicContact NZ-OE1 3.25Å; K1316-E1410 PolarHBondContact NZ-OE1 3.06Å; K1316-M1413 HydrophobicContact CB-CE 4.45Å; K1316-M1413 HydrophobicContact CB-CG 4.34Å; K1316-M1413 HydrophobicContact CG-CB 4.42Å; K1316-M1413 HydrophobicContact CG-CE 3.45Å; K1316-M1413 VanDerWaalsContact CG-CE 3.45Å; K1316-M1413 HydrophobicContact CG-CG 3.96Å; K1316-M1413 HydrophobicContact CG-SD 4.2Å; K1316-E1414 HydrophobicContact CD-CG 4.43Å; K1316-E1414 IonicContact NZ-OE1 3.26Å; K1316-E1414 PolarHBondContact NZ-OE1 3.02Å; K1316-Y1490 HydrophobicContact CD-CE2 4.06Å; K1316-Y1490 HydrophobicContact CD-CG 4.31Å; K1316-Y1490 WeakPolarHBondContact CD-OH 3.37Å; K1316-Y1490 WeakPolarHBondContact CE-OH 3.49Å; K1316-Y1490 PolarHBondContact NZ-OH 2.63Å
1317	Q	45.4	Very low	44.3	Very low	127.4 Å²	127.4	78 Å²	78	60%	0.595	47%	0.466	S	S	*	.	H	α-helix	trans	-68.7	-38.7	174	-77.9	175.3	-15.4	0	0	112.2	Q1313 T1314 M1315 S1319 S1320	Q1313-Q1317 VanDerWaalsContact O-CB 3.29Å; Q1313-Q1317 WeakPolarHBondContact O-CB 3.43Å; Q1313-Q1317 VanDerWaalsContact O-CG 3.27Å; Q1313-Q1317 WeakPolarHBondContact O-CG 3.41Å; Q1313-Q1317 PolarHBondContact O-N 3.18Å; T1314-Q1317 PolarHBondContact O-N 3.06Å; T1314-Q1317 VanDerWaalsContact O-N 3.12Å; M1315-Q1317 VanDerWaalsContact C-N 3.3Å; M1315-Q1317 PolarHBondContact O-N 3.34Å; Q1317-S1319 VanDerWaalsContact C-N 3.27Å; Q1317-S1319 PolarHBondContact O-N 3.15Å; Q1317-S1320 WeakPolarHBondContact CA-OG 3.16Å; Q1317-S1320 CarbonylContact O-C 3.55Å; Q1317-S1320 PolarHBondContact O-N 3.01Å; Q1317-S1320 VanDerWaalsContact O-N 3.09Å; Q1317-S1320 VanDerWaalsContact O-O 3.12Å; Q1317-S1320 PolarHBondContact O-OG 3.2Å
1318	L	41.9	Very low	42.4	Very low	41.6 Å²	41.6	82.4 Å²	82.4	22%	0.218	50%	0.497	C	S	.	.	H	α-helix	trans	-67.7	-19.6	174.1	-67.6	170.6	0	0	0	113.2	T1314 M1315 K1316 S1320 L1449 T1454 D1458 L1459 R1461 I1462 L1465	T1314-L1318 HydrophobicContact CG2-CD1 4.22Å; T1314-L1318 WeakPolarHBondContact O-CB 3.44Å; T1314-L1318 VanDerWaalsContact O-CD1 3.23Å; T1314-L1318 WeakPolarHBondContact O-CD1 3.41Å; T1314-L1318 VanDerWaalsContact O-CG 3.31Å; T1314-L1318 WeakPolarHBondContact O-CG 3.36Å; T1314-L1318 PolarHBondContact O-N 3.19Å; T1314-L1318 VanDerWaalsContact O-N 3.08Å; M1315-L1318 PolarHBondContact O-N 3.4Å; K1316-L1318 PolarHBondContact O-N 3.38Å; L1318-S1320 VanDerWaalsContact C-N 3.33Å; L1318-L1449 VanDerWaalsContact C-CD2 3.49Å; L1318-L1449 HydrophobicContact CB-CD2 3.73Å; L1318-T1454 HydrophobicContact CB-CG2 4.32Å; L1318-T1454 HydrophobicContact CD2-CG2 4.04Å; L1318-D1458 HydrophobicContact CD1-CB 4.27Å; L1318-D1458 HydrophobicContact CD2-CB 3.93Å; L1318-L1459 HydrophobicContact CD1-CD2 4.5Å; L1318-L1459 HydrophobicContact CD1-CG 4.46Å; L1318-R1461 HydrophobicContact CD1-CB 3.86Å; L1318-I1462 HydrophobicContact CB-CD1 4.32Å; L1318-I1462 HydrophobicContact CD1-CD1 3.64Å; L1318-I1462 VanDerWaalsContact CD1-CD1 3.49Å; L1318-I1462 HydrophobicContact CD1-CG1 3.79Å; L1318-I1462 HydrophobicContact CD1-CG2 4.16Å; L1318-I1462 HydrophobicContact CG-CD1 4.13Å; L1318-L1465 HydrophobicContact CD1-CD1 4.16Å
1319	S	41.7	Very low	40.7	Very low	47.8 Å²	47.8	84.6 Å²	84.6	33%	0.334	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-10.4	175.4	-102.2	0	0	0	0	113.5	M1315 K1316 Q1317 M1413 K1448	M1315-S1319 VanDerWaalsContact O-CB 3.24Å; M1315-S1319 WeakPolarHBondContact O-CB 3.34Å; M1315-S1319 PolarHBondContact O-N 3.03Å; M1315-S1319 VanDerWaalsContact O-N 3.17Å; M1315-S1319 PolarHBondContact O-OG 3.28Å; K1316-S1319 CarbonylContact O-C 3.56Å; K1316-S1319 WeakPolarHBondContact O-CA 3.28Å; K1316-S1319 VanDerWaalsContact O-CB 3.26Å; K1316-S1319 WeakPolarHBondContact O-CB 3.4Å; K1316-S1319 PolarHBondContact O-N 3.24Å; K1316-S1319 VanDerWaalsContact O-N 3.08Å; Q1317-S1319 VanDerWaalsContact C-N 3.27Å; Q1317-S1319 PolarHBondContact O-N 3.15Å; S1319-M1413 VanDerWaalsContact CB-SD 3.52Å; S1319-K1448 VanDerWaalsContact CB-O 3.26Å; S1319-K1448 WeakPolarHBondContact CB-O 3.5Å; S1319-K1448 PolarHBondContact OG-O 2.93Å
1320	S	35.6	Very low	39.2	Very low	64.2 Å²	64.2	87 Å²	87	45%	0.449	52%	0.52	S	S	.	.	S	Bend	trans	-118.7	86.2	177.9	60.1	0	0	0	0	110.6	K1316 Q1317 L1318 N1322	K1316-S1320 WeakPolarHBondContact O-CB 3.45Å; K1316-S1320 PolarHBondContact O-N 3.28Å; K1316-S1320 VanDerWaalsContact O-N 3.14Å; K1316-S1320 PolarHBondContact O-OG 3.22Å; K1316-S1320 VanDerWaalsContact O-OG 3.05Å; Q1317-S1320 WeakPolarHBondContact CA-OG 3.16Å; Q1317-S1320 CarbonylContact O-C 3.55Å; Q1317-S1320 PolarHBondContact O-N 3.01Å; Q1317-S1320 VanDerWaalsContact O-N 3.09Å; Q1317-S1320 VanDerWaalsContact O-O 3.12Å; Q1317-S1320 PolarHBondContact O-OG 3.2Å; L1318-S1320 VanDerWaalsContact C-N 3.33Å; S1320-N1322 PolarHBondContact O-N 3.13Å
1321	G	34.4	Very low	38.1	Very low	50.8 Å²	50.8	89 Å²	89	52%	0.524	54%	0.537	S	S	.	.			trans	-78.1	115.8	-178.6	0	0	0	0	0	113.8	D1323	G1321-D1323 PolarHBondContact O-N 3.14Å; G1321-D1323 VanDerWaalsContact O-N 3.07Å
1322	N	30.7	Very low	36.5	Very low	142 Å²	142	96.1 Å²	96.1	76%	0.759	57%	0.569	S	S	*	*			trans	-93.6	125.8	175	-80.2	-10.4	0	0	0	112.5	S1320 V1324	S1320-N1322 PolarHBondContact O-N 3.13Å; N1322-V1324 PolarHBondContact O-N 2.71Å
1323	D	28.7	Very low	35.1	Very low	149.6 Å²	149.6	102 Å²	102	80%	0.8	59%	0.592	S	S	*	*			trans	-71.4	99.8	154	-76.5	-44.3	0	0	0	115.1	G1321	G1321-D1323 PolarHBondContact O-N 3.14Å; G1321-D1323 VanDerWaalsContact O-N 3.07Å
1324	V	30.5	Very low	33.9	Very low	123.6 Å²	123.6	103.8 Å²	103.8	75%	0.749	61%	0.605	S	S	*	*			trans	-142.9	94.2	149.9	-161	0	0	0	0	111.6	N1322 G1326	N1322-V1324 PolarHBondContact O-N 2.71Å; V1324-G1326 PolarHBondContact O-N 2.91Å
1325	V	29	Very low	32.7	Very low	141 Å²	141	109.3 Å²	109.3	86%	0.855	63%	0.632	S	S	*	*			trans	-41.2	110	142.6	-174.8	0	0	0	0	112.3	S1327	V1325-S1327 PolarHBondContact O-N 3.33Å
1326	G	28.4	Very low	31.5	Very low	65.8 Å²	65.8	116 Å²	116	68%	0.678	66%	0.664	S	S	*	*			trans	-95.5	123.5	167	0	0	0	0	0	112.8	V1324 S1328	V1324-G1326 PolarHBondContact O-N 2.91Å; G1326-S1328 PolarHBondContact O-N 3.29Å
1327	S	26.9	Very low	30.4	Very low	117.2 Å²	117.2	120.2 Å²	120.2	82%	0.82	69%	0.688	S	S	*	*			trans	-82.7	117.7	166	51.9	0	0	0	0	114.1	V1325	V1325-S1327 PolarHBondContact O-N 3.33Å
1328	S	27.1	Very low	29.4	Very low	114.2 Å²	114.2	120.6 Å²	120.6	80%	0.799	69%	0.693	S	S	*	*			trans	-168.4	141.8	137.6	47.9	0	0	0	0	111.6	G1326	G1326-S1328 PolarHBondContact O-N 3.29Å
1329	S	25.8	Very low	28.5	Very low	96.4 Å²	96.4	127 Å²	127	67%	0.674	72%	0.722	S	S	*	*			trans	-126.8	147.5	175.6	60.8	0	0	0	0	114.9
1330	D	28.3	Very low	27.7	Very low	138.8 Å²	138.8	130.2 Å²	130.2	74%	0.742	74%	0.74	S	S	*	*			trans	79.9	106.7	148.5	-54.5	-28	0	0	0	120.3
1331	I	31.4	Very low	27.1	Very low	155 Å²	155	133.9 Å²	133.9	80%	0.795	75%	0.754	S	S	*	*				119.5	113.1	123.8	-72.5	163.4	0	0	0	114.8
1332	E	25.8	Very low	26.5	Very low	154.2 Å²	154.2	140 Å²	140	72%	0.721	77%	0.766	S	S	*	*			trans	-2.3	127.1	153.2	-67.7	-174.4	136.5	0	0	117.7
1333	K	27.9	Very low	26.3	Very low	162.8 Å²	162.8	139.8 Å²	139.8	71%	0.708	76%	0.764	S	S	*	*			trans	113.5	126.2	132.5	-74.5	167.2	-175.4	155.1	0	116.9	L1335	K1333-L1335 PolarHBondContact O-N 3.25Å
1334	N	25.8	Very low	26	Very low	152.6 Å²	152.6	140.8 Å²	140.8	82%	0.816	76%	0.764	S	S	*	*			trans	72.9	134.7	155.5	-57.2	-24.7	0	0	0	116.5
1335	L	25.1	Very low	25.7	Very low	157.8 Å²	157.8	139.4 Å²	139.4	83%	0.826	76%	0.759	S	S	*	*			trans	-61.9	125.9	169.9	-111.4	68.7	0	0	0	112.1	K1333 I1337	K1333-L1335 PolarHBondContact O-N 3.25Å; L1335-I1337 PolarHBondContact O-N 3.32Å
1336	E	24.5	Very low	25.5	Very low	167.4 Å²	167.4	139.7 Å²	139.7	78%	0.782	76%	0.756	S	S	*	*				-26.7	134.1	124.2	-100.2	165.9	-163.1	0	0	113.4	N1338	E1336-N1338 VanDerWaalsContact C-N 3.27Å; E1336-N1338 PolarHBondContact O-N 2.89Å; E1336-N1338 VanDerWaalsContact O-N 3.13Å; E1336-N1338 PolarHBondContact O-ND2 3.09Å
1337	I	23.7	Very low	25.4	Very low	155 Å²	155	143.7 Å²	143.7	80%	0.795	76%	0.762	S	S	*	*			trans	-68.6	107.7	170	-58.6	167.3	0	0	0	110.4	L1335 E1339	L1335-I1337 PolarHBondContact O-N 3.32Å; I1337-E1339 VanDerWaalsContact C-N 3.33Å; I1337-E1339 HydrophobicContact CG2-CG 4.01Å; I1337-E1339 PolarHBondContact O-N 3.24Å
1338	N	24.6	Very low	25.3	Very low	134.2 Å²	134.2	143.3 Å²	143.3	72%	0.718	76%	0.759	S	S	*	*			trans	-111.7	102.7	160.1	-81	-45.8	0	0	0	111.2	E1336 V1340	E1336-N1338 VanDerWaalsContact C-N 3.27Å; E1336-N1338 PolarHBondContact O-N 2.89Å; E1336-N1338 VanDerWaalsContact O-N 3.13Å; E1336-N1338 PolarHBondContact O-ND2 3.09Å; N1338-V1340 HydrophobicContact CB-CG2 4.16Å; N1338-V1340 PolarHBondContact O-N 3.07Å
1339	E	23.4	Very low	25.2	Very low	175.6 Å²	175.6	142.6 Å²	142.6	82%	0.821	75%	0.754	S	S	*	*			trans	-28.3	113	138.5	-66.3	-172.2	134.1	0	0	112.4	I1337 L1341	I1337-E1339 VanDerWaalsContact C-N 3.33Å; I1337-E1339 HydrophobicContact CG2-CG 4.01Å; I1337-E1339 PolarHBondContact O-N 3.24Å; E1339-L1341 PolarHBondContact O-N 3.17Å
1340	V	24.2	Very low	25.3	Very low	115.6 Å²	115.6	146.7 Å²	146.7	70%	0.701	76%	0.762	S	S	*	*			trans	-101.6	103.4	152.3	170.4	0	0	0	0	110.8	N1338 F1342	N1338-V1340 HydrophobicContact CB-CG2 4.16Å; N1338-V1340 PolarHBondContact O-N 3.07Å; V1340-F1342 VanDerWaalsContact C-N 3.28Å; V1340-F1342 HydrophobicContact CG1-CD1 4.45Å; V1340-F1342 HydrophobicContact CG1-CD2 3.48Å; V1340-F1342 VanDerWaalsContact CG1-CD2 3.43Å; V1340-F1342 HydrophobicContact CG1-CE1 4.32Å; V1340-F1342 HydrophobicContact CG1-CE2 3.35Å; V1340-F1342 VanDerWaalsContact CG1-CE2 3.42Å; V1340-F1342 HydrophobicContact CG1-CG 4.03Å; V1340-F1342 HydrophobicContact CG1-CZ 4.05Å; V1340-F1342 PolarHBondContact O-N 2.6Å
1341	L	22.7	Very low	25.3	Very low	142.4 Å²	142.4	144.4 Å²	144.4	75%	0.746	76%	0.762	S	S	*	*			trans	-4.9	101.6	166.7	-145	86.8	0	0	0	115.6	E1339 I1343	E1339-L1341 PolarHBondContact O-N 3.17Å; L1341-I1343 VanDerWaalsContact C-N 3.25Å; L1341-I1343 HydrophobicContact CD2-CD1 3.59Å; L1341-I1343 HydrophobicContact CD2-CG1 3.98Å; L1341-I1343 HydrophobicContact CG-CD1 4.28Å; L1341-I1343 HydrophobicContact CG-CG1 4.21Å; L1341-I1343 PolarHBondContact O-N 3.17Å
1342	F	22.2	Very low	25	Very low	178.6 Å²	178.6	144.4 Å²	144.4	78%	0.783	76%	0.762	S	S	*	*			trans	-61	117.9	153.7	-75.8	-81.2	0	0	0	111.4	V1340 Q1344	V1340-F1342 VanDerWaalsContact C-N 3.28Å; V1340-F1342 HydrophobicContact CG1-CD1 4.45Å; V1340-F1342 HydrophobicContact CG1-CD2 3.48Å; V1340-F1342 VanDerWaalsContact CG1-CD2 3.43Å; V1340-F1342 HydrophobicContact CG1-CE1 4.32Å; V1340-F1342 HydrophobicContact CG1-CE2 3.35Å; V1340-F1342 VanDerWaalsContact CG1-CE2 3.42Å; V1340-F1342 HydrophobicContact CG1-CG 4.03Å; V1340-F1342 HydrophobicContact CG1-CZ 4.05Å; V1340-F1342 PolarHBondContact O-N 2.6Å; F1342-Q1344 PolarHBondContact O-N 3.32Å
1343	I	25.5	Very low	25.1	Very low	138.2 Å²	138.2	145 Å²	145	71%	0.709	77%	0.765	S	S	*	*				-101.1	113.7	118.6	-73.5	172.4	0	0	0	109.6	L1341 S1345	L1341-I1343 VanDerWaalsContact C-N 3.25Å; L1341-I1343 HydrophobicContact CD2-CD1 3.59Å; L1341-I1343 HydrophobicContact CD2-CG1 3.98Å; L1341-I1343 HydrophobicContact CG-CD1 4.28Å; L1341-I1343 HydrophobicContact CG-CG1 4.21Å; L1341-I1343 PolarHBondContact O-N 3.17Å; I1343-S1345 WeakPolarHBondContact CG2-OG 3.35Å; I1343-S1345 PolarHBondContact O-N 2.68Å
1344	Q	23.1	Very low	25	Very low	171.4 Å²	171.4	141.9 Å²	141.9	80%	0.801	76%	0.764	S	S	*	*			trans	-78.1	122.5	154.1	-72.2	175.2	-71.9	0	0	111.5	F1342	F1342-Q1344 PolarHBondContact O-N 3.32Å
1345	S	24.2	Very low	25	Very low	93.4 Å²	93.4	141.9 Å²	141.9	65%	0.653	76%	0.763	S	S	*	*			trans	-86.1	127.6	136.1	56.3	0	0	0	0	112.9	I1343 D1347	I1343-S1345 WeakPolarHBondContact CG2-OG 3.35Å; I1343-S1345 PolarHBondContact O-N 2.68Å; S1345-D1347 PolarHBondContact O-N 3.27Å
1346	D	24	Very low	25	Very low	146.4 Å²	146.4	142.4 Å²	142.4	78%	0.783	76%	0.761	S	S	*	*			trans	-141.2	128.8	143.8	-69.7	-30.3	0	0	0	112.4
1347	D	26.3	Very low	25.1	Very low	151.2 Å²	151.2	141.2 Å²	141.2	81%	0.809	76%	0.758	S	S	*	*			trans	-78.4	137	151.1	-86.7	-36.3	0	0	0	115.7	S1345 S1349	S1345-D1347 PolarHBondContact O-N 3.27Å; D1347-S1349 PolarHBondContact O-N 3Å
1348	S	25.3	Very low	25.2	Very low	107.6 Å²	107.6	140.8 Å²	140.8	75%	0.752	76%	0.756	S	S	*	*			trans	-127.5	110.7	-177.2	60.6	0	0	0	0	113.7	H1350	S1348-H1350 PolarHBondContact O-N 3.12Å
1349	S	25.4	Very low	25.2	Very low	99 Å²	99	140.9 Å²	140.9	69%	0.692	76%	0.762	S	S	*	*			trans	129.9	128.4	151.4	66.8	0	0	0	0	115.2	D1347	D1347-S1349 PolarHBondContact O-N 3Å
1350	H	27.9	Very low	25.4	Very low	184 Å²	184	135.8 Å²	135.8	85%	0.852	76%	0.756	S	S	*	*			trans	171	121.3	145.2	-82.6	-56.9	0	0	0	115.1	S1348 I1352	S1348-H1350 PolarHBondContact O-N 3.12Å; H1350-I1352 VanDerWaalsContact C-N 3.32Å; H1350-I1352 PolarHBondContact O-N 3.32Å
1351	A	27.8	Very low	25.5	Very low	89 Å²	89	135.4 Å²	135.4	74%	0.736	76%	0.759	S	S	*	*			trans	-84.1	115.2	166.5	0	0	0	0	0	114.5	Q1353	A1351-Q1353 PolarHBondContact O-N 3.12Å
1352	I	26.5	Very low	25.7	Very low	156.4 Å²	156.4	134.7 Å²	134.7	80%	0.802	76%	0.761	S	S	*	*				-87.9	108	116.3	-61.4	175.2	0	0	0	111.4	H1350 S1354	H1350-I1352 VanDerWaalsContact C-N 3.32Å; H1350-I1352 PolarHBondContact O-N 3.32Å; I1352-S1354 PolarHBondContact O-N 2.82Å; I1352-S1354 VanDerWaalsContact O-N 3.16Å
1353	Q	26.9	Very low	26	Very low	166.6 Å²	166.6	134.3 Å²	134.3	78%	0.779	76%	0.761	S	S	*	*			trans	131.2	121.9	146.8	-133.5	157.2	21.8	0	0	113.8	A1351 L1355	A1351-Q1353 PolarHBondContact O-N 3.12Å; Q1353-L1355 PolarHBondContact O-N 2.63Å
1354	S	26.1	Very low	26.1	Very low	98 Å²	98	133.9 Å²	133.9	69%	0.685	77%	0.765	S	S	*	*			trans	-133.2	123.4	150.2	30.6	0	0	0	0	112.5	I1352 Q1356	I1352-S1354 PolarHBondContact O-N 2.82Å; I1352-S1354 VanDerWaalsContact O-N 3.16Å; S1354-Q1356 PolarHBondContact O-N 2.78Å
1355	L	24.8	Very low	26.2	Very low	151.4 Å²	151.4	133.5 Å²	133.5	79%	0.793	77%	0.766	S	S	*	*			trans	-149.2	125.1	135.8	-82.5	145.8	0	0	0	110.7	Q1353 I1357	Q1353-L1355 PolarHBondContact O-N 2.63Å; L1355-I1357 HydrophobicContact CD2-CD1 4.05Å; L1355-I1357 HydrophobicContact CD2-CG1 4.13Å; L1355-I1357 PolarHBondContact O-N 3.13Å
1356	Q	25.3	Very low	26.3	Very low	168 Å²	168	135.3 Å²	135.3	79%	0.785	77%	0.768	S	S	*	*				-84.7	104.4	68.2	-140.4	176.8	-11	0	0	112.7	S1354 I1358	S1354-Q1356 PolarHBondContact O-N 2.78Å; Q1356-I1358 HydrophobicContact CG-CG1 4.49Å; Q1356-I1358 PolarHBondContact O-N 3.33Å
1357	I	26.3	Very low	26.5	Very low	143 Å²	143	135.2 Å²	135.2	73%	0.733	77%	0.767	S	S	*	*			trans	-56.1	118	162.7	-54.7	172.4	0	0	0	110.5	L1355 T1359	L1355-I1357 HydrophobicContact CD2-CD1 4.05Å; L1355-I1357 HydrophobicContact CD2-CG1 4.13Å; L1355-I1357 PolarHBondContact O-N 3.13Å; I1357-T1359 VanDerWaalsContact C-N 3.33Å; I1357-T1359 PolarHBondContact O-N 3.06Å
1358	I	27.3	Very low	26.6	Very low	146.8 Å²	146.8	135 Å²	135	75%	0.753	77%	0.765	S	S	*	*				-116.3	125.4	116.8	-67.8	-175.1	0	0	0	110.8	Q1356 G1360	Q1356-I1358 HydrophobicContact CG-CG1 4.49Å; Q1356-I1358 PolarHBondContact O-N 3.33Å; I1358-G1360 PolarHBondContact O-N 3.4Å; I1358-G1360 VanDerWaalsContact O-N 3.13Å
1359	T	24.8	Very low	26.6	Very low	136.4 Å²	136.4	140.7 Å²	140.7	84%	0.837	77%	0.77	S	S	*	*			trans	-77.1	126	167.6	48	0	0	0	0	111.8	I1357 S1361	I1357-T1359 VanDerWaalsContact C-N 3.33Å; I1357-T1359 PolarHBondContact O-N 3.06Å; T1359-S1361 PolarHBondContact O-N 3.11Å
1360	G	26.4	Very low	26.7	Very low	68.2 Å²	68.2	142.1 Å²	142.1	70%	0.703	77%	0.774	S	S	*	*			trans	-150.7	125.9	161	0	0	0	0	0	112.2	I1358 T1362	I1358-G1360 PolarHBondContact O-N 3.4Å; I1358-G1360 VanDerWaalsContact O-N 3.13Å; G1360-T1362 PolarHBondContact O-N 2.85Å
1361	S	27.6	Very low	26.6	Very low	106.8 Å²	106.8	139.2 Å²	139.2	75%	0.747	76%	0.764	S	S	*	*				-158.3	129.5	119.6	54.4	0	0	0	0	112.1	T1359 Q1363	T1359-S1361 PolarHBondContact O-N 3.11Å; S1361-Q1363 PolarHBondContact O-N 3.29Å
1362	T	25.8	Very low	26.7	Very low	129 Å²	129	143.2 Å²	143.2	79%	0.791	77%	0.765	S	S	*	*			trans	-51.2	129.6	159.7	49.2	0	0	0	0	114.2	G1360 T1364	G1360-T1362 PolarHBondContact O-N 2.85Å; T1362-T1364 PolarHBondContact O-N 3.12Å
1363	Q	27.9	Very low	26.7	Very low	169.8 Å²	169.8	142.5 Å²	142.5	79%	0.793	76%	0.762	S	S	*	*				95.6	127	128.9	-80.7	-177.7	-3.1	0	0	115.4	S1361	S1361-Q1363 PolarHBondContact O-N 3.29Å
1364	T	28.1	Very low	26.8	Very low	128.8 Å²	128.8	140.8 Å²	140.8	79%	0.79	76%	0.758	S	S	*	*			trans	56.2	132.9	153.8	55.6	0	0	0	0	119.3	T1362	T1362-T1364 PolarHBondContact O-N 3.12Å
1365	M	25.4	Very low	26.8	Very low	164.2 Å²	164.2	142.5 Å²	142.5	81%	0.809	76%	0.755	S	S	*	*				146.2	134.5	115.6	-102.8	-177.1	152.7	0	0	114.5
1366	N	27.5	Very low	27	Very low	131 Å²	131	144.3 Å²	144.3	70%	0.701	75%	0.752	S	S	*	*				94.1	142.3	123.3	-73.9	-7.7	0	0	0	113.8
1367	D	26.7	Very low	27.2	Very low	143.2 Å²	143.2	143.1 Å²	143.1	77%	0.766	75%	0.746	S	S	*	*				176.2	153.1	88.5	-115.5	-22.8	0	0	0	112.8
1368	I	28.7	Very low	27.4	Very low	148 Å²	148	143.9 Å²	143.9	76%	0.759	75%	0.747	S	S	*	*			trans	108.7	114.1	160.1	-65.5	166.2	0	0	0	113.6	V1370	I1368-V1370 PolarHBondContact O-N 2.86Å
1369	R	24.9	Very low	27.4	Very low	227 Å²	227	141.4 Å²	141.4	86%	0.857	74%	0.742	S	S	*	*			trans	-2.7	146.3	152.8	-69.3	166.8	171.2	158.1	-3.4	113.6	D1371	R1369-D1371 PolarHBondContact O-N 3.14Å
1370	V	28.1	Very low	27.6	Very low	129.2 Å²	129.2	142.8 Å²	142.8	78%	0.783	75%	0.745	S	S	*	*				-161.2	125.4	101.6	152.8	0	0	0	0	110.1	I1368	I1368-V1370 PolarHBondContact O-N 2.86Å
1371	D	25.7	Very low	27.5	Very low	122.2 Å²	122.2	142.7 Å²	142.7	65%	0.653	74%	0.744	S	S	*	*			trans	21.4	140.5	159	-77.4	-7.6	0	0	0	118	R1369 I1373	R1369-D1371 PolarHBondContact O-N 3.14Å; D1371-I1373 PolarHBondContact O-N 2.77Å
1372	K	29.4	Very low	27.5	Very low	172.2 Å²	172.2	145.2 Å²	145.2	75%	0.749	75%	0.747	S	S	*	*				154.2	134	113.7	-92.5	170.4	-177.4	128.2	0	113.7
1373	I	28.1	Very low	27.5	Very low	143.2 Å²	143.2	145.8 Å²	145.8	73%	0.734	75%	0.746	S	S	*	*			trans	79.3	114.6	137.1	-62.5	165.4	0	0	0	115	D1371	D1371-I1373 PolarHBondContact O-N 2.77Å
1374	N	27.6	Very low	27.5	Very low	129.6 Å²	129.6	145 Å²	145	69%	0.693	75%	0.745	S	S	*	*				108.2	141.2	114.9	-72.1	-12.5	0	0	0	112.9
1375	H	27.3	Very low	27.4	Very low	134 Å²	134	144.8 Å²	144.8	62%	0.62	74%	0.744	S	S	*	*			cis	161	148.1	47.4	-107.5	-41.9	0	0	0	113
1376	Y	28	Very low	27.4	Very low	188.8 Å²	188.8	142 Å²	142	74%	0.74	74%	0.74	S	S	*	*			trans	106.1	147.4	139.9	-67.2	-63.8	0	0	0	115
1377	H	29.3	Very low	27.4	Very low	142.8 Å²	142.8	144.5 Å²	144.5	66%	0.661	75%	0.745	S	S	*	*			cis	-172	149.1	28	-87.7	-69.6	0	0	0	112.8
1378	H	29.9	Very low	27.4	Very low	161.4 Å²	161.4	145.2 Å²	145.2	75%	0.747	74%	0.743	S	S	*	*			cis	173.8	137.9	44.4	-101.2	-40.7	0	0	0	113.7
1379	S	27.6	Very low	27.3	Very low	94 Å²	94	143.9 Å²	143.9	66%	0.657	74%	0.742	S	S	*	*				-161.2	144.2	111.1	61.9	0	0	0	0	115.5	G1381	S1379-G1381 VanDerWaalsContact C-N 3.29Å; S1379-G1381 PolarHBondContact O-N 2.95Å
1380	N	29	Very low	27.2	Very low	165.2 Å²	165.2	142.4 Å²	142.4	88%	0.883	74%	0.737	S	S	*	*			trans	165	128.3	149.7	-70.3	-20.3	0	0	0	114.5
1381	G	25.5	Very low	27	Very low	66.4 Å²	66.4	146.8 Å²	146.8	69%	0.685	74%	0.739	S	S	*	*			trans	161.8	123.2	145.3	0	0	0	0	0	111.8	S1379 D1383	S1379-G1381 VanDerWaalsContact C-N 3.29Å; S1379-G1381 PolarHBondContact O-N 2.95Å; G1381-D1383 PolarHBondContact O-N 3.19Å
1382	I	28	Very low	26.9	Very low	159.6 Å²	159.6	147.9 Å²	147.9	82%	0.818	74%	0.74	S	S	*	*			trans	157.3	119.9	157.9	-68.7	167	0	0	0	109.2	I1384	I1382-I1384 HydrophobicContact CG2-CD1 4.43Å
1383	D	25.2	Very low	26.7	Very low	142 Å²	142	147.5 Å²	147.5	76%	0.759	74%	0.741	S	S	*	*			trans	-101.2	148.6	138.6	-96.8	-51.1	0	0	0	111.2	G1381 T1385	G1381-D1383 PolarHBondContact O-N 3.19Å; D1383-T1385 PolarHBondContact O-N 2.68Å
1384	I	27.7	Very low	26.4	Very low	153 Å²	153	149.9 Å²	149.9	79%	0.785	75%	0.746	S	S	*	*			trans	-150.7	118	144.8	-73.9	166.7	0	0	0	111	I1382	I1382-I1384 HydrophobicContact CG2-CD1 4.43Å
1385	T	25.9	Very low	26.2	Very low	123.2 Å²	123.2	148.1 Å²	148.1	76%	0.756	74%	0.743	S	S	*	*			trans	-115.1	117.7	152.8	52.3	0	0	0	0	115.1	D1383	D1383-T1385 PolarHBondContact O-N 2.68Å
1386	S	26.1	Very low	26	Very low	106 Å²	106	150.3 Å²	150.3	74%	0.741	75%	0.751	S	S	*	*			trans	146.3	108.5	137.2	59.6	0	0	0	0	114.5	E1388	S1386-E1388 VanDerWaalsContact C-N 3.27Å; S1386-E1388 PolarHBondContact O-N 2.95Å
1387	K	27.5	Very low	26	Very low	183 Å²	183	145.9 Å²	145.9	80%	0.796	75%	0.746	S	S	*	*				-156.8	100	97.7	-107.4	-176.3	177.5	-166.8	0	111.2	V1389	K1387-V1389 PolarHBondContact O-N 3.14Å
1388	E	26.2	Very low	25.8	Very low	157.4 Å²	157.4	145.3 Å²	145.3	74%	0.736	75%	0.747	S	S	*	*				34.6	117.4	118.1	-106.2	175.6	164	0	0	112.6	S1386 R1390	S1386-E1388 VanDerWaalsContact C-N 3.27Å; S1386-E1388 PolarHBondContact O-N 2.95Å; E1388-R1390 HydrophobicContact CG-CG 4.33Å; E1388-R1390 PolarHBondContact O-N 3.22Å; E1388-R1390 IonicContact OE1-CZ 3.26Å; E1388-R1390 IonicContact OE1-NE 3.58Å; E1388-R1390 PolarHBondContact OE1-NE 3.05Å; E1388-R1390 IonicContact OE1-NH2 3.6Å; E1388-R1390 PolarHBondContact OE1-NH2 3.46Å; E1388-R1390 IonicContact OE2-NH2 2.74Å
1389	V	25.7	Very low	25.6	Very low	120.8 Å²	120.8	142 Å²	142	73%	0.732	74%	0.742	S	S	*	*			trans	-111.9	120.6	157.9	151.1	0	0	0	0	108.6	K1387 R1391	K1387-V1389 PolarHBondContact O-N 3.14Å; V1389-R1391 PolarHBondContact O-N 3.16Å
1390	R	23.2	Very low	25.5	Very low	195.8 Å²	195.8	144 Å²	144	74%	0.739	74%	0.744	S	S	*	*			trans	-55.5	127.8	158	-64.3	178.5	-178.1	158.2	1.7	111.7	E1388 H1392	E1388-R1390 HydrophobicContact CG-CG 4.33Å; E1388-R1390 PolarHBondContact O-N 3.22Å; E1388-R1390 IonicContact OE1-CZ 3.26Å; E1388-R1390 IonicContact OE1-NE 3.58Å; E1388-R1390 PolarHBondContact OE1-NE 3.05Å; E1388-R1390 IonicContact OE1-NH2 3.6Å; E1388-R1390 PolarHBondContact OE1-NH2 3.46Å; E1388-R1390 IonicContact OE2-NH2 2.74Å; R1390-H1392 PolarHBondContact O-N 3.22Å; R1390-H1392 VanDerWaalsContact O-N 3.1Å
1391	R	24.5	Very low	25.3	Very low	221.8 Å²	221.8	143.1 Å²	143.1	84%	0.837	74%	0.739	S	S	*	*			trans	-101.1	112.4	138.9	-73.2	173.4	178.8	147.6	-3	109.1	V1389 H1393	V1389-R1391 PolarHBondContact O-N 3.16Å; R1391-H1393 VanDerWaalsContact C-N 3.35Å; R1391-H1393 PolarHBondContact O-N 3.4Å; R1391-H1393 VanDerWaalsContact O-N 3.08Å
1392	H	23.8	Very low	25.5	Very low	145.6 Å²	145.6	144.8 Å²	144.8	67%	0.674	74%	0.741	S	S	*	*			trans	-46.4	116.6	131.1	-75.4	-78.3	0	0	0	110.3	R1390 F1394	R1390-H1392 PolarHBondContact O-N 3.22Å; R1390-H1392 VanDerWaalsContact O-N 3.1Å; H1392-F1394 WeakPolarHBondContact O-CD2 3.42Å; H1392-F1394 PolarHBondContact O-N 2.88Å
1393	H	24.6	Very low	25.4	Very low	164.4 Å²	164.4	144.3 Å²	144.3	76%	0.761	74%	0.74	S	S	*	*			trans	-75.8	132.5	152.7	-71.4	-86	0	0	0	112	R1391 S1395	R1391-H1393 VanDerWaalsContact C-N 3.35Å; R1391-H1393 PolarHBondContact O-N 3.4Å; R1391-H1393 VanDerWaalsContact O-N 3.08Å; H1393-S1395 PolarHBondContact O-N 2.97Å
1394	F	22.5	Very low	25.6	Very low	193.4 Å²	193.4	144.4 Å²	144.4	85%	0.848	74%	0.74	S	S	*	*			trans	-87.7	117.2	155	-93.8	-88.8	0	0	0	109.7	H1392 F1396	H1392-F1394 WeakPolarHBondContact O-CD2 3.42Å; H1392-F1394 PolarHBondContact O-N 2.88Å; F1394-F1396 VanDerWaalsContact C-N 3.27Å; F1394-F1396 AromaticContact CD1-CD2 3.72Å; F1394-F1396 HydrophobicContact CD1-CD2 3.72Å; F1394-F1396 AromaticContact CD1-CE2 3.32Å; F1394-F1396 HydrophobicContact CD1-CE2 3.32Å; F1394-F1396 AromaticContact CD1-CZ 3.94Å; F1394-F1396 HydrophobicContact CD1-CZ 3.94Å; F1394-F1396 HydrophobicContact CE1-CD2 4.33Å; F1394-F1396 AromaticContact CE1-CE2 3.49Å; F1394-F1396 HydrophobicContact CE1-CE2 3.49Å; F1394-F1396 VanDerWaalsContact CE1-CE2 3.49Å; F1394-F1396 AromaticContact CE1-CZ 3.69Å; F1394-F1396 HydrophobicContact CE1-CZ 3.69Å; F1394-F1396 HydrophobicContact CG-CE2 4.38Å; F1394-F1396 PolarHBondContact O-N 3.43Å
1395	S	23.4	Very low	25.6	Very low	90.6 Å²	90.6	142.4 Å²	142.4	63%	0.634	74%	0.737	S	S	*	*			trans	-114	123.5	160	57.6	0	0	0	0	110.8	H1393 P1397	H1393-S1395 PolarHBondContact O-N 2.97Å; S1395-P1397 VanDerWaalsContact C-CD 3.48Å; S1395-P1397 WeakPolarHBondContact O-CD 3.31Å
1396	F	23.5	Very low	25.7	Very low	180.4 Å²	180.4	141.1 Å²	141.1	79%	0.791	73%	0.732	S	S	*	*			trans	-99.9	130.7	151.8	-87.5	-67.2	0	0	0	111.8	F1394 L1398	F1394-F1396 VanDerWaalsContact C-N 3.27Å; F1394-F1396 AromaticContact CD1-CD2 3.72Å; F1394-F1396 HydrophobicContact CD1-CD2 3.72Å; F1394-F1396 AromaticContact CD1-CE2 3.32Å; F1394-F1396 HydrophobicContact CD1-CE2 3.32Å; F1394-F1396 AromaticContact CD1-CZ 3.94Å; F1394-F1396 HydrophobicContact CD1-CZ 3.94Å; F1394-F1396 HydrophobicContact CE1-CD2 4.33Å; F1394-F1396 AromaticContact CE1-CE2 3.49Å; F1394-F1396 HydrophobicContact CE1-CE2 3.49Å; F1394-F1396 VanDerWaalsContact CE1-CE2 3.49Å; F1394-F1396 AromaticContact CE1-CZ 3.69Å; F1394-F1396 HydrophobicContact CE1-CZ 3.69Å; F1394-F1396 HydrophobicContact CG-CE2 4.38Å; F1394-F1396 PolarHBondContact O-N 3.43Å; F1396-L1398 PolarHBondContact O-N 3.34Å
1397	P	27.1	Very low	25.9	Very low	97 Å²	97	142.2 Å²	142.2	63%	0.63	73%	0.73	S	S	*	*			trans	-110.2	142.1	-167.2	38.5	-27.5	0	0	0	111.8	S1395 S1399	S1395-P1397 VanDerWaalsContact C-CD 3.48Å; S1395-P1397 WeakPolarHBondContact O-CD 3.31Å; P1397-S1399 VanDerWaalsContact C-N 3.34Å; P1397-S1399 PolarHBondContact O-N 3.33Å; P1397-S1399 VanDerWaalsContact O-N 3.09Å
1398	L	25	Very low	26.1	Very low	131.2 Å²	131.2	140.5 Å²	140.5	69%	0.687	73%	0.728	S	S	*	*			trans	-37.5	105.8	160.9	-86.8	109.1	0	0	0	111.5	Q1074 F1396 I1400	Q1074-L1398 HydrophobicContact CG-CD2 4.34Å; Q1074-L1398 PolarHBondContact NE2-O 3.32Å; F1396-L1398 PolarHBondContact O-N 3.34Å; L1398-I1400 HydrophobicContact CB-CG1 4.31Å; L1398-I1400 PolarHBondContact O-N 2.91Å
1399	S	24.9	Very low	26.5	Very low	91.2 Å²	91.2	138.5 Å²	138.5	64%	0.638	72%	0.721	S	S	*	*			trans	-94.3	111.8	148.5	50.9	0	0	0	0	110.4	P1397 D1401	P1397-S1399 VanDerWaalsContact C-N 3.34Å; P1397-S1399 PolarHBondContact O-N 3.33Å; P1397-S1399 VanDerWaalsContact O-N 3.09Å; S1399-D1401 VanDerWaalsContact C-N 3.32Å; S1399-D1401 PolarHBondContact O-N 2.79Å; S1399-D1401 VanDerWaalsContact O-N 3.08Å
1400	I	27.1	Very low	27	Very low	135.6 Å²	135.6	139.4 Å²	139.4	70%	0.695	72%	0.717	S	S	*	*			trans	-35.4	89.2	156.1	-64.9	169.7	0	0	0	110.8	L1398 S1402	L1398-I1400 HydrophobicContact CB-CG1 4.31Å; L1398-I1400 PolarHBondContact O-N 2.91Å; I1400-S1402 PolarHBondContact O-N 3.17Å
1401	D	24.7	Very low	27.6	Very low	145.8 Å²	145.8	134.9 Å²	134.9	78%	0.78	71%	0.708	S	S	*	*			trans	-159.7	119.3	165.4	-72	-30.3	0	0	0	116.7	S1399	S1399-D1401 VanDerWaalsContact C-N 3.32Å; S1399-D1401 PolarHBondContact O-N 2.79Å; S1399-D1401 VanDerWaalsContact O-N 3.08Å
1402	S	27.9	Very low	28.7	Very low	104 Å²	104	127.2 Å²	127.2	73%	0.727	69%	0.688	S	S	*	*			trans	124.9	107.9	156.1	67.8	0	0	0	0	116.9	I1400 N1404	I1400-S1402 PolarHBondContact O-N 3.17Å; S1402-N1404 PolarHBondContact O-N 3.28Å; S1402-N1404 VanDerWaalsContact O-N 3.08Å
1403	N	26.9	Very low	29.8	Very low	148.4 Å²	148.4	124.5 Å²	124.5	79%	0.794	68%	0.677	S	S	*	*			trans	9.6	93.2	149.9	-65.7	-28.1	0	0	0	117.9
1404	N	28.9	Very low	31	Very low	143.8 Å²	143.8	122.3 Å²	122.3	77%	0.769	67%	0.667	S	S	*	*			trans	176.6	98.4	140.5	-94.3	-17.5	0	0	0	114	S1402 C1406 N1407	S1402-N1404 PolarHBondContact O-N 3.28Å; S1402-N1404 VanDerWaalsContact O-N 3.08Å; N1404-C1406 VanDerWaalsContact C-N 3.27Å; N1404-C1406 PolarHBondContact O-N 3.21Å; N1404-C1406 VanDerWaalsContact O-N 3.07Å; N1404-N1407 PolarHBondContact ND2-OD1 3.2Å
1405	P	28	Very low	32.3	Very low	110.6 Å²	110.6	117 Å²	117	72%	0.718	65%	0.648	S	S	*	*			trans	-90.4	65.6	178.7	35.3	-33	0	0	0	113.1	I1409	P1405-I1409 VanDerWaalsContact O-CD1 3.26Å; P1405-I1409 WeakPolarHBondContact O-CD1 3.49Å
1406	C	28.3	Very low	33.6	Very low	97 Å²	97	116.7 Å²	116.7	66%	0.655	64%	0.638	S	S	*	*			trans	-123.5	107.5	171.7	-85.1	0	0	0	0	112.1	N1404 I1408 I1409	N1404-C1406 VanDerWaalsContact C-N 3.27Å; N1404-C1406 PolarHBondContact O-N 3.21Å; N1404-C1406 VanDerWaalsContact O-N 3.07Å; C1406-I1408 HydrophobicContact CB-CD1 4.47Å; C1406-I1408 HydrophobicContact CB-CG1 4.49Å; C1406-I1408 PolarHBondContact O-N 3.16Å; C1406-I1409 WeakPolarHBondContact O-CB 3.26Å; C1406-I1409 PolarHBondContact O-N 3.14Å
1407	N	29.9	Very low	34.9	Very low	128.8 Å²	128.8	109.6 Å²	109.6	69%	0.689	61%	0.61	S	S	*	*			trans	-102.7	37.6	-179.4	-69.8	17.6	0	0	0	114.3	N1404 I1409 E1410	N1404-N1407 PolarHBondContact ND2-OD1 3.2Å; N1407-I1409 VanDerWaalsContact C-N 3.34Å; N1407-I1409 PolarHBondContact O-N 2.82Å; N1407-E1410 PolarHBondContact ND2-OE2 3.19Å
1408	I	31.4	Very low	35.9	Very low	146 Å²	146	107.1 Å²	107.1	75%	0.749	60%	0.595	S	S	*	*			trans	-109	-4.1	174.6	-62.5	176.6	0	0	0	111.5	C1406 E1410	C1406-I1408 HydrophobicContact CB-CD1 4.47Å; C1406-I1408 HydrophobicContact CB-CG1 4.49Å; C1406-I1408 PolarHBondContact O-N 3.16Å; I1408-E1410 VanDerWaalsContact C-N 3.33Å
1409	I	34.9	Very low	37.1	Very low	116.4 Å²	116.4	105.4 Å²	105.4	60%	0.597	58%	0.582	S	S	*	*	S	Bend	trans	-92.3	-17.7	-174.7	-61.2	174.4	0	0	0	112.8	P1405 C1406 N1407 D1411 S1412 M1413	P1405-I1409 VanDerWaalsContact O-CD1 3.26Å; P1405-I1409 WeakPolarHBondContact O-CD1 3.49Å; C1406-I1409 WeakPolarHBondContact O-CB 3.26Å; C1406-I1409 PolarHBondContact O-N 3.14Å; N1407-I1409 VanDerWaalsContact C-N 3.34Å; N1407-I1409 PolarHBondContact O-N 2.82Å; I1409-D1411 VanDerWaalsContact C-N 3.31Å; I1409-D1411 PolarHBondContact O-N 3.04Å; I1409-S1412 PolarHBondContact O-N 2.87Å; I1409-S1412 PolarHBondContact O-OG 3.21Å; I1409-M1413 HydrophobicContact CG2-CE 4.48Å; I1409-M1413 VanDerWaalsContact O-CB 3.26Å; I1409-M1413 WeakPolarHBondContact O-CB 3.34Å; I1409-M1413 PolarHBondContact O-N 3.1Å
1410	E	35.7	Very low	38.3	Very low	139.2 Å²	139.2	103.9 Å²	103.9	65%	0.65	57%	0.566	S	S	*	*			trans	-84.4	-18.8	-176.2	-68.6	-168.9	129.3	0	0	114.4	K1316 N1407 I1408 S1412 M1413 E1414	K1316-E1410 WeakPolarHBondContact CE-OE1 3.26Å; K1316-E1410 IonicContact NZ-OE1 3.25Å; K1316-E1410 PolarHBondContact NZ-OE1 3.06Å; N1407-E1410 PolarHBondContact ND2-OE2 3.19Å; I1408-E1410 VanDerWaalsContact C-N 3.33Å; E1410-S1412 VanDerWaalsContact C-N 3.31Å; E1410-S1412 WeakPolarHBondContact O-CA 3.43Å; E1410-S1412 PolarHBondContact O-N 3.09Å; E1410-M1413 WeakPolarHBondContact O-CB 3.32Å; E1410-M1413 PolarHBondContact O-N 3.27Å; E1410-M1413 VanDerWaalsContact O-N 3.12Å; E1410-E1414 WeakPolarHBondContact O-CB 3.28Å; E1410-E1414 WeakPolarHBondContact O-CG 3.42Å; E1410-E1414 PolarHBondContact O-N 3.3Å
1411	D	36	Very low	39.4	Very low	100.8 Å²	100.8	100.2 Å²	100.2	54%	0.539	55%	0.548	S	S	.	.	H	α-helix	trans	-66.9	15.6	173.8	-82.7	-12.1	0	0	0	111.4	I1409 M1413 N1415 K1419 K1495	I1409-D1411 VanDerWaalsContact C-N 3.31Å; I1409-D1411 PolarHBondContact O-N 3.04Å; D1411-M1413 PolarHBondContact O-N 3.39Å; D1411-N1415 WeakPolarHBondContact O-CB 3.25Å; D1411-N1415 PolarHBondContact O-N 3.36Å; D1411-N1415 PolarHBondContact O-ND2 2.99Å; D1411-K1419 IonicContact OD2-NZ 3.13Å; D1411-K1419 PolarHBondContact OD2-NZ 2.91Å; D1411-K1495 VanDerWaalsContact CG-CE 3.43Å; D1411-K1495 WeakPolarHBondContact OD1-CE 3.16Å; D1411-K1495 IonicContact OD1-NZ 2.71Å; D1411-K1495 PolarHBondContact OD1-NZ 3.04Å; D1411-K1495 VanDerWaalsContact OD2-CD 3.25Å; D1411-K1495 WeakPolarHBondContact OD2-CD 3.45Å; D1411-K1495 WeakPolarHBondContact OD2-CE 3.44Å; D1411-K1495 IonicContact OD2-NZ 2.68Å; D1411-K1495 PolarHBondContact OD2-NZ 3.14Å
1412	S	47.9	Very low	40.5	Very low	61.8 Å²	61.8	96.3 Å²	96.3	43%	0.432	53%	0.527	S	S	.	.	H	α-helix	trans	-63.9	-14.4	-173.5	84.6	0	0	0	0	112.9	I1409 E1410 E1414 N1415 L1416	I1409-S1412 PolarHBondContact O-N 2.87Å; I1409-S1412 PolarHBondContact O-OG 3.21Å; E1410-S1412 VanDerWaalsContact C-N 3.31Å; E1410-S1412 WeakPolarHBondContact O-CA 3.43Å; E1410-S1412 PolarHBondContact O-N 3.09Å; S1412-E1414 PolarHBondContact O-N 3.44Å; S1412-N1415 WeakPolarHBondContact O-CA 3.41Å; S1412-N1415 WeakPolarHBondContact O-CB 3.34Å; S1412-N1415 PolarHBondContact O-N 3.04Å; S1412-N1415 PolarHBondContact OG-N 3.33Å; S1412-N1415 VanDerWaalsContact OG-N 3.14Å; S1412-N1415 PolarHBondContact OG-ND2 2.81Å; S1412-N1415 VanDerWaalsContact OG-ND2 3.12Å; S1412-N1415 PolarHBondContact OG-OD1 2.94Å; S1412-L1416 VanDerWaalsContact O-CB 3.25Å; S1412-L1416 WeakPolarHBondContact O-CB 3.39Å; S1412-L1416 PolarHBondContact O-N 2.95Å; S1412-L1416 VanDerWaalsContact O-N 3.12Å
1413	M	47.4	Very low	41.2	Very low	87.4 Å²	87.4	94 Å²	94	43%	0.431	51%	0.506	S	S	.	.	H	α-helix	trans	-72.4	-34.8	-175.1	-167	144.7	57.9	0	0	112.7	V843 K844 K1316 S1319 I1409 E1410 D1411 N1415 L1416 T1417	V843-M1413 HydrophobicContact CG1-CG 4.25Å; K844-M1413 HydrophobicContact CD-SD 4.31Å; K844-M1413 HydrophobicContact CG-SD 3.88Å; K1316-M1413 HydrophobicContact CB-CE 4.45Å; K1316-M1413 HydrophobicContact CB-CG 4.34Å; K1316-M1413 HydrophobicContact CG-CB 4.42Å; K1316-M1413 HydrophobicContact CG-CE 3.45Å; K1316-M1413 VanDerWaalsContact CG-CE 3.45Å; K1316-M1413 HydrophobicContact CG-CG 3.96Å; K1316-M1413 HydrophobicContact CG-SD 4.2Å; S1319-M1413 VanDerWaalsContact CB-SD 3.52Å; I1409-M1413 HydrophobicContact CG2-CE 4.48Å; I1409-M1413 VanDerWaalsContact O-CB 3.26Å; I1409-M1413 WeakPolarHBondContact O-CB 3.34Å; I1409-M1413 PolarHBondContact O-N 3.1Å; E1410-M1413 WeakPolarHBondContact O-CB 3.32Å; E1410-M1413 PolarHBondContact O-N 3.27Å; E1410-M1413 VanDerWaalsContact O-N 3.12Å; D1411-M1413 PolarHBondContact O-N 3.39Å; M1413-N1415 VanDerWaalsContact C-N 3.3Å; M1413-N1415 PolarHBondContact O-N 3.09Å; M1413-L1416 PolarHBondContact O-N 3.12Å; M1413-L1416 VanDerWaalsContact O-N 3.15Å; M1413-T1417 WeakPolarHBondContact O-CB 3.36Å; M1413-T1417 PolarHBondContact O-N 3.21Å; M1413-T1417 PolarHBondContact O-OG1 3.09Å; M1413-T1417 VanDerWaalsContact O-OG1 3.13Å
1414	E	49.5	Very low	42.1	Very low	118.6 Å²	118.6	89.4 Å²	89.4	55%	0.554	49%	0.485	S	S	*	.	H	α-helix	trans	-64.4	-41.1	172.9	-68.8	-150.1	144.9	0	0	112.1	K836 V1312 K1316 E1410 S1412 L1416 T1417 S1418	K836-E1414 WeakPolarHBondContact CE-OE1 3.37Å; K836-E1414 IonicContact NZ-OE1 3Å; K836-E1414 PolarHBondContact NZ-OE1 2.91Å; K836-E1414 IonicContact NZ-OE2 3.27Å; K836-E1414 PolarHBondContact NZ-OE2 3.46Å; V1312-E1414 HydrophobicContact CG1-CB 4.5Å; V1312-E1414 HydrophobicContact CG1-CG 4.03Å; K1316-E1414 HydrophobicContact CD-CG 4.43Å; K1316-E1414 IonicContact NZ-OE1 3.26Å; K1316-E1414 PolarHBondContact NZ-OE1 3.02Å; E1410-E1414 WeakPolarHBondContact O-CB 3.28Å; E1410-E1414 WeakPolarHBondContact O-CG 3.42Å; E1410-E1414 PolarHBondContact O-N 3.3Å; S1412-E1414 PolarHBondContact O-N 3.44Å; E1414-L1416 PolarHBondContact O-N 3.45Å; E1414-T1417 WeakPolarHBondContact O-CB 3.41Å; E1414-T1417 PolarHBondContact O-N 3.22Å; E1414-S1418 WeakPolarHBondContact O-CB 3.4Å; E1414-S1418 PolarHBondContact O-N 3.17Å; E1414-S1418 PolarHBondContact O-OG 3.11Å
1415	N	49.8	Very low	42.8	Very low	83 Å²	83	91.2 Å²	91.2	44%	0.444	48%	0.482	S	S	.	.	H	α-helix	trans	-65.4	-36.2	175.1	-83.1	-48.4	0	0	0	112.5	D1411 S1412 M1413 T1417 S1418 K1419 Y1453 Y1490	D1411-N1415 WeakPolarHBondContact O-CB 3.25Å; D1411-N1415 PolarHBondContact O-N 3.36Å; D1411-N1415 PolarHBondContact O-ND2 2.99Å; S1412-N1415 WeakPolarHBondContact O-CA 3.41Å; S1412-N1415 WeakPolarHBondContact O-CB 3.34Å; S1412-N1415 PolarHBondContact O-N 3.04Å; S1412-N1415 PolarHBondContact OG-N 3.33Å; S1412-N1415 VanDerWaalsContact OG-N 3.14Å; S1412-N1415 PolarHBondContact OG-ND2 2.81Å; S1412-N1415 VanDerWaalsContact OG-ND2 3.12Å; S1412-N1415 PolarHBondContact OG-OD1 2.94Å; M1413-N1415 VanDerWaalsContact C-N 3.3Å; M1413-N1415 PolarHBondContact O-N 3.09Å; N1415-T1417 VanDerWaalsContact C-N 3.3Å; N1415-T1417 PolarHBondContact O-N 3.19Å; N1415-S1418 WeakPolarHBondContact CA-OG 3.29Å; N1415-S1418 PolarHBondContact O-N 2.97Å; N1415-S1418 PolarHBondContact O-OG 3.11Å; N1415-S1418 VanDerWaalsContact O-OG 3.07Å; N1415-K1419 WeakPolarHBondContact O-CB 3.43Å; N1415-K1419 WeakPolarHBondContact O-CG 3.3Å; N1415-K1419 PolarHBondContact O-N 3.25Å; N1415-Y1453 PolarHBondContact OD1-OH 3.27Å; N1415-Y1490 HydrophobicContact CB-CE2 4.37Å; N1415-Y1490 WeakPolarHBondContact OD1-CE2 3.19Å; N1415-Y1490 PolarHBondContact OD1-OH 2.96Å; N1415-Y1490 VanDerWaalsContact OD1-OH 3.1Å
1416	L	50.4	Low	43.2	Very low	83.2 Å²	83.2	91.4 Å²	91.4	44%	0.436	47%	0.471	S	S	.	.	H	α-helix	trans	-71.7	-41.6	176	-144.1	132.9	0	0	0	111.1	V843 L1059 S1412 M1413 E1414 S1418 K1419 L1420	V843-L1416 HydrophobicContact CG1-CB 4.27Å; V843-L1416 HydrophobicContact CG1-CD2 4.2Å; V843-L1416 HydrophobicContact CG2-CB 4.38Å; V843-L1416 HydrophobicContact CG2-CD2 3.59Å; L1059-L1416 HydrophobicContact CD2-CD2 3.97Å; S1412-L1416 VanDerWaalsContact O-CB 3.25Å; S1412-L1416 WeakPolarHBondContact O-CB 3.39Å; S1412-L1416 PolarHBondContact O-N 2.95Å; S1412-L1416 VanDerWaalsContact O-N 3.12Å; M1413-L1416 PolarHBondContact O-N 3.12Å; M1413-L1416 VanDerWaalsContact O-N 3.15Å; E1414-L1416 PolarHBondContact O-N 3.45Å; L1416-S1418 VanDerWaalsContact C-N 3.34Å; L1416-S1418 PolarHBondContact O-N 3.03Å; L1416-K1419 CarbonylContact O-C 3.39Å; L1416-K1419 WeakPolarHBondContact O-CB 3.48Å; L1416-K1419 PolarHBondContact O-N 3.31Å; L1416-K1419 VanDerWaalsContact O-N 3.14Å; L1416-L1420 HydrophobicContact CD2-CD1 3.91Å; L1416-L1420 VanDerWaalsContact CD2-CD1 3.47Å; L1416-L1420 HydrophobicContact CD2-CG 3.92Å; L1416-L1420 HydrophobicContact CG-CD1 4.33Å; L1416-L1420 VanDerWaalsContact O-CB 3.26Å; L1416-L1420 WeakPolarHBondContact O-CB 3.38Å; L1416-L1420 WeakPolarHBondContact O-CG 3.43Å; L1416-L1420 PolarHBondContact O-N 3.22Å
1417	T	50.3	Low	43.8	Very low	31.2 Å²	31.2	91.9 Å²	91.9	19%	0.191	46%	0.464	C	S	.	.	H	α-helix	trans	-63.2	-43.8	177.3	-59.3	0	0	0	0	112.2	K836 A839 N840 V843 V1312 M1315 M1413 E1414 N1415 K1419 L1420 L1421	K836-T1417 HydrophobicContact CB-CG2 4.5Å; K836-T1417 HydrophobicContact CG-CG2 3.64Å; K836-T1417 WeakPolarHBondContact O-CG2 3.24Å; A839-T1417 HydrophobicContact CB-CG2 3.78Å; A839-T1417 WeakPolarHBondContact CB-O 3.4Å; N840-T1417 WeakPolarHBondContact CA-OG1 3.45Å; N840-T1417 HydrophobicContact CB-CG2 4.16Å; N840-T1417 WeakPolarHBondContact CB-OG1 3.47Å; N840-T1417 PolarHBondContact N-OG1 3.45Å; N840-T1417 WeakPolarHBondContact OD1-CG2 3.11Å; N840-T1417 PolarHBondContact OD1-OG1 3.29Å; V843-T1417 WeakPolarHBondContact CG2-OG1 3.3Å; V1312-T1417 HydrophobicContact CB-CG2 4.24Å; V1312-T1417 HydrophobicContact CG1-CG2 4.11Å; V1312-T1417 HydrophobicContact CG2-CG2 4.3Å; M1315-T1417 HydrophobicContact CB-CG2 3.95Å; M1315-T1417 WeakPolarHBondContact CB-OG1 3.34Å; M1315-T1417 HydrophobicContact CG-CG2 4.09Å; M1315-T1417 HydrophobicContact SD-CG2 3.52Å; M1315-T1417 VanDerWaalsContact SD-CG2 3.52Å; M1413-T1417 WeakPolarHBondContact O-CB 3.36Å; M1413-T1417 PolarHBondContact O-N 3.21Å; M1413-T1417 PolarHBondContact O-OG1 3.09Å; M1413-T1417 VanDerWaalsContact O-OG1 3.13Å; E1414-T1417 WeakPolarHBondContact O-CB 3.41Å; E1414-T1417 PolarHBondContact O-N 3.22Å; N1415-T1417 VanDerWaalsContact C-N 3.3Å; N1415-T1417 PolarHBondContact O-N 3.19Å; T1417-K1419 PolarHBondContact O-N 3.14Å; T1417-L1420 PolarHBondContact O-N 2.91Å; T1417-L1420 VanDerWaalsContact O-N 3.12Å; T1417-L1421 HydrophobicContact CG2-CD1 3.94Å; T1417-L1421 HydrophobicContact CG2-CG 4.43Å; T1417-L1421 VanDerWaalsContact O-CB 3.3Å; T1417-L1421 WeakPolarHBondContact O-CB 3.21Å; T1417-L1421 VanDerWaalsContact O-CG 3.29Å; T1417-L1421 WeakPolarHBondContact O-CG 3.35Å; T1417-L1421 PolarHBondContact O-N 3.12Å
1418	S	49.6	Very low	44.1	Very low	44.4 Å²	44.4	90.4 Å²	90.4	31%	0.31	46%	0.455	S	S	.	.	H	α-helix	trans	-65.9	-36.6	177.7	59	0	0	0	0	112.5	E1414 N1415 L1416 L1420 L1421 N1422 D1451	E1414-S1418 WeakPolarHBondContact O-CB 3.4Å; E1414-S1418 PolarHBondContact O-N 3.17Å; E1414-S1418 PolarHBondContact O-OG 3.11Å; N1415-S1418 WeakPolarHBondContact CA-OG 3.29Å; N1415-S1418 PolarHBondContact O-N 2.97Å; N1415-S1418 PolarHBondContact O-OG 3.11Å; N1415-S1418 VanDerWaalsContact O-OG 3.07Å; L1416-S1418 VanDerWaalsContact C-N 3.34Å; L1416-S1418 PolarHBondContact O-N 3.03Å; S1418-L1420 VanDerWaalsContact C-N 3.34Å; S1418-L1420 PolarHBondContact O-N 3.16Å; S1418-L1421 CarbonylContact O-C 3.59Å; S1418-L1421 WeakPolarHBondContact O-CA 3.37Å; S1418-L1421 VanDerWaalsContact O-CB 3.3Å; S1418-L1421 WeakPolarHBondContact O-CB 3.45Å; S1418-L1421 PolarHBondContact O-N 3.11Å; S1418-N1422 WeakPolarHBondContact O-CB 3.44Å; S1418-N1422 VanDerWaalsContact O-CG 3.31Å; S1418-N1422 PolarHBondContact O-N 3.1Å; S1418-N1422 VanDerWaalsContact O-N 3.11Å; S1418-N1422 PolarHBondContact O-ND2 3.06Å; S1418-D1451 WeakPolarHBondContact CB-OD2 3.38Å; S1418-D1451 PolarHBondContact OG-OD2 3.33Å; S1418-D1451 VanDerWaalsContact OG-OD2 3.1Å
1419	K	50.5	Low	44.3	Very low	96 Å²	96	87 Å²	87	42%	0.417	44%	0.441	S	S	.	.	H	α-helix	trans	-66.5	-34.2	173.6	-136.5	179	-179.9	179.8	0	112.5	D1411 N1415 L1416 T1417 N1422 L1423 W1447 F1460 Y1490	D1411-K1419 IonicContact OD2-NZ 3.13Å; D1411-K1419 PolarHBondContact OD2-NZ 2.91Å; N1415-K1419 WeakPolarHBondContact O-CB 3.43Å; N1415-K1419 WeakPolarHBondContact O-CG 3.3Å; N1415-K1419 PolarHBondContact O-N 3.25Å; L1416-K1419 CarbonylContact O-C 3.39Å; L1416-K1419 WeakPolarHBondContact O-CB 3.48Å; L1416-K1419 PolarHBondContact O-N 3.31Å; L1416-K1419 VanDerWaalsContact O-N 3.14Å; T1417-K1419 PolarHBondContact O-N 3.14Å; K1419-N1422 PolarHBondContact O-N 3.39Å; K1419-L1423 HydrophobicContact CG-CD1 4.44Å; K1419-L1423 WeakPolarHBondContact O-CB 3.27Å; K1419-L1423 WeakPolarHBondContact O-CD1 3.19Å; K1419-L1423 VanDerWaalsContact O-CG 3.28Å; K1419-L1423 WeakPolarHBondContact O-CG 3.4Å; K1419-L1423 PolarHBondContact O-N 2.91Å; K1419-W1447 HydrophobicContact CD-CB 4.41Å; K1419-W1447 WeakPolarHBondContact CE-O 3.3Å; K1419-W1447 HydrophobicContact CG-CB 3.96Å; K1419-F1460 HydrophobicContact CB-CE1 4.1Å; K1419-F1460 HydrophobicContact CD-CD1 4.27Å; K1419-F1460 HydrophobicContact CD-CE1 4.23Å; K1419-Y1490 HydrophobicContact CD-CE1 4.47Å
1420	L	49.6	Very low	44.3	Very low	59.6 Å²	59.6	84.9 Å²	84.9	31%	0.312	43%	0.434	S	S	.	.	H	α-helix	trans	-75.7	-34.6	178.2	-109.5	163.4	0	0	0	112.9	P833 A839 L842 V843 L846 Y1055 L1059 M1315 L1416 T1417 S1418 N1422 L1423 S1424 I1462	P833-L1420 HydrophobicContact CG-CD2 3.52Å; A839-L1420 HydrophobicContact CB-CD2 3.95Å; L842-L1420 HydrophobicContact CB-CD1 4.47Å; L842-L1420 HydrophobicContact CB-CD2 4.48Å; L842-L1420 HydrophobicContact CD2-CD1 4.28Å; L842-L1420 HydrophobicContact CD2-CD2 3.81Å; L842-L1420 HydrophobicContact CG-CD1 4.27Å; L842-L1420 HydrophobicContact CG-CD2 4.48Å; V843-L1420 HydrophobicContact CG2-CB 4.43Å; V843-L1420 HydrophobicContact CG2-CD1 3.72Å; L846-L1420 HydrophobicContact CD1-CD1 4.39Å; Y1055-L1420 HydrophobicContact CE2-CD2 3.57Å; Y1055-L1420 HydrophobicContact CE2-CG 4.06Å; Y1055-L1420 VanDerWaalsContact OH-CD2 3.24Å; Y1055-L1420 WeakPolarHBondContact OH-CD2 3.34Å; L1059-L1420 HydrophobicContact CD1-CD1 3.87Å; L1059-L1420 HydrophobicContact CD1-CG 4.09Å; M1315-L1420 HydrophobicContact SD-CB 4.39Å; M1315-L1420 HydrophobicContact SD-CD1 4.05Å; L1416-L1420 HydrophobicContact CD2-CD1 3.91Å; L1416-L1420 VanDerWaalsContact CD2-CD1 3.47Å; L1416-L1420 HydrophobicContact CD2-CG 3.92Å; L1416-L1420 HydrophobicContact CG-CD1 4.33Å; L1416-L1420 VanDerWaalsContact O-CB 3.26Å; L1416-L1420 WeakPolarHBondContact O-CB 3.38Å; L1416-L1420 WeakPolarHBondContact O-CG 3.43Å; L1416-L1420 PolarHBondContact O-N 3.22Å; T1417-L1420 PolarHBondContact O-N 2.91Å; T1417-L1420 VanDerWaalsContact O-N 3.12Å; S1418-L1420 VanDerWaalsContact C-N 3.34Å; S1418-L1420 PolarHBondContact O-N 3.16Å; L1420-N1422 PolarHBondContact O-N 3.1Å; L1420-L1423 PolarHBondContact O-N 3.18Å; L1420-S1424 WeakPolarHBondContact O-CB 3.43Å; L1420-S1424 PolarHBondContact O-N 3.22Å; L1420-S1424 PolarHBondContact O-OG 3.29Å; L1420-I1462 HydrophobicContact CD1-CD1 3.88Å; L1420-I1462 HydrophobicContact CD1-CG1 4.36Å; L1420-I1462 HydrophobicContact CD1-CG2 3.96Å; L1420-I1462 HydrophobicContact CD2-CG2 4.18Å; L1420-I1462 HydrophobicContact CG-CG2 4.47Å
1421	L	50.4	Low	44.1	Very low	59 Å²	59	84.4 Å²	84.4	31%	0.309	44%	0.436	S	S	.	.	H	α-helix	trans	-72.8	-28.5	179.2	-95.9	172.9	0	0	0	113	P833 K836 A839 P1307 I1311 M1315 T1417 S1418 L1423 S1424 R1425 Y1485	P833-L1421 WeakPolarHBondContact O-CD2 3.45Å; K836-L1421 HydrophobicContact CB-CD1 3.91Å; K836-L1421 HydrophobicContact CG-CD1 4.35Å; A839-L1421 HydrophobicContact CB-CB 4.24Å; A839-L1421 HydrophobicContact CB-CG 4.02Å; P1307-L1421 HydrophobicContact CB-CD1 3.96Å; P1307-L1421 HydrophobicContact CG-CD1 4.3Å; I1311-L1421 HydrophobicContact CG2-CD1 4.06Å; I1311-L1421 HydrophobicContact CG2-CD2 4.08Å; M1315-L1421 HydrophobicContact CE-CD2 3.88Å; M1315-L1421 HydrophobicContact CE-CG 4.25Å; T1417-L1421 HydrophobicContact CG2-CD1 3.94Å; T1417-L1421 HydrophobicContact CG2-CG 4.43Å; T1417-L1421 VanDerWaalsContact O-CB 3.3Å; T1417-L1421 WeakPolarHBondContact O-CB 3.21Å; T1417-L1421 VanDerWaalsContact O-CG 3.29Å; T1417-L1421 WeakPolarHBondContact O-CG 3.35Å; T1417-L1421 PolarHBondContact O-N 3.12Å; S1418-L1421 CarbonylContact O-C 3.59Å; S1418-L1421 WeakPolarHBondContact O-CA 3.37Å; S1418-L1421 VanDerWaalsContact O-CB 3.3Å; S1418-L1421 WeakPolarHBondContact O-CB 3.45Å; S1418-L1421 PolarHBondContact O-N 3.11Å; L1421-L1423 PolarHBondContact O-N 2.97Å; L1421-S1424 WeakPolarHBondContact CA-OG 3.26Å; L1421-S1424 PolarHBondContact O-N 2.9Å; L1421-S1424 PolarHBondContact O-OG 3.19Å; L1421-R1425 HydrophobicContact CD2-CG 4.31Å; L1421-R1425 VanDerWaalsContact CD2-NE 3.3Å; L1421-R1425 WeakPolarHBondContact O-CD 3.49Å; L1421-R1425 VanDerWaalsContact O-CG 3.23Å; L1421-R1425 WeakPolarHBondContact O-CG 3.38Å; L1421-R1425 PolarHBondContact O-N 2.97Å; L1421-R1425 PolarHBondContact O-NE 3.16Å; L1421-Y1485 WeakPolarHBondContact O-CE1 3.4Å
1422	N	46.7	Very low	43.9	Very low	62.4 Å²	62.4	85.6 Å²	85.6	33%	0.334	44%	0.441	S	S	.	.	H	α-helix	trans	-79.4	-20.1	178.7	-71.8	-21.5	0	0	0	112.6	S1418 K1419 L1420 S1424 R1425 F1426 D1451 Y1452 Y1485	S1418-N1422 WeakPolarHBondContact O-CB 3.44Å; S1418-N1422 VanDerWaalsContact O-CG 3.31Å; S1418-N1422 PolarHBondContact O-N 3.1Å; S1418-N1422 VanDerWaalsContact O-N 3.11Å; S1418-N1422 PolarHBondContact O-ND2 3.06Å; K1419-N1422 PolarHBondContact O-N 3.39Å; L1420-N1422 PolarHBondContact O-N 3.1Å; N1422-S1424 VanDerWaalsContact C-N 3.3Å; N1422-S1424 PolarHBondContact O-N 2.95Å; N1422-R1425 PolarHBondContact O-N 3.39Å; N1422-R1425 PolarHBondContact OD1-NH2 2.66Å; N1422-F1426 VanDerWaalsContact O-CB 3.27Å; N1422-F1426 WeakPolarHBondContact O-CB 3.47Å; N1422-F1426 WeakPolarHBondContact O-CD2 3.39Å; N1422-F1426 PolarHBondContact O-N 3.07Å; N1422-F1426 VanDerWaalsContact O-N 3.15Å; N1422-D1451 PolarHBondContact ND2-OD1 3.09Å; N1422-D1451 PolarHBondContact ND2-OD2 3.26Å; N1422-Y1452 WeakPolarHBondContact ND2-CE2 3.47Å; N1422-Y1452 PolarHBondContact ND2-OH 3.28Å; N1422-Y1452 PolarHBondContact OD1-OH 3.45Å; N1422-Y1485 PolarHBondContact ND2-O 3.13Å
1423	L	43.5	Very low	43.2	Very low	56.6 Å²	56.6	90.5 Å²	90.5	30%	0.296	46%	0.458	S	S	.	.	H	α-helix	trans	-77	-4.7	176.2	-75.5	171.2	0	0	0	113	Y1055 L1059 K1419 L1420 L1421 R1425 F1426 Q1427 R1439 P1446 W1447 L1459 F1460 K1466	Y1055-L1423 HydrophobicContact CD2-CB 3.98Å; Y1055-L1423 HydrophobicContact CD2-CD1 4.22Å; Y1055-L1423 HydrophobicContact CE2-CB 4.33Å; Y1055-L1423 HydrophobicContact CG-CB 4.37Å; L1059-L1423 HydrophobicContact CD1-CD1 4.06Å; L1059-L1423 HydrophobicContact CD2-CD1 4.31Å; L1059-L1423 HydrophobicContact CG-CD1 4.38Å; K1419-L1423 HydrophobicContact CG-CD1 4.44Å; K1419-L1423 WeakPolarHBondContact O-CB 3.27Å; K1419-L1423 WeakPolarHBondContact O-CD1 3.19Å; K1419-L1423 VanDerWaalsContact O-CG 3.28Å; K1419-L1423 WeakPolarHBondContact O-CG 3.4Å; K1419-L1423 PolarHBondContact O-N 2.91Å; L1420-L1423 PolarHBondContact O-N 3.18Å; L1421-L1423 PolarHBondContact O-N 2.97Å; L1423-R1425 VanDerWaalsContact C-N 3.27Å; L1423-R1425 PolarHBondContact O-N 3.41Å; L1423-F1426 HydrophobicContact CD1-CD2 4.48Å; L1423-F1426 HydrophobicContact CD2-CD2 4.02Å; L1423-F1426 HydrophobicContact CD2-CE2 3.99Å; L1423-F1426 WeakPolarHBondContact O-CB 3.44Å; L1423-F1426 PolarHBondContact O-N 3.18Å; L1423-F1426 VanDerWaalsContact O-N 3.09Å; L1423-Q1427 WeakPolarHBondContact O-CB 3.19Å; L1423-Q1427 PolarHBondContact O-N 3.28Å; L1423-R1439 HydrophobicContact CD2-CG 3.76Å; L1423-P1446 HydrophobicContact CD2-CG 4.37Å; L1423-W1447 HydrophobicContact CD1-CB 4.03Å; L1423-W1447 HydrophobicContact CD2-CB 3.89Å; L1423-W1447 HydrophobicContact CD2-CD2 4.25Å; L1423-W1447 HydrophobicContact CD2-CE3 3.52Å; L1423-W1447 HydrophobicContact CD2-CG 4.48Å; L1423-W1447 HydrophobicContact CD2-CZ3 4.31Å; L1423-W1447 HydrophobicContact CG-CB 3.95Å; L1423-L1459 HydrophobicContact CD2-CB 4.22Å; L1423-L1459 HydrophobicContact CD2-CD2 3.44Å; L1423-L1459 VanDerWaalsContact CD2-CD2 3.44Å; L1423-L1459 HydrophobicContact CD2-CG 4.36Å; L1423-F1460 HydrophobicContact CD1-CD1 4.36Å; L1423-F1460 HydrophobicContact CD1-CE1 3.56Å; L1423-F1460 HydrophobicContact CD1-CZ 3.74Å; L1423-K1466 PolarHBondContact O-NZ 3.14Å
1424	S	46.1	Very low	42.4	Very low	51.6 Å²	51.6	94.1 Å²	94.1	36%	0.361	47%	0.468	S	S	.	.	H	α-helix	trans	-79	-44.8	171.9	56.8	0	0	0	0	112.6	P833 Y1055 L1420 L1421 N1422 Q1427 L1428	P833-S1424 PolarHBondContact O-OG 3.3Å; Y1055-S1424 WeakPolarHBondContact OH-CB 3.45Å; L1420-S1424 WeakPolarHBondContact O-CB 3.43Å; L1420-S1424 PolarHBondContact O-N 3.22Å; L1420-S1424 PolarHBondContact O-OG 3.29Å; L1421-S1424 WeakPolarHBondContact CA-OG 3.26Å; L1421-S1424 PolarHBondContact O-N 2.9Å; L1421-S1424 PolarHBondContact O-OG 3.19Å; N1422-S1424 VanDerWaalsContact C-N 3.3Å; N1422-S1424 PolarHBondContact O-N 2.95Å; S1424-Q1427 PolarHBondContact O-N 3.37Å; S1424-L1428 WeakPolarHBondContact O-CB 3.1Å; S1424-L1428 PolarHBondContact O-N 3.1Å
1425	R	42.4	Very low	41.6	Very low	182.4 Å²	182.4	96.9 Å²	96.9	69%	0.688	47%	0.474	S	S	*	.	H	α-helix	trans	-89.4	-6.7	-178.6	-84.4	-179.1	-173.6	174.5	-1.8	113.3	N834 L1421 N1422 L1423 V1429	N834-R1425 PolarHBondContact O-NH2 3.31Å; L1421-R1425 HydrophobicContact CD2-CG 4.31Å; L1421-R1425 VanDerWaalsContact CD2-NE 3.3Å; L1421-R1425 WeakPolarHBondContact O-CD 3.49Å; L1421-R1425 VanDerWaalsContact O-CG 3.23Å; L1421-R1425 WeakPolarHBondContact O-CG 3.38Å; L1421-R1425 PolarHBondContact O-N 2.97Å; L1421-R1425 PolarHBondContact O-NE 3.16Å; N1422-R1425 PolarHBondContact O-N 3.39Å; N1422-R1425 PolarHBondContact OD1-NH2 2.66Å; L1423-R1425 VanDerWaalsContact C-N 3.27Å; L1423-R1425 PolarHBondContact O-N 3.41Å; R1425-V1429 VanDerWaalsContact O-CB 3.32Å; R1425-V1429 WeakPolarHBondContact O-CB 3.33Å; R1425-V1429 WeakPolarHBondContact O-CG2 3.42Å; R1425-V1429 PolarHBondContact O-N 3.16Å
1426	F	37.4	Very low	40.8	Very low	114.6 Å²	114.6	99.6 Å²	99.6	50%	0.503	48%	0.482	S	S	.	.	H	α-helix	trans	-67.2	-32.6	161.3	-106	-85.9	0	0	0	113.8	N1422 L1423 L1428 V1429 T1430 I1437 P1446	N1422-F1426 VanDerWaalsContact O-CB 3.27Å; N1422-F1426 WeakPolarHBondContact O-CB 3.47Å; N1422-F1426 WeakPolarHBondContact O-CD2 3.39Å; N1422-F1426 PolarHBondContact O-N 3.07Å; N1422-F1426 VanDerWaalsContact O-N 3.15Å; L1423-F1426 HydrophobicContact CD1-CD2 4.48Å; L1423-F1426 HydrophobicContact CD2-CD2 4.02Å; L1423-F1426 HydrophobicContact CD2-CE2 3.99Å; L1423-F1426 WeakPolarHBondContact O-CB 3.44Å; L1423-F1426 PolarHBondContact O-N 3.18Å; L1423-F1426 VanDerWaalsContact O-N 3.09Å; F1426-L1428 VanDerWaalsContact C-N 3.29Å; F1426-L1428 PolarHBondContact O-N 3.17Å; F1426-V1429 PolarHBondContact O-N 3.04Å; F1426-T1430 HydrophobicContact CD1-CG2 3.75Å; F1426-T1430 HydrophobicContact CE1-CG2 3.38Å; F1426-T1430 HydrophobicContact CE2-CG2 4.49Å; F1426-T1430 HydrophobicContact CG-CG2 4.47Å; F1426-T1430 HydrophobicContact CZ-CG2 3.8Å; F1426-T1430 PolarHBondContact O-N 2.89Å; F1426-T1430 PolarHBondContact O-OG1 2.95Å; F1426-I1437 HydrophobicContact CD1-CD1 4.42Å; F1426-I1437 HydrophobicContact CD2-CB 4.22Å; F1426-I1437 HydrophobicContact CD2-CD1 3.98Å; F1426-I1437 HydrophobicContact CD2-CG2 4.38Å; F1426-I1437 HydrophobicContact CE1-CD1 3.87Å; F1426-I1437 HydrophobicContact CE2-CB 4.38Å; F1426-I1437 HydrophobicContact CE2-CD1 3.38Å; F1426-I1437 HydrophobicContact CE2-CG1 4.46Å; F1426-I1437 HydrophobicContact CE2-CG2 4.41Å; F1426-I1437 HydrophobicContact CZ-CD1 3.33Å; F1426-P1446 HydrophobicContact CD1-CB 3.82Å; F1426-P1446 HydrophobicContact CD1-CG 3.67Å; F1426-P1446 HydrophobicContact CD2-CB 4.32Å; F1426-P1446 HydrophobicContact CE1-CB 3.95Å; F1426-P1446 HydrophobicContact CE1-CG 3.76Å; F1426-P1446 HydrophobicContact CE2-CB 4.45Å; F1426-P1446 HydrophobicContact CG-CB 4.01Å; F1426-P1446 HydrophobicContact CG-CG 4.33Å; F1426-P1446 HydrophobicContact CZ-CB 4.26Å; F1426-P1446 HydrophobicContact CZ-CG 4.49Å
1427	Q	39.4	Very low	39.9	Very low	107.8 Å²	107.8	99.8 Å²	99.8	50%	0.504	48%	0.482	S	S	.	.	H	α-helix	trans	-75.3	9.7	176.6	-151.4	147.5	-9	0	0	113.4	Y832 Y1055 L1423 S1424 V1429 T1430 D1431	Y832-Q1427 HydrophobicContact CE1-CB 4.12Å; Y832-Q1427 HydrophobicContact CE1-CG 4.13Å; Y1055-Q1427 HydrophobicContact CD1-CB 3.97Å; Y1055-Q1427 HydrophobicContact CD1-CG 3.86Å; Y1055-Q1427 HydrophobicContact CE1-CB 3.98Å; Y1055-Q1427 HydrophobicContact CE1-CG 4.02Å; L1423-Q1427 WeakPolarHBondContact O-CB 3.19Å; L1423-Q1427 PolarHBondContact O-N 3.28Å; S1424-Q1427 PolarHBondContact O-N 3.37Å; Q1427-V1429 VanDerWaalsContact C-N 3.3Å; Q1427-V1429 PolarHBondContact O-N 3.18Å; Q1427-T1430 WeakPolarHBondContact CA-OG1 3.29Å; Q1427-T1430 PolarHBondContact O-N 3.48Å; Q1427-T1430 PolarHBondContact O-OG1 3.37Å; Q1427-D1431 WeakPolarHBondContact O-CB 3.2Å; Q1427-D1431 PolarHBondContact O-N 3.36Å
1428	L	36.4	Very low	38.9	Very low	95.6 Å²	95.6	103.8 Å²	103.8	50%	0.501	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-12.2	175.7	-116.9	134.6	0	0	0	112.8	Y832 K889 S1424 F1426 T1430 L1432	Y832-L1428 VanDerWaalsContact CB-CD1 3.49Å; Y832-L1428 HydrophobicContact CD1-CD1 3.68Å; Y832-L1428 HydrophobicContact CD1-CG 3.68Å; Y832-L1428 HydrophobicContact CD2-CD1 4.29Å; Y832-L1428 HydrophobicContact CE1-CD1 4.35Å; Y832-L1428 HydrophobicContact CE1-CG 3.91Å; Y832-L1428 HydrophobicContact CG-CD1 3.78Å; Y832-L1428 HydrophobicContact CG-CG 4.38Å; K889-L1428 PolarHBondContact NZ-O 3.41Å; S1424-L1428 WeakPolarHBondContact O-CB 3.1Å; S1424-L1428 PolarHBondContact O-N 3.1Å; F1426-L1428 VanDerWaalsContact C-N 3.29Å; F1426-L1428 PolarHBondContact O-N 3.17Å; L1428-T1430 HydrophobicContact CD2-CG2 4.03Å; L1428-L1432 HydrophobicContact CD2-CD1 3.95Å; L1428-L1432 WeakPolarHBondContact O-CB 3.24Å; L1428-L1432 PolarHBondContact O-N 3.4Å
1429	V	36.5	Very low	38.1	Very low	74.6 Å²	74.6	108.7 Å²	108.7	45%	0.452	51%	0.511	S	S	.	.			trans	-106.1	18.3	176	176.7	0	0	0	0	111.1	R1425 F1426 Q1427 D1431 L1432 E1433 Y1435	R1425-V1429 VanDerWaalsContact O-CB 3.32Å; R1425-V1429 WeakPolarHBondContact O-CB 3.33Å; R1425-V1429 WeakPolarHBondContact O-CG2 3.42Å; R1425-V1429 PolarHBondContact O-N 3.16Å; F1426-V1429 PolarHBondContact O-N 3.04Å; Q1427-V1429 VanDerWaalsContact C-N 3.3Å; Q1427-V1429 PolarHBondContact O-N 3.18Å; V1429-D1431 PolarHBondContact O-N 3.16Å; V1429-D1431 VanDerWaalsContact O-N 3.1Å; V1429-L1432 WeakPolarHBondContact O-CB 3.35Å; V1429-L1432 PolarHBondContact O-N 3.19Å; V1429-E1433 WeakPolarHBondContact O-CB 3.28Å; V1429-E1433 PolarHBondContact O-N 2.7Å; V1429-Y1435 HydrophobicContact CG1-CD1 4.27Å; V1429-Y1435 HydrophobicContact CG1-CD2 3.4Å; V1429-Y1435 VanDerWaalsContact CG1-CD2 3.4Å; V1429-Y1435 HydrophobicContact CG1-CE1 4.37Å; V1429-Y1435 HydrophobicContact CG1-CE2 3.52Å; V1429-Y1435 HydrophobicContact CG1-CG 3.81Å
1430	T	34.1	Very low	37.2	Very low	72.6 Å²	72.6	108.2 Å²	108.2	45%	0.445	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	48.7	158.9	51.9	0	0	0	0	113.5	F1426 Q1427 L1428 L1432 E1433 Y1434	F1426-T1430 HydrophobicContact CD1-CG2 3.75Å; F1426-T1430 HydrophobicContact CE1-CG2 3.38Å; F1426-T1430 HydrophobicContact CE2-CG2 4.49Å; F1426-T1430 HydrophobicContact CG-CG2 4.47Å; F1426-T1430 HydrophobicContact CZ-CG2 3.8Å; F1426-T1430 PolarHBondContact O-N 2.89Å; F1426-T1430 PolarHBondContact O-OG1 2.95Å; Q1427-T1430 WeakPolarHBondContact CA-OG1 3.29Å; Q1427-T1430 PolarHBondContact O-N 3.48Å; Q1427-T1430 PolarHBondContact O-OG1 3.37Å; L1428-T1430 HydrophobicContact CD2-CG2 4.03Å; T1430-L1432 VanDerWaalsContact C-N 3.3Å; T1430-L1432 PolarHBondContact O-N 2.96Å; T1430-E1433 PolarHBondContact O-N 3.14Å; T1430-Y1434 WeakPolarHBondContact O-CB 3.45Å; T1430-Y1434 PolarHBondContact O-N 3.41Å
1431	D	32.8	Very low	36.3	Very low	129.6 Å²	129.6	107.6 Å²	107.6	69%	0.693	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.2	15	160.5	-61.3	-40.8	0	0	0	115	R882 Q1427 V1429	R882-D1431 IonicContact CZ-OD1 2.7Å; R882-D1431 IonicContact CZ-OD2 3.47Å; R882-D1431 VanDerWaalsContact CZ-OD2 3.31Å; R882-D1431 IonicContact NH1-OD1 3.51Å; R882-D1431 IonicContact NH1-OD2 3.74Å; R882-D1431 PolarHBondContact NH1-OD2 2.85Å; R882-D1431 IonicContact NH2-OD1 3.15Å; R882-D1431 PolarHBondContact NH2-OD1 3.15Å; R882-D1431 IonicContact NH2-OD2 2.72Å; R882-D1431 PolarHBondContact NH2-OD2 2.68Å; Q1427-D1431 WeakPolarHBondContact O-CB 3.2Å; Q1427-D1431 PolarHBondContact O-N 3.36Å; V1429-D1431 PolarHBondContact O-N 3.16Å; V1429-D1431 VanDerWaalsContact O-N 3.1Å
1432	L	31.4	Very low	35.4	Very low	125.6 Å²	125.6	109.7 Å²	109.7	66%	0.658	53%	0.527	S	S	*	.			trans	-112.7	107.3	169.2	-93.1	156	0	0	0	111.4	L1428 V1429 T1430 Y1434 Y1435	L1428-L1432 HydrophobicContact CD2-CD1 3.95Å; L1428-L1432 WeakPolarHBondContact O-CB 3.24Å; L1428-L1432 PolarHBondContact O-N 3.4Å; V1429-L1432 WeakPolarHBondContact O-CB 3.35Å; V1429-L1432 PolarHBondContact O-N 3.19Å; T1430-L1432 VanDerWaalsContact C-N 3.3Å; T1430-L1432 PolarHBondContact O-N 2.96Å; L1432-Y1434 VanDerWaalsContact C-N 3.25Å; L1432-Y1434 PolarHBondContact O-N 3.03Å; L1432-Y1435 PolarHBondContact O-N 3.43Å
1433	E	32.1	Very low	34.7	Very low	165.6 Å²	165.6	111.7 Å²	111.7	77%	0.774	54%	0.537	S	S	*	.	H	α-helix	trans	-68.1	-2.7	-178.8	-65.8	-172	119.8	0	0	113.9	V1429 T1430 Y1435 K1436	V1429-E1433 WeakPolarHBondContact O-CB 3.28Å; V1429-E1433 PolarHBondContact O-N 2.7Å; T1430-E1433 PolarHBondContact O-N 3.14Å; E1433-Y1435 PolarHBondContact O-N 2.9Å; E1433-K1436 WeakPolarHBondContact O-CB 3.49Å; E1433-K1436 PolarHBondContact O-N 3.08Å; E1433-K1436 VanDerWaalsContact O-N 3.13Å
1434	Y	31.9	Very low	34.3	Very low	162.8 Å²	162.8	114.3 Å²	114.3	64%	0.638	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-17.4	-171.4	-148.2	-100.2	0	0	0	114.7	T1430 L1432 K1436 I1437	T1430-Y1434 WeakPolarHBondContact O-CB 3.45Å; T1430-Y1434 PolarHBondContact O-N 3.41Å; L1432-Y1434 VanDerWaalsContact C-N 3.25Å; L1432-Y1434 PolarHBondContact O-N 3.03Å; Y1434-K1436 PolarHBondContact O-N 3.05Å; Y1434-I1437 PolarHBondContact O-N 2.94Å
1435	Y	31.5	Very low	33.8	Very low	176.2 Å²	176.2	115.7 Å²	115.7	69%	0.691	55%	0.549	S	S	*	.			trans	-86	31.4	-177.5	-92.3	-78.5	0	0	0	114.4	V1429 L1432 E1433 I1437 H1438 W1447	V1429-Y1435 HydrophobicContact CG1-CD1 4.27Å; V1429-Y1435 HydrophobicContact CG1-CD2 3.4Å; V1429-Y1435 VanDerWaalsContact CG1-CD2 3.4Å; V1429-Y1435 HydrophobicContact CG1-CE1 4.37Å; V1429-Y1435 HydrophobicContact CG1-CE2 3.52Å; V1429-Y1435 HydrophobicContact CG1-CG 3.81Å; L1432-Y1435 PolarHBondContact O-N 3.43Å; E1433-Y1435 PolarHBondContact O-N 2.9Å; Y1435-I1437 VanDerWaalsContact C-N 3.32Å; Y1435-I1437 HydrophobicContact CD1-CD1 3.93Å; Y1435-I1437 HydrophobicContact CD1-CG1 3.86Å; Y1435-I1437 HydrophobicContact CE1-CD1 3.59Å; Y1435-I1437 HydrophobicContact CE1-CG1 4.16Å; Y1435-I1437 PolarHBondContact O-N 3.09Å; Y1435-H1438 PolarHBondContact O-N 2.74Å; Y1435-W1447 WeakPolarHBondContact O-CH2 3.42Å; Y1435-W1447 WeakPolarHBondContact O-CZ2 3.12Å
1436	K	33.5	Very low	33.5	Very low	139.4 Å²	139.4	110.1 Å²	110.1	61%	0.606	54%	0.536	S	S	*	.			trans	-76.9	28.1	170.1	-89.4	179.6	179.9	177.6	0	112.5	E1241 E1433 Y1434 E1444 W1447 K1448	E1241-K1436 WeakPolarHBondContact OE1-CE 3.49Å; E1241-K1436 IonicContact OE1-NZ 3.14Å; E1241-K1436 PolarHBondContact OE1-NZ 3.3Å; E1433-K1436 WeakPolarHBondContact O-CB 3.49Å; E1433-K1436 PolarHBondContact O-N 3.08Å; E1433-K1436 VanDerWaalsContact O-N 3.13Å; Y1434-K1436 PolarHBondContact O-N 3.05Å; K1436-E1444 WeakPolarHBondContact CD-OE1 3.5Å; K1436-E1444 IonicContact NZ-OE1 2.74Å; K1436-E1444 PolarHBondContact NZ-OE1 3.47Å; K1436-W1447 HydrophobicContact CG-CD2 4.38Å; K1436-W1447 HydrophobicContact CG-CG 4.32Å; K1436-W1447 HydrophobicContact CG-CZ2 4.49Å; K1436-W1447 PolarHBondContact O-NE1 2.76Å; K1436-K1448 PolarHBondContact O-NZ 3.3Å
1437	I	31.7	Very low	33.5	Very low	87.4 Å²	87.4	108.8 Å²	108.8	45%	0.448	53%	0.528	S	S	.	.			trans	-102.7	68.1	179.6	-65.2	170.2	0	0	0	111.3	F1426 Y1434 Y1435 R1439	F1426-I1437 HydrophobicContact CD1-CD1 4.42Å; F1426-I1437 HydrophobicContact CD2-CB 4.22Å; F1426-I1437 HydrophobicContact CD2-CD1 3.98Å; F1426-I1437 HydrophobicContact CD2-CG2 4.38Å; F1426-I1437 HydrophobicContact CE1-CD1 3.87Å; F1426-I1437 HydrophobicContact CE2-CB 4.38Å; F1426-I1437 HydrophobicContact CE2-CD1 3.38Å; F1426-I1437 HydrophobicContact CE2-CG1 4.46Å; F1426-I1437 HydrophobicContact CE2-CG2 4.41Å; F1426-I1437 HydrophobicContact CZ-CD1 3.33Å; Y1434-I1437 PolarHBondContact O-N 2.94Å; Y1435-I1437 VanDerWaalsContact C-N 3.32Å; Y1435-I1437 HydrophobicContact CD1-CD1 3.93Å; Y1435-I1437 HydrophobicContact CD1-CG1 3.86Å; Y1435-I1437 HydrophobicContact CE1-CD1 3.59Å; Y1435-I1437 HydrophobicContact CE1-CG1 4.16Å; Y1435-I1437 PolarHBondContact O-N 3.09Å; I1437-R1439 PolarHBondContact O-N 3.09Å
1438	H	30.2	Very low	33.3	Very low	116.6 Å²	116.6	108.5 Å²	108.5	54%	0.54	53%	0.525	S	S	.	.			trans	-99.5	88.4	-178.5	-79.4	-85.7	0	0	0	113.1	Y1435 L1440 F1442 E1444 K1448	Y1435-H1438 PolarHBondContact O-N 2.74Å; H1438-L1440 PolarHBondContact O-N 3.24Å; H1438-L1440 VanDerWaalsContact O-N 3.09Å; H1438-F1442 PolarHBondContact ND1-O 2.86Å; H1438-E1444 PolarHBondContact CE1-N 3.01Å; H1438-E1444 PolarHBondContact ND1-N 3.44Å; H1438-K1448 WeakPolarHBondContact NE2-CB 3.39Å; H1438-K1448 WeakPolarHBondContact NE2-CD 3.24Å
1439	R	32.8	Very low	33.2	Very low	147 Å²	147	107.9 Å²	107.9	56%	0.555	52%	0.522	S	S	*	.			trans	-69.5	97.7	166.7	-98.7	-176.7	-177.9	-177.7	0.2	112.1	H1058 G1239 E1241 L1423 I1437 G1441 Y1490 N1492	H1058-R1439 PolarHBondContact CD2-NH1 3.03Å; G1239-R1439 PolarHBondContact O-NH1 3.42Å; E1241-R1439 IonicContact OE1-CZ 2.71Å; E1241-R1439 IonicContact OE1-NH1 2.68Å; E1241-R1439 IonicContact OE1-NH2 3.54Å; E1241-R1439 PolarHBondContact OE1-NH2 3.11Å; E1241-R1439 IonicContact OE2-CZ 3.47Å; E1241-R1439 IonicContact OE2-NH1 2.99Å; E1241-R1439 PolarHBondContact OE2-NH1 2.92Å; E1241-R1439 IonicContact OE2-NH2 3.18Å; E1241-R1439 PolarHBondContact OE2-NH2 3.49Å; L1423-R1439 HydrophobicContact CD2-CG 3.76Å; I1437-R1439 PolarHBondContact O-N 3.09Å; R1439-G1441 VanDerWaalsContact C-N 3.26Å; R1439-G1441 PolarHBondContact O-N 3.49Å; R1439-Y1490 PolarHBondContact NH2-O 2.95Å; R1439-N1492 VanDerWaalsContact CZ-CB 3.43Å
1440	L	29.9	Very low	33.1	Very low	85.2 Å²	85.2	107.6 Å²	107.6	45%	0.446	52%	0.521	S	S	.	.			trans	-127.6	75.7	165.3	-74.1	163.1	0	0	0	111	H1058 L1059 D1062 H1438 F1442 L1443 L1459 K1466	H1058-L1440 HydrophobicContact CB-CD1 3.2Å; L1059-L1440 HydrophobicContact CB-CD1 4.49Å; L1059-L1440 HydrophobicContact CB-CD2 4.49Å; L1059-L1440 HydrophobicContact CD2-CD2 3.79Å; L1059-L1440 HydrophobicContact CG-CD1 4.2Å; L1059-L1440 HydrophobicContact CG-CD2 3.99Å; L1059-L1440 HydrophobicContact CG-CG 4.38Å; L1059-L1440 VanDerWaalsContact N-CD1 3.28Å; D1062-L1440 HydrophobicContact CB-CD2 4.09Å; D1062-L1440 WeakPolarHBondContact OD2-CD2 3.39Å; H1438-L1440 PolarHBondContact O-N 3.24Å; H1438-L1440 VanDerWaalsContact O-N 3.09Å; L1440-F1442 HydrophobicContact CB-CD2 4.46Å; L1440-F1442 HydrophobicContact CB-CE2 4.25Å; L1440-F1442 PolarHBondContact O-N 2.86Å; L1440-F1442 VanDerWaalsContact O-N 3.15Å; L1440-L1443 PolarHBondContact O-N 2.99Å; L1440-L1459 HydrophobicContact CD1-CD2 4.49Å; L1440-K1466 HydrophobicContact CB-CD 4.45Å; L1440-K1466 HydrophobicContact CD2-CD 3.88Å
1441	G	30.9	Very low	33.1	Very low	47.2 Å²	47.2	109.6 Å²	109.6	49%	0.487	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	69.7	172.7	0	0	0	0	0	113.8	R1439 L1443 Y1485	R1439-G1441 VanDerWaalsContact C-N 3.26Å; R1439-G1441 PolarHBondContact O-N 3.49Å; G1441-L1443 PolarHBondContact O-N 3.09Å; G1441-L1443 VanDerWaalsContact O-N 3.14Å; G1441-Y1485 WeakPolarHBondContact O-CD2 3.38Å; G1441-Y1485 WeakPolarHBondContact O-CE2 3.49Å; G1441-Y1485 VanDerWaalsContact O-CG 3.29Å
1442	F	31.4	Very low	33.4	Very low	102 Å²	102	111.6 Å²	111.6	45%	0.447	53%	0.529	S	S	.	.			trans	-78	106.1	165.1	-68.1	-92.5	0	0	0	112.4	D1244 I1311 M1315 H1438 L1440 E1444 K1466 Y1469 Y1485 P1489 F1491	D1244-F1442 VanDerWaalsContact OD1-CB 3.32Å; D1244-F1442 WeakPolarHBondContact OD1-CB 3.26Å; I1311-F1442 HydrophobicContact CG2-CD1 4.1Å; I1311-F1442 HydrophobicContact CG2-CE1 4.05Å; M1315-F1442 HydrophobicContact CE-CB 3.59Å; M1315-F1442 HydrophobicContact CE-CD1 3.59Å; M1315-F1442 HydrophobicContact CE-CE1 4.5Å; M1315-F1442 HydrophobicContact CE-CG 3.83Å; M1315-F1442 HydrophobicContact SD-CB 3.85Å; H1438-F1442 PolarHBondContact ND1-O 2.86Å; L1440-F1442 HydrophobicContact CB-CD2 4.46Å; L1440-F1442 HydrophobicContact CB-CE2 4.25Å; L1440-F1442 PolarHBondContact O-N 2.86Å; L1440-F1442 VanDerWaalsContact O-N 3.15Å; F1442-E1444 VanDerWaalsContact C-N 3.32Å; F1442-E1444 PolarHBondContact O-N 3.45Å; F1442-K1466 HydrophobicContact CD2-CB 3.72Å; F1442-K1466 HydrophobicContact CD2-CD 3.67Å; F1442-K1466 HydrophobicContact CD2-CG 3.55Å; F1442-K1466 HydrophobicContact CE2-CB 3.65Å; F1442-K1466 HydrophobicContact CE2-CD 4.07Å; F1442-K1466 HydrophobicContact CE2-CG 3.44Å; F1442-K1466 VanDerWaalsContact CE2-CG 3.44Å; F1442-K1466 HydrophobicContact CG-CB 4.33Å; F1442-K1466 HydrophobicContact CZ-CB 4.16Å; F1442-K1466 HydrophobicContact CZ-CG 4.36Å; F1442-Y1469 AromaticContact CE1-CD1 3.96Å; F1442-Y1469 HydrophobicContact CE1-CD1 3.96Å; F1442-Y1469 HydrophobicContact CE1-CE1 4.47Å; F1442-Y1469 HydrophobicContact CE1-CG 4.24Å; F1442-Y1469 HydrophobicContact CE2-CD1 4.24Å; F1442-Y1469 AromaticContact CZ-CD1 3.35Å; F1442-Y1469 HydrophobicContact CZ-CD1 3.35Å; F1442-Y1469 HydrophobicContact CZ-CE1 4.08Å; F1442-Y1469 AromaticContact CZ-CG 3.85Å; F1442-Y1469 HydrophobicContact CZ-CG 3.85Å; F1442-Y1485 HydrophobicContact CD1-CE1 4.02Å; F1442-Y1485 HydrophobicContact CD2-CD1 4.36Å; F1442-Y1485 AromaticContact CD2-CE1 3.63Å; F1442-Y1485 HydrophobicContact CD2-CE1 3.63Å; F1442-Y1485 AromaticContact CD2-CZ 3.85Å; F1442-Y1485 AromaticContact CE1-CE1 3.82Å; F1442-Y1485 HydrophobicContact CE1-CE1 3.82Å; F1442-Y1485 HydrophobicContact CE2-CD1 4.49Å; F1442-Y1485 AromaticContact CE2-CE1 3.39Å; F1442-Y1485 HydrophobicContact CE2-CE1 3.39Å; F1442-Y1485 AromaticContact CE2-CZ 3.41Å; F1442-Y1485 VanDerWaalsContact CE2-CZ 3.41Å; F1442-Y1485 WeakPolarHBondContact CE2-OH 3.41Å; F1442-Y1485 HydrophobicContact CG-CD1 4.38Å; F1442-Y1485 AromaticContact CG-CE1 3.95Å; F1442-Y1485 HydrophobicContact CG-CE1 3.95Å; F1442-Y1485 AromaticContact CZ-CE1 3.51Å; F1442-Y1485 HydrophobicContact CZ-CE1 3.51Å; F1442-Y1485 AromaticContact CZ-CZ 3.86Å; F1442-Y1485 WeakPolarHBondContact CZ-OH 3.47Å; F1442-P1489 HydrophobicContact CD1-CB 4.2Å; F1442-P1489 HydrophobicContact CE1-CB 4.29Å; F1442-F1491 AromaticContact CE1-CD1 3.52Å; F1442-F1491 HydrophobicContact CE1-CD1 3.99Å; F1442-F1491 AromaticContact CE1-CE1 3.51Å; F1442-F1491 HydrophobicContact CE1-CE1 3.51Å; F1442-F1491 VanDerWaalsContact CE1-CE1 3.46Å; F1442-F1491 HydrophobicContact CE1-CE2 4.33Å; F1442-F1491 HydrophobicContact CE1-CG 4.4Å; F1442-F1491 AromaticContact CE1-CZ 3.5Å; F1442-F1491 HydrophobicContact CE1-CZ 3.9Å; F1442-F1491 AromaticContact CZ-CD1 3.76Å; F1442-F1491 HydrophobicContact CZ-CD1 3.76Å; F1442-F1491 AromaticContact CZ-CE1 3.57Å; F1442-F1491 HydrophobicContact CZ-CE1 3.57Å; F1442-F1491 VanDerWaalsContact CZ-CE1 3.43Å; F1442-F1491 AromaticContact CZ-CZ 3.47Å; F1442-F1491 HydrophobicContact CZ-CZ 3.47Å; F1442-F1491 VanDerWaalsContact CZ-CZ 3.47Å
1443	L	32.5	Very low	33.6	Very low	105.8 Å²	105.8	114.4 Å²	114.4	55%	0.554	53%	0.532	S	S	*	.			trans	-121.7	109.8	166.1	-87.8	162.5	0	0	0	108.5	M1315 L1440 G1441 Q1445 K1448 I1462 Y1490	M1315-L1443 HydrophobicContact SD-CD2 4.22Å; M1315-L1443 HydrophobicContact SD-CG 4.2Å; L1440-L1443 PolarHBondContact O-N 2.99Å; G1441-L1443 PolarHBondContact O-N 3.09Å; G1441-L1443 VanDerWaalsContact O-N 3.14Å; L1443-Q1445 CarbonylContact O-C 3.55Å; L1443-Q1445 WeakPolarHBondContact O-CA 3.44Å; L1443-Q1445 PolarHBondContact O-N 3.13Å; L1443-K1448 HydrophobicContact CD2-CB 4.48Å; L1443-K1448 VanDerWaalsContact CD2-O 3.29Å; L1443-K1448 WeakPolarHBondContact CD2-O 3.42Å; L1443-I1462 HydrophobicContact CD1-CG2 4.46Å; L1443-Y1490 HydrophobicContact CB-CD2 3.79Å; L1443-Y1490 HydrophobicContact CB-CG 4.12Å; L1443-Y1490 WeakPolarHBondContact O-CD2 3.46Å
1444	E	34.9	Very low	34.2	Very low	110.6 Å²	110.6	108.7 Å²	108.7	52%	0.517	51%	0.508	S	S	.	.	S	Bend	trans	-64.2	44.3	179.4	-73.6	-169.2	143	0	0	112.9	N1243 K1436 H1438 F1442 K1448 S1486	N1243-E1444 PolarHBondContact ND2-N 3.04Å; K1436-E1444 WeakPolarHBondContact CD-OE1 3.5Å; K1436-E1444 IonicContact NZ-OE1 2.74Å; K1436-E1444 PolarHBondContact NZ-OE1 3.47Å; H1438-E1444 PolarHBondContact CE1-N 3.01Å; H1438-E1444 PolarHBondContact ND1-N 3.44Å; F1442-E1444 VanDerWaalsContact C-N 3.32Å; F1442-E1444 PolarHBondContact O-N 3.45Å; E1444-K1448 IonicContact OE2-NZ 2.82Å; E1444-K1448 PolarHBondContact OE2-NZ 3.18Å; E1444-S1486 PolarHBondContact OE2-OG 2.89Å
1445	Q	35.6	Very low	35.1	Very low	81.2 Å²	81.2	104.9 Å²	104.9	38%	0.379	50%	0.502	S	S	.	.			trans	171.1	107.1	172.7	-58.4	-135.9	-22	0	0	112	N1243 D1244 L1443 W1447 K1448 Y1485	N1243-Q1445 PolarHBondContact ND2-NE2 2.88Å; N1243-Q1445 PolarHBondContact ND2-OE1 3.37Å; D1244-Q1445 PolarHBondContact OD1-NE2 3.36Å; D1244-Q1445 PolarHBondContact OD1-OE1 3.26Å; L1443-Q1445 CarbonylContact O-C 3.55Å; L1443-Q1445 WeakPolarHBondContact O-CA 3.44Å; L1443-Q1445 PolarHBondContact O-N 3.13Å; Q1445-W1447 VanDerWaalsContact C-N 3.3Å; Q1445-W1447 HydrophobicContact CB-CD2 4.49Å; Q1445-W1447 HydrophobicContact CB-CZ2 4.29Å; Q1445-W1447 HydrophobicContact CG-CZ2 4.32Å; Q1445-W1447 PolarHBondContact O-N 3.01Å; Q1445-W1447 VanDerWaalsContact O-N 3.11Å; Q1445-W1447 VanDerWaalsContact OE1-CE2 3.3Å; Q1445-K1448 HydrophobicContact CB-CB 4.12Å; Q1445-K1448 HydrophobicContact CB-CD 4.27Å; Q1445-K1448 HydrophobicContact CB-CG 3.91Å; Q1445-K1448 HydrophobicContact CG-CD 4.07Å; Q1445-K1448 HydrophobicContact CG-CG 4.03Å; Q1445-K1448 PolarHBondContact O-N 3.17Å; Q1445-K1448 VanDerWaalsContact OE1-CD 3.31Å; Q1445-K1448 VanDerWaalsContact OE1-CE 3.27Å; Q1445-Y1485 HydrophobicContact CG-CG 4.47Å
1446	P	35.6	Very low	36.1	Very low	64.4 Å²	64.4	100.7 Å²	100.7	42%	0.418	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-4	175.7	28.5	-33.9	0	0	0	114	P1307 M1315 L1423 F1426 K1448 L1449 Y1485 Y1490	P1307-P1446 HydrophobicContact CG-CG 4.19Å; M1315-P1446 HydrophobicContact CE-CB 3.87Å; M1315-P1446 WeakPolarHBondContact CE-O 3.43Å; M1315-P1446 HydrophobicContact SD-CB 3.65Å; L1423-P1446 HydrophobicContact CD2-CG 4.37Å; F1426-P1446 HydrophobicContact CD1-CB 3.82Å; F1426-P1446 HydrophobicContact CD1-CG 3.67Å; F1426-P1446 HydrophobicContact CD2-CB 4.32Å; F1426-P1446 HydrophobicContact CE1-CB 3.95Å; F1426-P1446 HydrophobicContact CE1-CG 3.76Å; F1426-P1446 HydrophobicContact CE2-CB 4.45Å; F1426-P1446 HydrophobicContact CG-CB 4.01Å; F1426-P1446 HydrophobicContact CG-CG 4.33Å; F1426-P1446 HydrophobicContact CZ-CB 4.26Å; F1426-P1446 HydrophobicContact CZ-CG 4.49Å; P1446-K1448 PolarHBondContact O-N 3.09Å; P1446-K1448 VanDerWaalsContact O-N 3.08Å; P1446-L1449 PolarHBondContact O-N 3.1Å; P1446-Y1485 HydrophobicContact CG-CD1 4.06Å; P1446-Y1485 HydrophobicContact CG-CE1 4.06Å; P1446-Y1490 HydrophobicContact CB-CE2 4.08Å
1447	W	38.3	Very low	37.1	Very low	87.6 Å²	87.6	97 Å²	97	33%	0.332	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	3.2	-178.5	-13.5	97.7	0	0	0	114.9	D1244 I1311 M1315 K1419 L1423 Y1435 K1436 Q1445 L1449 I1462 L1465 K1466 Y1469 Y1485	D1244-W1447 WeakPolarHBondContact OD1-CZ2 3.3Å; I1311-W1447 HydrophobicContact CD1-CH2 4.12Å; I1311-W1447 HydrophobicContact CG2-CH2 3.54Å; I1311-W1447 HydrophobicContact CG2-CZ3 3.65Å; M1315-W1447 HydrophobicContact CE-CD2 3.61Å; M1315-W1447 HydrophobicContact CE-CE3 2.98Å; M1315-W1447 HydrophobicContact CE-CG 4.41Å; M1315-W1447 HydrophobicContact CE-CH2 3.86Å; M1315-W1447 HydrophobicContact CE-CZ2 4.36Å; M1315-W1447 HydrophobicContact CE-CZ3 3.13Å; K1419-W1447 HydrophobicContact CD-CB 4.41Å; K1419-W1447 WeakPolarHBondContact CE-O 3.3Å; K1419-W1447 HydrophobicContact CG-CB 3.96Å; L1423-W1447 HydrophobicContact CD1-CB 4.03Å; L1423-W1447 HydrophobicContact CD2-CB 3.89Å; L1423-W1447 HydrophobicContact CD2-CD2 4.25Å; L1423-W1447 HydrophobicContact CD2-CE3 3.52Å; L1423-W1447 HydrophobicContact CD2-CG 4.48Å; L1423-W1447 HydrophobicContact CD2-CZ3 4.31Å; L1423-W1447 HydrophobicContact CG-CB 3.95Å; Y1435-W1447 WeakPolarHBondContact O-CH2 3.42Å; Y1435-W1447 WeakPolarHBondContact O-CZ2 3.12Å; K1436-W1447 HydrophobicContact CG-CD2 4.38Å; K1436-W1447 HydrophobicContact CG-CG 4.32Å; K1436-W1447 HydrophobicContact CG-CZ2 4.49Å; K1436-W1447 PolarHBondContact O-NE1 2.76Å; Q1445-W1447 VanDerWaalsContact C-N 3.3Å; Q1445-W1447 HydrophobicContact CB-CD2 4.49Å; Q1445-W1447 HydrophobicContact CB-CZ2 4.29Å; Q1445-W1447 HydrophobicContact CG-CZ2 4.32Å; Q1445-W1447 PolarHBondContact O-N 3.01Å; Q1445-W1447 VanDerWaalsContact O-N 3.11Å; Q1445-W1447 VanDerWaalsContact OE1-CE2 3.3Å; W1447-L1449 VanDerWaalsContact C-N 3.34Å; W1447-L1449 PolarHBondContact O-N 3.16Å; W1447-L1449 VanDerWaalsContact O-N 3.16Å; W1447-I1462 HydrophobicContact CE3-CG2 4.37Å; W1447-I1462 VanDerWaalsContact O-CG2 3.3Å; W1447-I1462 WeakPolarHBondContact O-CG2 3.32Å; W1447-L1465 HydrophobicContact CH2-CB 4.45Å; W1447-L1465 VanDerWaalsContact CH2-O 3.3Å; W1447-L1465 WeakPolarHBondContact CH2-O 3.45Å; W1447-L1465 HydrophobicContact CZ3-CB 3.73Å; W1447-L1465 WeakPolarHBondContact CZ3-O 3.21Å; W1447-K1466 HydrophobicContact CB-CB 4.2Å; W1447-K1466 HydrophobicContact CB-CD 3.78Å; W1447-K1466 HydrophobicContact CB-CG 4.12Å; W1447-K1466 HydrophobicContact CD2-CB 3.85Å; W1447-K1466 VanDerWaalsContact CD2-CB 3.44Å; W1447-K1466 HydrophobicContact CD2-CD 3.85Å; W1447-K1466 VanDerWaalsContact CD2-CD 3.49Å; W1447-K1466 HydrophobicContact CD2-CG 3.65Å; W1447-K1466 HydrophobicContact CE3-CB 3.55Å; W1447-K1466 VanDerWaalsContact CE3-CB 3.4Å; W1447-K1466 HydrophobicContact CE3-CD 3.7Å; W1447-K1466 HydrophobicContact CE3-CG 3.9Å; W1447-K1466 HydrophobicContact CG-CB 3.77Å; W1447-K1466 HydrophobicContact CG-CD 3.58Å; W1447-K1466 VanDerWaalsContact CG-CE 3.46Å; W1447-K1466 HydrophobicContact CG-CG 3.9Å; W1447-K1466 HydrophobicContact CH2-CB 4.07Å; W1447-K1466 HydrophobicContact CH2-CG 4.11Å; W1447-K1466 HydrophobicContact CZ2-CG 4.09Å; W1447-K1466 HydrophobicContact CZ3-CB 3.82Å; W1447-K1466 HydrophobicContact CZ3-CD 4.43Å; W1447-K1466 HydrophobicContact CZ3-CG 3.9Å; W1447-Y1469 HydrophobicContact CH2-CD1 4.42Å; W1447-Y1469 HydrophobicContact CH2-CG 4.06Å; W1447-Y1469 AromaticContact CZ2-CD1 3.47Å; W1447-Y1469 HydrophobicContact CZ2-CD1 3.89Å; W1447-Y1469 VanDerWaalsContact CZ2-CD1 3.47Å; W1447-Y1469 HydrophobicContact CZ2-CD2 4.33Å; W1447-Y1469 HydrophobicContact CZ2-CE1 4.17Å; W1447-Y1469 AromaticContact CZ2-CG 3.53Å; W1447-Y1469 HydrophobicContact CZ2-CG 3.53Å; W1447-Y1485 AromaticContact CD1-CE1 3.88Å; W1447-Y1485 AromaticContact CD1-CZ 3.99Å; W1447-Y1485 HydrophobicContact CZ2-CE1 4.06Å; W1447-Y1485 AromaticContact NE1-CE1 3.43Å; W1447-Y1485 AromaticContact NE1-CZ 3.63Å; W1447-Y1485 VanDerWaalsContact NE1-CZ 3.34Å; W1447-Y1485 PolarHBondContact NE1-OH 3.45Å
1448	K	34.9	Very low	38	Very low	100.8 Å²	100.8	94.5 Å²	94.5	44%	0.438	48%	0.478	S	S	.	.			trans	-90.4	77.5	167.7	-85.5	-175.6	178.3	-165	0	109.6	S1319 K1436 H1438 L1443 E1444 Q1445 P1446 P1450 D1451 Y1490	S1319-K1448 VanDerWaalsContact CB-O 3.26Å; S1319-K1448 WeakPolarHBondContact CB-O 3.5Å; S1319-K1448 PolarHBondContact OG-O 2.93Å; K1436-K1448 PolarHBondContact O-NZ 3.3Å; H1438-K1448 WeakPolarHBondContact NE2-CB 3.39Å; H1438-K1448 WeakPolarHBondContact NE2-CD 3.24Å; L1443-K1448 HydrophobicContact CD2-CB 4.48Å; L1443-K1448 VanDerWaalsContact CD2-O 3.29Å; L1443-K1448 WeakPolarHBondContact CD2-O 3.42Å; E1444-K1448 IonicContact OE2-NZ 2.82Å; E1444-K1448 PolarHBondContact OE2-NZ 3.18Å; Q1445-K1448 HydrophobicContact CB-CB 4.12Å; Q1445-K1448 HydrophobicContact CB-CD 4.27Å; Q1445-K1448 HydrophobicContact CB-CG 3.91Å; Q1445-K1448 HydrophobicContact CG-CD 4.07Å; Q1445-K1448 HydrophobicContact CG-CG 4.03Å; Q1445-K1448 PolarHBondContact O-N 3.17Å; Q1445-K1448 VanDerWaalsContact OE1-CD 3.31Å; Q1445-K1448 VanDerWaalsContact OE1-CE 3.27Å; P1446-K1448 PolarHBondContact O-N 3.09Å; P1446-K1448 VanDerWaalsContact O-N 3.08Å; K1448-P1450 VanDerWaalsContact O-CD 3.26Å; K1448-P1450 WeakPolarHBondContact O-CD 3.42Å; K1448-D1451 IonicContact NZ-OD2 3.99Å; K1448-D1451 PolarHBondContact NZ-OD2 3.47Å; K1448-Y1490 VanDerWaalsContact NZ-CE1 3.32Å
1449	L	34.3	Very low	39.1	Very low	83.8 Å²	83.8	92.7 Å²	92.7	44%	0.439	47%	0.471	S	S	.	.			trans	-60.5	134.1	157.5	-110.3	73.4	0	0	0	108.8	M1315 L1318 P1446 W1447 D1451 T1454 L1459 I1462	M1315-L1449 HydrophobicContact CB-CD1 4.17Å; M1315-L1449 HydrophobicContact CG-CD1 4.44Å; L1318-L1449 VanDerWaalsContact C-CD2 3.49Å; L1318-L1449 HydrophobicContact CB-CD2 3.73Å; P1446-L1449 PolarHBondContact O-N 3.1Å; W1447-L1449 VanDerWaalsContact C-N 3.34Å; W1447-L1449 PolarHBondContact O-N 3.16Å; W1447-L1449 VanDerWaalsContact O-N 3.16Å; L1449-D1451 PolarHBondContact O-N 3.1Å; L1449-T1454 WeakPolarHBondContact CD1-OG1 3.11Å; L1449-T1454 HydrophobicContact CD2-CG2 3.6Å; L1449-T1454 VanDerWaalsContact CD2-CG2 3.48Å; L1449-L1459 HydrophobicContact CD2-CD2 3.89Å; L1449-I1462 HydrophobicContact CD1-CD1 4.03Å; L1449-I1462 HydrophobicContact CD2-CD1 4.04Å; L1449-I1462 HydrophobicContact CG-CD1 4.31Å
1450	P	35.2	Very low	40.6	Very low	68 Å²	68	91.8 Å²	91.8	44%	0.442	47%	0.472	S	S	.	.			trans	-64.1	134.6	164.9	0.9	7.6	0	0	0	108.6	K1448 Y1452 Y1453	K1448-P1450 VanDerWaalsContact O-CD 3.26Å; K1448-P1450 WeakPolarHBondContact O-CD 3.42Å; P1450-Y1452 VanDerWaalsContact C-N 3.33Å; P1450-Y1452 CarbonylContact C-O 3.59Å; P1450-Y1452 HydrophobicContact CB-CE2 4.23Å; P1450-Y1452 WeakPolarHBondContact CB-O 3.34Å; P1450-Y1452 HydrophobicContact CG-CE2 4.46Å; P1450-Y1452 WeakPolarHBondContact CG-O 3.39Å; P1450-Y1452 CarbonylContact O-C 3.54Å; P1450-Y1452 VanDerWaalsContact O-CD2 3.23Å; P1450-Y1452 WeakPolarHBondContact O-CD2 3.15Å; P1450-Y1452 PolarHBondContact O-N 3.12Å; P1450-Y1453 PolarHBondContact O-N 2.91Å
1451	D	33.9	Very low	42.1	Very low	114.6 Å²	114.6	95.3 Å²	95.3	61%	0.613	48%	0.479	S	S	*	.	S	Bend	trans	-66.1	48.3	178.9	-61.1	-72.6	0	0	0	112.7	S1418 N1422 K1448 L1449 Y1453	S1418-D1451 WeakPolarHBondContact CB-OD2 3.38Å; S1418-D1451 PolarHBondContact OG-OD2 3.33Å; S1418-D1451 VanDerWaalsContact OG-OD2 3.1Å; N1422-D1451 PolarHBondContact ND2-OD1 3.09Å; N1422-D1451 PolarHBondContact ND2-OD2 3.26Å; K1448-D1451 IonicContact NZ-OD2 3.99Å; K1448-D1451 PolarHBondContact NZ-OD2 3.47Å; L1449-D1451 PolarHBondContact O-N 3.1Å; D1451-Y1453 HydrophobicContact CB-CD2 4.45Å; D1451-Y1453 HydrophobicContact CB-CE2 4.07Å; D1451-Y1453 PolarHBondContact O-N 2.86Å; D1451-Y1453 VanDerWaalsContact O-N 3.13Å
1452	Y	38.1	Very low	43.4	Very low	172.8 Å²	172.8	93.9 Å²	93.9	68%	0.678	46%	0.46	S	S	*	.	S	Bend	trans	-114.4	95.9	-174.6	-64.9	-85.6	0	0	0	111.1	N1422 P1450 T1454	N1422-Y1452 WeakPolarHBondContact ND2-CE2 3.47Å; N1422-Y1452 PolarHBondContact ND2-OH 3.28Å; N1422-Y1452 PolarHBondContact OD1-OH 3.45Å; P1450-Y1452 VanDerWaalsContact C-N 3.33Å; P1450-Y1452 CarbonylContact C-O 3.59Å; P1450-Y1452 HydrophobicContact CB-CE2 4.23Å; P1450-Y1452 WeakPolarHBondContact CB-O 3.34Å; P1450-Y1452 HydrophobicContact CG-CE2 4.46Å; P1450-Y1452 WeakPolarHBondContact CG-O 3.39Å; P1450-Y1452 CarbonylContact O-C 3.54Å; P1450-Y1452 VanDerWaalsContact O-CD2 3.23Å; P1450-Y1452 WeakPolarHBondContact O-CD2 3.15Å; P1450-Y1452 PolarHBondContact O-N 3.12Å; Y1452-T1454 PolarHBondContact O-N 2.96Å
1453	Y	36.1	Very low	45	Very low	184.2 Å²	184.2	91.6 Å²	91.6	72%	0.722	46%	0.457	S	S	*	.	S	Bend	trans	33.4	45.8	169.3	-54.2	-72.7	0	0	0	116.3	N1415 P1450 D1451 T1455	N1415-Y1453 PolarHBondContact OD1-OH 3.27Å; P1450-Y1453 PolarHBondContact O-N 2.91Å; D1451-Y1453 HydrophobicContact CB-CD2 4.45Å; D1451-Y1453 HydrophobicContact CB-CE2 4.07Å; D1451-Y1453 PolarHBondContact O-N 2.86Å; D1451-Y1453 VanDerWaalsContact O-N 3.13Å; Y1453-T1455 PolarHBondContact O-N 3.22Å
1454	T	45.7	Very low	46.7	Very low	44.4 Å²	44.4	90.7 Å²	90.7	27%	0.272	45%	0.453	S	S	.	.			trans	-102.4	124.1	152.1	31.8	0	0	0	0	109.5	L1318 L1449 Y1452 D1458 L1459 I1462	L1318-T1454 HydrophobicContact CB-CG2 4.32Å; L1318-T1454 HydrophobicContact CD2-CG2 4.04Å; L1449-T1454 WeakPolarHBondContact CD1-OG1 3.11Å; L1449-T1454 HydrophobicContact CD2-CG2 3.6Å; L1449-T1454 VanDerWaalsContact CD2-CG2 3.48Å; Y1452-T1454 PolarHBondContact O-N 2.96Å; T1454-D1458 HydrophobicContact CG2-CB 3.91Å; T1454-L1459 WeakPolarHBondContact OG1-CG 3.23Å; T1454-I1462 HydrophobicContact CG2-CD1 4.19Å
1455	T	49.1	Very low	48.2	Very low	83.8 Å²	83.8	87.7 Å²	87.7	51%	0.514	44%	0.44	S	S	.	.			trans	-64.4	150.7	174	-4.5	0	0	0	0	109.2	Y1453 S1457 D1458 L1459	Y1453-T1455 PolarHBondContact O-N 3.22Å; T1455-S1457 WeakPolarHBondContact CB-OG 3.32Å; T1455-S1457 PolarHBondContact O-N 3.03Å; T1455-S1457 VanDerWaalsContact O-N 3.12Å; T1455-D1458 WeakPolarHBondContact CA-OD2 3.27Å; T1455-D1458 VanDerWaalsContact CB-OD2 3.23Å; T1455-D1458 WeakPolarHBondContact CB-OD2 3.42Å; T1455-D1458 PolarHBondContact N-OD2 3.4Å; T1455-D1458 VanDerWaalsContact N-OD2 3.15Å; T1455-D1458 WeakPolarHBondContact O-CA 3.33Å; T1455-D1458 WeakPolarHBondContact O-CB 3.31Å; T1455-D1458 PolarHBondContact O-N 2.99Å; T1455-D1458 VanDerWaalsContact OG1-CG 3.24Å; T1455-D1458 PolarHBondContact OG1-N 3.29Å; T1455-D1458 PolarHBondContact OG1-OD2 3.09Å; T1455-L1459 PolarHBondContact O-N 3.2Å; T1455-L1459 VanDerWaalsContact O-N 3.17Å
1456	S	52.5	Low	49.7	Very low	87 Å²	87	86.4 Å²	86.4	61%	0.608	43%	0.433	S	S	*	.	H	α-helix	trans	-54.8	-33.8	177.6	37.7	0	0	0	0	112.4	D1458 L1459 F1460	S1456-D1458 VanDerWaalsContact C-N 3.28Å; S1456-D1458 PolarHBondContact O-N 3.12Å; S1456-L1459 PolarHBondContact O-N 3.31Å; S1456-F1460 WeakPolarHBondContact O-CD2 3.29Å; S1456-F1460 PolarHBondContact O-N 3.07Å; S1456-F1460 VanDerWaalsContact O-N 3.1Å
1457	S	54.9	Low	51.3	Low	61.6 Å²	61.6	88 Å²	88	43%	0.431	44%	0.435	S	S	.	.	H	α-helix	trans	-57.7	-34.7	172.1	89.1	0	0	0	0	114.3	T1455 F1460 R1461	T1455-S1457 WeakPolarHBondContact CB-OG 3.32Å; T1455-S1457 PolarHBondContact O-N 3.03Å; T1455-S1457 VanDerWaalsContact O-N 3.12Å; S1457-F1460 PolarHBondContact O-N 3.49Å; S1457-R1461 WeakPolarHBondContact O-CB 3.5Å; S1457-R1461 VanDerWaalsContact O-CG 3.29Å; S1457-R1461 WeakPolarHBondContact O-CG 3.31Å; S1457-R1461 PolarHBondContact O-N 3.34Å
1458	D	52.1	Low	52.9	Low	36.6 Å²	36.6	88.2 Å²	88.2	20%	0.196	44%	0.442	C	S	.	.	H	α-helix	trans	-81.7	-36.4	-175.5	-54.9	-46.4	0	0	0	110.6	L1318 T1454 T1455 S1456 F1460 R1461 I1462	L1318-D1458 HydrophobicContact CD1-CB 4.27Å; L1318-D1458 HydrophobicContact CD2-CB 3.93Å; T1454-D1458 HydrophobicContact CG2-CB 3.91Å; T1455-D1458 WeakPolarHBondContact CA-OD2 3.27Å; T1455-D1458 VanDerWaalsContact CB-OD2 3.23Å; T1455-D1458 WeakPolarHBondContact CB-OD2 3.42Å; T1455-D1458 PolarHBondContact N-OD2 3.4Å; T1455-D1458 VanDerWaalsContact N-OD2 3.15Å; T1455-D1458 WeakPolarHBondContact O-CA 3.33Å; T1455-D1458 WeakPolarHBondContact O-CB 3.31Å; T1455-D1458 PolarHBondContact O-N 2.99Å; T1455-D1458 VanDerWaalsContact OG1-CG 3.24Å; T1455-D1458 PolarHBondContact OG1-N 3.29Å; T1455-D1458 PolarHBondContact OG1-OD2 3.09Å; S1456-D1458 VanDerWaalsContact C-N 3.28Å; S1456-D1458 PolarHBondContact O-N 3.12Å; D1458-F1460 VanDerWaalsContact C-N 3.34Å; D1458-F1460 PolarHBondContact O-N 2.83Å; D1458-R1461 WeakPolarHBondContact O-CB 3.2Å; D1458-R1461 PolarHBondContact O-N 3.32Å; D1458-R1461 IonicContact OD1-NH1 2.72Å; D1458-R1461 PolarHBondContact OD1-NH1 3.34Å; D1458-I1462 WeakPolarHBondContact O-CB 3.39Å; D1458-I1462 WeakPolarHBondContact O-CD1 3.36Å; D1458-I1462 VanDerWaalsContact O-CG1 3.27Å; D1458-I1462 WeakPolarHBondContact O-CG1 3.4Å; D1458-I1462 PolarHBondContact O-N 3.16Å
1459	L	52.9	Low	54.6	Low	78.6 Å²	78.6	83.8 Å²	83.8	41%	0.412	42%	0.423	S	S	.	.	H	α-helix	trans	-60.4	-42.4	167.6	-96	158.6	0	0	0	112	L1318 L1423 L1440 L1449 T1454 T1455 S1456 I1462 S1463	L1318-L1459 HydrophobicContact CD1-CD2 4.5Å; L1318-L1459 HydrophobicContact CD1-CG 4.46Å; L1423-L1459 HydrophobicContact CD2-CB 4.22Å; L1423-L1459 HydrophobicContact CD2-CD2 3.44Å; L1423-L1459 VanDerWaalsContact CD2-CD2 3.44Å; L1423-L1459 HydrophobicContact CD2-CG 4.36Å; L1440-L1459 HydrophobicContact CD1-CD2 4.49Å; L1449-L1459 HydrophobicContact CD2-CD2 3.89Å; T1454-L1459 WeakPolarHBondContact OG1-CG 3.23Å; T1455-L1459 PolarHBondContact O-N 3.2Å; T1455-L1459 VanDerWaalsContact O-N 3.17Å; S1456-L1459 PolarHBondContact O-N 3.31Å; L1459-I1462 PolarHBondContact O-N 3.06Å; L1459-S1463 VanDerWaalsContact O-CB 3.31Å; L1459-S1463 WeakPolarHBondContact O-CB 3.43Å; L1459-S1463 PolarHBondContact O-N 3.31Å
1460	F	63.8	Low	56.3	Low	127.2 Å²	127.2	81.9 Å²	81.9	56%	0.558	41%	0.413	S	S	*	.	H	α-helix	trans	-62.4	-47.6	172.4	-79.7	-64.3	0	0	0	111.8	K1419 L1423 S1456 S1457 D1458 I1462 S1463 D1464	K1419-F1460 HydrophobicContact CB-CE1 4.1Å; K1419-F1460 HydrophobicContact CD-CD1 4.27Å; K1419-F1460 HydrophobicContact CD-CE1 4.23Å; L1423-F1460 HydrophobicContact CD1-CD1 4.36Å; L1423-F1460 HydrophobicContact CD1-CE1 3.56Å; L1423-F1460 HydrophobicContact CD1-CZ 3.74Å; S1456-F1460 WeakPolarHBondContact O-CD2 3.29Å; S1456-F1460 PolarHBondContact O-N 3.07Å; S1456-F1460 VanDerWaalsContact O-N 3.1Å; S1457-F1460 PolarHBondContact O-N 3.49Å; D1458-F1460 VanDerWaalsContact C-N 3.34Å; D1458-F1460 PolarHBondContact O-N 2.83Å; F1460-I1462 VanDerWaalsContact C-N 3.32Å; F1460-I1462 PolarHBondContact O-N 3.07Å; F1460-S1463 CarbonylContact O-C 3.51Å; F1460-S1463 WeakPolarHBondContact O-CA 3.39Å; F1460-S1463 VanDerWaalsContact O-CB 3.28Å; F1460-S1463 WeakPolarHBondContact O-CB 3.44Å; F1460-S1463 PolarHBondContact O-N 2.89Å; F1460-S1463 VanDerWaalsContact O-N 3.1Å; F1460-D1464 VanDerWaalsContact O-CG 3.26Å; F1460-D1464 PolarHBondContact O-N 3.13Å
1461	R	60.7	Low	58.3	Low	158.8 Å²	158.8	83.7 Å²	83.7	60%	0.599	41%	0.414	S	S	*	.	H	α-helix	trans	-58.2	-40.3	176.2	-84.6	175.6	163.1	-179.3	-6.5	113.3	L1318 S1457 D1458 S1463 D1464 L1465	L1318-R1461 HydrophobicContact CD1-CB 3.86Å; S1457-R1461 WeakPolarHBondContact O-CB 3.5Å; S1457-R1461 VanDerWaalsContact O-CG 3.29Å; S1457-R1461 WeakPolarHBondContact O-CG 3.31Å; S1457-R1461 PolarHBondContact O-N 3.34Å; D1458-R1461 WeakPolarHBondContact O-CB 3.2Å; D1458-R1461 PolarHBondContact O-N 3.32Å; D1458-R1461 IonicContact OD1-NH1 2.72Å; D1458-R1461 PolarHBondContact OD1-NH1 3.34Å; R1461-S1463 VanDerWaalsContact C-N 3.33Å; R1461-D1464 PolarHBondContact O-N 3.17Å; R1461-L1465 WeakPolarHBondContact O-CB 3.29Å; R1461-L1465 WeakPolarHBondContact O-CD1 3.43Å; R1461-L1465 VanDerWaalsContact O-CG 3.28Å; R1461-L1465 WeakPolarHBondContact O-CG 3.34Å; R1461-L1465 PolarHBondContact O-N 3.13Å
1462	I	58.6	Low	60.1	Low	17.8 Å²	17.8	82.6 Å²	82.6	9%	0.091	40%	0.404	C	S	.	.	H	α-helix	trans	-66.7	-39.8	175.7	-69.1	161.6	0	0	0	110.5	T1314 M1315 L1318 L1420 L1443 W1447 L1449 T1454 D1458 L1459 F1460 L1465 K1466	T1314-I1462 HydrophobicContact CG2-CD1 3.33Å; T1314-I1462 HydrophobicContact CG2-CG1 3.66Å; M1315-I1462 HydrophobicContact CE-CG1 4.35Å; M1315-I1462 HydrophobicContact CE-CG2 4.16Å; M1315-I1462 HydrophobicContact CG-CD1 4.44Å; M1315-I1462 HydrophobicContact CG-CG1 4.25Å; M1315-I1462 HydrophobicContact CG-CG2 3.91Å; M1315-I1462 HydrophobicContact SD-CG1 4.49Å; M1315-I1462 HydrophobicContact SD-CG2 4.38Å; L1318-I1462 HydrophobicContact CB-CD1 4.32Å; L1318-I1462 HydrophobicContact CD1-CD1 3.64Å; L1318-I1462 VanDerWaalsContact CD1-CD1 3.49Å; L1318-I1462 HydrophobicContact CD1-CG1 3.79Å; L1318-I1462 HydrophobicContact CD1-CG2 4.16Å; L1318-I1462 HydrophobicContact CG-CD1 4.13Å; L1420-I1462 HydrophobicContact CD1-CD1 3.88Å; L1420-I1462 HydrophobicContact CD1-CG1 4.36Å; L1420-I1462 HydrophobicContact CD1-CG2 3.96Å; L1420-I1462 HydrophobicContact CD2-CG2 4.18Å; L1420-I1462 HydrophobicContact CG-CG2 4.47Å; L1443-I1462 HydrophobicContact CD1-CG2 4.46Å; W1447-I1462 HydrophobicContact CE3-CG2 4.37Å; W1447-I1462 VanDerWaalsContact O-CG2 3.3Å; W1447-I1462 WeakPolarHBondContact O-CG2 3.32Å; L1449-I1462 HydrophobicContact CD1-CD1 4.03Å; L1449-I1462 HydrophobicContact CD2-CD1 4.04Å; L1449-I1462 HydrophobicContact CG-CD1 4.31Å; T1454-I1462 HydrophobicContact CG2-CD1 4.19Å; D1458-I1462 WeakPolarHBondContact O-CB 3.39Å; D1458-I1462 WeakPolarHBondContact O-CD1 3.36Å; D1458-I1462 VanDerWaalsContact O-CG1 3.27Å; D1458-I1462 WeakPolarHBondContact O-CG1 3.4Å; D1458-I1462 PolarHBondContact O-N 3.16Å; L1459-I1462 PolarHBondContact O-N 3.06Å; F1460-I1462 VanDerWaalsContact C-N 3.32Å; F1460-I1462 PolarHBondContact O-N 3.07Å; I1462-L1465 PolarHBondContact O-N 3.01Å; I1462-K1466 VanDerWaalsContact O-CB 3.25Å; I1462-K1466 WeakPolarHBondContact O-CB 3.35Å; I1462-K1466 PolarHBondContact O-N 3.09Å
1463	S	64.5	Low	61.9	Low	54.6 Å²	54.6	74.4 Å²	74.4	38%	0.382	37%	0.372	S	S	.	.	H	α-helix	trans	-63.9	-41.6	174.7	-171.8	0	0	0	0	112.4	L1459 F1460 R1461 K1466 H1467	L1459-S1463 VanDerWaalsContact O-CB 3.31Å; L1459-S1463 WeakPolarHBondContact O-CB 3.43Å; L1459-S1463 PolarHBondContact O-N 3.31Å; F1460-S1463 CarbonylContact O-C 3.51Å; F1460-S1463 WeakPolarHBondContact O-CA 3.39Å; F1460-S1463 VanDerWaalsContact O-CB 3.28Å; F1460-S1463 WeakPolarHBondContact O-CB 3.44Å; F1460-S1463 PolarHBondContact O-N 2.89Å; F1460-S1463 VanDerWaalsContact O-N 3.1Å; R1461-S1463 VanDerWaalsContact C-N 3.33Å; S1463-K1466 WeakPolarHBondContact O-CB 3.45Å; S1463-K1466 PolarHBondContact O-N 3.23Å; S1463-H1467 VanDerWaalsContact O-CB 3.25Å; S1463-H1467 WeakPolarHBondContact O-CB 3.24Å; S1463-H1467 PolarHBondContact O-N 3.26Å
1464	D	68.4	Low	63.7	Low	86.6 Å²	86.6	69.6 Å²	69.6	46%	0.463	37%	0.365	S	S	.	.	H	α-helix	trans	-67.2	-46.6	178.2	-66.5	-28.6	0	0	0	111	F1460 R1461 K1466 H1467 D1468	F1460-D1464 VanDerWaalsContact O-CG 3.26Å; F1460-D1464 PolarHBondContact O-N 3.13Å; R1461-D1464 PolarHBondContact O-N 3.17Å; D1464-K1466 VanDerWaalsContact C-N 3.3Å; D1464-K1466 PolarHBondContact O-N 3.17Å; D1464-H1467 WeakPolarHBondContact O-CB 3.47Å; D1464-H1467 PolarHBondContact O-N 3Å; D1464-H1467 VanDerWaalsContact O-N 3.13Å; D1464-D1468 WeakPolarHBondContact O-CB 3.32Å; D1464-D1468 VanDerWaalsContact O-CG 3.3Å; D1464-D1468 PolarHBondContact O-N 3.01Å
1465	L	66.7	Low	64.9	Low	47.4 Å²	47.4	72 Å²	72	25%	0.248	37%	0.373	C	S	.	.	H	α-helix	trans	-61.6	-38.4	175.2	-72.9	170.1	0	0	0	112.2	Y1310 I1311 T1314 M1315 L1318 W1447 R1461 I1462 H1467 Y1469	Y1310-L1465 HydrophobicContact CE2-CD1 3.43Å; Y1310-L1465 VanDerWaalsContact CE2-CD1 3.43Å; Y1310-L1465 HydrophobicContact CE2-CD2 4.14Å; Y1310-L1465 HydrophobicContact CE2-CG 4.41Å; Y1310-L1465 WeakPolarHBondContact OH-CD1 3.46Å; Y1310-L1465 WeakPolarHBondContact OH-CD2 3.38Å; Y1310-L1465 WeakPolarHBondContact OH-CG 3.45Å; I1311-L1465 HydrophobicContact CD1-CB 4.08Å; I1311-L1465 HydrophobicContact CG1-CB 4.34Å; T1314-L1465 HydrophobicContact CG2-CD1 4.06Å; M1315-L1465 HydrophobicContact CE-CB 4.15Å; M1315-L1465 HydrophobicContact CE-CD1 4.13Å; M1315-L1465 HydrophobicContact CG-CD1 4.17Å; L1318-L1465 HydrophobicContact CD1-CD1 4.16Å; W1447-L1465 HydrophobicContact CH2-CB 4.45Å; W1447-L1465 VanDerWaalsContact CH2-O 3.3Å; W1447-L1465 WeakPolarHBondContact CH2-O 3.45Å; W1447-L1465 HydrophobicContact CZ3-CB 3.73Å; W1447-L1465 WeakPolarHBondContact CZ3-O 3.21Å; R1461-L1465 WeakPolarHBondContact O-CB 3.29Å; R1461-L1465 WeakPolarHBondContact O-CD1 3.43Å; R1461-L1465 VanDerWaalsContact O-CG 3.28Å; R1461-L1465 WeakPolarHBondContact O-CG 3.34Å; R1461-L1465 PolarHBondContact O-N 3.13Å; I1462-L1465 PolarHBondContact O-N 3.01Å; L1465-H1467 VanDerWaalsContact C-N 3.32Å; L1465-Y1469 WeakPolarHBondContact O-CB 3.42Å; L1465-Y1469 PolarHBondContact O-N 3.29Å; L1465-Y1469 VanDerWaalsContact O-N 3.12Å
1466	K	66.8	Low	66.1	Low	53 Å²	53	68.4 Å²	68.4	23%	0.23	35%	0.351	C	S	.	.	H	α-helix	trans	-60.7	-51.7	171	179.2	175.5	-174.5	-141.8	0	110.5	M1315 L1423 L1440 F1442 W1447 I1462 S1463 D1464 D1468 Y1469 D1470	M1315-K1466 HydrophobicContact CE-CB 3.14Å; M1315-K1466 HydrophobicContact CE-CD 3.63Å; M1315-K1466 HydrophobicContact CE-CG 3.28Å; M1315-K1466 HydrophobicContact SD-CD 4.37Å; M1315-K1466 HydrophobicContact SD-CG 4.42Å; L1423-K1466 PolarHBondContact O-NZ 3.14Å; L1440-K1466 HydrophobicContact CB-CD 4.45Å; L1440-K1466 HydrophobicContact CD2-CD 3.88Å; F1442-K1466 HydrophobicContact CD2-CB 3.72Å; F1442-K1466 HydrophobicContact CD2-CD 3.67Å; F1442-K1466 HydrophobicContact CD2-CG 3.55Å; F1442-K1466 HydrophobicContact CE2-CB 3.65Å; F1442-K1466 HydrophobicContact CE2-CD 4.07Å; F1442-K1466 HydrophobicContact CE2-CG 3.44Å; F1442-K1466 VanDerWaalsContact CE2-CG 3.44Å; F1442-K1466 HydrophobicContact CG-CB 4.33Å; F1442-K1466 HydrophobicContact CZ-CB 4.16Å; F1442-K1466 HydrophobicContact CZ-CG 4.36Å; W1447-K1466 HydrophobicContact CB-CB 4.2Å; W1447-K1466 HydrophobicContact CB-CD 3.78Å; W1447-K1466 HydrophobicContact CB-CG 4.12Å; W1447-K1466 HydrophobicContact CD2-CB 3.85Å; W1447-K1466 VanDerWaalsContact CD2-CB 3.44Å; W1447-K1466 HydrophobicContact CD2-CD 3.85Å; W1447-K1466 VanDerWaalsContact CD2-CD 3.49Å; W1447-K1466 HydrophobicContact CD2-CG 3.65Å; W1447-K1466 HydrophobicContact CE3-CB 3.55Å; W1447-K1466 VanDerWaalsContact CE3-CB 3.4Å; W1447-K1466 HydrophobicContact CE3-CD 3.7Å; W1447-K1466 HydrophobicContact CE3-CG 3.9Å; W1447-K1466 HydrophobicContact CG-CB 3.77Å; W1447-K1466 HydrophobicContact CG-CD 3.58Å; W1447-K1466 VanDerWaalsContact CG-CE 3.46Å; W1447-K1466 HydrophobicContact CG-CG 3.9Å; W1447-K1466 HydrophobicContact CH2-CB 4.07Å; W1447-K1466 HydrophobicContact CH2-CG 4.11Å; W1447-K1466 HydrophobicContact CZ2-CG 4.09Å; W1447-K1466 HydrophobicContact CZ3-CB 3.82Å; W1447-K1466 HydrophobicContact CZ3-CD 4.43Å; W1447-K1466 HydrophobicContact CZ3-CG 3.9Å; I1462-K1466 VanDerWaalsContact O-CB 3.25Å; I1462-K1466 WeakPolarHBondContact O-CB 3.35Å; I1462-K1466 PolarHBondContact O-N 3.09Å; S1463-K1466 WeakPolarHBondContact O-CB 3.45Å; S1463-K1466 PolarHBondContact O-N 3.23Å; D1464-K1466 VanDerWaalsContact C-N 3.3Å; D1464-K1466 PolarHBondContact O-N 3.17Å; K1466-D1468 VanDerWaalsContact C-N 3.31Å; K1466-D1468 PolarHBondContact O-N 3Å; K1466-Y1469 CarbonylContact O-C 3.58Å; K1466-Y1469 WeakPolarHBondContact O-CA 3.46Å; K1466-Y1469 WeakPolarHBondContact O-CB 3.38Å; K1466-Y1469 PolarHBondContact O-N 3.13Å; K1466-Y1469 VanDerWaalsContact O-N 3.12Å; K1466-D1470 WeakPolarHBondContact CE-OD2 3.45Å; K1466-D1470 VanDerWaalsContact CG-OD2 3.26Å; K1466-D1470 WeakPolarHBondContact CG-OD2 3.33Å; K1466-D1470 IonicContact NZ-OD1 3.51Å; K1466-D1470 PolarHBondContact NZ-OD1 2.82Å; K1466-D1470 IonicContact NZ-OD2 2.86Å; K1466-D1470 PolarHBondContact NZ-OD2 3.4Å; K1466-D1470 WeakPolarHBondContact O-CB 3.39Å; K1466-D1470 VanDerWaalsContact O-CG 3.28Å; K1466-D1470 PolarHBondContact O-N 3.17Å
1467	H	70.1	Confident	67.2	Low	99.8 Å²	99.8	66.8 Å²	66.8	46%	0.462	34%	0.339	S	S	.	.	H	α-helix	trans	-63.3	-38	-174.6	-176	47.6	0	0	0	112.2	S1463 D1464 L1465 Y1469 D1470 K1471	S1463-H1467 VanDerWaalsContact O-CB 3.25Å; S1463-H1467 WeakPolarHBondContact O-CB 3.24Å; S1463-H1467 PolarHBondContact O-N 3.26Å; D1464-H1467 WeakPolarHBondContact O-CB 3.47Å; D1464-H1467 PolarHBondContact O-N 3Å; D1464-H1467 VanDerWaalsContact O-N 3.13Å; L1465-H1467 VanDerWaalsContact C-N 3.32Å; H1467-Y1469 VanDerWaalsContact C-N 3.33Å; H1467-D1470 PolarHBondContact O-N 2.86Å; H1467-K1471 VanDerWaalsContact CD2-CE 3.45Å; H1467-K1471 WeakPolarHBondContact CD2-CE 3.34Å; H1467-K1471 PolarHBondContact CD2-NZ 3.24Å; H1467-K1471 VanDerWaalsContact CD2-NZ 3.28Å; H1467-K1471 VanDerWaalsContact CE1-CE 3.42Å; H1467-K1471 WeakPolarHBondContact CE1-CE 3.4Å; H1467-K1471 WeakPolarHBondContact NE2-CE 3.35Å; H1467-K1471 PolarHBondContact NE2-NZ 3.03Å; H1467-K1471 WeakPolarHBondContact O-CB 3.44Å; H1467-K1471 VanDerWaalsContact O-CG 3.25Å; H1467-K1471 WeakPolarHBondContact O-CG 3.27Å; H1467-K1471 PolarHBondContact O-N 3.17Å; H1467-K1471 VanDerWaalsContact O-N 3.1Å
1468	D	70.9	Confident	67.9	Low	90.6 Å²	90.6	66.2 Å²	66.2	48%	0.484	34%	0.342	S	S	.	.	H	α-helix	trans	-72.3	-28.7	175.5	-77.9	-10.3	0	0	0	113.3	D1464 K1466 K1471 K1472	D1464-D1468 WeakPolarHBondContact O-CB 3.32Å; D1464-D1468 VanDerWaalsContact O-CG 3.3Å; D1464-D1468 PolarHBondContact O-N 3.01Å; K1466-D1468 VanDerWaalsContact C-N 3.31Å; K1466-D1468 PolarHBondContact O-N 3Å; D1468-K1471 WeakPolarHBondContact OD1-CE 3.07Å; D1468-K1471 IonicContact OD1-NZ 3.19Å; D1468-K1471 PolarHBondContact OD1-NZ 3.3Å; D1468-K1472 WeakPolarHBondContact O-CB 3.29Å; D1468-K1472 WeakPolarHBondContact O-CG 3.16Å; D1468-K1472 PolarHBondContact O-N 3.29Å
1469	Y	70.7	Confident	68.9	Low	8.4 Å²	8.4	66.4 Å²	66.4	3%	0.033	35%	0.345	C	S	.	.	H	α-helix	trans	-77.7	-42	171.5	-179.4	-92.7	0	0	0	112	L1305 L1306 P1307 I1311 F1442 W1447 L1465 K1466 H1467 K1471 K1472 I1473 L1484 Y1485	L1305-Y1469 VanDerWaalsContact O-CE2 3.24Å; L1305-Y1469 WeakPolarHBondContact O-CE2 3.47Å; L1305-Y1469 PolarHBondContact O-OH 3.08Å; L1306-Y1469 VanDerWaalsContact C-OH 3.24Å; P1307-Y1469 VanDerWaalsContact CA-CE2 3.47Å; P1307-Y1469 HydrophobicContact CB-CD1 4.49Å; P1307-Y1469 HydrophobicContact CB-CD2 4.49Å; P1307-Y1469 HydrophobicContact CB-CE1 3.92Å; P1307-Y1469 HydrophobicContact CB-CE2 4.17Å; P1307-Y1469 VanDerWaalsContact CD-OH 3.26Å; P1307-Y1469 WeakPolarHBondContact CD-OH 3.31Å; P1307-Y1469 HydrophobicContact CG-CE1 4.34Å; P1307-Y1469 HydrophobicContact CG-CE2 4.26Å; P1307-Y1469 WeakPolarHBondContact CG-OH 3.37Å; I1311-Y1469 HydrophobicContact CD1-CD2 4Å; F1442-Y1469 AromaticContact CE1-CD1 3.96Å; F1442-Y1469 HydrophobicContact CE1-CD1 3.96Å; F1442-Y1469 HydrophobicContact CE1-CE1 4.47Å; F1442-Y1469 HydrophobicContact CE1-CG 4.24Å; F1442-Y1469 HydrophobicContact CE2-CD1 4.24Å; F1442-Y1469 AromaticContact CZ-CD1 3.35Å; F1442-Y1469 HydrophobicContact CZ-CD1 3.35Å; F1442-Y1469 HydrophobicContact CZ-CE1 4.08Å; F1442-Y1469 AromaticContact CZ-CG 3.85Å; F1442-Y1469 HydrophobicContact CZ-CG 3.85Å; W1447-Y1469 HydrophobicContact CH2-CD1 4.42Å; W1447-Y1469 HydrophobicContact CH2-CG 4.06Å; W1447-Y1469 AromaticContact CZ2-CD1 3.47Å; W1447-Y1469 HydrophobicContact CZ2-CD1 3.89Å; W1447-Y1469 VanDerWaalsContact CZ2-CD1 3.47Å; W1447-Y1469 HydrophobicContact CZ2-CD2 4.33Å; W1447-Y1469 HydrophobicContact CZ2-CE1 4.17Å; W1447-Y1469 AromaticContact CZ2-CG 3.53Å; W1447-Y1469 HydrophobicContact CZ2-CG 3.53Å; L1465-Y1469 WeakPolarHBondContact O-CB 3.42Å; L1465-Y1469 PolarHBondContact O-N 3.29Å; L1465-Y1469 VanDerWaalsContact O-N 3.12Å; K1466-Y1469 CarbonylContact O-C 3.58Å; K1466-Y1469 WeakPolarHBondContact O-CA 3.46Å; K1466-Y1469 WeakPolarHBondContact O-CB 3.38Å; K1466-Y1469 PolarHBondContact O-N 3.13Å; K1466-Y1469 VanDerWaalsContact O-N 3.12Å; H1467-Y1469 VanDerWaalsContact C-N 3.33Å; Y1469-K1471 VanDerWaalsContact C-N 3.29Å; Y1469-K1471 PolarHBondContact O-N 3.18Å; Y1469-K1472 HydrophobicContact CD2-CD 4.42Å; Y1469-K1472 WeakPolarHBondContact O-CA 3.42Å; Y1469-K1472 VanDerWaalsContact O-CB 3.31Å; Y1469-K1472 WeakPolarHBondContact O-CB 3.3Å; Y1469-K1472 PolarHBondContact O-N 3.11Å; Y1469-I1473 HydrophobicContact CD1-CD1 4.08Å; Y1469-I1473 HydrophobicContact CD1-CG2 4.39Å; Y1469-I1473 HydrophobicContact CD2-CD1 4.06Å; Y1469-I1473 HydrophobicContact CE1-CD1 3.61Å; Y1469-I1473 HydrophobicContact CE1-CG1 4.47Å; Y1469-I1473 HydrophobicContact CE1-CG2 4.03Å; Y1469-I1473 HydrophobicContact CE2-CD1 3.56Å; Y1469-I1473 VanDerWaalsContact CE2-CD1 3.49Å; Y1469-I1473 HydrophobicContact CE2-CG2 4.08Å; Y1469-I1473 HydrophobicContact CG-CD1 4.17Å; Y1469-I1473 WeakPolarHBondContact O-CG1 3.24Å; Y1469-I1473 PolarHBondContact O-N 3.05Å; Y1469-I1473 VanDerWaalsContact O-N 3.08Å; Y1469-I1473 WeakPolarHBondContact OH-CD1 3.33Å; Y1469-L1484 WeakPolarHBondContact OH-CD2 3.28Å; Y1469-Y1485 AromaticContact CD1-CE1 3.99Å; Y1469-Y1485 HydrophobicContact CD1-CE1 4.19Å; Y1469-Y1485 AromaticContact CD1-CZ 3.8Å; Y1469-Y1485 VanDerWaalsContact CD1-OH 3.27Å; Y1469-Y1485 WeakPolarHBondContact CD1-OH 3.41Å; Y1469-Y1485 HydrophobicContact CE1-CD1 4.49Å; Y1469-Y1485 AromaticContact CE1-CE1 3.71Å; Y1469-Y1485 HydrophobicContact CE1-CE1 3.71Å; Y1469-Y1485 VanDerWaalsContact CE1-CE1 3.5Å; Y1469-Y1485 HydrophobicContact CE1-CE2 4.27Å; Y1469-Y1485 AromaticContact CE1-CZ 3.79Å; Y1469-Y1485 WeakPolarHBondContact CE1-OH 3.32Å
1470	D	71.3	Confident	70	Confident	43.8 Å²	43.8	62.8 Å²	62.8	23%	0.234	33%	0.326	C	S	.	.	H	α-helix	trans	-58.4	-39.6	173.2	-74.8	-24.5	0	0	0	110.8	K1466 H1467 K1472 I1473 S1474 Y1485	K1466-D1470 WeakPolarHBondContact CE-OD2 3.45Å; K1466-D1470 VanDerWaalsContact CG-OD2 3.26Å; K1466-D1470 WeakPolarHBondContact CG-OD2 3.33Å; K1466-D1470 IonicContact NZ-OD1 3.51Å; K1466-D1470 PolarHBondContact NZ-OD1 2.82Å; K1466-D1470 IonicContact NZ-OD2 2.86Å; K1466-D1470 PolarHBondContact NZ-OD2 3.4Å; K1466-D1470 WeakPolarHBondContact O-CB 3.39Å; K1466-D1470 VanDerWaalsContact O-CG 3.28Å; K1466-D1470 PolarHBondContact O-N 3.17Å; H1467-D1470 PolarHBondContact O-N 2.86Å; D1470-K1472 VanDerWaalsContact C-N 3.31Å; D1470-K1472 PolarHBondContact O-N 3.25Å; D1470-I1473 CarbonylContact O-C 3.53Å; D1470-I1473 WeakPolarHBondContact O-CG1 3.2Å; D1470-I1473 PolarHBondContact O-N 3.13Å; D1470-I1473 VanDerWaalsContact O-N 3.11Å; D1470-S1474 WeakPolarHBondContact O-CA 3.37Å; D1470-S1474 WeakPolarHBondContact O-CB 3.25Å; D1470-S1474 PolarHBondContact O-N 3.29Å; D1470-Y1485 PolarHBondContact OD1-OH 3.05Å
1471	K	75.7	Confident	70.5	Confident	106 Å²	106	59.1 Å²	59.1	46%	0.461	31%	0.311	S	S	.	.	H	α-helix	trans	-58.7	-39.5	170.2	-76.8	170.6	-162.4	160.5	0	112.8	H1467 D1468 Y1469 I1473 S1474	H1467-K1471 VanDerWaalsContact CD2-CE 3.45Å; H1467-K1471 WeakPolarHBondContact CD2-CE 3.34Å; H1467-K1471 PolarHBondContact CD2-NZ 3.24Å; H1467-K1471 VanDerWaalsContact CD2-NZ 3.28Å; H1467-K1471 VanDerWaalsContact CE1-CE 3.42Å; H1467-K1471 WeakPolarHBondContact CE1-CE 3.4Å; H1467-K1471 WeakPolarHBondContact NE2-CE 3.35Å; H1467-K1471 PolarHBondContact NE2-NZ 3.03Å; H1467-K1471 WeakPolarHBondContact O-CB 3.44Å; H1467-K1471 VanDerWaalsContact O-CG 3.25Å; H1467-K1471 WeakPolarHBondContact O-CG 3.27Å; H1467-K1471 PolarHBondContact O-N 3.17Å; H1467-K1471 VanDerWaalsContact O-N 3.1Å; D1468-K1471 WeakPolarHBondContact OD1-CE 3.07Å; D1468-K1471 IonicContact OD1-NZ 3.19Å; D1468-K1471 PolarHBondContact OD1-NZ 3.3Å; Y1469-K1471 VanDerWaalsContact C-N 3.29Å; Y1469-K1471 PolarHBondContact O-N 3.18Å; K1471-I1473 VanDerWaalsContact C-N 3.29Å; K1471-I1473 PolarHBondContact O-N 3.21Å; K1471-S1474 WeakPolarHBondContact O-CB 3.33Å; K1471-S1474 PolarHBondContact O-N 2.87Å; K1471-S1474 PolarHBondContact O-OG 3.01Å; K1471-S1474 VanDerWaalsContact O-OG 3.13Å
1472	K	73.4	Confident	71.1	Confident	91 Å²	91	56.2 Å²	56.2	40%	0.396	30%	0.304	S	S	.	.	H	α-helix	trans	-67.8	-22.5	178.9	-132.1	-174.9	175	-170.5	0	112.9	R1304 D1468 Y1469 D1470 H1475 P1570 Y1571	R1304-K1472 PolarHBondContact O-NZ 3.2Å; D1468-K1472 WeakPolarHBondContact O-CB 3.29Å; D1468-K1472 WeakPolarHBondContact O-CG 3.16Å; D1468-K1472 PolarHBondContact O-N 3.29Å; Y1469-K1472 HydrophobicContact CD2-CD 4.42Å; Y1469-K1472 WeakPolarHBondContact O-CA 3.42Å; Y1469-K1472 VanDerWaalsContact O-CB 3.31Å; Y1469-K1472 WeakPolarHBondContact O-CB 3.3Å; Y1469-K1472 PolarHBondContact O-N 3.11Å; D1470-K1472 VanDerWaalsContact C-N 3.31Å; D1470-K1472 PolarHBondContact O-N 3.25Å; K1472-H1475 PolarHBondContact O-CE1 3.29Å; K1472-H1475 VanDerWaalsContact O-CE1 3.28Å; K1472-H1475 PolarHBondContact O-ND1 3.1Å; K1472-H1475 VanDerWaalsContact O-ND1 3.13Å; K1472-P1570 HydrophobicContact CG-CG 4.49Å; K1472-Y1571 HydrophobicContact CG-CE1 4.28Å; K1472-Y1571 WeakPolarHBondContact CG-OH 3.5Å
1473	I	74.5	Confident	72.1	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-113.4	-1.1	-175.5	30.5	165.4	0	0	0	113	Y1469 D1470 K1471 H1475 L1476 Q1481 L1484 Y1485	Y1469-I1473 HydrophobicContact CD1-CD1 4.08Å; Y1469-I1473 HydrophobicContact CD1-CG2 4.39Å; Y1469-I1473 HydrophobicContact CD2-CD1 4.06Å; Y1469-I1473 HydrophobicContact CE1-CD1 3.61Å; Y1469-I1473 HydrophobicContact CE1-CG1 4.47Å; Y1469-I1473 HydrophobicContact CE1-CG2 4.03Å; Y1469-I1473 HydrophobicContact CE2-CD1 3.56Å; Y1469-I1473 VanDerWaalsContact CE2-CD1 3.49Å; Y1469-I1473 HydrophobicContact CE2-CG2 4.08Å; Y1469-I1473 HydrophobicContact CG-CD1 4.17Å; Y1469-I1473 WeakPolarHBondContact O-CG1 3.24Å; Y1469-I1473 PolarHBondContact O-N 3.05Å; Y1469-I1473 VanDerWaalsContact O-N 3.08Å; Y1469-I1473 WeakPolarHBondContact OH-CD1 3.33Å; D1470-I1473 CarbonylContact O-C 3.53Å; D1470-I1473 WeakPolarHBondContact O-CG1 3.2Å; D1470-I1473 PolarHBondContact O-N 3.13Å; D1470-I1473 VanDerWaalsContact O-N 3.11Å; K1471-I1473 VanDerWaalsContact C-N 3.29Å; K1471-I1473 PolarHBondContact O-N 3.21Å; I1473-H1475 PolarHBondContact O-N 3.22Å; I1473-H1475 VanDerWaalsContact O-N 3.1Å; I1473-L1476 HydrophobicContact CB-CD1 4.18Å; I1473-L1476 HydrophobicContact CG1-CD1 4.36Å; I1473-L1476 HydrophobicContact CG2-CD1 4.26Å; I1473-L1476 VanDerWaalsContact O-CB 3.27Å; I1473-L1476 WeakPolarHBondContact O-CB 3.41Å; I1473-L1476 PolarHBondContact O-N 2.92Å; I1473-Q1481 HydrophobicContact CB-CG 4.43Å; I1473-Q1481 HydrophobicContact CD1-CB 4.08Å; I1473-Q1481 HydrophobicContact CD1-CG 3.89Å; I1473-Q1481 HydrophobicContact CG1-CG 4.17Å; I1473-Q1481 HydrophobicContact CG2-CB 4.33Å; I1473-Q1481 HydrophobicContact CG2-CG 3.63Å; I1473-Q1481 PolarHBondContact O-NE2 3.07Å; I1473-Q1481 VanDerWaalsContact O-NE2 3.12Å; I1473-L1484 HydrophobicContact CB-CD1 4.47Å; I1473-L1484 HydrophobicContact CB-CD2 4.42Å; I1473-L1484 HydrophobicContact CD1-CD2 3.86Å; I1473-L1484 HydrophobicContact CG1-CD2 3.94Å; I1473-L1484 HydrophobicContact CG2-CD1 4.01Å; I1473-L1484 HydrophobicContact CG2-CD2 4.11Å; I1473-Y1485 HydrophobicContact CD1-CE1 4.42Å; I1473-Y1485 HydrophobicContact CD1-CE2 3.99Å; I1473-Y1485 VanDerWaalsContact CD1-OH 3.27Å; I1473-Y1485 WeakPolarHBondContact CD1-OH 2.98Å
1474	S	73.2	Confident	72.7	Confident	84.4 Å²	84.4	52.8 Å²	52.8	59%	0.59	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-13.9	-176.3	60.4	0	0	0	0	115	D1470 K1471 L1476	D1470-S1474 WeakPolarHBondContact O-CA 3.37Å; D1470-S1474 WeakPolarHBondContact O-CB 3.25Å; D1470-S1474 PolarHBondContact O-N 3.29Å; K1471-S1474 WeakPolarHBondContact O-CB 3.33Å; K1471-S1474 PolarHBondContact O-N 2.87Å; K1471-S1474 PolarHBondContact O-OG 3.01Å; K1471-S1474 VanDerWaalsContact O-OG 3.13Å; S1474-L1476 PolarHBondContact O-N 2.87Å
1475	H	72.9	Confident	72.9	Confident	94.4 Å²	94.4	50.4 Å²	50.4	44%	0.437	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-11.5	173.1	66.3	-67.9	0	0	0	113.8	K1472 I1473 I1567	K1472-H1475 PolarHBondContact O-CE1 3.29Å; K1472-H1475 VanDerWaalsContact O-CE1 3.28Å; K1472-H1475 PolarHBondContact O-ND1 3.1Å; K1472-H1475 VanDerWaalsContact O-ND1 3.13Å; I1473-H1475 PolarHBondContact O-N 3.22Å; I1473-H1475 VanDerWaalsContact O-N 3.1Å; H1475-I1567 PolarHBondContact NE2-O 3.01Å; H1475-I1567 VanDerWaalsContact NE2-O 3.15Å
1476	L	73.3	Confident	73.3	Confident	8.6 Å²	8.6	48.5 Å²	48.5	5%	0.045	26%	0.257	C	S	.	.	S	Bend	trans	-93.2	149.6	-179.9	-61.2	166.2	0	0	0	111	L1305 I1473 S1474 F1480 Q1481 L1484 I1567 W1568	L1305-L1476 HydrophobicContact CD1-CD1 4.08Å; I1473-L1476 HydrophobicContact CB-CD1 4.18Å; I1473-L1476 HydrophobicContact CG1-CD1 4.36Å; I1473-L1476 HydrophobicContact CG2-CD1 4.26Å; I1473-L1476 VanDerWaalsContact O-CB 3.27Å; I1473-L1476 WeakPolarHBondContact O-CB 3.41Å; I1473-L1476 PolarHBondContact O-N 2.92Å; S1474-L1476 PolarHBondContact O-N 2.87Å; L1476-F1480 HydrophobicContact CB-CB 4.3Å; L1476-F1480 HydrophobicContact CB-CD1 4.04Å; L1476-F1480 HydrophobicContact CB-CE1 4.49Å; L1476-F1480 HydrophobicContact CB-CG 4.4Å; L1476-F1480 HydrophobicContact CD1-CD1 4.02Å; L1476-F1480 HydrophobicContact CD1-CE1 3.72Å; L1476-F1480 HydrophobicContact CD2-CD1 4.04Å; L1476-F1480 HydrophobicContact CD2-CE1 3.63Å; L1476-F1480 HydrophobicContact CD2-CG 4.38Å; L1476-F1480 HydrophobicContact CG-CD1 4.16Å; L1476-F1480 HydrophobicContact CG-CE1 4.12Å; L1476-Q1481 HydrophobicContact CB-CG 4.26Å; L1476-Q1481 PolarHBondContact O-NE2 3.19Å; L1476-L1484 HydrophobicContact CD1-CD1 4.11Å; L1476-L1484 HydrophobicContact CD1-CD2 4.43Å; L1476-I1567 HydrophobicContact CD2-CG2 3.81Å; L1476-W1568 HydrophobicContact CD2-CH2 4.28Å; L1476-W1568 HydrophobicContact CD2-CZ3 4.14Å
1477	S	75	Confident	74	Confident	52.6 Å²	52.6	46 Å²	46	37%	0.368	25%	0.246	S	C	.	.			trans	-58.5	145.5	174.2	136.4	0	0	0	0	111.7	S1229 T1479 F1480 Q1481	S1229-S1477 PolarHBondContact O-OG 3.43Å; S1229-S1477 VanDerWaalsContact O-OG 3.08Å; S1477-T1479 VanDerWaalsContact C-N 3.27Å; S1477-T1479 PolarHBondContact O-N 3.09Å; S1477-T1479 VanDerWaalsContact O-N 3.13Å; S1477-T1479 PolarHBondContact OG-N 2.99Å; S1477-T1479 PolarHBondContact OG-OG1 3.27Å; S1477-F1480 CarbonylContact O-C 3.51Å; S1477-F1480 VanDerWaalsContact O-CA 3.28Å; S1477-F1480 WeakPolarHBondContact O-CA 3.42Å; S1477-F1480 VanDerWaalsContact O-CB 3.28Å; S1477-F1480 WeakPolarHBondContact O-CB 3.32Å; S1477-F1480 PolarHBondContact O-N 3.07Å; S1477-F1480 WeakPolarHBondContact OG-CB 3.38Å; S1477-F1480 PolarHBondContact OG-N 3.34Å; S1477-Q1481 WeakPolarHBondContact O-CG 3.38Å; S1477-Q1481 PolarHBondContact O-N 3.13Å
1478	G	70.1	Confident	74.2	Confident	48 Å²	48	45.6 Å²	45.6	50%	0.495	24%	0.243	S	C	.	.	H	α-helix	trans	-57.4	-31.9	-179.4	0	0	0	0	0	114.2	F1480 Q1481 Q1482	G1478-F1480 VanDerWaalsContact C-N 3.33Å; G1478-F1480 PolarHBondContact O-N 3.42Å; G1478-Q1481 PolarHBondContact O-N 3.01Å; G1478-Q1482 WeakPolarHBondContact O-CB 3.23Å; G1478-Q1482 WeakPolarHBondContact O-CG 3.45Å; G1478-Q1482 PolarHBondContact O-N 3.11Å
1479	T	72.2	Confident	74.2	Confident	42.4 Å²	42.4	42 Å²	42	26%	0.26	23%	0.225	S	C	.	.	H	α-helix	trans	-66.5	-37	171.9	47.2	0	0	0	0	112.2	I1231 L1234 S1477 L1483	I1231-T1479 PolarHBondContact O-OG1 2.82Å; L1234-T1479 HydrophobicContact CD1-CG2 4.43Å; S1477-T1479 VanDerWaalsContact C-N 3.27Å; S1477-T1479 PolarHBondContact O-N 3.09Å; S1477-T1479 VanDerWaalsContact O-N 3.13Å; S1477-T1479 PolarHBondContact OG-N 2.99Å; S1477-T1479 PolarHBondContact OG-OG1 3.27Å; T1479-L1483 WeakPolarHBondContact O-CB 3.36Å; T1479-L1483 PolarHBondContact O-N 3.23Å; T1479-L1483 VanDerWaalsContact O-N 3.08Å
1480	F	76.2	Confident	73.8	Confident	2.8 Å²	2.8	44.8 Å²	44.8	1%	0.012	24%	0.236	C	C	.	.	H	α-helix	trans	-70.2	-38.6	174.4	-156.4	-77.2	0	0	0	111.8	A1223 S1229 I1231 L1302 L1305 L1476 S1477 G1478 Q1482 L1483 L1484 W1568	A1223-F1480 HydrophobicContact CB-CE2 4.36Å; S1229-F1480 VanDerWaalsContact O-CD2 3.28Å; S1229-F1480 WeakPolarHBondContact O-CD2 3.33Å; I1231-F1480 HydrophobicContact CD1-CB 4.08Å; I1231-F1480 HydrophobicContact CD1-CD2 3.42Å; I1231-F1480 VanDerWaalsContact CD1-CD2 3.48Å; I1231-F1480 HydrophobicContact CD1-CE2 3.99Å; I1231-F1480 HydrophobicContact CD1-CG 4.02Å; I1231-F1480 HydrophobicContact CG1-CB 4.35Å; I1231-F1480 HydrophobicContact CG1-CD2 3.82Å; I1231-F1480 HydrophobicContact CG1-CE2 4.19Å; I1231-F1480 HydrophobicContact CG1-CG 4.3Å; L1302-F1480 HydrophobicContact CD1-CE1 3.78Å; L1302-F1480 HydrophobicContact CD1-CE2 3.83Å; L1302-F1480 HydrophobicContact CD1-CZ 3.94Å; L1302-F1480 HydrophobicContact CD2-CE1 3.77Å; L1302-F1480 HydrophobicContact CD2-CE2 3.91Å; L1302-F1480 HydrophobicContact CD2-CZ 3.68Å; L1302-F1480 HydrophobicContact CG-CE1 4.36Å; L1302-F1480 HydrophobicContact CG-CZ 4.4Å; L1305-F1480 HydrophobicContact CD1-CE1 4.12Å; L1476-F1480 HydrophobicContact CB-CB 4.3Å; L1476-F1480 HydrophobicContact CB-CD1 4.04Å; L1476-F1480 HydrophobicContact CB-CE1 4.49Å; L1476-F1480 HydrophobicContact CB-CG 4.4Å; L1476-F1480 HydrophobicContact CD1-CD1 4.02Å; L1476-F1480 HydrophobicContact CD1-CE1 3.72Å; L1476-F1480 HydrophobicContact CD2-CD1 4.04Å; L1476-F1480 HydrophobicContact CD2-CE1 3.63Å; L1476-F1480 HydrophobicContact CD2-CG 4.38Å; L1476-F1480 HydrophobicContact CG-CD1 4.16Å; L1476-F1480 HydrophobicContact CG-CE1 4.12Å; S1477-F1480 CarbonylContact O-C 3.51Å; S1477-F1480 VanDerWaalsContact O-CA 3.28Å; S1477-F1480 WeakPolarHBondContact O-CA 3.42Å; S1477-F1480 VanDerWaalsContact O-CB 3.28Å; S1477-F1480 WeakPolarHBondContact O-CB 3.32Å; S1477-F1480 PolarHBondContact O-N 3.07Å; S1477-F1480 WeakPolarHBondContact OG-CB 3.38Å; S1477-F1480 PolarHBondContact OG-N 3.34Å; G1478-F1480 VanDerWaalsContact C-N 3.33Å; G1478-F1480 PolarHBondContact O-N 3.42Å; F1480-Q1482 VanDerWaalsContact C-N 3.34Å; F1480-Q1482 PolarHBondContact O-N 3.45Å; F1480-L1483 HydrophobicContact CD2-CD2 4.13Å; F1480-L1483 HydrophobicContact CE2-CD2 4.48Å; F1480-L1483 WeakPolarHBondContact O-CB 3.3Å; F1480-L1483 PolarHBondContact O-N 3.11Å; F1480-L1484 HydrophobicContact CD1-CD1 3.74Å; F1480-L1484 VanDerWaalsContact CD1-CD1 3.46Å; F1480-L1484 HydrophobicContact CD1-CG 4.33Å; F1480-L1484 HydrophobicContact CE1-CD1 3.79Å; F1480-L1484 VanDerWaalsContact CE1-CD1 3.45Å; F1480-L1484 HydrophobicContact CE1-CG 4.4Å; F1480-L1484 WeakPolarHBondContact O-CB 3.3Å; F1480-L1484 WeakPolarHBondContact O-CG 3.5Å; F1480-L1484 PolarHBondContact O-N 3.13Å; F1480-W1568 HydrophobicContact CD2-CH2 4.37Å; F1480-W1568 AromaticContact CE1-CH2 3.91Å; F1480-W1568 HydrophobicContact CE1-CH2 4.08Å; F1480-W1568 AromaticContact CE1-CZ3 3.83Å; F1480-W1568 HydrophobicContact CE1-CZ3 3.96Å; F1480-W1568 AromaticContact CE2-CH2 3.69Å; F1480-W1568 HydrophobicContact CE2-CH2 3.82Å; F1480-W1568 HydrophobicContact CE2-CZ3 4.31Å; F1480-W1568 AromaticContact CZ-CH2 3.48Å; F1480-W1568 HydrophobicContact CZ-CH2 3.48Å; F1480-W1568 VanDerWaalsContact CZ-CH2 3.48Å; F1480-W1568 AromaticContact CZ-CZ3 3.63Å; F1480-W1568 HydrophobicContact CZ-CZ3 3.76Å
1481	Q	75.1	Confident	73.6	Confident	50 Å²	50	44.4 Å²	44.4	23%	0.234	23%	0.232	C	C	.	.	H	α-helix	trans	-61.4	-45.7	174	-62.3	178.8	-9.9	0	0	111.1	I1473 L1476 S1477 G1478 L1483 L1484 Y1485	I1473-Q1481 HydrophobicContact CB-CG 4.43Å; I1473-Q1481 HydrophobicContact CD1-CB 4.08Å; I1473-Q1481 HydrophobicContact CD1-CG 3.89Å; I1473-Q1481 HydrophobicContact CG1-CG 4.17Å; I1473-Q1481 HydrophobicContact CG2-CB 4.33Å; I1473-Q1481 HydrophobicContact CG2-CG 3.63Å; I1473-Q1481 PolarHBondContact O-NE2 3.07Å; I1473-Q1481 VanDerWaalsContact O-NE2 3.12Å; L1476-Q1481 HydrophobicContact CB-CG 4.26Å; L1476-Q1481 PolarHBondContact O-NE2 3.19Å; S1477-Q1481 WeakPolarHBondContact O-CG 3.38Å; S1477-Q1481 PolarHBondContact O-N 3.13Å; G1478-Q1481 PolarHBondContact O-N 3.01Å; Q1481-L1483 VanDerWaalsContact C-N 3.33Å; Q1481-L1483 PolarHBondContact O-N 2.93Å; Q1481-L1484 WeakPolarHBondContact O-CB 3.36Å; Q1481-L1484 PolarHBondContact O-N 3.16Å; Q1481-L1484 VanDerWaalsContact O-N 3.14Å; Q1481-Y1485 HydrophobicContact CB-CE2 4.42Å; Q1481-Y1485 VanDerWaalsContact O-CD2 3.27Å; Q1481-Y1485 WeakPolarHBondContact O-CD2 3.36Å; Q1481-Y1485 PolarHBondContact O-N 3.16Å
1482	Q	73.8	Confident	73	Confident	96 Å²	96	44.6 Å²	44.6	45%	0.449	24%	0.238	S	C	.	.	H	α-helix	trans	-60.1	-41.9	174.9	-156.7	178.9	8.6	0	0	112.1	L1242 G1478 F1480 L1484 Y1485 S1486	L1242-Q1482 HydrophobicContact CD2-CG 4.31Å; G1478-Q1482 WeakPolarHBondContact O-CB 3.23Å; G1478-Q1482 WeakPolarHBondContact O-CG 3.45Å; G1478-Q1482 PolarHBondContact O-N 3.11Å; F1480-Q1482 VanDerWaalsContact C-N 3.34Å; F1480-Q1482 PolarHBondContact O-N 3.45Å; Q1482-L1484 VanDerWaalsContact C-N 3.28Å; Q1482-L1484 PolarHBondContact O-N 3.27Å; Q1482-Y1485 PolarHBondContact O-N 3.12Å; Q1482-S1486 VanDerWaalsContact O-CB 3.3Å; Q1482-S1486 WeakPolarHBondContact O-CB 3.43Å; Q1482-S1486 PolarHBondContact O-N 3.27Å; Q1482-S1486 VanDerWaalsContact O-N 3.11Å; Q1482-S1486 PolarHBondContact O-OG 3.02Å
1483	L	79.1	Confident	72.8	Confident	0.2 Å²	0.2	42.2 Å²	42.2	0%	0.001	23%	0.227	C	C	.	.	H	α-helix	trans	-62.6	-43.2	174.5	-179.4	63.8	0	0	0	111.9	L1220 A1223 I1231 L1234 L1242 L1298 T1479 F1480 Q1481 Y1485 S1486 I1487	L1220-L1483 HydrophobicContact CD2-CD1 3.86Å; L1220-L1483 HydrophobicContact CD2-CD2 4.37Å; A1223-L1483 HydrophobicContact CB-CD2 3.95Å; I1231-L1483 HydrophobicContact CD1-CB 4.4Å; I1231-L1483 HydrophobicContact CD1-CD2 3.73Å; L1234-L1483 HydrophobicContact CD1-CB 4.31Å; L1242-L1483 HydrophobicContact CD2-CB 4.42Å; L1242-L1483 HydrophobicContact CD2-CD1 4.1Å; L1298-L1483 HydrophobicContact CD1-CD2 4.37Å; L1298-L1483 HydrophobicContact CD2-CD2 4.48Å; T1479-L1483 WeakPolarHBondContact O-CB 3.36Å; T1479-L1483 PolarHBondContact O-N 3.23Å; T1479-L1483 VanDerWaalsContact O-N 3.08Å; F1480-L1483 HydrophobicContact CD2-CD2 4.13Å; F1480-L1483 HydrophobicContact CE2-CD2 4.48Å; F1480-L1483 WeakPolarHBondContact O-CB 3.3Å; F1480-L1483 PolarHBondContact O-N 3.11Å; Q1481-L1483 VanDerWaalsContact C-N 3.33Å; Q1481-L1483 PolarHBondContact O-N 2.93Å; L1483-Y1485 VanDerWaalsContact C-N 3.3Å; L1483-Y1485 PolarHBondContact O-N 3.11Å; L1483-S1486 WeakPolarHBondContact CA-OG 3.37Å; L1483-S1486 PolarHBondContact O-N 3.18Å; L1483-S1486 VanDerWaalsContact O-N 3.1Å; L1483-S1486 PolarHBondContact O-OG 3.36Å; L1483-S1486 VanDerWaalsContact O-OG 3.07Å; L1483-I1487 HydrophobicContact CD1-CD1 3.99Å; L1483-I1487 HydrophobicContact CD1-CG1 3.85Å; L1483-I1487 HydrophobicContact CD2-CD1 4.3Å; L1483-I1487 HydrophobicContact CG-CD1 3.69Å; L1483-I1487 HydrophobicContact CG-CG1 4.08Å; L1483-I1487 WeakPolarHBondContact O-CB 3.39Å; L1483-I1487 VanDerWaalsContact O-CG1 3.29Å; L1483-I1487 WeakPolarHBondContact O-CG1 3.24Å; L1483-I1487 PolarHBondContact O-N 3.08Å
1484	L	77.9	Confident	72.3	Confident	1.8 Å²	1.8	46 Å²	46	1%	0.009	25%	0.252	C	S	.	.	H	α-helix	trans	-60.4	-40	178	-147	85.6	0	0	0	112.5	L1302 L1305 L1306 Y1469 I1473 L1476 F1480 Q1481 Q1482 S1486	L1302-L1484 HydrophobicContact CB-CD1 4.02Å; L1302-L1484 HydrophobicContact CB-CD2 4Å; L1302-L1484 HydrophobicContact CD1-CD1 4.07Å; L1302-L1484 HydrophobicContact CD1-CD2 3.86Å; L1302-L1484 HydrophobicContact CD2-CD1 4.4Å; L1302-L1484 HydrophobicContact CG-CD1 4.4Å; L1302-L1484 HydrophobicContact CG-CD2 4.38Å; L1305-L1484 HydrophobicContact CB-CD1 4.31Å; L1305-L1484 HydrophobicContact CB-CD2 4.07Å; L1306-L1484 HydrophobicContact CD2-CD1 3.93Å; L1306-L1484 HydrophobicContact CD2-CD2 4.42Å; L1306-L1484 WeakPolarHBondContact CD2-O 3.45Å; L1306-L1484 HydrophobicContact CG-CD1 3.95Å; Y1469-L1484 WeakPolarHBondContact OH-CD2 3.28Å; I1473-L1484 HydrophobicContact CB-CD1 4.47Å; I1473-L1484 HydrophobicContact CB-CD2 4.42Å; I1473-L1484 HydrophobicContact CD1-CD2 3.86Å; I1473-L1484 HydrophobicContact CG1-CD2 3.94Å; I1473-L1484 HydrophobicContact CG2-CD1 4.01Å; I1473-L1484 HydrophobicContact CG2-CD2 4.11Å; L1476-L1484 HydrophobicContact CD1-CD1 4.11Å; L1476-L1484 HydrophobicContact CD1-CD2 4.43Å; F1480-L1484 HydrophobicContact CD1-CD1 3.74Å; F1480-L1484 VanDerWaalsContact CD1-CD1 3.46Å; F1480-L1484 HydrophobicContact CD1-CG 4.33Å; F1480-L1484 HydrophobicContact CE1-CD1 3.79Å; F1480-L1484 VanDerWaalsContact CE1-CD1 3.45Å; F1480-L1484 HydrophobicContact CE1-CG 4.4Å; F1480-L1484 WeakPolarHBondContact O-CB 3.3Å; F1480-L1484 WeakPolarHBondContact O-CG 3.5Å; F1480-L1484 PolarHBondContact O-N 3.13Å; Q1481-L1484 WeakPolarHBondContact O-CB 3.36Å; Q1481-L1484 PolarHBondContact O-N 3.16Å; Q1481-L1484 VanDerWaalsContact O-N 3.14Å; Q1482-L1484 VanDerWaalsContact C-N 3.28Å; Q1482-L1484 PolarHBondContact O-N 3.27Å; L1484-S1486 VanDerWaalsContact C-N 3.31Å; L1484-S1486 PolarHBondContact O-N 2.93Å
1485	Y	72.2	Confident	72	Confident	36.4 Å²	36.4	51 Å²	51	14%	0.143	26%	0.262	C	S	.	.	H	α-helix	trans	-71.1	-27.3	175.4	-72.8	-60.9	0	0	0	113.4	P1307 L1421 N1422 G1441 F1442 Q1445 P1446 W1447 Y1469 D1470 I1473 Q1481 Q1482 L1483	P1307-Y1485 HydrophobicContact CG-CD1 4.42Å; L1421-Y1485 WeakPolarHBondContact O-CE1 3.4Å; N1422-Y1485 PolarHBondContact ND2-O 3.13Å; G1441-Y1485 WeakPolarHBondContact O-CD2 3.38Å; G1441-Y1485 WeakPolarHBondContact O-CE2 3.49Å; G1441-Y1485 VanDerWaalsContact O-CG 3.29Å; F1442-Y1485 HydrophobicContact CD1-CE1 4.02Å; F1442-Y1485 HydrophobicContact CD2-CD1 4.36Å; F1442-Y1485 AromaticContact CD2-CE1 3.63Å; F1442-Y1485 HydrophobicContact CD2-CE1 3.63Å; F1442-Y1485 AromaticContact CD2-CZ 3.85Å; F1442-Y1485 AromaticContact CE1-CE1 3.82Å; F1442-Y1485 HydrophobicContact CE1-CE1 3.82Å; F1442-Y1485 HydrophobicContact CE2-CD1 4.49Å; F1442-Y1485 AromaticContact CE2-CE1 3.39Å; F1442-Y1485 HydrophobicContact CE2-CE1 3.39Å; F1442-Y1485 AromaticContact CE2-CZ 3.41Å; F1442-Y1485 VanDerWaalsContact CE2-CZ 3.41Å; F1442-Y1485 WeakPolarHBondContact CE2-OH 3.41Å; F1442-Y1485 HydrophobicContact CG-CD1 4.38Å; F1442-Y1485 AromaticContact CG-CE1 3.95Å; F1442-Y1485 HydrophobicContact CG-CE1 3.95Å; F1442-Y1485 AromaticContact CZ-CE1 3.51Å; F1442-Y1485 HydrophobicContact CZ-CE1 3.51Å; F1442-Y1485 AromaticContact CZ-CZ 3.86Å; F1442-Y1485 WeakPolarHBondContact CZ-OH 3.47Å; Q1445-Y1485 HydrophobicContact CG-CG 4.47Å; P1446-Y1485 HydrophobicContact CG-CD1 4.06Å; P1446-Y1485 HydrophobicContact CG-CE1 4.06Å; W1447-Y1485 AromaticContact CD1-CE1 3.88Å; W1447-Y1485 AromaticContact CD1-CZ 3.99Å; W1447-Y1485 HydrophobicContact CZ2-CE1 4.06Å; W1447-Y1485 AromaticContact NE1-CE1 3.43Å; W1447-Y1485 AromaticContact NE1-CZ 3.63Å; W1447-Y1485 VanDerWaalsContact NE1-CZ 3.34Å; W1447-Y1485 PolarHBondContact NE1-OH 3.45Å; Y1469-Y1485 AromaticContact CD1-CE1 3.99Å; Y1469-Y1485 HydrophobicContact CD1-CE1 4.19Å; Y1469-Y1485 AromaticContact CD1-CZ 3.8Å; Y1469-Y1485 VanDerWaalsContact CD1-OH 3.27Å; Y1469-Y1485 WeakPolarHBondContact CD1-OH 3.41Å; Y1469-Y1485 HydrophobicContact CE1-CD1 4.49Å; Y1469-Y1485 AromaticContact CE1-CE1 3.71Å; Y1469-Y1485 HydrophobicContact CE1-CE1 3.71Å; Y1469-Y1485 VanDerWaalsContact CE1-CE1 3.5Å; Y1469-Y1485 HydrophobicContact CE1-CE2 4.27Å; Y1469-Y1485 AromaticContact CE1-CZ 3.79Å; Y1469-Y1485 WeakPolarHBondContact CE1-OH 3.32Å; D1470-Y1485 PolarHBondContact OD1-OH 3.05Å; I1473-Y1485 HydrophobicContact CD1-CE1 4.42Å; I1473-Y1485 HydrophobicContact CD1-CE2 3.99Å; I1473-Y1485 VanDerWaalsContact CD1-OH 3.27Å; I1473-Y1485 WeakPolarHBondContact CD1-OH 2.98Å; Q1481-Y1485 HydrophobicContact CB-CE2 4.42Å; Q1481-Y1485 VanDerWaalsContact O-CD2 3.27Å; Q1481-Y1485 WeakPolarHBondContact O-CD2 3.36Å; Q1481-Y1485 PolarHBondContact O-N 3.16Å; Q1482-Y1485 PolarHBondContact O-N 3.12Å; L1483-Y1485 VanDerWaalsContact C-N 3.3Å; L1483-Y1485 PolarHBondContact O-N 3.11Å
1486	S	75.7	Confident	71.6	Confident	6.8 Å²	6.8	53.5 Å²	53.5	5%	0.048	28%	0.279	C	S	.	.	H	α-helix	trans	-95.8	-18.8	-174.8	-46.1	0	0	0	0	114.7	L1242 N1243 I1246 E1444 Q1482 L1483 L1484 K1488	L1242-S1486 WeakPolarHBondContact CB-OG 3.38Å; L1242-S1486 VanDerWaalsContact CD2-OG 3.29Å; L1242-S1486 WeakPolarHBondContact CD2-OG 3.42Å; L1242-S1486 VanDerWaalsContact CG-OG 3.29Å; L1242-S1486 WeakPolarHBondContact CG-OG 3.15Å; N1243-S1486 PolarHBondContact N-OG 2.93Å; I1246-S1486 WeakPolarHBondContact CD1-O 3.29Å; E1444-S1486 PolarHBondContact OE2-OG 2.89Å; Q1482-S1486 VanDerWaalsContact O-CB 3.3Å; Q1482-S1486 WeakPolarHBondContact O-CB 3.43Å; Q1482-S1486 PolarHBondContact O-N 3.27Å; Q1482-S1486 VanDerWaalsContact O-N 3.11Å; Q1482-S1486 PolarHBondContact O-OG 3.02Å; L1483-S1486 WeakPolarHBondContact CA-OG 3.37Å; L1483-S1486 PolarHBondContact O-N 3.18Å; L1483-S1486 VanDerWaalsContact O-N 3.1Å; L1483-S1486 PolarHBondContact O-OG 3.36Å; L1483-S1486 VanDerWaalsContact O-OG 3.07Å; L1484-S1486 VanDerWaalsContact C-N 3.31Å; L1484-S1486 PolarHBondContact O-N 2.93Å; S1486-K1488 VanDerWaalsContact C-N 3.29Å; S1486-K1488 PolarHBondContact O-N 2.94Å
1487	I	79.6	Confident	71.4	Confident	0.4 Å²	0.4	55.4 Å²	55.4	0%	0.002	29%	0.286	C	S	.	.	S	Bend	trans	-61.9	-30	-174	-105.2	166.9	0	0	0	113.6	R1295 L1298 E1299 L1302 L1306 L1483 P1489	R1295-I1487 VanDerWaalsContact CD-O 3.28Å; R1295-I1487 WeakPolarHBondContact CD-O 3.36Å; R1295-I1487 HydrophobicContact CG-CG1 4.42Å; R1295-I1487 PolarHBondContact NH1-O 3.09Å; L1298-I1487 HydrophobicContact CB-CD1 3.71Å; L1298-I1487 VanDerWaalsContact CB-CD1 3.45Å; L1298-I1487 HydrophobicContact CD1-CD1 4.41Å; L1298-I1487 HydrophobicContact CG-CD1 4.48Å; E1299-I1487 HydrophobicContact CB-CD1 4.14Å; E1299-I1487 HydrophobicContact CB-CG1 4.22Å; E1299-I1487 HydrophobicContact CB-CG2 3.78Å; E1299-I1487 HydrophobicContact CG-CG2 4.2Å; L1302-I1487 HydrophobicContact CD1-CD1 3.72Å; L1306-I1487 HydrophobicContact CD1-CG2 4.36Å; L1306-I1487 HydrophobicContact CD2-CB 4.32Å; L1306-I1487 HydrophobicContact CD2-CG2 3.83Å; L1483-I1487 HydrophobicContact CD1-CD1 3.99Å; L1483-I1487 HydrophobicContact CD1-CG1 3.85Å; L1483-I1487 HydrophobicContact CD2-CD1 4.3Å; L1483-I1487 HydrophobicContact CG-CD1 3.69Å; L1483-I1487 HydrophobicContact CG-CG1 4.08Å; L1483-I1487 WeakPolarHBondContact O-CB 3.39Å; L1483-I1487 VanDerWaalsContact O-CG1 3.29Å; L1483-I1487 WeakPolarHBondContact O-CG1 3.24Å; L1483-I1487 PolarHBondContact O-N 3.08Å; I1487-P1489 VanDerWaalsContact O-CD 3.28Å; I1487-P1489 WeakPolarHBondContact O-CD 3.27Å
1488	K	75.5	Confident	71.2	Confident	92.4 Å²	92.4	54.7 Å²	54.7	40%	0.402	29%	0.287	S	S	.	.	S	Bend	trans	-112.9	84.2	179.5	-164.8	172.2	-171.8	106.9	0	110.2	E1299 L1306 S1486 Y1490	E1299-K1488 WeakPolarHBondContact OE1-CD 3.35Å; E1299-K1488 WeakPolarHBondContact OE1-CG 3.43Å; E1299-K1488 IonicContact OE1-NZ 3.25Å; E1299-K1488 PolarHBondContact OE1-NZ 3.26Å; L1306-K1488 HydrophobicContact CD2-CB 4.37Å; S1486-K1488 VanDerWaalsContact C-N 3.29Å; S1486-K1488 PolarHBondContact O-N 2.94Å; K1488-Y1490 HydrophobicContact CG-CE1 4.49Å; K1488-Y1490 WeakPolarHBondContact O-CD1 3.44Å; K1488-Y1490 WeakPolarHBondContact O-CE1 3.36Å; K1488-Y1490 WeakPolarHBondContact O-CE2 3.42Å; K1488-Y1490 PolarHBondContact O-N 3.1Å
1489	P	70	Confident	71.7	Confident	14.6 Å²	14.6	53.9 Å²	53.9	10%	0.095	27%	0.271	C	S	.	.			trans	-65	136	-172.9	26.9	-36.5	0	0	0	112.4	N1243 I1246 L1250 F1442 I1487 F1491	N1243-P1489 WeakPolarHBondContact OD1-CA 3.29Å; I1246-P1489 HydrophobicContact CG2-CG 4.01Å; L1250-P1489 HydrophobicContact CD1-CG 4.04Å; F1442-P1489 HydrophobicContact CD1-CB 4.2Å; F1442-P1489 HydrophobicContact CE1-CB 4.29Å; I1487-P1489 VanDerWaalsContact O-CD 3.28Å; I1487-P1489 WeakPolarHBondContact O-CD 3.27Å; P1489-F1491 HydrophobicContact CB-CD2 4.01Å; P1489-F1491 HydrophobicContact CB-CE2 4.18Å; P1489-F1491 HydrophobicContact CB-CZ 4.15Å; P1489-F1491 HydrophobicContact CG-CE2 3.72Å; P1489-F1491 HydrophobicContact CG-CZ 3.79Å; P1489-F1491 WeakPolarHBondContact O-CD2 3.25Å; P1489-F1491 PolarHBondContact O-N 3.17Å
1490	Y	63.7	Low	72.1	Confident	67 Å²	67	59.2 Å²	59.2	26%	0.263	29%	0.293	S	S	.	.			trans	-85.8	103.4	-179.8	-142.2	-87.8	0	0	0	112	V1312 K1316 N1415 K1419 R1439 L1443 P1446 K1448 K1488 N1492	V1312-Y1490 HydrophobicContact CG1-CD1 4.31Å; V1312-Y1490 HydrophobicContact CG1-CD2 4.41Å; V1312-Y1490 HydrophobicContact CG1-CE1 3.66Å; V1312-Y1490 HydrophobicContact CG2-CE1 4.1Å; K1316-Y1490 HydrophobicContact CD-CE2 4.06Å; K1316-Y1490 HydrophobicContact CD-CG 4.31Å; K1316-Y1490 WeakPolarHBondContact CD-OH 3.37Å; K1316-Y1490 WeakPolarHBondContact CE-OH 3.49Å; K1316-Y1490 PolarHBondContact NZ-OH 2.63Å; N1415-Y1490 HydrophobicContact CB-CE2 4.37Å; N1415-Y1490 WeakPolarHBondContact OD1-CE2 3.19Å; N1415-Y1490 PolarHBondContact OD1-OH 2.96Å; N1415-Y1490 VanDerWaalsContact OD1-OH 3.1Å; K1419-Y1490 HydrophobicContact CD-CE1 4.47Å; R1439-Y1490 PolarHBondContact NH2-O 2.95Å; L1443-Y1490 HydrophobicContact CB-CD2 3.79Å; L1443-Y1490 HydrophobicContact CB-CG 4.12Å; L1443-Y1490 WeakPolarHBondContact O-CD2 3.46Å; P1446-Y1490 HydrophobicContact CB-CE2 4.08Å; K1448-Y1490 VanDerWaalsContact NZ-CE1 3.32Å; K1488-Y1490 HydrophobicContact CG-CE1 4.49Å; K1488-Y1490 WeakPolarHBondContact O-CD1 3.44Å; K1488-Y1490 WeakPolarHBondContact O-CE1 3.36Å; K1488-Y1490 WeakPolarHBondContact O-CE2 3.42Å; K1488-Y1490 PolarHBondContact O-N 3.1Å; Y1490-N1492 HydrophobicContact CE1-CB 3.96Å; Y1490-N1492 WeakPolarHBondContact CE1-OD1 3.32Å; Y1490-N1492 PolarHBondContact OH-OD1 3.38Å
1491	F	66.7	Low	72.4	Confident	36.2 Å²	36.2	61.2 Å²	61.2	16%	0.159	31%	0.31	C	S	.	.			trans	-97.5	144.9	170.5	-57.9	-78.2	0	0	0	111.6	L1250 R1251 F1442 P1489 Y1493 V1506	L1250-F1491 HydrophobicContact CD1-CE2 4.36Å; L1250-F1491 HydrophobicContact CD1-CZ 4.32Å; R1251-F1491 HydrophobicContact CG-CE1 4.19Å; F1442-F1491 AromaticContact CE1-CD1 3.52Å; F1442-F1491 HydrophobicContact CE1-CD1 3.99Å; F1442-F1491 AromaticContact CE1-CE1 3.51Å; F1442-F1491 HydrophobicContact CE1-CE1 3.51Å; F1442-F1491 VanDerWaalsContact CE1-CE1 3.46Å; F1442-F1491 HydrophobicContact CE1-CE2 4.33Å; F1442-F1491 HydrophobicContact CE1-CG 4.4Å; F1442-F1491 AromaticContact CE1-CZ 3.5Å; F1442-F1491 HydrophobicContact CE1-CZ 3.9Å; F1442-F1491 AromaticContact CZ-CD1 3.76Å; F1442-F1491 HydrophobicContact CZ-CD1 3.76Å; F1442-F1491 AromaticContact CZ-CE1 3.57Å; F1442-F1491 HydrophobicContact CZ-CE1 3.57Å; F1442-F1491 VanDerWaalsContact CZ-CE1 3.43Å; F1442-F1491 AromaticContact CZ-CZ 3.47Å; F1442-F1491 HydrophobicContact CZ-CZ 3.47Å; F1442-F1491 VanDerWaalsContact CZ-CZ 3.47Å; P1489-F1491 HydrophobicContact CB-CD2 4.01Å; P1489-F1491 HydrophobicContact CB-CE2 4.18Å; P1489-F1491 HydrophobicContact CB-CZ 4.15Å; P1489-F1491 HydrophobicContact CG-CE2 3.72Å; P1489-F1491 HydrophobicContact CG-CZ 3.79Å; P1489-F1491 WeakPolarHBondContact O-CD2 3.25Å; P1489-F1491 PolarHBondContact O-N 3.17Å; F1491-Y1493 VanDerWaalsContact C-N 3.32Å; F1491-Y1493 HydrophobicContact CB-CD2 3.6Å; F1491-Y1493 HydrophobicContact CB-CE1 4.2Å; F1491-Y1493 HydrophobicContact CB-CE2 3.6Å; F1491-Y1493 VanDerWaalsContact CB-CE2 3.49Å; F1491-Y1493 HydrophobicContact CB-CG 4.44Å; F1491-Y1493 HydrophobicContact CD1-CD2 4.35Å; F1491-Y1493 AromaticContact CD1-CE2 3.77Å; F1491-Y1493 HydrophobicContact CD1-CE2 3.77Å; F1491-Y1493 HydrophobicContact CD2-CE2 4.48Å; F1491-Y1493 HydrophobicContact CE1-CE2 4.44Å; F1491-Y1493 AromaticContact CG-CD2 3.97Å; F1491-Y1493 HydrophobicContact CG-CD2 4.07Å; F1491-Y1493 AromaticContact CG-CE2 3.74Å; F1491-Y1493 HydrophobicContact CG-CE2 3.74Å; F1491-Y1493 PolarHBondContact O-N 3.06Å; F1491-V1506 HydrophobicContact CD1-CG1 4.32Å; F1491-V1506 HydrophobicContact CD2-CG1 4.05Å; F1491-V1506 HydrophobicContact CE1-CG1 3.98Å; F1491-V1506 HydrophobicContact CE2-CG1 3.61Å; F1491-V1506 VanDerWaalsContact CE2-O 3.23Å; F1491-V1506 WeakPolarHBondContact CE2-O 3.33Å; F1491-V1506 HydrophobicContact CG-CG1 4.3Å; F1491-V1506 HydrophobicContact CZ-CG1 3.56Å
1492	N	63.7	Low	72.9	Confident	110.4 Å²	110.4	59 Å²	59	59%	0.59	30%	0.3	S	S	*	.			trans	-101.1	57.4	174.2	-149.7	37.5	0	0	0	111.3	R1439 Y1490	R1439-N1492 VanDerWaalsContact CZ-CB 3.43Å; Y1490-N1492 HydrophobicContact CE1-CB 3.96Å; Y1490-N1492 WeakPolarHBondContact CE1-OD1 3.32Å; Y1490-N1492 PolarHBondContact OH-OD1 3.38Å
1493	Y	68.3	Low	73.3	Confident	40 Å²	40	57 Å²	57	16%	0.157	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-81.9	148.8	171.4	-62.9	-68.1	0	0	0	110.9	E1069 R1251 F1491 K1495 Y1497 F1502 V1506 I1507	E1069-Y1493 PolarHBondContact OE2-OH 3.27Å; E1069-Y1493 VanDerWaalsContact OE2-OH 3.05Å; R1251-Y1493 PolarHBondContact NE-OH 3.01Å; R1251-Y1493 PolarHBondContact NH2-OH 3.29Å; F1491-Y1493 VanDerWaalsContact C-N 3.32Å; F1491-Y1493 HydrophobicContact CB-CD2 3.6Å; F1491-Y1493 HydrophobicContact CB-CE1 4.2Å; F1491-Y1493 HydrophobicContact CB-CE2 3.6Å; F1491-Y1493 VanDerWaalsContact CB-CE2 3.49Å; F1491-Y1493 HydrophobicContact CB-CG 4.44Å; F1491-Y1493 HydrophobicContact CD1-CD2 4.35Å; F1491-Y1493 AromaticContact CD1-CE2 3.77Å; F1491-Y1493 HydrophobicContact CD1-CE2 3.77Å; F1491-Y1493 HydrophobicContact CD2-CE2 4.48Å; F1491-Y1493 HydrophobicContact CE1-CE2 4.44Å; F1491-Y1493 AromaticContact CG-CD2 3.97Å; F1491-Y1493 HydrophobicContact CG-CD2 4.07Å; F1491-Y1493 AromaticContact CG-CE2 3.74Å; F1491-Y1493 HydrophobicContact CG-CE2 3.74Å; F1491-Y1493 PolarHBondContact O-N 3.06Å; Y1493-K1495 PolarHBondContact O-N 3.4Å; Y1493-Y1497 AromaticContact CD1-CD1 3.36Å; Y1493-Y1497 HydrophobicContact CD1-CD1 3.36Å; Y1493-Y1497 VanDerWaalsContact CD1-CD1 3.43Å; Y1493-Y1497 HydrophobicContact CD1-CD2 4.28Å; Y1493-Y1497 AromaticContact CD1-CE1 3.31Å; Y1493-Y1497 HydrophobicContact CD1-CE1 3.31Å; Y1493-Y1497 HydrophobicContact CD1-CE2 4.24Å; Y1493-Y1497 AromaticContact CD1-CG 3.86Å; Y1493-Y1497 HydrophobicContact CD1-CG 3.86Å; Y1493-Y1497 AromaticContact CD1-CZ 3.76Å; Y1493-Y1497 HydrophobicContact CD2-CD1 4.41Å; Y1493-Y1497 AromaticContact CE1-CD1 3.89Å; Y1493-Y1497 HydrophobicContact CE1-CD1 3.94Å; Y1493-Y1497 AromaticContact CE1-CE1 3.41Å; Y1493-Y1497 HydrophobicContact CE1-CE1 3.41Å; Y1493-Y1497 VanDerWaalsContact CE1-CE1 3.41Å; Y1493-Y1497 AromaticContact CE1-CZ 3.82Å; Y1493-Y1497 AromaticContact CG-CD1 3.67Å; Y1493-Y1497 HydrophobicContact CG-CD1 3.67Å; Y1493-Y1497 AromaticContact CG-CE1 3.88Å; Y1493-Y1497 HydrophobicContact CG-CE1 4.04Å; Y1493-Y1497 HydrophobicContact CG-CG 4.16Å; Y1493-F1502 AromaticContact CD1-CE1 3.87Å; Y1493-F1502 HydrophobicContact CD1-CE1 3.87Å; Y1493-F1502 AromaticContact CD1-CZ 3.89Å; Y1493-F1502 HydrophobicContact CD1-CZ 4.17Å; Y1493-F1502 AromaticContact CD2-CE1 3.92Å; Y1493-F1502 HydrophobicContact CD2-CE1 3.99Å; Y1493-F1502 HydrophobicContact CD2-CZ 4.14Å; Y1493-F1502 HydrophobicContact CE1-CE1 4.3Å; Y1493-F1502 AromaticContact CE1-CZ 3.74Å; Y1493-F1502 HydrophobicContact CE1-CZ 4.03Å; Y1493-F1502 AromaticContact CE2-CE1 3.88Å; Y1493-F1502 HydrophobicContact CE2-CE1 3.92Å; Y1493-F1502 AromaticContact CE2-CZ 3.59Å; Y1493-F1502 HydrophobicContact CE2-CZ 3.59Å; Y1493-F1502 HydrophobicContact CG-CE1 4.31Å; Y1493-F1502 HydrophobicContact CG-CZ 4.46Å; Y1493-F1502 AromaticContact CZ-CZ 3.57Å; Y1493-V1506 HydrophobicContact CE1-CG1 4.38Å; Y1493-V1506 HydrophobicContact CE2-CG1 4.23Å; Y1493-V1506 WeakPolarHBondContact OH-CG1 3.5Å; Y1493-I1507 HydrophobicContact CD2-CD1 4.01Å; Y1493-I1507 HydrophobicContact CD2-CG1 4.18Å; Y1493-I1507 HydrophobicContact CE2-CG1 4.14Å; Y1493-I1507 HydrophobicContact CG-CD1 4.34Å; Y1493-I1507 HydrophobicContact CG-CG1 4.42Å
1494	P	65.1	Low	73.5	Confident	80.8 Å²	80.8	59.7 Å²	59.7	53%	0.525	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-54.6	149.1	168.2	-24.5	33.3	0	0	0	112.2	N1496 Y1497	P1494-N1496 PolarHBondContact O-N 3.15Å; P1494-N1496 VanDerWaalsContact O-N 3.13Å; P1494-Y1497 HydrophobicContact CG-CD2 4.37Å; P1494-Y1497 VanDerWaalsContact O-CB 3.29Å; P1494-Y1497 WeakPolarHBondContact O-CB 3.37Å; P1494-Y1497 PolarHBondContact O-N 3.32Å; P1494-Y1497 VanDerWaalsContact O-N 3.14Å
1495	K	65.2	Low	73.7	Confident	188.4 Å²	188.4	60 Å²	60	82%	0.819	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	122.8	171.7	-73.6	-174.2	178	176.6	0	110.1	D1411 Y1493 Y1497	D1411-K1495 VanDerWaalsContact CG-CE 3.43Å; D1411-K1495 WeakPolarHBondContact OD1-CE 3.16Å; D1411-K1495 IonicContact OD1-NZ 2.71Å; D1411-K1495 PolarHBondContact OD1-NZ 3.04Å; D1411-K1495 VanDerWaalsContact OD2-CD 3.25Å; D1411-K1495 WeakPolarHBondContact OD2-CD 3.45Å; D1411-K1495 WeakPolarHBondContact OD2-CE 3.44Å; D1411-K1495 IonicContact OD2-NZ 2.68Å; D1411-K1495 PolarHBondContact OD2-NZ 3.14Å; Y1493-K1495 PolarHBondContact O-N 3.4Å; K1495-Y1497 VanDerWaalsContact C-N 3.3Å; K1495-Y1497 PolarHBondContact O-N 3.1Å
1496	N	65.5	Low	74.3	Confident	147.8 Å²	147.8	58.3 Å²	58.3	79%	0.79	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	27.6	-177.1	-50.1	-7.2	0	0	0	114.4	P1494 G1498	P1494-N1496 PolarHBondContact O-N 3.15Å; P1494-N1496 VanDerWaalsContact O-N 3.13Å; N1496-G1498 PolarHBondContact O-N 2.96Å
1497	Y	69.4	Low	74.6	Confident	49.2 Å²	49.2	60.3 Å²	60.3	19%	0.193	31%	0.31	C	S	.	.			trans	-68.8	135.9	171.5	-177.3	-90.9	0	0	0	112	N1070 Y1493 P1494 K1495 D1499 F1502 Q1503	N1070-Y1497 PolarHBondContact ND2-OH 3.15Å; Y1493-Y1497 AromaticContact CD1-CD1 3.36Å; Y1493-Y1497 HydrophobicContact CD1-CD1 3.36Å; Y1493-Y1497 VanDerWaalsContact CD1-CD1 3.43Å; Y1493-Y1497 HydrophobicContact CD1-CD2 4.28Å; Y1493-Y1497 AromaticContact CD1-CE1 3.31Å; Y1493-Y1497 HydrophobicContact CD1-CE1 3.31Å; Y1493-Y1497 HydrophobicContact CD1-CE2 4.24Å; Y1493-Y1497 AromaticContact CD1-CG 3.86Å; Y1493-Y1497 HydrophobicContact CD1-CG 3.86Å; Y1493-Y1497 AromaticContact CD1-CZ 3.76Å; Y1493-Y1497 HydrophobicContact CD2-CD1 4.41Å; Y1493-Y1497 AromaticContact CE1-CD1 3.89Å; Y1493-Y1497 HydrophobicContact CE1-CD1 3.94Å; Y1493-Y1497 AromaticContact CE1-CE1 3.41Å; Y1493-Y1497 HydrophobicContact CE1-CE1 3.41Å; Y1493-Y1497 VanDerWaalsContact CE1-CE1 3.41Å; Y1493-Y1497 AromaticContact CE1-CZ 3.82Å; Y1493-Y1497 AromaticContact CG-CD1 3.67Å; Y1493-Y1497 HydrophobicContact CG-CD1 3.67Å; Y1493-Y1497 AromaticContact CG-CE1 3.88Å; Y1493-Y1497 HydrophobicContact CG-CE1 4.04Å; Y1493-Y1497 HydrophobicContact CG-CG 4.16Å; P1494-Y1497 HydrophobicContact CG-CD2 4.37Å; P1494-Y1497 VanDerWaalsContact O-CB 3.29Å; P1494-Y1497 WeakPolarHBondContact O-CB 3.37Å; P1494-Y1497 PolarHBondContact O-N 3.32Å; P1494-Y1497 VanDerWaalsContact O-N 3.14Å; K1495-Y1497 VanDerWaalsContact C-N 3.3Å; K1495-Y1497 PolarHBondContact O-N 3.1Å; Y1497-D1499 PolarHBondContact O-N 3.09Å; Y1497-F1502 AromaticContact CD1-CD1 3.9Å; Y1497-F1502 HydrophobicContact CD1-CD1 3.94Å; Y1497-F1502 AromaticContact CD1-CE1 3.52Å; Y1497-F1502 HydrophobicContact CD1-CE1 3.71Å; Y1497-F1502 HydrophobicContact CD1-CG 4.27Å; Y1497-F1502 AromaticContact CD1-CZ 3.9Å; Y1497-F1502 HydrophobicContact CD1-CZ 4.06Å; Y1497-F1502 HydrophobicContact CE1-CD1 4.19Å; Y1497-F1502 AromaticContact CE1-CE1 3.68Å; Y1497-F1502 HydrophobicContact CE1-CE1 3.68Å; Y1497-F1502 HydrophobicContact CE1-CE2 4.25Å; Y1497-F1502 AromaticContact CE1-CZ 3.72Å; Y1497-F1502 HydrophobicContact CE1-CZ 3.72Å; Y1497-Q1503 PolarHBondContact O-NE2 2.96Å
1498	G	71.3	Confident	74.7	Confident	37.2 Å²	37.2	64.5 Å²	64.5	38%	0.384	33%	0.333	S	S	.	.	S	Bend	trans	68.6	176.2	-176.4	0	0	0	0	0	114	N1496	N1496-G1498 PolarHBondContact O-N 2.96Å
1499	D	78.9	Confident	75.1	Confident	30.4 Å²	30.4	60.3 Å²	60.3	16%	0.163	32%	0.315	C	S	.	.			trans	-98.9	168.3	172.5	98.7	-39.8	0	0	0	111.2	K1080 Y1254 Y1497 A1501 F1502 Q1503	K1080-D1499 IonicContact NZ-OD2 3.03Å; K1080-D1499 PolarHBondContact NZ-OD2 2.92Å; K1080-D1499 VanDerWaalsContact NZ-OD2 3.15Å; Y1254-D1499 WeakPolarHBondContact CE2-OD1 3.41Å; Y1254-D1499 PolarHBondContact OH-OD1 3.19Å; Y1254-D1499 VanDerWaalsContact OH-OD1 3.07Å; Y1497-D1499 PolarHBondContact O-N 3.09Å; D1499-A1501 VanDerWaalsContact C-N 3.28Å; D1499-A1501 PolarHBondContact O-N 3.22Å; D1499-A1501 WeakPolarHBondContact OD1-CB 3.2Å; D1499-A1501 PolarHBondContact OD1-N 2.91Å; D1499-A1501 VanDerWaalsContact OD2-CB 3.24Å; D1499-A1501 WeakPolarHBondContact OD2-CB 3.29Å; D1499-A1501 PolarHBondContact OD2-N 3.39Å; D1499-A1501 VanDerWaalsContact OD2-N 3.09Å; D1499-F1502 HydrophobicContact CB-CB 4.09Å; D1499-F1502 WeakPolarHBondContact O-CB 3.44Å; D1499-F1502 PolarHBondContact O-N 3.31Å; D1499-F1502 VanDerWaalsContact O-N 3.13Å; D1499-F1502 VanDerWaalsContact OD1-CB 3.32Å; D1499-F1502 WeakPolarHBondContact OD1-CB 3.28Å; D1499-F1502 PolarHBondContact OD1-N 3.19Å; D1499-F1502 VanDerWaalsContact OD1-N 3.13Å; D1499-F1502 PolarHBondContact OD2-N 3.04Å; D1499-Q1503 WeakPolarHBondContact O-CG 3.36Å; D1499-Q1503 PolarHBondContact O-N 3.05Å
1500	E	81	Confident	75.9	Confident	154.6 Å²	154.6	61 Å²	61	72%	0.722	32%	0.319	S	S	*	.	H	α-helix	trans	-57.7	-37.6	177.5	-79.4	179.9	161.8	0	0	111.7	F1502 Q1503 D1504	E1500-F1502 VanDerWaalsContact C-N 3.32Å; E1500-F1502 PolarHBondContact O-N 3.11Å; E1500-Q1503 PolarHBondContact O-N 3.07Å; E1500-D1504 VanDerWaalsContact O-CB 3.23Å; E1500-D1504 WeakPolarHBondContact O-CB 3.41Å; E1500-D1504 VanDerWaalsContact O-CG 3.25Å; E1500-D1504 PolarHBondContact O-N 3.12Å
1501	A	82	Confident	76.9	Confident	44.4 Å²	44.4	63.9 Å²	63.9	37%	0.367	33%	0.333	S	S	.	.	H	α-helix	trans	-66.9	-33.2	177.2	0	0	0	0	0	112.6	Y1254 D1499 D1504 T1505	Y1254-A1501 HydrophobicContact CE2-CB 4.07Å; D1499-A1501 VanDerWaalsContact C-N 3.28Å; D1499-A1501 PolarHBondContact O-N 3.22Å; D1499-A1501 WeakPolarHBondContact OD1-CB 3.2Å; D1499-A1501 PolarHBondContact OD1-N 2.91Å; D1499-A1501 VanDerWaalsContact OD2-CB 3.24Å; D1499-A1501 WeakPolarHBondContact OD2-CB 3.29Å; D1499-A1501 PolarHBondContact OD2-N 3.39Å; D1499-A1501 VanDerWaalsContact OD2-N 3.09Å; A1501-D1504 PolarHBondContact O-N 3.03Å; A1501-T1505 VanDerWaalsContact O-CB 3.22Å; A1501-T1505 WeakPolarHBondContact O-CB 3.35Å; A1501-T1505 PolarHBondContact O-N 3.09Å; A1501-T1505 VanDerWaalsContact O-N 3.14Å; A1501-T1505 PolarHBondContact O-OG1 3.17Å
1502	F	85.4	Confident	77.7	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.018	34%	0.343	C	S	.	.	H	α-helix	trans	-67.7	-46.5	173.7	-172.4	-92	0	0	0	111.6	E1069 Y1254 Y1493 Y1497 D1499 E1500 D1504 T1505 V1506 I1507	E1069-F1502 HydrophobicContact CB-CE2 4.22Å; E1069-F1502 HydrophobicContact CG-CE2 3.9Å; Y1254-F1502 AromaticContact CD1-CD2 3.71Å; Y1254-F1502 HydrophobicContact CD1-CD2 3.71Å; Y1254-F1502 HydrophobicContact CD1-CE2 4.25Å; Y1254-F1502 HydrophobicContact CD2-CB 4.19Å; Y1254-F1502 HydrophobicContact CD2-CD2 4.14Å; Y1254-F1502 AromaticContact CE1-CD2 3.66Å; Y1254-F1502 HydrophobicContact CE1-CD2 3.66Å; Y1254-F1502 HydrophobicContact CE1-CE2 4.44Å; Y1254-F1502 VanDerWaalsContact CE2-CA 3.47Å; Y1254-F1502 HydrophobicContact CE2-CB 3.67Å; Y1254-F1502 HydrophobicContact CE2-CD2 4.09Å; Y1254-F1502 HydrophobicContact CE2-CG 4.41Å; Y1254-F1502 VanDerWaalsContact CE2-N 3.31Å; Y1254-F1502 AromaticContact CG-CD2 3.94Å; Y1254-F1502 HydrophobicContact CG-CD2 3.94Å; Y1254-F1502 AromaticContact CZ-CD2 3.83Å; Y1493-F1502 AromaticContact CD1-CE1 3.87Å; Y1493-F1502 HydrophobicContact CD1-CE1 3.87Å; Y1493-F1502 AromaticContact CD1-CZ 3.89Å; Y1493-F1502 HydrophobicContact CD1-CZ 4.17Å; Y1493-F1502 AromaticContact CD2-CE1 3.92Å; Y1493-F1502 HydrophobicContact CD2-CE1 3.99Å; Y1493-F1502 HydrophobicContact CD2-CZ 4.14Å; Y1493-F1502 HydrophobicContact CE1-CE1 4.3Å; Y1493-F1502 AromaticContact CE1-CZ 3.74Å; Y1493-F1502 HydrophobicContact CE1-CZ 4.03Å; Y1493-F1502 AromaticContact CE2-CE1 3.88Å; Y1493-F1502 HydrophobicContact CE2-CE1 3.92Å; Y1493-F1502 AromaticContact CE2-CZ 3.59Å; Y1493-F1502 HydrophobicContact CE2-CZ 3.59Å; Y1493-F1502 HydrophobicContact CG-CE1 4.31Å; Y1493-F1502 HydrophobicContact CG-CZ 4.46Å; Y1493-F1502 AromaticContact CZ-CZ 3.57Å; Y1497-F1502 AromaticContact CD1-CD1 3.9Å; Y1497-F1502 HydrophobicContact CD1-CD1 3.94Å; Y1497-F1502 AromaticContact CD1-CE1 3.52Å; Y1497-F1502 HydrophobicContact CD1-CE1 3.71Å; Y1497-F1502 HydrophobicContact CD1-CG 4.27Å; Y1497-F1502 AromaticContact CD1-CZ 3.9Å; Y1497-F1502 HydrophobicContact CD1-CZ 4.06Å; Y1497-F1502 HydrophobicContact CE1-CD1 4.19Å; Y1497-F1502 AromaticContact CE1-CE1 3.68Å; Y1497-F1502 HydrophobicContact CE1-CE1 3.68Å; Y1497-F1502 HydrophobicContact CE1-CE2 4.25Å; Y1497-F1502 AromaticContact CE1-CZ 3.72Å; Y1497-F1502 HydrophobicContact CE1-CZ 3.72Å; D1499-F1502 HydrophobicContact CB-CB 4.09Å; D1499-F1502 WeakPolarHBondContact O-CB 3.44Å; D1499-F1502 PolarHBondContact O-N 3.31Å; D1499-F1502 VanDerWaalsContact O-N 3.13Å; D1499-F1502 VanDerWaalsContact OD1-CB 3.32Å; D1499-F1502 WeakPolarHBondContact OD1-CB 3.28Å; D1499-F1502 PolarHBondContact OD1-N 3.19Å; D1499-F1502 VanDerWaalsContact OD1-N 3.13Å; D1499-F1502 PolarHBondContact OD2-N 3.04Å; E1500-F1502 VanDerWaalsContact C-N 3.32Å; E1500-F1502 PolarHBondContact O-N 3.11Å; F1502-D1504 VanDerWaalsContact C-N 3.32Å; F1502-D1504 PolarHBondContact O-N 3.18Å; F1502-T1505 PolarHBondContact O-N 3.16Å; F1502-V1506 HydrophobicContact CD1-CB 4.43Å; F1502-V1506 HydrophobicContact CD2-CB 4.43Å; F1502-V1506 HydrophobicContact CD2-CG2 3.9Å; F1502-V1506 HydrophobicContact CE1-CB 4.04Å; F1502-V1506 HydrophobicContact CE1-CG1 4.26Å; F1502-V1506 HydrophobicContact CE1-CG2 4.42Å; F1502-V1506 HydrophobicContact CE2-CB 4.04Å; F1502-V1506 HydrophobicContact CE2-CG1 4.29Å; F1502-V1506 HydrophobicContact CE2-CG2 3.64Å; F1502-V1506 HydrophobicContact CG-CB 4.49Å; F1502-V1506 HydrophobicContact CG-CG2 4.45Å; F1502-V1506 HydrophobicContact CZ-CB 3.82Å; F1502-V1506 HydrophobicContact CZ-CG1 3.8Å; F1502-V1506 HydrophobicContact CZ-CG2 3.95Å; F1502-V1506 WeakPolarHBondContact O-CB 3.33Å; F1502-V1506 PolarHBondContact O-N 3.22Å; F1502-I1507 HydrophobicContact CD1-CD1 4.2Å; F1502-I1507 HydrophobicContact CD1-CG1 4.36Å; F1502-I1507 HydrophobicContact CE1-CD1 3.93Å; F1502-I1507 HydrophobicContact CE1-CG1 4.03Å
1503	Q	82.3	Confident	78.6	Confident	53.6 Å²	53.6	62.5 Å²	62.5	25%	0.25	33%	0.329	S	S	.	.	I	π-helix	trans	-58.9	-45.4	175.5	-68.8	-84.7	-19.4	0	0	111.3	Y1497 D1499 E1500 T1505 I1507 N1508	Y1497-Q1503 PolarHBondContact O-NE2 2.96Å; D1499-Q1503 WeakPolarHBondContact O-CG 3.36Å; D1499-Q1503 PolarHBondContact O-N 3.05Å; E1500-Q1503 PolarHBondContact O-N 3.07Å; Q1503-T1505 VanDerWaalsContact C-N 3.29Å; Q1503-T1505 PolarHBondContact O-N 3.06Å; Q1503-I1507 VanDerWaalsContact CD-CD1 3.43Å; Q1503-I1507 HydrophobicContact CG-CD1 4.38Å; Q1503-I1507 VanDerWaalsContact NE2-CD1 3.34Å; Q1503-I1507 PolarHBondContact O-N 3.16Å; Q1503-I1507 VanDerWaalsContact OE1-CD1 3.26Å; Q1503-N1508 PolarHBondContact O-N 2.99Å
1504	D	83.2	Confident	79.3	Confident	57 Å²	57	65.6 Å²	65.6	31%	0.305	35%	0.345	S	S	.	.	I	π-helix	trans	-70.9	-12.3	-179.8	-78.4	10.7	0	0	0	114.8	E1500 A1501 F1502 P1509 K1511	E1500-D1504 VanDerWaalsContact O-CB 3.23Å; E1500-D1504 WeakPolarHBondContact O-CB 3.41Å; E1500-D1504 VanDerWaalsContact O-CG 3.25Å; E1500-D1504 PolarHBondContact O-N 3.12Å; A1501-D1504 PolarHBondContact O-N 3.03Å; F1502-D1504 VanDerWaalsContact C-N 3.32Å; F1502-D1504 PolarHBondContact O-N 3.18Å; D1504-P1509 VanDerWaalsContact O-CA 3.29Å; D1504-P1509 WeakPolarHBondContact O-CA 3.34Å; D1504-K1511 VanDerWaalsContact CG-CE 3.42Å; D1504-K1511 WeakPolarHBondContact OD1-CE 3.34Å; D1504-K1511 IonicContact OD1-NZ 3.05Å; D1504-K1511 PolarHBondContact OD1-NZ 3.18Å; D1504-K1511 WeakPolarHBondContact OD2-CE 3.42Å; D1504-K1511 IonicContact OD2-NZ 2.9Å; D1504-K1511 PolarHBondContact OD2-NZ 3.15Å
1505	T	83.9	Confident	80.4	Confident	7.4 Å²	7.4	62.6 Å²	62.6	5%	0.045	32%	0.324	C	S	.	.	I	π-helix	trans	-116.3	-39.6	-175.5	-57.6	0	0	0	0	112.9	T1253 A1501 F1502 Q1503 R1524	T1253-T1505 HydrophobicContact CG2-CG2 3.99Å; A1501-T1505 VanDerWaalsContact O-CB 3.22Å; A1501-T1505 WeakPolarHBondContact O-CB 3.35Å; A1501-T1505 PolarHBondContact O-N 3.09Å; A1501-T1505 VanDerWaalsContact O-N 3.14Å; A1501-T1505 PolarHBondContact O-OG1 3.17Å; F1502-T1505 PolarHBondContact O-N 3.16Å; Q1503-T1505 VanDerWaalsContact C-N 3.29Å; Q1503-T1505 PolarHBondContact O-N 3.06Å; T1505-R1524 PolarHBondContact OG1-NH2 3.07Å
1506	V	84.1	Confident	81.6	Confident	2.4 Å²	2.4	53.8 Å²	53.8	2%	0.015	29%	0.286	C	S	.	.	I	π-helix	trans	-105.9	-43.1	-171.6	-173.5	0	0	0	0	111.7	L1250 R1251 Y1254 F1491 Y1493 F1502	L1250-V1506 HydrophobicContact CB-CG2 4.47Å; R1251-V1506 HydrophobicContact CG-CG1 3.88Å; R1251-V1506 HydrophobicContact CG-CG2 4.37Å; Y1254-V1506 HydrophobicContact CG-CG2 4.44Å; F1491-V1506 HydrophobicContact CD1-CG1 4.32Å; F1491-V1506 HydrophobicContact CD2-CG1 4.05Å; F1491-V1506 HydrophobicContact CE1-CG1 3.98Å; F1491-V1506 HydrophobicContact CE2-CG1 3.61Å; F1491-V1506 VanDerWaalsContact CE2-O 3.23Å; F1491-V1506 WeakPolarHBondContact CE2-O 3.33Å; F1491-V1506 HydrophobicContact CG-CG1 4.3Å; F1491-V1506 HydrophobicContact CZ-CG1 3.56Å; Y1493-V1506 HydrophobicContact CE1-CG1 4.38Å; Y1493-V1506 HydrophobicContact CE2-CG1 4.23Å; Y1493-V1506 WeakPolarHBondContact OH-CG1 3.5Å; F1502-V1506 HydrophobicContact CD1-CB 4.43Å; F1502-V1506 HydrophobicContact CD2-CB 4.43Å; F1502-V1506 HydrophobicContact CD2-CG2 3.9Å; F1502-V1506 HydrophobicContact CE1-CB 4.04Å; F1502-V1506 HydrophobicContact CE1-CG1 4.26Å; F1502-V1506 HydrophobicContact CE1-CG2 4.42Å; F1502-V1506 HydrophobicContact CE2-CB 4.04Å; F1502-V1506 HydrophobicContact CE2-CG1 4.29Å; F1502-V1506 HydrophobicContact CE2-CG2 3.64Å; F1502-V1506 HydrophobicContact CG-CB 4.49Å; F1502-V1506 HydrophobicContact CG-CG2 4.45Å; F1502-V1506 HydrophobicContact CZ-CB 3.82Å; F1502-V1506 HydrophobicContact CZ-CG1 3.8Å; F1502-V1506 HydrophobicContact CZ-CG2 3.95Å; F1502-V1506 WeakPolarHBondContact O-CB 3.33Å; F1502-V1506 PolarHBondContact O-N 3.22Å
1507	I	80.9	Confident	82.9	Confident	49 Å²	49	46.8 Å²	46.8	25%	0.251	25%	0.249	S	C	.	.	I	π-helix	trans	-91.3	-52.1	-171	-59.5	-176.7	0	0	0	112.2	Y1493 F1502 Q1503 P1509	Y1493-I1507 HydrophobicContact CD2-CD1 4.01Å; Y1493-I1507 HydrophobicContact CD2-CG1 4.18Å; Y1493-I1507 HydrophobicContact CE2-CG1 4.14Å; Y1493-I1507 HydrophobicContact CG-CD1 4.34Å; Y1493-I1507 HydrophobicContact CG-CG1 4.42Å; F1502-I1507 HydrophobicContact CD1-CD1 4.2Å; F1502-I1507 HydrophobicContact CD1-CG1 4.36Å; F1502-I1507 HydrophobicContact CE1-CD1 3.93Å; F1502-I1507 HydrophobicContact CE1-CG1 4.03Å; Q1503-I1507 VanDerWaalsContact CD-CD1 3.43Å; Q1503-I1507 HydrophobicContact CG-CD1 4.38Å; Q1503-I1507 VanDerWaalsContact NE2-CD1 3.34Å; Q1503-I1507 PolarHBondContact O-N 3.16Å; Q1503-I1507 VanDerWaalsContact OE1-CD1 3.26Å; I1507-P1509 VanDerWaalsContact C-CD 3.47Å; I1507-P1509 WeakPolarHBondContact O-CD 3.11Å
1508	N	82.6	Confident	83.9	Confident	88 Å²	88	44.8 Å²	44.8	47%	0.471	24%	0.241	S	C	.	.			trans	-132	68.7	179.1	-71	-50.5	0	0	0	111.8	Q1503 V1510	Q1503-N1508 PolarHBondContact O-N 2.99Å; N1508-V1510 VanDerWaalsContact C-N 3.32Å; N1508-V1510 PolarHBondContact O-N 3.39Å
1509	P	84.2	Confident	84.8	Confident	4.6 Å²	4.6	47.5 Å²	47.5	3%	0.03	25%	0.247	C	C	.	.			trans	-70.9	-25.5	-176.9	25.8	-33.5	0	0	0	115.1	L1250 D1504 I1507 K1511	L1250-P1509 HydrophobicContact CD1-CG 4.31Å; L1250-P1509 HydrophobicContact CD2-CG 4.45Å; D1504-P1509 VanDerWaalsContact O-CA 3.29Å; D1504-P1509 WeakPolarHBondContact O-CA 3.34Å; I1507-P1509 VanDerWaalsContact C-CD 3.47Å; I1507-P1509 WeakPolarHBondContact O-CD 3.11Å; P1509-K1511 PolarHBondContact O-N 3.17Å
1510	V	86.8	Confident	85.2	Confident	29.4 Å²	29.4	47.6 Å²	47.6	18%	0.178	25%	0.251	C	S	.	.			trans	-91.7	109.7	172.1	177.5	0	0	0	0	108.8	N1296 E1299 S1300 N1508 P1513	N1296-V1510 HydrophobicContact CB-CG2 4.08Å; N1296-V1510 WeakPolarHBondContact O-CG2 3.4Å; E1299-V1510 HydrophobicContact CB-CG2 4.03Å; E1299-V1510 HydrophobicContact CG-CG2 4.05Å; S1300-V1510 VanDerWaalsContact OG-CG1 3.25Å; S1300-V1510 WeakPolarHBondContact OG-CG1 3.34Å; N1508-V1510 VanDerWaalsContact C-N 3.32Å; N1508-V1510 PolarHBondContact O-N 3.39Å; V1510-P1513 HydrophobicContact CG1-CB 4.36Å
1511	K	84.2	Confident	85.7	Confident	128 Å²	128	40.4 Å²	40.4	56%	0.557	22%	0.217	S	C	*	.	S	Bend	trans	-95.3	-42.6	176.8	-68.5	-167.6	170.4	-171	0	112.4	D1504 P1509 Q1518	D1504-K1511 VanDerWaalsContact CG-CE 3.42Å; D1504-K1511 WeakPolarHBondContact OD1-CE 3.34Å; D1504-K1511 IonicContact OD1-NZ 3.05Å; D1504-K1511 PolarHBondContact OD1-NZ 3.18Å; D1504-K1511 WeakPolarHBondContact OD2-CE 3.42Å; D1504-K1511 IonicContact OD2-NZ 2.9Å; D1504-K1511 PolarHBondContact OD2-NZ 3.15Å; P1509-K1511 PolarHBondContact O-N 3.17Å; K1511-Q1518 VanDerWaalsContact N-OE1 3.1Å
1512	N	84.4	Confident	86.2	Confident	69.4 Å²	69.4	39.3 Å²	39.3	37%	0.371	20%	0.204	S	C	.	.			trans	-121.3	110.8	177	-137.9	-0.9	0	0	0	108.3	E1514 I1515 Q1518	N1512-E1514 VanDerWaalsContact C-N 3.28Å; N1512-E1514 PolarHBondContact O-N 3.11Å; N1512-E1514 WeakPolarHBondContact OD1-CB 3.43Å; N1512-E1514 PolarHBondContact OD1-N 2.92Å; N1512-I1515 HydrophobicContact CB-CD1 3.91Å; N1512-I1515 HydrophobicContact CB-CG1 3.97Å; N1512-I1515 HydrophobicContact CB-CG2 4.38Å; N1512-I1515 VanDerWaalsContact O-CG1 3.25Å; N1512-I1515 WeakPolarHBondContact O-CG1 3.28Å; N1512-Q1518 VanDerWaalsContact N-OE1 3.14Å; N1512-Q1518 PolarHBondContact O-NE2 3.12Å; N1512-Q1518 PolarHBondContact O-OE1 2.8Å
1513	P	82.7	Confident	86.4	Confident	47.6 Å²	47.6	45.8 Å²	45.8	31%	0.309	23%	0.233	S	C	.	.	S	Bend	trans	-76.8	-8.4	-177.9	31.9	-36	0	0	0	113.7	S1300 V1510	S1300-P1513 WeakPolarHBondContact CB-O 3.17Å; V1510-P1513 HydrophobicContact CG1-CB 4.36Å
1514	E	82.5	Confident	86.8	Confident	104.2 Å²	104.2	43.9 Å²	43.9	49%	0.487	22%	0.223	S	C	.	.	S	Bend	trans	-82.5	-36.7	-179.5	-57.9	-166.2	148.5	0	0	112.2	N1512 K1557 C1689	N1512-E1514 VanDerWaalsContact C-N 3.28Å; N1512-E1514 PolarHBondContact O-N 3.11Å; N1512-E1514 WeakPolarHBondContact OD1-CB 3.43Å; N1512-E1514 PolarHBondContact OD1-N 2.92Å; E1514-K1557 VanDerWaalsContact O-CE 3.26Å; E1514-K1557 WeakPolarHBondContact O-CE 3.29Å; E1514-K1557 PolarHBondContact O-NZ 3.01Å; E1514-C1689 WeakPolarHBondContact O-CA 3.4Å; E1514-C1689 PolarHBondContact O-SG 3.27Å; E1514-C1689 VanDerWaalsContact O-SG 3.33Å
1515	I	88.3	Confident	87.3	Confident	17.6 Å²	17.6	41.2 Å²	41.2	9%	0.09	21%	0.209	C	C	.	.	S	Bend	trans	-72.2	141.6	179.7	52	-179.9	0	0	0	111.4	N1512 L1517 T1688	N1512-I1515 HydrophobicContact CB-CD1 3.91Å; N1512-I1515 HydrophobicContact CB-CG1 3.97Å; N1512-I1515 HydrophobicContact CB-CG2 4.38Å; N1512-I1515 VanDerWaalsContact O-CG1 3.25Å; N1512-I1515 WeakPolarHBondContact O-CG1 3.28Å; I1515-L1517 VanDerWaalsContact CD1-O 3.31Å; I1515-L1517 WeakPolarHBondContact CD1-O 3.34Å; I1515-L1517 WeakPolarHBondContact CG1-O 3.3Å; I1515-L1517 WeakPolarHBondContact CG2-O 3.45Å; I1515-L1517 PolarHBondContact O-N 2.91Å; I1515-T1688 WeakPolarHBondContact CG2-O 3.3Å
1516	L	89.7	Confident	87.5	Confident	3.8 Å²	3.8	44 Å²	44	2%	0.02	22%	0.223	C	C	.	.	S	Bend	trans	-63.4	-47.9	-177.6	177.3	56.8	0	0	0	113.4	C1297 M1553 M1554 K1557 C1689 L1690 T1693	C1297-L1516 PolarHBondContact SG-O 3.28Å; L1516-M1553 HydrophobicContact CD1-CB 4.18Å; L1516-M1553 HydrophobicContact CD1-CE 4.11Å; L1516-M1553 HydrophobicContact CD2-CB 4.03Å; L1516-M1553 HydrophobicContact CG-CB 4.39Å; L1516-M1554 HydrophobicContact CD2-CB 4.29Å; L1516-M1554 HydrophobicContact CD2-CG 3.69Å; L1516-K1557 HydrophobicContact CB-CG 4.38Å; L1516-K1557 HydrophobicContact CD1-CB 3.75Å; L1516-K1557 HydrophobicContact CD1-CD 4.45Å; L1516-K1557 HydrophobicContact CD1-CG 4.08Å; L1516-K1557 HydrophobicContact CD2-CB 4.27Å; L1516-K1557 HydrophobicContact CG-CB 4.47Å; L1516-C1689 WeakPolarHBondContact CB-O 3.48Å; L1516-C1689 PolarHBondContact N-O 3.14Å; L1516-L1690 HydrophobicContact CB-CD2 4.24Å; L1516-L1690 HydrophobicContact CD2-CD2 3.66Å; L1516-L1690 HydrophobicContact CG-CD2 4.47Å; L1516-T1693 HydrophobicContact CD2-CG2 4.08Å; L1516-T1693 HydrophobicContact CG-CG2 4.47Å
1517	L	92.2	Very high	87.7	Confident	1.6 Å²	1.6	48 Å²	48	1%	0.008	24%	0.242	C	C	.	.	S	Bend	trans	-122.4	141.4	175.1	-66.8	-177.8	0	0	0	109.5	A1293 I1515 I1522 L1525 F1549 L1550 T1693	A1293-L1517 HydrophobicContact CB-CD2 4.01Å; I1515-L1517 VanDerWaalsContact CD1-O 3.31Å; I1515-L1517 WeakPolarHBondContact CD1-O 3.34Å; I1515-L1517 WeakPolarHBondContact CG1-O 3.3Å; I1515-L1517 WeakPolarHBondContact CG2-O 3.45Å; I1515-L1517 PolarHBondContact O-N 2.91Å; L1517-I1522 HydrophobicContact CB-CD1 4.26Å; L1517-I1522 HydrophobicContact CB-CG1 4Å; L1517-I1522 HydrophobicContact CD1-CG1 4.41Å; L1517-L1525 HydrophobicContact CD1-CD1 4.33Å; L1517-F1549 HydrophobicContact CD1-CE1 4.13Å; L1517-F1549 HydrophobicContact CD2-CE1 4.23Å; L1517-F1549 HydrophobicContact CD2-CZ 4.18Å; L1517-L1550 HydrophobicContact CD1-CD2 3.45Å; L1517-L1550 VanDerWaalsContact CD1-CD2 3.45Å; L1517-T1693 HydrophobicContact CD1-CG2 4.01Å; L1517-T1693 HydrophobicContact CG-CG2 4.35Å
1518	Q	91.9	Very high	88	Confident	5.6 Å²	5.6	45.7 Å²	45.7	3%	0.026	23%	0.23	C	C	.	.			trans	-71.8	151.3	176.6	-56.8	-60.5	-61.5	0	0	110.3	N1296 K1511 N1512 S1520 D1521 I1522	N1296-Q1518 HydrophobicContact CB-CG 4.38Å; K1511-Q1518 VanDerWaalsContact N-OE1 3.1Å; N1512-Q1518 VanDerWaalsContact N-OE1 3.14Å; N1512-Q1518 PolarHBondContact O-NE2 3.12Å; N1512-Q1518 PolarHBondContact O-OE1 2.8Å; Q1518-S1520 WeakPolarHBondContact CB-OG 3.38Å; Q1518-S1520 PolarHBondContact O-N 3.07Å; Q1518-S1520 VanDerWaalsContact O-N 3.12Å; Q1518-D1521 WeakPolarHBondContact CB-OD2 3.41Å; Q1518-D1521 PolarHBondContact N-OD2 3.27Å; Q1518-D1521 WeakPolarHBondContact O-CB 3.18Å; Q1518-D1521 PolarHBondContact O-N 2.96Å; Q1518-I1522 PolarHBondContact O-N 3Å; Q1518-I1522 VanDerWaalsContact O-N 3.1Å
1519	N	88.6	Confident	88.2	Confident	95.2 Å²	95.2	41.6 Å²	41.6	51%	0.509	21%	0.208	S	C	.	.	H	α-helix	trans	-61.2	-23.2	178.5	-71.2	-29.3	0	0	0	113	K1523	N1519-K1523 WeakPolarHBondContact O-CB 3.22Å; N1519-K1523 VanDerWaalsContact O-CD 3.31Å; N1519-K1523 WeakPolarHBondContact O-CD 3.36Å; N1519-K1523 WeakPolarHBondContact O-CG 3.3Å; N1519-K1523 PolarHBondContact O-N 3.06Å
1520	S	87.9	Confident	88.2	Confident	33.2 Å²	33.2	43.3 Å²	43.3	23%	0.232	22%	0.223	C	C	.	.	H	α-helix	trans	-66.4	-44.5	169.5	42.9	0	0	0	0	111.9	Q1518 K1523 R1524	Q1518-S1520 WeakPolarHBondContact CB-OG 3.38Å; Q1518-S1520 PolarHBondContact O-N 3.07Å; Q1518-S1520 VanDerWaalsContact O-N 3.12Å; S1520-K1523 WeakPolarHBondContact O-CB 3.28Å; S1520-K1523 PolarHBondContact O-N 3.17Å; S1520-R1524 VanDerWaalsContact O-CG 3.3Å; S1520-R1524 WeakPolarHBondContact O-CG 3.37Å; S1520-R1524 PolarHBondContact O-N 3.17Å; S1520-R1524 PolarHBondContact OG-NH1 3.33Å
1521	D	92.3	Very high	87.8	Confident	1.8 Å²	1.8	44.2 Å²	44.2	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-70.5	-41	-177.2	-55.7	-32.2	0	0	0	111.6	A1293 N1296 Q1518 K1523 R1524 L1525	A1293-D1521 HydrophobicContact CB-CB 4.11Å; N1296-D1521 VanDerWaalsContact ND2-CG 3.34Å; N1296-D1521 PolarHBondContact ND2-OD1 3.19Å; N1296-D1521 VanDerWaalsContact ND2-OD1 3.16Å; N1296-D1521 PolarHBondContact ND2-OD2 3.14Å; Q1518-D1521 WeakPolarHBondContact CB-OD2 3.41Å; Q1518-D1521 PolarHBondContact N-OD2 3.27Å; Q1518-D1521 WeakPolarHBondContact O-CB 3.18Å; Q1518-D1521 PolarHBondContact O-N 2.96Å; D1521-K1523 VanDerWaalsContact C-N 3.33Å; D1521-K1523 PolarHBondContact O-N 3.09Å; D1521-R1524 WeakPolarHBondContact O-CB 3.45Å; D1521-R1524 PolarHBondContact O-N 3.19Å; D1521-R1524 IonicContact OD1-NH1 2.92Å; D1521-R1524 PolarHBondContact OD1-NH1 2.93Å; D1521-R1524 VanDerWaalsContact OD1-NH1 3.13Å; D1521-L1525 VanDerWaalsContact O-CG 3.29Å; D1521-L1525 WeakPolarHBondContact O-CG 3.39Å; D1521-L1525 PolarHBondContact O-N 3.28Å
1522	I	92	Very high	87.4	Confident	21.6 Å²	21.6	38.4 Å²	38.4	11%	0.111	20%	0.199	C	C	.	.	H	α-helix	trans	-60.5	-43.9	172.6	-64.6	172.7	0	0	0	110.5	L1517 Q1518 R1524 L1525 N1526 F1696	L1517-I1522 HydrophobicContact CB-CD1 4.26Å; L1517-I1522 HydrophobicContact CB-CG1 4Å; L1517-I1522 HydrophobicContact CD1-CG1 4.41Å; Q1518-I1522 PolarHBondContact O-N 3Å; Q1518-I1522 VanDerWaalsContact O-N 3.1Å; I1522-R1524 PolarHBondContact O-N 2.95Å; I1522-L1525 PolarHBondContact O-N 3.31Å; I1522-N1526 VanDerWaalsContact O-CB 3.28Å; I1522-N1526 WeakPolarHBondContact O-CB 3.27Å; I1522-N1526 PolarHBondContact O-N 3.29Å; I1522-F1696 HydrophobicContact CG1-CD1 4.47Å; I1522-F1696 HydrophobicContact CG2-CB 3.96Å; I1522-F1696 HydrophobicContact CG2-CD1 3.94Å; I1522-F1696 HydrophobicContact CG2-CD2 4.27Å; I1522-F1696 HydrophobicContact CG2-CE1 4.48Å; I1522-F1696 HydrophobicContact CG2-CG 3.8Å
1523	K	89.7	Confident	86.7	Confident	140.6 Å²	140.6	38 Å²	38	61%	0.611	20%	0.199	S	C	*	.	H	α-helix	trans	-61.5	-44.3	175.6	-77	171.8	-176.3	-178.4	0	112.1	N1519 S1520 D1521 L1525 N1526 H1527	N1519-K1523 WeakPolarHBondContact O-CB 3.22Å; N1519-K1523 VanDerWaalsContact O-CD 3.31Å; N1519-K1523 WeakPolarHBondContact O-CD 3.36Å; N1519-K1523 WeakPolarHBondContact O-CG 3.3Å; N1519-K1523 PolarHBondContact O-N 3.06Å; S1520-K1523 WeakPolarHBondContact O-CB 3.28Å; S1520-K1523 PolarHBondContact O-N 3.17Å; D1521-K1523 VanDerWaalsContact C-N 3.33Å; D1521-K1523 PolarHBondContact O-N 3.09Å; K1523-L1525 PolarHBondContact O-N 2.95Å; K1523-N1526 PolarHBondContact O-N 3.04Å; K1523-H1527 VanDerWaalsContact O-CB 3.27Å; K1523-H1527 WeakPolarHBondContact O-CB 3.34Å; K1523-H1527 PolarHBondContact O-N 3.09Å; K1523-H1527 PolarHBondContact O-ND1 3.26Å
1524	R	91.1	Very high	85.7	Confident	14.2 Å²	14.2	43.7 Å²	43.7	5%	0.054	22%	0.222	C	C	.	.	H	α-helix	trans	-58.3	-50.9	177.3	-76	168.6	179.9	132.5	7.3	111.9	D1257 Y1289 T1505 S1520 D1521 I1522 N1526 H1527 L1528	D1257-R1524 WeakPolarHBondContact OD1-CG 3.19Å; D1257-R1524 IonicContact OD1-NE 3.23Å; D1257-R1524 PolarHBondContact OD1-NE 3.16Å; D1257-R1524 IonicContact OD2-CZ 3.26Å; D1257-R1524 VanDerWaalsContact OD2-CZ 3.26Å; D1257-R1524 IonicContact OD2-NE 3.28Å; D1257-R1524 PolarHBondContact OD2-NE 3.31Å; D1257-R1524 IonicContact OD2-NH2 3.01Å; D1257-R1524 PolarHBondContact OD2-NH2 3.33Å; Y1289-R1524 HydrophobicContact CD1-CB 4.29Å; Y1289-R1524 HydrophobicContact CD1-CG 4.33Å; Y1289-R1524 HydrophobicContact CD2-CB 3.83Å; Y1289-R1524 HydrophobicContact CD2-CG 4.4Å; Y1289-R1524 HydrophobicContact CE1-CB 4.39Å; Y1289-R1524 HydrophobicContact CE1-CG 4.14Å; Y1289-R1524 HydrophobicContact CE2-CB 3.97Å; Y1289-R1524 HydrophobicContact CE2-CG 4.35Å; Y1289-R1524 HydrophobicContact CG-CB 4.01Å; Y1289-R1524 HydrophobicContact CG-CG 4.44Å; T1505-R1524 PolarHBondContact OG1-NH2 3.07Å; S1520-R1524 VanDerWaalsContact O-CG 3.3Å; S1520-R1524 WeakPolarHBondContact O-CG 3.37Å; S1520-R1524 PolarHBondContact O-N 3.17Å; S1520-R1524 PolarHBondContact OG-NH1 3.33Å; D1521-R1524 WeakPolarHBondContact O-CB 3.45Å; D1521-R1524 PolarHBondContact O-N 3.19Å; D1521-R1524 IonicContact OD1-NH1 2.92Å; D1521-R1524 PolarHBondContact OD1-NH1 2.93Å; D1521-R1524 VanDerWaalsContact OD1-NH1 3.13Å; I1522-R1524 PolarHBondContact O-N 2.95Å; R1524-N1526 PolarHBondContact O-N 2.86Å; R1524-H1527 PolarHBondContact O-N 3.38Å; R1524-L1528 VanDerWaalsContact O-CB 3.28Å; R1524-L1528 WeakPolarHBondContact O-CB 3.38Å; R1524-L1528 PolarHBondContact O-N 3.06Å
1525	L	92.3	Very high	84.6	Confident	0.8 Å²	0.8	40.6 Å²	40.6	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-62.5	-47.4	-179.7	-66.8	173.1	0	0	0	111.4	L1286 L1290 L1517 D1521 I1522 K1523 L1528 I1529 T1546 F1549 F1696	L1286-L1525 HydrophobicContact CD1-CD2 3.54Å; L1286-L1525 VanDerWaalsContact CD1-CD2 3.46Å; L1290-L1525 HydrophobicContact CD2-CD1 4.34Å; L1290-L1525 HydrophobicContact CD2-CD2 3.96Å; L1290-L1525 HydrophobicContact CG-CD2 4.35Å; L1517-L1525 HydrophobicContact CD1-CD1 4.33Å; D1521-L1525 VanDerWaalsContact O-CG 3.29Å; D1521-L1525 WeakPolarHBondContact O-CG 3.39Å; D1521-L1525 PolarHBondContact O-N 3.28Å; I1522-L1525 PolarHBondContact O-N 3.31Å; K1523-L1525 PolarHBondContact O-N 2.95Å; L1525-L1528 PolarHBondContact O-N 3.08Å; L1525-I1529 VanDerWaalsContact O-CG1 3.27Å; L1525-I1529 WeakPolarHBondContact O-CG1 3.37Å; L1525-I1529 PolarHBondContact O-N 3.22Å; L1525-I1529 VanDerWaalsContact O-N 3.08Å; L1525-T1546 HydrophobicContact CB-CG2 4.49Å; L1525-T1546 HydrophobicContact CD1-CG2 4.31Å; L1525-T1546 HydrophobicContact CD2-CG2 4.46Å; L1525-F1549 HydrophobicContact CD1-CE1 4.42Å; L1525-F1696 HydrophobicContact CB-CE1 3.87Å; L1525-F1696 HydrophobicContact CB-CZ 3.9Å; L1525-F1696 HydrophobicContact CD1-CE1 4.23Å
1526	N	90	Very high	83.1	Confident	65.2 Å²	65.2	43.2 Å²	43.2	35%	0.349	23%	0.227	S	C	.	.	H	α-helix	trans	-62.1	-51.1	178.8	-170	-14.9	0	0	0	111.8	I1522 K1523 R1524 L1528 I1529 A1530 F1696	I1522-N1526 VanDerWaalsContact O-CB 3.28Å; I1522-N1526 WeakPolarHBondContact O-CB 3.27Å; I1522-N1526 PolarHBondContact O-N 3.29Å; K1523-N1526 PolarHBondContact O-N 3.04Å; R1524-N1526 PolarHBondContact O-N 2.86Å; N1526-L1528 VanDerWaalsContact C-N 3.3Å; N1526-L1528 PolarHBondContact O-N 3.15Å; N1526-I1529 PolarHBondContact O-N 3.13Å; N1526-I1529 VanDerWaalsContact O-N 3.14Å; N1526-A1530 VanDerWaalsContact O-CB 3.28Å; N1526-A1530 WeakPolarHBondContact O-CB 3.38Å; N1526-A1530 PolarHBondContact O-N 3.09Å; N1526-F1696 HydrophobicContact CB-CD2 4.35Å; N1526-F1696 HydrophobicContact CB-CE2 3.64Å; N1526-F1696 HydrophobicContact CB-CZ 4.04Å
1527	H	86.7	Confident	81.6	Confident	87 Å²	87	52.7 Å²	52.7	40%	0.403	27%	0.268	S	S	.	.	H	α-helix	trans	-61.8	-37	179.6	-110.7	92.8	0	0	0	112.4	I1260 L1261 K1523 R1524 K1531	I1260-H1527 PolarHBondContact O-NE2 2.87Å; L1261-H1527 HydrophobicContact CD2-CB 3.81Å; L1261-H1527 PolarHBondContact O-CE1 3.17Å; K1523-H1527 VanDerWaalsContact O-CB 3.27Å; K1523-H1527 WeakPolarHBondContact O-CB 3.34Å; K1523-H1527 PolarHBondContact O-N 3.09Å; K1523-H1527 PolarHBondContact O-ND1 3.26Å; R1524-H1527 PolarHBondContact O-N 3.38Å; H1527-K1531 WeakPolarHBondContact O-CB 3.35Å; H1527-K1531 PolarHBondContact O-N 3.27Å
1528	L	87.9	Confident	80.4	Confident	1.2 Å²	1.2	54.1 Å²	54.1	1%	0.006	28%	0.278	C	S	.	.	H	α-helix	trans	-65.2	-43.9	176.5	-177.9	66.4	0	0	0	111.8	I1260 L1285 L1286 Y1289 R1524 L1525 N1526 Y1532 L1542	I1260-L1528 HydrophobicContact CD1-CD1 4.11Å; L1285-L1528 HydrophobicContact CB-CD1 3.97Å; L1285-L1528 HydrophobicContact CB-CD2 4.16Å; L1285-L1528 HydrophobicContact CD1-CD1 4.26Å; L1286-L1528 VanDerWaalsContact CA-CD2 3.47Å; L1286-L1528 HydrophobicContact CB-CD2 3.73Å; L1286-L1528 HydrophobicContact CD1-CD2 4.26Å; L1286-L1528 HydrophobicContact CG-CD2 4.43Å; L1286-L1528 VanDerWaalsContact N-CD2 3.34Å; Y1289-L1528 HydrophobicContact CD2-CB 4.47Å; Y1289-L1528 HydrophobicContact CD2-CD2 4.01Å; Y1289-L1528 HydrophobicContact CE2-CB 4.36Å; Y1289-L1528 HydrophobicContact CE2-CD2 4.36Å; R1524-L1528 VanDerWaalsContact O-CB 3.28Å; R1524-L1528 WeakPolarHBondContact O-CB 3.38Å; R1524-L1528 PolarHBondContact O-N 3.06Å; L1525-L1528 PolarHBondContact O-N 3.08Å; N1526-L1528 VanDerWaalsContact C-N 3.3Å; N1526-L1528 PolarHBondContact O-N 3.15Å; L1528-Y1532 HydrophobicContact CD1-CD2 3.93Å; L1528-Y1532 HydrophobicContact CD1-CE2 3.82Å; L1528-Y1532 HydrophobicContact CG-CD2 4.45Å; L1528-Y1532 WeakPolarHBondContact O-CD2 3.36Å; L1528-Y1532 PolarHBondContact O-N 3.09Å; L1528-L1542 HydrophobicContact CD2-CD2 4.3Å; L1528-L1542 HydrophobicContact CG-CD2 4.18Å
1529	I	87.9	Confident	79.9	Confident	0.6 Å²	0.6	54.3 Å²	54.3	0%	0.003	28%	0.28	C	S	.	.	H	α-helix	trans	-64.2	-54	177.3	-67.6	166	0	0	0	109.9	L1525 N1526 K1531 Y1532 T1533 L1542 A1543 T1546 F1696 L1700 F1704	L1525-I1529 VanDerWaalsContact O-CG1 3.27Å; L1525-I1529 WeakPolarHBondContact O-CG1 3.37Å; L1525-I1529 PolarHBondContact O-N 3.22Å; L1525-I1529 VanDerWaalsContact O-N 3.08Å; N1526-I1529 PolarHBondContact O-N 3.13Å; N1526-I1529 VanDerWaalsContact O-N 3.14Å; I1529-K1531 VanDerWaalsContact C-N 3.32Å; I1529-K1531 PolarHBondContact O-N 2.91Å; I1529-Y1532 PolarHBondContact O-N 3Å; I1529-Y1532 VanDerWaalsContact O-N 3.09Å; I1529-T1533 WeakPolarHBondContact O-CG2 3.23Å; I1529-T1533 PolarHBondContact O-N 3.14Å; I1529-T1533 PolarHBondContact O-OG1 3.04Å; I1529-T1533 VanDerWaalsContact O-OG1 3.1Å; I1529-L1542 HydrophobicContact CG1-CB 4.24Å; I1529-L1542 HydrophobicContact CG1-CD2 3.97Å; I1529-L1542 HydrophobicContact CG1-CG 4.26Å; I1529-A1543 HydrophobicContact CG2-CB 4.4Å; I1529-T1546 HydrophobicContact CD1-CG2 4.22Å; I1529-F1696 HydrophobicContact CD1-CZ 4.45Å; I1529-L1700 HydrophobicContact CD1-CD1 4.45Å; I1529-L1700 HydrophobicContact CD1-CD2 3.86Å; I1529-L1700 HydrophobicContact CG2-CD2 4.43Å; I1529-F1704 HydrophobicContact CG2-CE2 3.73Å; I1529-F1704 HydrophobicContact CG2-CZ 3.6Å
1530	A	83.4	Confident	79.8	Confident	41.6 Å²	41.6	52.2 Å²	52.2	34%	0.344	27%	0.268	S	S	.	.	H	α-helix	trans	-56.6	-43.7	-178.6	0	0	0	0	0	112.8	N1526 Y1532 T1533 E1534	N1526-A1530 VanDerWaalsContact O-CB 3.28Å; N1526-A1530 WeakPolarHBondContact O-CB 3.38Å; N1526-A1530 PolarHBondContact O-N 3.09Å; A1530-Y1532 VanDerWaalsContact C-N 3.32Å; A1530-Y1532 PolarHBondContact O-N 3.06Å; A1530-Y1532 VanDerWaalsContact O-N 3.15Å; A1530-T1533 VanDerWaalsContact O-CB 3.3Å; A1530-T1533 WeakPolarHBondContact O-CB 3.31Å; A1530-T1533 WeakPolarHBondContact O-CG2 3.48Å; A1530-T1533 PolarHBondContact O-N 3.14Å; A1530-T1533 PolarHBondContact O-OG1 3.13Å; A1530-E1534 PolarHBondContact O-N 2.89Å
1531	K	78	Confident	79.8	Confident	47.6 Å²	47.6	52.3 Å²	52.3	21%	0.207	27%	0.265	C	S	.	.	H	α-helix	trans	-66.5	-27.6	-179.5	-172.2	170.8	-174.8	174	0	113.6	I1260 D1262 K1263 H1527 I1529 T1535	I1260-K1531 HydrophobicContact CG2-CD 4.16Å; I1260-K1531 PolarHBondContact O-NZ 3.36Å; D1262-K1531 PolarHBondContact O-NZ 3.06Å; K1263-K1531 WeakPolarHBondContact O-CE 3.39Å; K1263-K1531 PolarHBondContact O-NZ 3Å; H1527-K1531 WeakPolarHBondContact O-CB 3.35Å; H1527-K1531 PolarHBondContact O-N 3.27Å; I1529-K1531 VanDerWaalsContact C-N 3.32Å; I1529-K1531 PolarHBondContact O-N 2.91Å; K1531-T1535 PolarHBondContact O-OG1 3Å
1532	Y	76.5	Confident	79.7	Confident	6 Å²	6	52.4 Å²	52.4	2%	0.024	27%	0.265	C	S	.	.	H	α-helix	trans	-91.8	-8.9	177.4	-82.9	-86.3	0	0	0	113.8	T1267 A1282 L1528 I1529 A1530 E1534 T1535 T1536 S1538 L1542	T1267-Y1532 HydrophobicContact CG2-CE1 4.21Å; T1267-Y1532 HydrophobicContact CG2-CE2 4.37Å; T1267-Y1532 VanDerWaalsContact CG2-OH 3.27Å; T1267-Y1532 WeakPolarHBondContact CG2-OH 3.37Å; A1282-Y1532 HydrophobicContact CB-CD1 3.58Å; A1282-Y1532 HydrophobicContact CB-CD2 3.61Å; A1282-Y1532 HydrophobicContact CB-CE1 3.52Å; A1282-Y1532 VanDerWaalsContact CB-CE1 3.43Å; A1282-Y1532 HydrophobicContact CB-CE2 3.55Å; A1282-Y1532 HydrophobicContact CB-CG 3.61Å; A1282-Y1532 VanDerWaalsContact CB-CZ 3.44Å; A1282-Y1532 PolarHBondContact N-OH 3.17Å; L1528-Y1532 HydrophobicContact CD1-CD2 3.93Å; L1528-Y1532 HydrophobicContact CD1-CE2 3.82Å; L1528-Y1532 HydrophobicContact CG-CD2 4.45Å; L1528-Y1532 WeakPolarHBondContact O-CD2 3.36Å; L1528-Y1532 PolarHBondContact O-N 3.09Å; I1529-Y1532 PolarHBondContact O-N 3Å; I1529-Y1532 VanDerWaalsContact O-N 3.09Å; A1530-Y1532 VanDerWaalsContact C-N 3.32Å; A1530-Y1532 PolarHBondContact O-N 3.06Å; A1530-Y1532 VanDerWaalsContact O-N 3.15Å; Y1532-E1534 VanDerWaalsContact C-N 3.34Å; Y1532-E1534 PolarHBondContact O-N 3.31Å; Y1532-T1535 WeakPolarHBondContact CD1-OG1 3.46Å; Y1532-T1535 PolarHBondContact O-N 2.93Å; Y1532-T1535 VanDerWaalsContact O-N 3.11Å; Y1532-T1535 PolarHBondContact O-OG1 2.94Å; Y1532-T1535 VanDerWaalsContact O-OG1 3.1Å; Y1532-T1536 HydrophobicContact CD1-CG2 3.84Å; Y1532-T1536 HydrophobicContact CE1-CG2 4.15Å; Y1532-T1536 PolarHBondContact O-N 3.04Å; Y1532-T1536 VanDerWaalsContact O-N 3.1Å; Y1532-T1536 PolarHBondContact O-OG1 3.06Å; Y1532-S1538 PolarHBondContact O-OG 3.06Å; Y1532-S1538 VanDerWaalsContact O-OG 3.05Å; Y1532-L1542 HydrophobicContact CG-CD1 4.48Å
1533	T	69	Low	79.6	Confident	61.4 Å²	61.4	51.3 Å²	51.3	38%	0.377	26%	0.26	S	S	.	.	H	α-helix	trans	-60.1	-34.8	169.1	-16	0	0	0	0	112.7	I1529 A1530 T1535 P1539	I1529-T1533 WeakPolarHBondContact O-CG2 3.23Å; I1529-T1533 PolarHBondContact O-N 3.14Å; I1529-T1533 PolarHBondContact O-OG1 3.04Å; I1529-T1533 VanDerWaalsContact O-OG1 3.1Å; A1530-T1533 VanDerWaalsContact O-CB 3.3Å; A1530-T1533 WeakPolarHBondContact O-CB 3.31Å; A1530-T1533 WeakPolarHBondContact O-CG2 3.48Å; A1530-T1533 PolarHBondContact O-N 3.14Å; A1530-T1533 PolarHBondContact O-OG1 3.13Å; T1533-T1535 VanDerWaalsContact C-N 3.3Å; T1533-T1535 PolarHBondContact O-N 3.42Å; T1533-P1539 HydrophobicContact CG2-CB 4.17Å; T1533-P1539 HydrophobicContact CG2-CG 4.22Å; T1533-P1539 VanDerWaalsContact OG1-CB 3.28Å; T1533-P1539 WeakPolarHBondContact OG1-CB 3.3Å
1534	E	61.2	Low	79.7	Confident	166.8 Å²	166.8	44.9 Å²	44.9	78%	0.779	23%	0.232	S	C	*	.	H	α-helix	trans	-71.9	-17.2	177.8	-61.7	-171.3	163.1	0	0	114	A1530 Y1532	A1530-E1534 PolarHBondContact O-N 2.89Å; Y1532-E1534 VanDerWaalsContact C-N 3.34Å; Y1532-E1534 PolarHBondContact O-N 3.31Å
1535	T	60.4	Low	79.8	Confident	39.6 Å²	39.6	44.3 Å²	44.3	24%	0.243	23%	0.23	C	C	.	.	H	α-helix	trans	-113.4	17.1	-169.4	43.7	0	0	0	0	112.8	K1268 K1531 Y1532 T1533 K1537 S1538 P1539	K1268-T1535 VanDerWaalsContact CE-O 3.24Å; K1268-T1535 WeakPolarHBondContact CE-O 3.28Å; K1268-T1535 PolarHBondContact NZ-O 2.92Å; K1531-T1535 PolarHBondContact O-OG1 3Å; Y1532-T1535 WeakPolarHBondContact CD1-OG1 3.46Å; Y1532-T1535 PolarHBondContact O-N 2.93Å; Y1532-T1535 VanDerWaalsContact O-N 3.11Å; Y1532-T1535 PolarHBondContact O-OG1 2.94Å; Y1532-T1535 VanDerWaalsContact O-OG1 3.1Å; T1533-T1535 VanDerWaalsContact C-N 3.3Å; T1533-T1535 PolarHBondContact O-N 3.42Å; T1535-K1537 PolarHBondContact O-N 3.13Å; T1535-S1538 VanDerWaalsContact CB-OG 3.26Å; T1535-S1538 WeakPolarHBondContact CB-OG 3.44Å; T1535-S1538 PolarHBondContact O-N 3.31Å; T1535-S1538 PolarHBondContact O-OG 3.01Å; T1535-S1538 PolarHBondContact OG1-OG 3.13Å; T1535-P1539 WeakPolarHBondContact O-CD 3.38Å
1536	T	57.4	Low	79.9	Confident	72.6 Å²	72.6	44.2 Å²	44.2	45%	0.445	23%	0.229	S	C	.	.	S	Bend	trans	-104.2	120.7	-168.1	58	0	0	0	0	115.1	Y1532 S1538 P1539	Y1532-T1536 HydrophobicContact CD1-CG2 3.84Å; Y1532-T1536 HydrophobicContact CE1-CG2 4.15Å; Y1532-T1536 PolarHBondContact O-N 3.04Å; Y1532-T1536 VanDerWaalsContact O-N 3.1Å; Y1532-T1536 PolarHBondContact O-OG1 3.06Å; T1536-S1538 VanDerWaalsContact C-N 3.29Å; T1536-S1538 WeakPolarHBondContact CB-OG 3.5Å; T1536-S1538 PolarHBondContact O-N 2.96Å; T1536-S1538 VanDerWaalsContact O-N 3.13Å; T1536-S1538 PolarHBondContact OG1-N 3.43Å; T1536-S1538 PolarHBondContact OG1-OG 2.99Å; T1536-P1539 WeakPolarHBondContact O-CD 3.19Å
1537	K	58.2	Low	80.1	Confident	202.2 Å²	202.2	41.1 Å²	41.1	88%	0.879	21%	0.213	S	C	*	.	S	Bend	trans	-107.7	10.8	177.6	-71.5	-167.3	174.1	-173.3	0	114.8	T1535	T1535-K1537 PolarHBondContact O-N 3.13Å
1538	S	66.5	Low	80.5	Confident	30.4 Å²	30.4	39 Å²	39	21%	0.213	20%	0.202	C	C	.	.			trans	-125.8	12.7	-174.9	58.6	0	0	0	0	115.6	Y1532 T1535 T1536 D1540 F1541 L1542	Y1532-S1538 PolarHBondContact O-OG 3.06Å; Y1532-S1538 VanDerWaalsContact O-OG 3.05Å; T1535-S1538 VanDerWaalsContact CB-OG 3.26Å; T1535-S1538 WeakPolarHBondContact CB-OG 3.44Å; T1535-S1538 PolarHBondContact O-N 3.31Å; T1535-S1538 PolarHBondContact O-OG 3.01Å; T1535-S1538 PolarHBondContact OG1-OG 3.13Å; T1536-S1538 VanDerWaalsContact C-N 3.29Å; T1536-S1538 WeakPolarHBondContact CB-OG 3.5Å; T1536-S1538 PolarHBondContact O-N 2.96Å; T1536-S1538 VanDerWaalsContact O-N 3.13Å; T1536-S1538 PolarHBondContact OG1-N 3.43Å; T1536-S1538 PolarHBondContact OG1-OG 2.99Å; S1538-D1540 VanDerWaalsContact C-N 3.28Å; S1538-D1540 PolarHBondContact O-N 3.19Å; S1538-F1541 PolarHBondContact O-N 2.6Å; S1538-L1542 VanDerWaalsContact O-CD1 3.3Å; S1538-L1542 WeakPolarHBondContact O-CD1 3.38Å; S1538-L1542 VanDerWaalsContact O-CG 3.31Å; S1538-L1542 WeakPolarHBondContact O-CG 3.44Å; S1538-L1542 PolarHBondContact O-N 3.07Å
1539	P	80.1	Confident	80.8	Confident	11 Å²	11	39 Å²	39	7%	0.071	20%	0.201	C	C	.	.	H	α-helix	trans	-63.8	-35	176.8	30.6	-36.9	0	0	0	111.4	T1533 T1535 T1536 F1541 L1542 A1543 F1704	T1533-P1539 HydrophobicContact CG2-CB 4.17Å; T1533-P1539 HydrophobicContact CG2-CG 4.22Å; T1533-P1539 VanDerWaalsContact OG1-CB 3.28Å; T1533-P1539 WeakPolarHBondContact OG1-CB 3.3Å; T1535-P1539 WeakPolarHBondContact O-CD 3.38Å; T1536-P1539 WeakPolarHBondContact O-CD 3.19Å; P1539-F1541 VanDerWaalsContact C-N 3.3Å; P1539-F1541 PolarHBondContact O-N 2.97Å; P1539-F1541 VanDerWaalsContact O-N 3.09Å; P1539-L1542 WeakPolarHBondContact O-CA 3.45Å; P1539-L1542 WeakPolarHBondContact O-CB 3.26Å; P1539-L1542 PolarHBondContact O-N 3.04Å; P1539-A1543 WeakPolarHBondContact O-CB 3.43Å; P1539-A1543 PolarHBondContact O-N 3.17Å; P1539-F1704 HydrophobicContact CB-CE1 3.92Å; P1539-F1704 HydrophobicContact CB-CZ 4.21Å; P1539-F1704 HydrophobicContact CG-CE1 4.03Å
1540	D	86.5	Confident	81.1	Confident	51.2 Å²	51.2	38.9 Å²	38.9	27%	0.274	20%	0.201	S	C	.	.	H	α-helix	trans	-44.5	-47.4	176.4	-54	-5.3	0	0	0	113.2	S1538 L1544 F1704 Y1707	S1538-D1540 VanDerWaalsContact C-N 3.28Å; S1538-D1540 PolarHBondContact O-N 3.19Å; D1540-L1544 VanDerWaalsContact O-CB 3.26Å; D1540-L1544 WeakPolarHBondContact O-CB 3.43Å; D1540-L1544 PolarHBondContact O-N 3.18Å; D1540-F1704 WeakPolarHBondContact OD1-CD1 3.11Å; D1540-Y1707 HydrophobicContact CB-CD1 3.82Å; D1540-Y1707 HydrophobicContact CB-CD2 3.78Å; D1540-Y1707 HydrophobicContact CB-CE1 3.77Å; D1540-Y1707 HydrophobicContact CB-CE2 3.72Å; D1540-Y1707 HydrophobicContact CB-CG 3.83Å; D1540-Y1707 WeakPolarHBondContact OD2-CD2 3.42Å
1541	F	88.2	Confident	81.6	Confident	35.6 Å²	35.6	37.3 Å²	37.3	16%	0.156	19%	0.187	C	C	.	.	H	α-helix	trans	-68.2	-42	179.3	179.8	-87.3	0	0	0	112.2	R1283 S1538 P1539 L1544 A1545 A1757 E1760 L1761	R1283-F1541 VanDerWaalsContact CD-CE1 3.47Å; R1283-F1541 HydrophobicContact CG-CD1 4.28Å; R1283-F1541 HydrophobicContact CG-CE1 4.14Å; S1538-F1541 PolarHBondContact O-N 2.6Å; P1539-F1541 VanDerWaalsContact C-N 3.3Å; P1539-F1541 PolarHBondContact O-N 2.97Å; P1539-F1541 VanDerWaalsContact O-N 3.09Å; F1541-L1544 PolarHBondContact O-N 3.07Å; F1541-A1545 WeakPolarHBondContact O-CB 3.35Å; F1541-A1545 PolarHBondContact O-N 3.19Å; F1541-A1757 HydrophobicContact CD2-CB 4.17Å; F1541-A1757 HydrophobicContact CE2-CB 3.85Å; F1541-A1757 HydrophobicContact CZ-CB 4.34Å; F1541-A1757 VanDerWaalsContact CZ-O 3.3Å; F1541-A1757 WeakPolarHBondContact CZ-O 3.26Å; F1541-E1760 HydrophobicContact CE2-CB 4.4Å; F1541-E1760 HydrophobicContact CE2-CG 4.36Å; F1541-E1760 WeakPolarHBondContact CE2-OE2 3.32Å; F1541-E1760 HydrophobicContact CZ-CB 4.26Å; F1541-E1760 HydrophobicContact CZ-CG 4.27Å; F1541-L1761 HydrophobicContact CE1-CB 4.19Å; F1541-L1761 HydrophobicContact CE1-CD1 4.13Å; F1541-L1761 HydrophobicContact CZ-CB 4.26Å
1542	L	89.9	Confident	82.3	Confident	2.4 Å²	2.4	36.7 Å²	36.7	1%	0.013	19%	0.188	C	C	.	.	H	α-helix	trans	-66.1	-43.9	178.5	-92	91.5	0	0	0	110.5	A1282 R1283 L1286 L1528 I1529 Y1532 S1538 P1539 L1544 A1545 T1546	A1282-L1542 HydrophobicContact CB-CD1 4.15Å; A1282-L1542 HydrophobicContact CB-CD2 3.91Å; R1283-L1542 HydrophobicContact CG-CD1 4.25Å; L1286-L1542 HydrophobicContact CB-CD1 3.89Å; L1286-L1542 HydrophobicContact CB-CD2 4.46Å; L1286-L1542 HydrophobicContact CD2-CB 4.1Å; L1286-L1542 HydrophobicContact CD2-CD1 3.54Å; L1286-L1542 HydrophobicContact CD2-CD2 4.45Å; L1286-L1542 HydrophobicContact CD2-CG 3.92Å; L1286-L1542 HydrophobicContact CG-CD1 4.27Å; L1528-L1542 HydrophobicContact CD2-CD2 4.3Å; L1528-L1542 HydrophobicContact CG-CD2 4.18Å; I1529-L1542 HydrophobicContact CG1-CB 4.24Å; I1529-L1542 HydrophobicContact CG1-CD2 3.97Å; I1529-L1542 HydrophobicContact CG1-CG 4.26Å; Y1532-L1542 HydrophobicContact CG-CD1 4.48Å; S1538-L1542 VanDerWaalsContact O-CD1 3.3Å; S1538-L1542 WeakPolarHBondContact O-CD1 3.38Å; S1538-L1542 VanDerWaalsContact O-CG 3.31Å; S1538-L1542 WeakPolarHBondContact O-CG 3.44Å; S1538-L1542 PolarHBondContact O-N 3.07Å; P1539-L1542 WeakPolarHBondContact O-CA 3.45Å; P1539-L1542 WeakPolarHBondContact O-CB 3.26Å; P1539-L1542 PolarHBondContact O-N 3.04Å; L1542-L1544 VanDerWaalsContact C-N 3.32Å; L1542-L1544 PolarHBondContact O-N 3.29Å; L1542-A1545 PolarHBondContact O-N 3.38Å; L1542-T1546 VanDerWaalsContact O-CB 3.26Å; L1542-T1546 WeakPolarHBondContact O-CB 3.36Å; L1542-T1546 PolarHBondContact O-N 3.08Å; L1542-T1546 VanDerWaalsContact O-N 3.13Å; L1542-T1546 PolarHBondContact O-OG1 3.18Å; L1542-T1546 VanDerWaalsContact O-OG1 3.04Å
1543	A	91.4	Very high	83	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.8	-45.4	175	0	0	0	0	0	111.1	I1529 P1539 T1546 V1547 F1704 F1708	I1529-A1543 HydrophobicContact CG2-CB 4.4Å; P1539-A1543 WeakPolarHBondContact O-CB 3.43Å; P1539-A1543 PolarHBondContact O-N 3.17Å; A1543-T1546 WeakPolarHBondContact O-CB 3.25Å; A1543-T1546 PolarHBondContact O-N 3.16Å; A1543-V1547 WeakPolarHBondContact O-CB 3.34Å; A1543-V1547 VanDerWaalsContact O-CG2 3.31Å; A1543-V1547 WeakPolarHBondContact O-CG2 3.35Å; A1543-V1547 PolarHBondContact O-N 3.18Å; A1543-F1704 HydrophobicContact CB-CD1 4.11Å; A1543-F1704 HydrophobicContact CB-CD2 3.68Å; A1543-F1704 HydrophobicContact CB-CE1 4.2Å; A1543-F1704 HydrophobicContact CB-CE2 3.78Å; A1543-F1704 HydrophobicContact CB-CG 3.87Å; A1543-F1704 HydrophobicContact CB-CZ 4.05Å; A1543-F1708 HydrophobicContact CB-CE1 4.49Å; A1543-F1708 HydrophobicContact CB-CZ 3.95Å
1544	L	91.8	Very high	84.2	Confident	6.2 Å²	6.2	33.6 Å²	33.6	3%	0.032	17%	0.169	C	C	.	.	H	α-helix	trans	-62.5	-46.8	179.2	-172.8	65.9	0	0	0	112.9	D1540 F1541 L1542 T1546 V1547 Y1548 Y1707 F1708 T1711 L1712 A1754 A1757	D1540-L1544 VanDerWaalsContact O-CB 3.26Å; D1540-L1544 WeakPolarHBondContact O-CB 3.43Å; D1540-L1544 PolarHBondContact O-N 3.18Å; F1541-L1544 PolarHBondContact O-N 3.07Å; L1542-L1544 VanDerWaalsContact C-N 3.32Å; L1542-L1544 PolarHBondContact O-N 3.29Å; L1544-T1546 VanDerWaalsContact C-N 3.3Å; L1544-T1546 PolarHBondContact O-N 3.18Å; L1544-V1547 PolarHBondContact O-N 3.1Å; L1544-Y1548 PolarHBondContact O-N 3.09Å; L1544-Y1548 VanDerWaalsContact O-N 3.11Å; L1544-Y1707 HydrophobicContact CB-CE1 4.23Å; L1544-Y1707 HydrophobicContact CD1-CE1 4.49Å; L1544-Y1707 HydrophobicContact CD2-CE1 4.22Å; L1544-F1708 HydrophobicContact CB-CE1 4.02Å; L1544-F1708 HydrophobicContact CD1-CD1 4.03Å; L1544-F1708 HydrophobicContact CD1-CE1 3.83Å; L1544-T1711 HydrophobicContact CD1-CG2 4.32Å; L1544-T1711 HydrophobicContact CD2-CG2 4.04Å; L1544-L1712 HydrophobicContact CD1-CD2 4.06Å; L1544-L1712 HydrophobicContact CD1-CG 4.45Å; L1544-A1754 HydrophobicContact CD1-CB 3.59Å; L1544-A1754 HydrophobicContact CG-CB 3.94Å; L1544-A1757 HydrophobicContact CD2-CB 3.8Å; L1544-A1757 HydrophobicContact CG-CB 4.1Å
1545	A	93.1	Very high	85.6	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65.2	-35.4	176.1	0	0	0	0	0	112	L1286 F1541 L1542 Y1548 F1549 A1757 L1761	L1286-A1545 HydrophobicContact CD2-CB 4.39Å; F1541-A1545 WeakPolarHBondContact O-CB 3.35Å; F1541-A1545 PolarHBondContact O-N 3.19Å; L1542-A1545 PolarHBondContact O-N 3.38Å; A1545-Y1548 PolarHBondContact O-N 3.48Å; A1545-F1549 PolarHBondContact O-N 3.07Å; A1545-F1549 VanDerWaalsContact O-N 3.15Å; A1545-A1757 HydrophobicContact CB-CB 4.41Å; A1545-L1761 HydrophobicContact CB-CD2 4.05Å
1546	T	94	Very high	86.9	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-67.1	-44.3	174.2	-57.7	0	0	0	0	111.3	L1525 I1529 L1542 A1543 L1544 Y1548 F1549 L1550 F1696 L1700	L1525-T1546 HydrophobicContact CB-CG2 4.49Å; L1525-T1546 HydrophobicContact CD1-CG2 4.31Å; L1525-T1546 HydrophobicContact CD2-CG2 4.46Å; I1529-T1546 HydrophobicContact CD1-CG2 4.22Å; L1542-T1546 VanDerWaalsContact O-CB 3.26Å; L1542-T1546 WeakPolarHBondContact O-CB 3.36Å; L1542-T1546 PolarHBondContact O-N 3.08Å; L1542-T1546 VanDerWaalsContact O-N 3.13Å; L1542-T1546 PolarHBondContact O-OG1 3.18Å; L1542-T1546 VanDerWaalsContact O-OG1 3.04Å; A1543-T1546 WeakPolarHBondContact O-CB 3.25Å; A1543-T1546 PolarHBondContact O-N 3.16Å; L1544-T1546 VanDerWaalsContact C-N 3.3Å; L1544-T1546 PolarHBondContact O-N 3.18Å; T1546-Y1548 VanDerWaalsContact C-N 3.31Å; T1546-Y1548 PolarHBondContact O-N 3Å; T1546-F1549 WeakPolarHBondContact O-CB 3.45Å; T1546-F1549 PolarHBondContact O-N 3.11Å; T1546-F1549 VanDerWaalsContact O-N 3.13Å; T1546-L1550 HydrophobicContact CG2-CD1 4.08Å; T1546-L1550 HydrophobicContact CG2-CG 4.12Å; T1546-L1550 VanDerWaalsContact O-CG 3.28Å; T1546-L1550 WeakPolarHBondContact O-CG 3.41Å; T1546-L1550 PolarHBondContact O-N 3.13Å; T1546-F1696 HydrophobicContact CG2-CE1 4.29Å; T1546-L1700 HydrophobicContact CG2-CD1 4.01Å
1547	V	93.6	Very high	88.4	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.2	-42.7	175.8	161.3	0	0	0	0	111.6	A1543 L1544 L1550 S1551 L1697 L1700 F1701 F1708 L1750	A1543-V1547 WeakPolarHBondContact O-CB 3.34Å; A1543-V1547 VanDerWaalsContact O-CG2 3.31Å; A1543-V1547 WeakPolarHBondContact O-CG2 3.35Å; A1543-V1547 PolarHBondContact O-N 3.18Å; L1544-V1547 PolarHBondContact O-N 3.1Å; V1547-L1550 PolarHBondContact O-N 3.07Å; V1547-S1551 VanDerWaalsContact O-CB 3.31Å; V1547-S1551 WeakPolarHBondContact O-CB 3.36Å; V1547-S1551 PolarHBondContact O-N 3.03Å; V1547-S1551 PolarHBondContact O-OG 3.32Å; V1547-L1697 HydrophobicContact CB-CD1 4.33Å; V1547-L1697 HydrophobicContact CG1-CD1 4.19Å; V1547-L1697 HydrophobicContact CG2-CD1 3.95Å; V1547-L1700 HydrophobicContact CG2-CB 4.24Å; V1547-L1700 HydrophobicContact CG2-CD1 4.29Å; V1547-F1701 HydrophobicContact CG1-CD1 4.46Å; V1547-F1701 HydrophobicContact CG1-CE1 3.66Å; V1547-F1701 HydrophobicContact CG1-CZ 3.81Å; V1547-F1701 HydrophobicContact CG2-CD1 4.47Å; V1547-F1701 HydrophobicContact CG2-CE1 4.32Å; V1547-F1708 HydrophobicContact CB-CZ 4.4Å; V1547-F1708 HydrophobicContact CG2-CE2 3.86Å; V1547-F1708 HydrophobicContact CG2-CZ 3.65Å; V1547-L1750 HydrophobicContact CG1-CD2 3.8Å
1548	Y	94.7	Very high	89.9	Confident	43.2 Å²	43.2	16.8 Å²	16.8	17%	0.169	9%	0.087	C	C	.	.	H	α-helix	trans	-60.4	-49.7	174.2	-178.6	-103	0	0	0	111.9	L1544 A1545 T1546 L1550 S1551 V1552 Q1751 A1754 G1755 F1758	L1544-Y1548 PolarHBondContact O-N 3.09Å; L1544-Y1548 VanDerWaalsContact O-N 3.11Å; A1545-Y1548 PolarHBondContact O-N 3.48Å; T1546-Y1548 VanDerWaalsContact C-N 3.31Å; T1546-Y1548 PolarHBondContact O-N 3Å; Y1548-L1550 PolarHBondContact O-N 3.27Å; Y1548-S1551 PolarHBondContact O-N 3.11Å; Y1548-V1552 HydrophobicContact CD1-CG2 4.31Å; Y1548-V1552 HydrophobicContact CD2-CG2 4.42Å; Y1548-V1552 HydrophobicContact CE1-CG2 3.9Å; Y1548-V1552 HydrophobicContact CE2-CG2 4Å; Y1548-V1552 WeakPolarHBondContact O-CG2 3.38Å; Y1548-V1552 PolarHBondContact O-N 3.14Å; Y1548-Q1751 PolarHBondContact OH-NE2 3.31Å; Y1548-Q1751 PolarHBondContact OH-OE1 2.91Å; Y1548-A1754 HydrophobicContact CD2-CB 4.33Å; Y1548-A1754 HydrophobicContact CG-CB 4.46Å; Y1548-G1755 VanDerWaalsContact CD2-CA 3.44Å; Y1548-G1755 VanDerWaalsContact CD2-N 3.33Å; Y1548-G1755 VanDerWaalsContact CE2-CA 3.48Å; Y1548-F1758 HydrophobicContact CD1-CB 3.46Å; Y1548-F1758 VanDerWaalsContact CD1-CB 3.43Å; Y1548-F1758 AromaticContact CD1-CD1 3.87Å; Y1548-F1758 HydrophobicContact CD1-CD1 3.95Å; Y1548-F1758 AromaticContact CD1-CD2 3.9Å; Y1548-F1758 HydrophobicContact CD1-CD2 3.95Å; Y1548-F1758 AromaticContact CD1-CG 3.52Å; Y1548-F1758 HydrophobicContact CD1-CG 3.52Å; Y1548-F1758 VanDerWaalsContact CD1-CG 3.47Å; Y1548-F1758 HydrophobicContact CE1-CB 4.08Å; Y1548-F1758 AromaticContact CE1-CD1 3.82Å; Y1548-F1758 HydrophobicContact CE1-CD1 3.92Å; Y1548-F1758 HydrophobicContact CE1-CE1 4.39Å; Y1548-F1758 AromaticContact CE1-CG 3.94Å; Y1548-F1758 HydrophobicContact CE1-CG 3.98Å; Y1548-F1758 HydrophobicContact CG-CB 4.12Å; Y1548-F1758 HydrophobicContact CG-CG 4.46Å
1549	F	95.3	Very high	90.9	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-56.7	-51.4	177.9	167.3	-108.3	0	0	0	112.3	L1221 L1290 A1293 V1294 L1517 L1525 A1545 T1546 S1551 V1552 M1553 F1758	L1221-F1549 HydrophobicContact CD1-CD2 4Å; L1221-F1549 HydrophobicContact CD1-CE2 3.96Å; L1290-F1549 HydrophobicContact CD2-CB 4.05Å; L1290-F1549 HydrophobicContact CD2-CD1 3.25Å; L1290-F1549 HydrophobicContact CD2-CD2 4.06Å; L1290-F1549 HydrophobicContact CD2-CE1 3.59Å; L1290-F1549 HydrophobicContact CD2-CE2 4.35Å; L1290-F1549 HydrophobicContact CD2-CG 3.5Å; L1290-F1549 VanDerWaalsContact CD2-CG 3.48Å; L1290-F1549 HydrophobicContact CD2-CZ 4.13Å; A1293-F1549 HydrophobicContact CB-CE1 4.42Å; A1293-F1549 HydrophobicContact CB-CZ 4.18Å; V1294-F1549 HydrophobicContact CG2-CD2 4.46Å; V1294-F1549 HydrophobicContact CG2-CE2 3.49Å; V1294-F1549 VanDerWaalsContact CG2-CE2 3.44Å; V1294-F1549 HydrophobicContact CG2-CZ 4.08Å; L1517-F1549 HydrophobicContact CD1-CE1 4.13Å; L1517-F1549 HydrophobicContact CD2-CE1 4.23Å; L1517-F1549 HydrophobicContact CD2-CZ 4.18Å; L1525-F1549 HydrophobicContact CD1-CE1 4.42Å; A1545-F1549 PolarHBondContact O-N 3.07Å; A1545-F1549 VanDerWaalsContact O-N 3.15Å; T1546-F1549 WeakPolarHBondContact O-CB 3.45Å; T1546-F1549 PolarHBondContact O-N 3.11Å; T1546-F1549 VanDerWaalsContact O-N 3.13Å; F1549-S1551 VanDerWaalsContact C-N 3.3Å; F1549-S1551 PolarHBondContact O-N 3.16Å; F1549-V1552 PolarHBondContact O-N 3.12Å; F1549-M1553 HydrophobicContact CD2-CG 3.9Å; F1549-M1553 HydrophobicContact CE1-CG 4.44Å; F1549-M1553 HydrophobicContact CE2-CG 3.47Å; F1549-M1553 VanDerWaalsContact CE2-CG 3.44Å; F1549-M1553 HydrophobicContact CE2-SD 4.09Å; F1549-M1553 HydrophobicContact CG-CG 4.48Å; F1549-M1553 HydrophobicContact CZ-CG 3.84Å; F1549-M1553 WeakPolarHBondContact O-CB 3.4Å; F1549-M1553 VanDerWaalsContact O-CG 3.27Å; F1549-M1553 WeakPolarHBondContact O-CG 3.28Å; F1549-M1553 PolarHBondContact O-N 3.09Å; F1549-M1553 VanDerWaalsContact O-N 3.07Å; F1549-F1758 HydrophobicContact CB-CD2 4.33Å; F1549-F1758 HydrophobicContact CB-CE2 4.03Å; F1549-F1758 HydrophobicContact CD2-CE2 4.47Å
1550	L	94.6	Very high	91	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-58.8	-43.1	178.5	-64.6	-178.2	0	0	0	111.1	L1517 T1546 V1547 Y1548 M1553 M1554 T1693 F1696 L1697 L1700	L1517-L1550 HydrophobicContact CD1-CD2 3.45Å; L1517-L1550 VanDerWaalsContact CD1-CD2 3.45Å; T1546-L1550 HydrophobicContact CG2-CD1 4.08Å; T1546-L1550 HydrophobicContact CG2-CG 4.12Å; T1546-L1550 VanDerWaalsContact O-CG 3.28Å; T1546-L1550 WeakPolarHBondContact O-CG 3.41Å; T1546-L1550 PolarHBondContact O-N 3.13Å; V1547-L1550 PolarHBondContact O-N 3.07Å; Y1548-L1550 PolarHBondContact O-N 3.27Å; L1550-M1553 PolarHBondContact O-N 3.12Å; L1550-M1554 WeakPolarHBondContact O-CB 3.29Å; L1550-M1554 VanDerWaalsContact O-CG 3.28Å; L1550-M1554 WeakPolarHBondContact O-CG 3.36Å; L1550-M1554 PolarHBondContact O-N 3.16Å; L1550-T1693 HydrophobicContact CD2-CG2 3.87Å; L1550-F1696 HydrophobicContact CD1-CD1 3.69Å; L1550-F1696 HydrophobicContact CD1-CE1 3.88Å; L1550-F1696 HydrophobicContact CD1-CG 4.49Å; L1550-F1696 HydrophobicContact CD2-CD1 4.39Å; L1550-F1696 HydrophobicContact CD2-CE1 4.49Å; L1550-L1697 HydrophobicContact CB-CD1 4.19Å; L1550-L1697 HydrophobicContact CB-CD2 4.47Å; L1550-L1697 HydrophobicContact CD1-CB 4.18Å; L1550-L1697 HydrophobicContact CD1-CD1 4.13Å; L1550-L1700 HydrophobicContact CD1-CD1 3.88Å
1551	S	93.1	Very high	90.8	Very high	7.2 Å²	7.2	18.9 Å²	18.9	5%	0.05	9%	0.09	C	C	.	.	H	α-helix	trans	-61.9	-48.1	179.8	-57.5	0	0	0	0	112.2	V1547 Y1548 F1549 M1553 M1554 V1555 L1741	V1547-S1551 VanDerWaalsContact O-CB 3.31Å; V1547-S1551 WeakPolarHBondContact O-CB 3.36Å; V1547-S1551 PolarHBondContact O-N 3.03Å; V1547-S1551 PolarHBondContact O-OG 3.32Å; Y1548-S1551 PolarHBondContact O-N 3.11Å; F1549-S1551 VanDerWaalsContact C-N 3.3Å; F1549-S1551 PolarHBondContact O-N 3.16Å; S1551-M1553 VanDerWaalsContact C-N 3.34Å; S1551-M1553 PolarHBondContact O-N 3.31Å; S1551-M1554 PolarHBondContact O-N 3.15Å; S1551-V1555 WeakPolarHBondContact O-CB 3.34Å; S1551-V1555 VanDerWaalsContact O-CG2 3.29Å; S1551-V1555 WeakPolarHBondContact O-CG2 3.28Å; S1551-V1555 PolarHBondContact O-N 3.04Å; S1551-L1741 WeakPolarHBondContact OG-CD2 3.3Å
1552	V	92.7	Very high	90.6	Very high	35.6 Å²	35.6	21 Å²	21	22%	0.216	10%	0.103	C	C	.	.	H	α-helix	trans	-60.6	-44.3	177.7	170.7	0	0	0	0	111.1	L1221 Y1548 F1549 S1556	L1221-V1552 HydrophobicContact CD1-CG1 4.39Å; Y1548-V1552 HydrophobicContact CD1-CG2 4.31Å; Y1548-V1552 HydrophobicContact CD2-CG2 4.42Å; Y1548-V1552 HydrophobicContact CE1-CG2 3.9Å; Y1548-V1552 HydrophobicContact CE2-CG2 4Å; Y1548-V1552 WeakPolarHBondContact O-CG2 3.38Å; Y1548-V1552 PolarHBondContact O-N 3.14Å; F1549-V1552 PolarHBondContact O-N 3.12Å; V1552-S1556 VanDerWaalsContact O-CB 3.27Å; V1552-S1556 WeakPolarHBondContact O-CB 3.36Å; V1552-S1556 PolarHBondContact O-N 3.04Å; V1552-S1556 VanDerWaalsContact O-N 3.08Å; V1552-S1556 PolarHBondContact O-OG 3Å
1553	M	92.3	Very high	90	Very high	2.4 Å²	2.4	26.3 Å²	26.3	1%	0.012	13%	0.131	C	C	.	.	H	α-helix	trans	-68.8	-41.6	-179.3	-67	-59.5	-67.5	0	0	112.4	L1221 A1224 C1297 L1516 F1549 L1550 S1551 S1556 K1557	L1221-M1553 HydrophobicContact CD1-CG 4.17Å; L1221-M1553 HydrophobicContact CD1-SD 3.46Å; L1221-M1553 WeakPolarHBondContact CD1-SD 3.36Å; A1224-M1553 HydrophobicContact CB-CE 4.11Å; A1224-M1553 HydrophobicContact CB-SD 4.25Å; C1297-M1553 HydrophobicContact CB-CE 3.64Å; C1297-M1553 WeakPolarHBondContact SG-CE 3.33Å; L1516-M1553 HydrophobicContact CD1-CB 4.18Å; L1516-M1553 HydrophobicContact CD1-CE 4.11Å; L1516-M1553 HydrophobicContact CD2-CB 4.03Å; L1516-M1553 HydrophobicContact CG-CB 4.39Å; F1549-M1553 HydrophobicContact CD2-CG 3.9Å; F1549-M1553 HydrophobicContact CE1-CG 4.44Å; F1549-M1553 HydrophobicContact CE2-CG 3.47Å; F1549-M1553 VanDerWaalsContact CE2-CG 3.44Å; F1549-M1553 HydrophobicContact CE2-SD 4.09Å; F1549-M1553 HydrophobicContact CG-CG 4.48Å; F1549-M1553 HydrophobicContact CZ-CG 3.84Å; F1549-M1553 WeakPolarHBondContact O-CB 3.4Å; F1549-M1553 VanDerWaalsContact O-CG 3.27Å; F1549-M1553 WeakPolarHBondContact O-CG 3.28Å; F1549-M1553 PolarHBondContact O-N 3.09Å; F1549-M1553 VanDerWaalsContact O-N 3.07Å; L1550-M1553 PolarHBondContact O-N 3.12Å; S1551-M1553 VanDerWaalsContact C-N 3.34Å; S1551-M1553 PolarHBondContact O-N 3.31Å; M1553-S1556 PolarHBondContact O-N 3.19Å; M1553-K1557 WeakPolarHBondContact O-CB 3.37Å; M1553-K1557 PolarHBondContact O-N 3.01Å
1554	M	92.4	Very high	88.9	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65.3	-46.4	177.3	-74.7	-176.5	70.4	0	0	112	L1516 L1550 S1551 S1556 K1557 Y1558 L1690 T1693 L1697 V1734 L1737 V1738 L1741	L1516-M1554 HydrophobicContact CD2-CB 4.29Å; L1516-M1554 HydrophobicContact CD2-CG 3.69Å; L1550-M1554 WeakPolarHBondContact O-CB 3.29Å; L1550-M1554 VanDerWaalsContact O-CG 3.28Å; L1550-M1554 WeakPolarHBondContact O-CG 3.36Å; L1550-M1554 PolarHBondContact O-N 3.16Å; S1551-M1554 PolarHBondContact O-N 3.15Å; M1554-S1556 VanDerWaalsContact C-N 3.33Å; M1554-S1556 PolarHBondContact O-N 3.13Å; M1554-K1557 PolarHBondContact O-N 3.22Å; M1554-Y1558 VanDerWaalsContact O-CB 3.26Å; M1554-Y1558 WeakPolarHBondContact O-CB 3.42Å; M1554-Y1558 PolarHBondContact O-N 3.3Å; M1554-L1690 HydrophobicContact CB-CD2 4.4Å; M1554-L1690 HydrophobicContact CE-CB 4.35Å; M1554-L1690 HydrophobicContact CG-CD2 4.28Å; M1554-T1693 HydrophobicContact CG-CG2 3.84Å; M1554-T1693 HydrophobicContact SD-CG2 3.96Å; M1554-L1697 HydrophobicContact SD-CB 4.37Å; M1554-L1697 HydrophobicContact SD-CD2 3.65Å; M1554-V1734 HydrophobicContact CE-CG1 3.67Å; M1554-V1734 HydrophobicContact CE-CG2 4.27Å; M1554-L1737 HydrophobicContact CE-CD2 4.2Å; M1554-L1737 HydrophobicContact CE-CG 4.46Å; M1554-V1738 HydrophobicContact CB-CG2 4.43Å; M1554-V1738 HydrophobicContact CE-CG2 3.94Å; M1554-L1741 HydrophobicContact CB-CD1 4.42Å; M1554-L1741 HydrophobicContact SD-CD1 4.42Å
1555	V	91.1	Very high	87.4	Confident	37.4 Å²	37.4	31.6 Å²	31.6	23%	0.227	16%	0.164	C	C	.	.	H	α-helix	trans	-63.1	-40.3	177.5	172.1	0	0	0	0	111.1	S1551 Y1558 R1559 V1738 L1741	S1551-V1555 WeakPolarHBondContact O-CB 3.34Å; S1551-V1555 VanDerWaalsContact O-CG2 3.29Å; S1551-V1555 WeakPolarHBondContact O-CG2 3.28Å; S1551-V1555 PolarHBondContact O-N 3.04Å; V1555-Y1558 PolarHBondContact O-N 3.36Å; V1555-R1559 WeakPolarHBondContact O-CB 3.37Å; V1555-R1559 PolarHBondContact O-N 3.04Å; V1555-R1559 VanDerWaalsContact O-N 3.09Å; V1555-V1738 HydrophobicContact CG2-CG1 4.27Å; V1555-L1741 HydrophobicContact CG2-CB 3.93Å; V1555-L1741 HydrophobicContact CG2-CD1 4.49Å
1556	S	88.9	Confident	85.6	Confident	6.2 Å²	6.2	36.3 Å²	36.3	4%	0.043	19%	0.194	C	C	.	.	H	α-helix	trans	-62.8	-52.1	175.3	-158.2	0	0	0	0	112	S1225 V1552 M1553 M1554 Y1558 R1559 D1560	S1225-S1556 VanDerWaalsContact CA-OG 3.32Å; S1225-S1556 WeakPolarHBondContact CA-OG 3.33Å; S1225-S1556 WeakPolarHBondContact CB-OG 3.4Å; S1225-S1556 PolarHBondContact O-OG 3.14Å; V1552-S1556 VanDerWaalsContact O-CB 3.27Å; V1552-S1556 WeakPolarHBondContact O-CB 3.36Å; V1552-S1556 PolarHBondContact O-N 3.04Å; V1552-S1556 VanDerWaalsContact O-N 3.08Å; V1552-S1556 PolarHBondContact O-OG 3Å; M1553-S1556 PolarHBondContact O-N 3.19Å; M1554-S1556 VanDerWaalsContact C-N 3.33Å; M1554-S1556 PolarHBondContact O-N 3.13Å; S1556-Y1558 VanDerWaalsContact C-N 3.33Å; S1556-Y1558 PolarHBondContact O-N 3.12Å; S1556-R1559 CarbonylContact O-C 3.57Å; S1556-R1559 WeakPolarHBondContact O-CA 3.34Å; S1556-R1559 WeakPolarHBondContact O-CB 3.4Å; S1556-R1559 PolarHBondContact O-N 3.18Å; S1556-R1559 PolarHBondContact OG-NH2 3.17Å; S1556-R1559 VanDerWaalsContact OG-NH2 3.09Å; S1556-D1560 WeakPolarHBondContact O-CB 3.3Å; S1556-D1560 VanDerWaalsContact O-CG 3.27Å; S1556-D1560 PolarHBondContact O-N 3.09Å; S1556-D1560 PolarHBondContact OG-OD2 3.01Å
1557	K	88	Confident	83.9	Confident	43.2 Å²	43.2	38.3 Å²	38.3	19%	0.188	20%	0.204	C	C	.	.	H	α-helix	trans	-64	-35	-178.5	176.2	70.5	172.8	-166.4	0	112.2	E1514 L1516 M1553 M1554 D1560 V1561 C1689 L1690	E1514-K1557 VanDerWaalsContact O-CE 3.26Å; E1514-K1557 WeakPolarHBondContact O-CE 3.29Å; E1514-K1557 PolarHBondContact O-NZ 3.01Å; L1516-K1557 HydrophobicContact CB-CG 4.38Å; L1516-K1557 HydrophobicContact CD1-CB 3.75Å; L1516-K1557 HydrophobicContact CD1-CD 4.45Å; L1516-K1557 HydrophobicContact CD1-CG 4.08Å; L1516-K1557 HydrophobicContact CD2-CB 4.27Å; L1516-K1557 HydrophobicContact CG-CB 4.47Å; M1553-K1557 WeakPolarHBondContact O-CB 3.37Å; M1553-K1557 PolarHBondContact O-N 3.01Å; M1554-K1557 PolarHBondContact O-N 3.22Å; K1557-D1560 PolarHBondContact O-N 3.13Å; K1557-V1561 HydrophobicContact CD-CG2 4.45Å; K1557-V1561 WeakPolarHBondContact O-CB 3.33Å; K1557-V1561 VanDerWaalsContact O-CG2 3.27Å; K1557-V1561 WeakPolarHBondContact O-CG2 3.4Å; K1557-V1561 PolarHBondContact O-N 3.06Å; K1557-V1561 VanDerWaalsContact O-N 3.11Å; K1557-C1689 VanDerWaalsContact CE-CB 3.47Å; K1557-C1689 VanDerWaalsContact CE-SG 3.54Å; K1557-C1689 WeakPolarHBondContact CE-SG 3.46Å; K1557-C1689 HydrophobicContact CG-CB 4.5Å; K1557-L1690 HydrophobicContact CB-CD2 3.92Å; K1557-L1690 HydrophobicContact CG-CD2 3.67Å; K1557-L1690 HydrophobicContact CG-CG 4.37Å
1558	Y	89.8	Confident	82.2	Confident	39.8 Å²	39.8	39.7 Å²	39.7	16%	0.156	21%	0.21	C	C	.	.	H	α-helix	trans	-62.3	-49.4	172	-179.8	-96.5	0	0	0	111.7	M1554 V1555 S1556 D1560 V1561 L1562 L1686 L1690 V1735 V1738	M1554-Y1558 VanDerWaalsContact O-CB 3.26Å; M1554-Y1558 WeakPolarHBondContact O-CB 3.42Å; M1554-Y1558 PolarHBondContact O-N 3.3Å; V1555-Y1558 PolarHBondContact O-N 3.36Å; S1556-Y1558 VanDerWaalsContact C-N 3.33Å; S1556-Y1558 PolarHBondContact O-N 3.12Å; Y1558-D1560 VanDerWaalsContact C-N 3.34Å; Y1558-D1560 PolarHBondContact O-N 3.05Å; Y1558-V1561 PolarHBondContact O-N 3.28Å; Y1558-L1562 HydrophobicContact CD1-CD1 3.95Å; Y1558-L1562 HydrophobicContact CD1-CG 4.45Å; Y1558-L1562 HydrophobicContact CE1-CD1 3.36Å; Y1558-L1562 VanDerWaalsContact CE1-CD1 3.43Å; Y1558-L1562 HydrophobicContact CE1-CG 4.22Å; Y1558-L1562 HydrophobicContact CE2-CD1 4.46Å; Y1558-L1562 WeakPolarHBondContact O-CG 3.39Å; Y1558-L1562 PolarHBondContact O-N 3.2Å; Y1558-L1686 HydrophobicContact CD2-CD1 4.15Å; Y1558-L1686 HydrophobicContact CD2-CD2 3.75Å; Y1558-L1686 HydrophobicContact CE2-CD1 3.87Å; Y1558-L1686 HydrophobicContact CE2-CD2 4.33Å; Y1558-L1690 HydrophobicContact CD2-CD1 4.3Å; Y1558-V1735 HydrophobicContact CE2-CB 4.47Å; Y1558-V1735 HydrophobicContact CE2-CG1 4.18Å; Y1558-V1735 HydrophobicContact CE2-CG2 4.47Å; Y1558-V1738 HydrophobicContact CD1-CB 4.46Å; Y1558-V1738 HydrophobicContact CD1-CG1 3.73Å; Y1558-V1738 HydrophobicContact CD2-CB 4.09Å; Y1558-V1738 HydrophobicContact CD2-CG1 3.91Å; Y1558-V1738 HydrophobicContact CD2-CG2 4.25Å; Y1558-V1738 HydrophobicContact CE1-CG1 4.29Å; Y1558-V1738 HydrophobicContact CE2-CB 4.4Å; Y1558-V1738 HydrophobicContact CE2-CG1 4.42Å; Y1558-V1738 HydrophobicContact CG-CB 4.21Å; Y1558-V1738 HydrophobicContact CG-CG1 3.52Å; Y1558-V1738 VanDerWaalsContact CG-CG1 3.47Å; Y1558-V1738 HydrophobicContact CG-CG2 4.34Å
1559	R	87	Confident	80.2	Confident	79.6 Å²	79.6	41.3 Å²	41.3	30%	0.3	22%	0.221	S	C	.	.	H	α-helix	trans	-57	-46.6	173.5	-179.2	-160	67	-141.8	-6.1	111.6	S1225 S1226 V1555 S1556 V1561 L1562 D1563	S1225-R1559 PolarHBondContact O-NH1 3.08Å; S1225-R1559 PolarHBondContact O-NH2 3.31Å; S1226-R1559 PolarHBondContact O-NH2 3.14Å; V1555-R1559 WeakPolarHBondContact O-CB 3.37Å; V1555-R1559 PolarHBondContact O-N 3.04Å; V1555-R1559 VanDerWaalsContact O-N 3.09Å; S1556-R1559 CarbonylContact O-C 3.57Å; S1556-R1559 WeakPolarHBondContact O-CA 3.34Å; S1556-R1559 WeakPolarHBondContact O-CB 3.4Å; S1556-R1559 PolarHBondContact O-N 3.18Å; S1556-R1559 PolarHBondContact OG-NH2 3.17Å; S1556-R1559 VanDerWaalsContact OG-NH2 3.09Å; R1559-V1561 PolarHBondContact O-N 3.09Å; R1559-L1562 PolarHBondContact O-N 3.17Å; R1559-L1562 VanDerWaalsContact O-N 3.14Å; R1559-D1563 PolarHBondContact O-N 3.16Å
1560	D	82.2	Confident	77.8	Confident	30.6 Å²	30.6	44.5 Å²	44.5	16%	0.164	24%	0.242	C	C	.	.	H	α-helix	trans	-68.5	-18.6	-178.3	-62.3	-36.8	0	0	0	113.4	R1301 S1556 K1557 Y1558 D1563	R1301-D1560 IonicContact CZ-OD1 2.89Å; R1301-D1560 IonicContact CZ-OD2 2.89Å; R1301-D1560 IonicContact NE-OD2 2.68Å; R1301-D1560 VanDerWaalsContact NH1-CG 3.34Å; R1301-D1560 IonicContact NH1-OD1 3.07Å; R1301-D1560 PolarHBondContact NH1-OD1 3.32Å; R1301-D1560 IonicContact NH1-OD2 3.53Å; R1301-D1560 PolarHBondContact NH1-OD2 3.06Å; R1301-D1560 VanDerWaalsContact NH2-CG 3.27Å; R1301-D1560 IonicContact NH2-OD1 3.24Å; R1301-D1560 PolarHBondContact NH2-OD1 2.85Å; R1301-D1560 IonicContact NH2-OD2 3.56Å; R1301-D1560 PolarHBondContact NH2-OD2 3.08Å; S1556-D1560 WeakPolarHBondContact O-CB 3.3Å; S1556-D1560 VanDerWaalsContact O-CG 3.27Å; S1556-D1560 PolarHBondContact O-N 3.09Å; S1556-D1560 PolarHBondContact OG-OD2 3.01Å; K1557-D1560 PolarHBondContact O-N 3.13Å; Y1558-D1560 VanDerWaalsContact C-N 3.34Å; Y1558-D1560 PolarHBondContact O-N 3.05Å; D1560-D1563 CarbonylContact O-C 3.43Å
1561	V	83.4	Confident	75.2	Confident	27.2 Å²	27.2	53.5 Å²	53.5	17%	0.165	28%	0.277	C	S	.	.	H	α-helix	trans	-87.1	-35.2	172.7	167.1	0	0	0	0	111.8	K1557 Y1558 R1559 L1682 L1685 L1686	K1557-V1561 HydrophobicContact CD-CG2 4.45Å; K1557-V1561 WeakPolarHBondContact O-CB 3.33Å; K1557-V1561 VanDerWaalsContact O-CG2 3.27Å; K1557-V1561 WeakPolarHBondContact O-CG2 3.4Å; K1557-V1561 PolarHBondContact O-N 3.06Å; K1557-V1561 VanDerWaalsContact O-N 3.11Å; Y1558-V1561 PolarHBondContact O-N 3.28Å; R1559-V1561 PolarHBondContact O-N 3.09Å; V1561-L1682 HydrophobicContact CG1-CD1 3.72Å; V1561-L1685 HydrophobicContact CB-CD2 4.37Å; V1561-L1685 HydrophobicContact CG1-CD2 3.84Å; V1561-L1685 HydrophobicContact CG1-CG 4.36Å; V1561-L1685 HydrophobicContact CG2-CD2 3.83Å; V1561-L1686 HydrophobicContact CB-CD2 3.86Å; V1561-L1686 HydrophobicContact CG1-CD2 3.56Å; V1561-L1686 HydrophobicContact CG1-CG 3.92Å; V1561-L1686 HydrophobicContact CG2-CD2 4.36Å
1562	L	83	Confident	72.4	Confident	80.2 Å²	80.2	56.8 Å²	56.8	42%	0.42	30%	0.304	S	S	.	.	H	α-helix	trans	-73.3	-44.4	174.4	-68.7	-175	0	0	0	112.6	Y1558 R1559 P1564 L1682 L1686	Y1558-L1562 HydrophobicContact CD1-CD1 3.95Å; Y1558-L1562 HydrophobicContact CD1-CG 4.45Å; Y1558-L1562 HydrophobicContact CE1-CD1 3.36Å; Y1558-L1562 VanDerWaalsContact CE1-CD1 3.43Å; Y1558-L1562 HydrophobicContact CE1-CG 4.22Å; Y1558-L1562 HydrophobicContact CE2-CD1 4.46Å; Y1558-L1562 WeakPolarHBondContact O-CG 3.39Å; Y1558-L1562 PolarHBondContact O-N 3.2Å; R1559-L1562 PolarHBondContact O-N 3.17Å; R1559-L1562 VanDerWaalsContact O-N 3.14Å; L1562-P1564 VanDerWaalsContact C-CD 3.43Å; L1562-P1564 VanDerWaalsContact O-CD 3.25Å; L1562-P1564 WeakPolarHBondContact O-CD 3.36Å; L1562-L1682 HydrophobicContact CD2-CD1 4.48Å; L1562-L1682 HydrophobicContact CD2-CD2 3.98Å; L1562-L1686 HydrophobicContact CD2-CD1 4.39Å
1563	D	77.4	Confident	69.3	Low	113 Å²	113	62.2 Å²	62.2	60%	0.604	33%	0.332	S	S	*	.	S	Bend	trans	-116.9	81.6	-178.9	-105.6	-24.7	0	0	0	109.6	R1559 D1560 N1565	R1559-D1563 PolarHBondContact O-N 3.16Å; D1560-D1563 CarbonylContact O-C 3.43Å; D1563-N1565 VanDerWaalsContact C-N 3.31Å; D1563-N1565 PolarHBondContact O-N 3.23Å; D1563-N1565 PolarHBondContact O-ND2 3.15Å; D1563-N1565 VanDerWaalsContact O-ND2 3.13Å
1564	P	67.7	Low	66.4	Low	81 Å²	81	67.9 Å²	67.9	53%	0.526	37%	0.367	S	S	.	.			trans	-68.3	88.1	-179.1	28	-35	0	0	0	110.6	L1562 L1569	L1562-P1564 VanDerWaalsContact C-CD 3.43Å; L1562-P1564 VanDerWaalsContact O-CD 3.25Å; L1562-P1564 WeakPolarHBondContact O-CD 3.36Å; P1564-L1569 HydrophobicContact CB-CD1 4.31Å
1565	N	61.2	Low	63.3	Low	37 Å²	37	74.6 Å²	74.6	20%	0.198	40%	0.403	C	S	.	.			trans	-53.4	127.8	-170.4	-148.9	-18.7	0	0	0	112.1	S1227 D1563 I1567 W1568	S1227-N1565 VanDerWaalsContact O-CG 3.29Å; S1227-N1565 PolarHBondContact O-ND2 3.35Å; S1227-N1565 PolarHBondContact O-OD1 2.85Å; D1563-N1565 VanDerWaalsContact C-N 3.31Å; D1563-N1565 PolarHBondContact O-N 3.23Å; D1563-N1565 PolarHBondContact O-ND2 3.15Å; D1563-N1565 VanDerWaalsContact O-ND2 3.13Å; N1565-I1567 WeakPolarHBondContact ND2-CD1 3.39Å; N1565-I1567 PolarHBondContact O-N 3.03Å; N1565-I1567 VanDerWaalsContact O-N 3.09Å; N1565-I1567 WeakPolarHBondContact OD1-CG1 3.46Å; N1565-I1567 PolarHBondContact OD1-N 3.37Å; N1565-W1568 VanDerWaalsContact CB-CD1 3.49Å; N1565-W1568 VanDerWaalsContact O-CD1 3.26Å; N1565-W1568 PolarHBondContact O-N 3.23Å
1566	P	55.4	Low	60.3	Low	97.8 Å²	97.8	81.6 Å²	81.6	64%	0.635	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-61.2	-17.1	-172	21.5	-34.6	0	0	0	115.2	W1568 L1569	P1566-W1568 PolarHBondContact O-N 3.24Å; P1566-W1568 VanDerWaalsContact O-N 3.12Å; P1566-L1569 HydrophobicContact CB-CD1 4.15Å; P1566-L1569 CarbonylContact O-C 3.52Å; P1566-L1569 WeakPolarHBondContact O-CB 3.32Å; P1566-L1569 PolarHBondContact O-N 3.22Å
1567	I	58.1	Low	57.4	Low	42.8 Å²	42.8	87.6 Å²	87.6	22%	0.219	47%	0.469	C	S	.	.	G	3₁₀ helix	trans	-52	-30.4	170.4	-61.9	171.9	0	0	0	111.8	L1305 H1475 L1476 N1565	L1305-I1567 HydrophobicContact CD1-CG2 3.89Å; H1475-I1567 PolarHBondContact NE2-O 3.01Å; H1475-I1567 VanDerWaalsContact NE2-O 3.15Å; L1476-I1567 HydrophobicContact CD2-CG2 3.81Å; N1565-I1567 WeakPolarHBondContact ND2-CD1 3.39Å; N1565-I1567 PolarHBondContact O-N 3.03Å; N1565-I1567 VanDerWaalsContact O-N 3.09Å; N1565-I1567 WeakPolarHBondContact OD1-CG1 3.46Å; N1565-I1567 PolarHBondContact OD1-N 3.37Å
1568	W	57.6	Low	54.5	Low	30.2 Å²	30.2	91.2 Å²	91.2	11%	0.114	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-96.3	-4.3	-178.9	-46.6	110.8	0	0	0	114.1	R1301 L1302 R1304 L1305 L1476 F1480 N1565 P1566 P1570 Y1571	R1301-W1568 WeakPolarHBondContact O-CH2 3.46Å; R1301-W1568 WeakPolarHBondContact O-CZ2 3.26Å; L1302-W1568 HydrophobicContact CD2-CE3 3.85Å; L1302-W1568 HydrophobicContact CD2-CH2 4.36Å; L1302-W1568 HydrophobicContact CD2-CZ3 3.47Å; L1302-W1568 VanDerWaalsContact CD2-CZ3 3.45Å; R1304-W1568 HydrophobicContact CB-CE3 4.25Å; R1304-W1568 HydrophobicContact CB-CH2 4.22Å; R1304-W1568 HydrophobicContact CB-CZ3 3.51Å; R1304-W1568 HydrophobicContact CG-CZ3 4.38Å; L1305-W1568 HydrophobicContact CD1-CE3 3.6Å; L1305-W1568 HydrophobicContact CD1-CH2 4.21Å; L1305-W1568 HydrophobicContact CD1-CZ3 3.97Å; L1305-W1568 HydrophobicContact CD2-CZ3 4.46Å; L1305-W1568 HydrophobicContact CG-CH2 4.14Å; L1305-W1568 HydrophobicContact CG-CZ3 3.71Å; L1476-W1568 HydrophobicContact CD2-CH2 4.28Å; L1476-W1568 HydrophobicContact CD2-CZ3 4.14Å; F1480-W1568 HydrophobicContact CD2-CH2 4.37Å; F1480-W1568 AromaticContact CE1-CH2 3.91Å; F1480-W1568 HydrophobicContact CE1-CH2 4.08Å; F1480-W1568 AromaticContact CE1-CZ3 3.83Å; F1480-W1568 HydrophobicContact CE1-CZ3 3.96Å; F1480-W1568 AromaticContact CE2-CH2 3.69Å; F1480-W1568 HydrophobicContact CE2-CH2 3.82Å; F1480-W1568 HydrophobicContact CE2-CZ3 4.31Å; F1480-W1568 AromaticContact CZ-CH2 3.48Å; F1480-W1568 HydrophobicContact CZ-CH2 3.48Å; F1480-W1568 VanDerWaalsContact CZ-CH2 3.48Å; F1480-W1568 AromaticContact CZ-CZ3 3.63Å; F1480-W1568 HydrophobicContact CZ-CZ3 3.76Å; N1565-W1568 VanDerWaalsContact CB-CD1 3.49Å; N1565-W1568 VanDerWaalsContact O-CD1 3.26Å; N1565-W1568 PolarHBondContact O-N 3.23Å; P1566-W1568 PolarHBondContact O-N 3.24Å; P1566-W1568 VanDerWaalsContact O-N 3.12Å; W1568-P1570 VanDerWaalsContact C-CD 3.49Å; W1568-Y1571 PolarHBondContact O-N 3.28Å
1569	L	52.9	Low	51.6	Low	76.2 Å²	76.2	94.2 Å²	94.2	40%	0.399	53%	0.526	S	S	.	.			trans	-117.7	61.3	-176.1	-87	104.4	0	0	0	112.8	P1564 P1566 Y1571 A1572	P1564-L1569 HydrophobicContact CB-CD1 4.31Å; P1566-L1569 HydrophobicContact CB-CD1 4.15Å; P1566-L1569 CarbonylContact O-C 3.52Å; P1566-L1569 WeakPolarHBondContact O-CB 3.32Å; P1566-L1569 PolarHBondContact O-N 3.22Å; L1569-Y1571 PolarHBondContact O-N 3.18Å; L1569-Y1571 VanDerWaalsContact O-N 3.15Å; L1569-A1572 HydrophobicContact CB-CB 4.22Å; L1569-A1572 HydrophobicContact CD2-CB 4.18Å
1570	P	44.3	Very low	48.8	Very low	67.4 Å²	67.4	99 Å²	99	44%	0.438	55%	0.549	S	S	.	.			trans	-64.7	75.8	173.4	-1.8	7.7	0	0	0	112.5	L1305 K1472 W1568 A1572	L1305-P1570 HydrophobicContact CD2-CG 4Å; K1472-P1570 HydrophobicContact CG-CG 4.49Å; W1568-P1570 VanDerWaalsContact C-CD 3.49Å; P1570-A1572 PolarHBondContact O-N 2.98Å
1571	Y	41.3	Very low	46.2	Very low	189.2 Å²	189.2	104 Å²	104	74%	0.742	58%	0.576	S	S	*	*			trans	66.5	60.5	179.7	-63.2	-80.3	0	0	0	115.8	K1472 W1568 L1569 V1574	K1472-Y1571 HydrophobicContact CG-CE1 4.28Å; K1472-Y1571 WeakPolarHBondContact CG-OH 3.5Å; W1568-Y1571 PolarHBondContact O-N 3.28Å; L1569-Y1571 PolarHBondContact O-N 3.18Å; L1569-Y1571 VanDerWaalsContact O-N 3.15Å; Y1571-V1574 HydrophobicContact CD1-CG2 3.8Å; Y1571-V1574 HydrophobicContact CE1-CG2 4.31Å
1572	A	33.4	Very low	43.6	Very low	76 Å²	76	110 Å²	110	63%	0.628	61%	0.607	S	S	*	*	S	Bend	trans	-100.8	25.9	165.7	0	0	0	0	0	112.6	L1569 P1570	L1569-A1572 HydrophobicContact CB-CB 4.22Å; L1569-A1572 HydrophobicContact CD2-CB 4.18Å; P1570-A1572 PolarHBondContact O-N 2.98Å
1573	N	28.6	Very low	40.9	Very low	149.6 Å²	149.6	115.1 Å²	115.1	80%	0.8	63%	0.626	S	S	*	*			trans	-154.8	79.7	174.8	-84.1	-13.8	0	0	0	113
1574	V	30.1	Very low	38.7	Very low	122 Å²	122	114.6 Å²	114.6	74%	0.739	63%	0.627	S	S	*	*			trans	-124.6	74.2	157.4	-173.1	0	0	0	0	107.9	Y1571	Y1571-V1574 HydrophobicContact CD1-CG2 3.8Å; Y1571-V1574 HydrophobicContact CE1-CG2 4.31Å
1575	D	28.5	Very low	36.8	Very low	140.8 Å²	140.8	118.8 Å²	118.8	75%	0.753	64%	0.639	S	S	*	*			trans	-115.4	133.4	173.2	-100.9	-43.4	0	0	0	110.9	V1577	D1575-V1577 PolarHBondContact O-N 3.12Å
1576	H	27.5	Very low	35.1	Very low	183.8 Å²	183.8	122.4 Å²	122.4	85%	0.851	67%	0.667	S	S	*	*			trans	-15.8	92.1	174.7	-75.7	-72.7	0	0	0	115.4	S1578	H1576-S1578 VanDerWaalsContact C-N 3.27Å; H1576-S1578 PolarHBondContact O-N 2.8Å
1577	V	28.2	Very low	33.7	Very low	133.2 Å²	133.2	125.7 Å²	125.7	81%	0.807	67%	0.674	S	S	*	*			trans	-130.4	102.5	148	179.4	0	0	0	0	108.7	D1575 S1579	D1575-V1577 PolarHBondContact O-N 3.12Å; V1577-S1579 PolarHBondContact O-N 2.99Å; V1577-S1579 VanDerWaalsContact O-N 3.07Å
1578	S	26.7	Very low	32.3	Very low	117.4 Å²	117.4	130.1 Å²	130.1	82%	0.821	70%	0.703	S	S	*	*			trans	-95.3	107.7	159.1	156.7	0	0	0	0	110.5	H1576	H1576-S1578 VanDerWaalsContact C-N 3.27Å; H1576-S1578 PolarHBondContact O-N 2.8Å
1579	S	28.8	Very low	30.9	Very low	103.2 Å²	103.2	137.9 Å²	137.9	72%	0.722	74%	0.738	S	S	*	*			trans	-135.3	111.5	163.2	56.3	0	0	0	0	110.6	V1577	V1577-S1579 PolarHBondContact O-N 2.99Å; V1577-S1579 VanDerWaalsContact O-N 3.07Å
1580	K	28.7	Very low	29.5	Very low	181 Å²	181	141.4 Å²	141.4	79%	0.787	76%	0.756	S	S	*	*			trans	-9.8	124.1	147.8	-82.2	-172.3	167.4	-165.3	0	115.6
1581	D	27.6	Very low	28.7	Very low	135.2 Å²	135.2	143.9 Å²	143.9	72%	0.723	77%	0.77	S	S	*	*				80.7	138.6	129.2	-54.3	-22.7	0	0	0	117.9
1582	D	27.9	Very low	28	Very low	152.8 Å²	152.8	142.5 Å²	142.5	82%	0.817	77%	0.77	S	S	*	*			trans	75.2	118.3	152.9	-78.1	-25.2	0	0	0	120.2
1583	F	27.4	Very low	27.7	Very low	187.4 Å²	187.4	144.7 Å²	144.7	82%	0.822	78%	0.776	S	S	*	*				108.5	105.4	123.1	-135.8	-109.6	0	0	0	119.7
1584	V	29.9	Very low	27.6	Very low	102.6 Å²	102.6	143.9 Å²	143.9	62%	0.622	77%	0.771	S	S	*	*			trans	68	118.6	136.4	175.8	0	0	0	0	120.5
1585	Q	27.7	Very low	27.6	Very low	169.4 Å²	169.4	146.5 Å²	146.5	79%	0.792	77%	0.772	S	S	*	*			trans	66.9	118.3	134.4	-117.4	168.9	13.1	0	0	117.6
1586	S	26.7	Very low	27.5	Very low	112.2 Å²	112.2	148.5 Å²	148.5	79%	0.785	78%	0.775	S	S	*	*			trans	-173.6	130.6	142.6	63	0	0	0	0	113.7
1587	H	26.7	Very low	27.6	Very low	168.2 Å²	168.2	148.2 Å²	148.2	78%	0.779	77%	0.771	S	S	*	*			trans	-88.3	124	168.2	-67.1	-77.3	0	0	0	114.2
1588	T	27.7	Very low	27.6	Very low	134 Å²	134	150.9 Å²	150.9	82%	0.822	77%	0.772	S	S	*	*			trans	-177.3	120.5	133.2	18.3	0	0	0	0	113.4	L1590	T1588-L1590 PolarHBondContact O-N 3.21Å; T1588-L1590 VanDerWaalsContact O-N 3.14Å
1589	K	27.6	Very low	27.4	Very low	195.2 Å²	195.2	152.8 Å²	152.8	85%	0.849	77%	0.768	S	S	*	*			trans	50.9	117.7	142.1	-81	179.8	176.4	178.6	0	118.4
1590	L	24.7	Very low	27.6	Very low	148.6 Å²	148.6	153.2 Å²	153.2	78%	0.778	77%	0.768	S	S	*	*			trans	-66.6	139.2	155.6	-93.5	79.4	0	0	0	115	T1588	T1588-L1590 PolarHBondContact O-N 3.21Å; T1588-L1590 VanDerWaalsContact O-N 3.14Å
1591	T	26.2	Very low	27.4	Very low	120.6 Å²	120.6	152.6 Å²	152.6	74%	0.74	77%	0.768	S	S	*	*			trans	150.7	125	147.9	44.5	0	0	0	0	110.8
1592	H	26.5	Very low	27.4	Very low	159.8 Å²	159.8	152.2 Å²	152.2	74%	0.74	77%	0.77	S	S	*	*			cis	-122.3	133.3	44.2	-117.5	-66.6	0	0	0	112.7	N1594	H1592-N1594 PolarHBondContact CE1-OD1 2.9Å; H1592-N1594 PolarHBondContact ND1-OD1 3.32Å; H1592-N1594 VanDerWaalsContact ND1-OD1 3.14Å; H1592-N1594 PolarHBondContact O-N 2.76Å; H1592-N1594 VanDerWaalsContact O-N 3.1Å
1593	V	27.9	Very low	27.4	Very low	122.4 Å²	122.4	152.6 Å²	152.6	74%	0.742	77%	0.767	S	S	*	*			trans	-142.7	118.6	159.6	163.4	0	0	0	0	109.4
1594	N	27	Very low	27.4	Very low	131.8 Å²	131.8	151.1 Å²	151.1	71%	0.705	76%	0.764	S	S	*	*			trans	-55.9	139.1	169.6	-77.9	-21.7	0	0	0	113.5	H1592 F1596	H1592-N1594 PolarHBondContact CE1-OD1 2.9Å; H1592-N1594 PolarHBondContact ND1-OD1 3.32Å; H1592-N1594 VanDerWaalsContact ND1-OD1 3.14Å; H1592-N1594 PolarHBondContact O-N 2.76Å; H1592-N1594 VanDerWaalsContact O-N 3.1Å; N1594-F1596 PolarHBondContact O-N 2.88Å
1595	K	28.8	Very low	27.3	Very low	176 Å²	176	153.2 Å²	153.2	77%	0.765	77%	0.772	S	S	*	*			trans	-148.4	136.2	148.9	-125.2	166.7	-178.9	171.5	0	109.6	K1597	K1595-K1597 PolarHBondContact O-N 3.08Å; K1595-K1597 VanDerWaalsContact O-N 3.16Å
1596	F	27.7	Very low	27.3	Very low	184.4 Å²	184.4	149 Å²	149	81%	0.809	77%	0.766	S	S	*	*			trans	-94.3	134.8	132.2	-80.4	-81.8	0	0	0	110.1	N1594	N1594-F1596 PolarHBondContact O-N 2.88Å
1597	K	28.7	Very low	27.4	Very low	176.4 Å²	176.4	150.5 Å²	150.5	77%	0.767	77%	0.765	S	S	*	*				173.4	123.9	75.3	-124.3	-172.3	179.2	-172.5	0	111.8	K1595 E1599	K1595-K1597 PolarHBondContact O-N 3.08Å; K1595-K1597 VanDerWaalsContact O-N 3.16Å; K1597-E1599 VanDerWaalsContact CE-CD 3.45Å; K1597-E1599 VanDerWaalsContact CE-OE1 3.23Å; K1597-E1599 WeakPolarHBondContact CE-OE1 3.32Å; K1597-E1599 WeakPolarHBondContact CE-OE2 3.44Å; K1597-E1599 IonicContact NZ-OE1 3.73Å; K1597-E1599 PolarHBondContact NZ-OE1 3.1Å; K1597-E1599 IonicContact NZ-OE2 3.61Å; K1597-E1599 PolarHBondContact NZ-OE2 2.92Å
1598	K	28	Very low	27.5	Very low	189.8 Å²	189.8	148.6 Å²	148.6	83%	0.825	76%	0.761	S	S	*	*			trans	-114.9	128.1	147.6	-102.6	-178.5	174.6	-174	0	112.4
1599	E	23.8	Very low	27.6	Very low	158.2 Å²	158.2	147.3 Å²	147.3	74%	0.739	75%	0.753	S	S	*	*			trans	-77.8	156	154	-78.3	154.6	162.5	0	0	109.7	K1597	K1597-E1599 VanDerWaalsContact CE-CD 3.45Å; K1597-E1599 VanDerWaalsContact CE-OE1 3.23Å; K1597-E1599 WeakPolarHBondContact CE-OE1 3.32Å; K1597-E1599 WeakPolarHBondContact CE-OE2 3.44Å; K1597-E1599 IonicContact NZ-OE1 3.73Å; K1597-E1599 PolarHBondContact NZ-OE1 3.1Å; K1597-E1599 IonicContact NZ-OE2 3.61Å; K1597-E1599 PolarHBondContact NZ-OE2 2.92Å
1600	P	32.7	Very low	27.7	Very low	112.2 Å²	112.2	148.5 Å²	148.5	73%	0.729	75%	0.752	S	S	*	*				-132.7	173.2	55.1	27.8	-8.5	0	0	0	114
1601	E	24.3	Very low	27.9	Very low	166.4 Å²	166.4	147.5 Å²	147.5	78%	0.778	75%	0.748	S	S	*	*			trans	-93.8	148	143.7	-70.1	175.5	152.2	0	0	115.1
1602	V	27.8	Very low	28.1	Very low	127 Å²	127	147.5 Å²	147.5	77%	0.77	74%	0.743	S	S	*	*			trans	159.9	114.2	140.6	178.8	0	0	0	0	112.1
1603	H	27.1	Very low	28.3	Very low	161.8 Å²	161.8	147.1 Å²	147.1	75%	0.749	74%	0.742	S	S	*	*				73.4	137.5	113.9	-85.5	-58.2	0	0	0	115.8
1604	M	27.6	Very low	28.4	Very low	156.6 Å²	156.6	147.3 Å²	147.3	77%	0.771	74%	0.743	S	S	*	*			trans	-170.6	131.7	161.6	-83.5	-100.7	177.5	0	0	113.8
1605	N	27.4	Very low	28.5	Very low	146.6 Å²	146.6	146.6 Å²	146.6	78%	0.784	74%	0.744	S	S	*	*			trans	59	134.8	132.4	-68.7	-8.1	0	0	0	116.5
1606	A	28	Very low	28.5	Very low	81.2 Å²	81.2	146 Å²	146	67%	0.671	74%	0.744	S	S	*	*				164	147.3	67.3	0	0	0	0	0	113.4
1607	N	28.5	Very low	28.5	Very low	142.8 Å²	142.8	141.9 Å²	141.9	76%	0.764	73%	0.734	S	S	*	*			trans	69.5	137.9	151.9	-64.6	23.3	0	0	0	119.4
1608	D	29.5	Very low	28.6	Very low	128.6 Å²	128.6	141.8 Å²	141.8	69%	0.688	73%	0.734	S	S	*	*			cis	171.7	152.3	45.8	-110.8	-41.6	0	0	0	117.8
1609	T	29.9	Very low	28.6	Very low	107.6 Å²	107.6	139 Å²	139	66%	0.66	73%	0.727	S	S	*	*			trans	43.5	122.1	152.5	11.5	0	0	0	0	118.7
1610	R	29.1	Very low	29	Very low	218.8 Å²	218.8	137.5 Å²	137.5	83%	0.826	73%	0.725	S	S	*	*				142.4	147	73.7	-114.9	171.9	-170	172.5	1.5	114.1
1611	N	30.1	Very low	28.8	Very low	128.8 Å²	128.8	138.8 Å²	138.8	69%	0.689	73%	0.725	S	S	*	*			trans	71.3	148.5	139.5	-64	15.1	0	0	0	117
1612	N	30.7	Very low	29.1	Very low	119.6 Å²	119.6	136.8 Å²	136.8	64%	0.64	72%	0.72	S	S	*	*			cis	175.2	168.9	-17.6	-98.4	13.3	0	0	0	108.9
1613	E	30.3	Very low	29.4	Very low	152.2 Å²	152.2	138.4 Å²	138.4	71%	0.711	72%	0.719	S	S	*	*			cis	155.2	140.8	35.9	-106.4	156.1	-168.3	0	0	116.1
1614	T	28.4	Very low	29.5	Very low	125.8 Å²	125.8	136.9 Å²	136.9	77%	0.772	72%	0.716	S	S	*	*			trans	73.7	166.2	140.6	59.1	0	0	0	0	118.5
1615	V	30.8	Very low	29.6	Very low	117.4 Å²	117.4	136.2 Å²	136.2	71%	0.712	71%	0.714	S	S	*	*			trans	150.5	140.4	-142.5	169.7	0	0	0	0	111.4
1616	E	27.6	Very low	29.7	Very low	164.2 Å²	164.2	135.9 Å²	135.9	77%	0.767	71%	0.713	S	S	*	*				78.6	160	121.7	-76.5	-174	-166.5	0	0	117.9
1617	T	28.6	Very low	29.7	Very low	98.6 Å²	98.6	137 Å²	137	61%	0.605	72%	0.715	S	S	*	*			cis	-178.1	152.8	-29.1	33.3	0	0	0	0	112.1
1618	K	30.7	Very low	29.8	Very low	174.6 Å²	174.6	138.4 Å²	138.4	76%	0.759	72%	0.715	S	S	*	*			trans	70.4	143	146.3	-68	165	-172.5	160.4	0	119.6
1619	N	27.7	Very low	29.6	Very low	129.2 Å²	129.2	140.4 Å²	140.4	69%	0.691	72%	0.72	S	S	*	*				121.7	141.8	54.9	-87.4	34.1	0	0	0	113.8
1620	D	31.2	Very low	29.6	Very low	128 Å²	128	139.5 Å²	139.5	68%	0.684	72%	0.724	S	S	*	*				163.7	148.5	82.4	-82.4	-23.2	0	0	0	116.4
1621	N	30.5	Very low	29.5	Very low	139.4 Å²	139.4	135.6 Å²	135.6	75%	0.745	72%	0.724	S	S	*	*			trans	63.5	136.8	152.1	-66.8	-12.2	0	0	0	120.7
1622	D	30.3	Very low	29.4	Very low	124.2 Å²	124.2	138.9 Å²	138.9	66%	0.664	73%	0.732	S	S	*	*				118.7	146.9	85.4	-106.8	-35.2	0	0	0	118.5
1623	H	32.8	Very low	29.2	Very low	159.4 Å²	159.4	136.4 Å²	136.4	74%	0.738	74%	0.735	S	S	*	*			trans	84.8	127.6	143.3	-72.1	-2.6	0	0	0	117.8
1624	N	29.2	Very low	29.1	Very low	131.2 Å²	131.2	136.1 Å²	136.1	70%	0.702	74%	0.737	S	S	*	*			cis	118.5	152.5	48.2	-155.5	10.4	0	0	0	111.7
1625	I	31.5	Very low	29.2	Very low	142.6 Å²	142.6	136.6 Å²	136.6	73%	0.731	74%	0.74	S	S	*	*			trans	121.5	125.6	139.3	-67.1	169.1	0	0	0	115.4
1626	N	28.2	Very low	29	Very low	140.6 Å²	140.6	141.7 Å²	141.7	75%	0.752	75%	0.746	S	S	*	*			trans	-56.4	148.4	145.2	-73.7	-31.5	0	0	0	116.9
1627	S	29	Very low	29	Very low	102.6 Å²	102.6	144.7 Å²	144.7	72%	0.717	75%	0.751	S	S	*	*				145.1	145.9	122.2	67.5	0	0	0	0	116.1
1628	K	29.1	Very low	29	Very low	173.2 Å²	173.2	146.2 Å²	146.2	75%	0.753	76%	0.755	S	S	*	*				140.3	129	61	-103.8	177.1	174.6	-142.7	0	111.3
1629	E	27.1	Very low	28.9	Very low	169.4 Å²	169.4	146.1 Å²	146.1	79%	0.792	76%	0.757	S	S	*	*			trans	61.5	125.8	132.9	-84.3	168.9	-173	0	0	117.2
1630	A	28.7	Very low	29	Very low	90.4 Å²	90.4	146.9 Å²	146.9	75%	0.747	76%	0.761	S	S	*	*				-158.3	138.6	123.8	0	0	0	0	0	110	F1632	A1630-F1632 PolarHBondContact O-N 2.85Å
1631	V	27.7	Very low	29	Very low	136.8 Å²	136.8	147.6 Å²	147.6	83%	0.829	77%	0.765	S	S	*	*			trans	84.9	123.9	153.6	-178.4	0	0	0	0	114.3
1632	F	27.1	Very low	29.1	Very low	196.6 Å²	196.6	146.8 Å²	146.8	86%	0.862	77%	0.766	S	S	*	*			trans	-58	136.5	166.7	-92.1	-94.4	0	0	0	115.4	A1630 I1634	A1630-F1632 PolarHBondContact O-N 2.85Å; F1632-I1634 HydrophobicContact CB-CD1 3.71Å; F1632-I1634 HydrophobicContact CB-CG1 3.89Å; F1632-I1634 HydrophobicContact CD1-CD1 4.1Å; F1632-I1634 HydrophobicContact CD1-CG1 3.5Å; F1632-I1634 VanDerWaalsContact CD1-CG1 3.5Å; F1632-I1634 HydrophobicContact CE1-CD1 4.2Å; F1632-I1634 HydrophobicContact CE1-CG1 4.25Å; F1632-I1634 HydrophobicContact CG-CD1 3.81Å; F1632-I1634 HydrophobicContact CG-CG1 3.99Å
1633	G	27.4	Very low	29.1	Very low	68.2 Å²	68.2	147.5 Å²	147.5	70%	0.703	77%	0.769	S	S	*	*			trans	-155.6	138.2	153.6	0	0	0	0	0	111.5
1634	I	27.6	Very low	29	Very low	146.6 Å²	146.6	151.1 Å²	151.1	75%	0.752	78%	0.776	S	S	*	*			trans	80.8	115.1	161	-53.3	173.3	0	0	0	113	F1632	F1632-I1634 HydrophobicContact CB-CD1 3.71Å; F1632-I1634 HydrophobicContact CB-CG1 3.89Å; F1632-I1634 HydrophobicContact CD1-CD1 4.1Å; F1632-I1634 HydrophobicContact CD1-CG1 3.5Å; F1632-I1634 VanDerWaalsContact CD1-CG1 3.5Å; F1632-I1634 HydrophobicContact CE1-CD1 4.2Å; F1632-I1634 HydrophobicContact CE1-CG1 4.25Å; F1632-I1634 HydrophobicContact CG-CD1 3.81Å; F1632-I1634 HydrophobicContact CG-CG1 3.99Å
1635	T	30.6	Very low	29	Very low	134.8 Å²	134.8	152.2 Å²	152.2	83%	0.827	78%	0.782	S	S	*	*				-151	130.1	125.4	17.8	0	0	0	0	111
1636	R	26.3	Very low	28.8	Very low	224.6 Å²	224.6	150.3 Å²	150.3	85%	0.848	78%	0.782	S	S	*	*			trans	-35.4	135.7	143.6	-70.9	-179.2	174.5	175	-2.6	114.1
1637	R	28.1	Very low	28.8	Very low	228.6 Å²	228.6	151.2 Å²	151.2	86%	0.863	79%	0.785	S	S	*	*			trans	-177.2	149.2	141.9	-98.9	-168.1	174.2	137.4	-0.9	111.6
1638	D	28.7	Very low	28.8	Very low	129.8 Å²	129.8	152.2 Å²	152.2	69%	0.694	79%	0.787	S	S	*	*			trans	-122.3	140.1	-158.5	-67.7	-40.8	0	0	0	111
1639	E	28.8	Very low	28.7	Very low	172.8 Å²	172.8	148.6 Å²	148.6	81%	0.807	78%	0.784	S	S	*	*			trans	56.1	130.5	133.6	-87.9	176.8	-156.2	0	0	118.2
1640	N	28.8	Very low	28.8	Very low	144.4 Å²	144.4	148.2 Å²	148.2	77%	0.772	78%	0.782	S	S	*	*			trans	157	148.2	148.7	-66.5	-46.9	0	0	0	115.6
1641	D	30.9	Very low	28.7	Very low	144 Å²	144	151 Å²	151	77%	0.77	79%	0.785	S	S	*	*			trans	170.9	135.3	141.1	-88.7	-29.4	0	0	0	116.5
1642	T	32.2	Very low	28.8	Very low	123 Å²	123	154.4 Å²	154.4	76%	0.755	78%	0.784	S	S	*	*			trans	90.1	141	151.1	45.5	0	0	0	0	117.3
1643	D	30.6	Very low	28.9	Very low	138.4 Å²	138.4	153.9 Å²	153.9	74%	0.74	78%	0.784	S	S	*	*			trans	169.7	137.2	135	-80	-23.5	0	0	0	115
1644	R	31.8	Very low	28.9	Very low	233.8 Å²	233.8	157.9 Å²	157.9	88%	0.882	79%	0.789	S	S	*	*				-153.2	146	102.5	-89.2	167.4	-179.3	169.2	6.1	114.7
1645	N	29.3	Very low	29	Very low	154.8 Å²	154.8	157 Å²	157	83%	0.828	79%	0.79	S	S	*	*			trans	-63.1	145.2	151.4	-65.4	-26.3	0	0	0	114.6
1646	S	27.2	Very low	29	Very low	103.2 Å²	103.2	157.2 Å²	157.2	72%	0.722	79%	0.786	S	S	*	*			trans	156.3	130	130.8	171.2	0	0	0	0	113.9
1647	L	28.2	Very low	29.3	Very low	158.2 Å²	158.2	152.1 Å²	152.1	83%	0.828	78%	0.779	S	S	*	*			trans	88.8	135.3	144.6	-110.5	101.7	0	0	0	113.1
1648	V	28	Very low	29.5	Very low	124 Å²	124	146.8 Å²	146.8	75%	0.752	78%	0.775	S	S	*	*				-137.1	138.7	83.2	159.1	0	0	0	0	109.5	E1650	V1648-E1650 HydrophobicContact CG1-CG 4.01Å
1649	S	27.5	Very low	29.6	Very low	97.6 Å²	97.6	148.3 Å²	148.3	68%	0.683	78%	0.781	S	S	*	*			trans	-101.7	140.6	159.8	-59.8	0	0	0	0	112.5
1650	E	28.5	Very low	29.8	Very low	160.6 Å²	160.6	147 Å²	147	75%	0.75	78%	0.78	S	S	*	*			trans	-106.1	127.2	156.8	-78.5	167.9	157.8	0	0	111.1	V1648 Y1652	V1648-E1650 HydrophobicContact CG1-CG 4.01Å; E1650-Y1652 HydrophobicContact CB-CD2 4.21Å; E1650-Y1652 HydrophobicContact CB-CE2 4.02Å; E1650-Y1652 HydrophobicContact CG-CE2 4.41Å
1651	D	27.9	Very low	29.9	Very low	151.2 Å²	151.2	146.7 Å²	146.7	81%	0.809	78%	0.778	S	S	*	*			trans	-115.8	157.5	145.5	-84.2	-49	0	0	0	111.3
1652	Y	29.7	Very low	30	Very low	206.2 Å²	206.2	147.3 Å²	147.3	81%	0.809	78%	0.782	S	S	*	*			trans	-112.4	141.4	169.9	-77.9	-89.4	0	0	0	112.7	E1650 L1654	E1650-Y1652 HydrophobicContact CB-CD2 4.21Å; E1650-Y1652 HydrophobicContact CB-CE2 4.02Å; E1650-Y1652 HydrophobicContact CG-CE2 4.41Å; Y1652-L1654 PolarHBondContact O-N 3Å
1653	E	28.7	Very low	29.9	Very low	187.4 Å²	187.4	144.1 Å²	144.1	88%	0.876	77%	0.773	S	S	*	*			trans	-83.9	152.7	170.2	-88.8	-178.1	149.5	0	0	114	V1655	E1653-V1655 PolarHBondContact O-N 3.19Å
1654	L	27.4	Very low	30	Very low	152.4 Å²	152.4	145 Å²	145	80%	0.798	78%	0.778	S	S	*	*			trans	-100.4	149.8	-165.4	-139.2	78.9	0	0	0	110.6	Y1652 D1656	Y1652-L1654 PolarHBondContact O-N 3Å; L1654-D1656 PolarHBondContact O-N 3.12Å; L1654-D1656 VanDerWaalsContact O-N 3.11Å
1655	V	29.3	Very low	30	Very low	127.6 Å²	127.6	140.6 Å²	140.6	77%	0.773	77%	0.772	S	S	*	*			trans	-131.9	120	161.2	177.2	0	0	0	0	111.4	E1653 V1657	E1653-V1655 PolarHBondContact O-N 3.19Å; V1655-V1657 HydrophobicContact CG1-CG2 4.21Å; V1655-V1657 PolarHBondContact O-N 3.36Å
1656	D	30	Very low	30.2	Very low	138.8 Å²	138.8	139.2 Å²	139.2	74%	0.742	77%	0.769	S	S	*	*			trans	-103.9	144.1	155	-100.9	-39.9	0	0	0	114.2	L1654	L1654-D1656 PolarHBondContact O-N 3.12Å; L1654-D1656 VanDerWaalsContact O-N 3.11Å
1657	V	32.6	Very low	30.7	Very low	118 Å²	118	138.8 Å²	138.8	72%	0.715	76%	0.763	S	S	*	*			trans	-88.5	136.5	161.5	-176.1	0	0	0	0	111.3	V1655 L1659	V1655-V1657 HydrophobicContact CG1-CG2 4.21Å; V1655-V1657 PolarHBondContact O-N 3.36Å; V1657-L1659 PolarHBondContact O-N 3.43Å
1658	P	33.7	Very low	31.3	Very low	117.4 Å²	117.4	137.5 Å²	137.5	76%	0.762	76%	0.755	S	S	*	*			trans	-106.7	138.8	147.9	25.6	-14.5	0	0	0	113.8
1659	L	30.6	Very low	31.9	Very low	159.6 Å²	159.6	136.6 Å²	136.6	84%	0.836	75%	0.75	S	S	*	*			trans	-73.4	132.5	161.8	-71.5	151.4	0	0	0	112.3	V1657 N1661	V1657-L1659 PolarHBondContact O-N 3.43Å; L1659-N1661 PolarHBondContact O-N 3.14Å; L1659-N1661 VanDerWaalsContact O-N 3.09Å
1660	D	32.4	Very low	32.6	Very low	146 Å²	146	135.4 Å²	135.4	78%	0.781	74%	0.739	S	S	*	*				-128.8	145.1	129.5	-110.5	-32	0	0	0	113.7	N1662	D1660-N1662 PolarHBondContact O-N 3.3Å
1661	N	31.9	Very low	33.3	Very low	137.8 Å²	137.8	135 Å²	135	74%	0.737	74%	0.735	S	S	*	*			trans	-39.2	115.5	170.9	-108.4	-35.1	0	0	0	116.4	L1659 G1663	L1659-N1661 PolarHBondContact O-N 3.14Å; L1659-N1661 VanDerWaalsContact O-N 3.09Å; N1661-G1663 PolarHBondContact O-N 3.33Å
1662	N	32.1	Very low	34.3	Very low	157.8 Å²	157.8	133.2 Å²	133.2	84%	0.844	72%	0.724	S	S	*	*				-148	127.7	111.8	-118.2	-25.7	0	0	0	114.2	D1660	D1660-N1662 PolarHBondContact O-N 3.3Å
1663	G	31.1	Very low	35.1	Very low	55.2 Å²	55.2	129.4 Å²	129.4	57%	0.569	71%	0.713	S	S	*	*			trans	-71.7	142.2	173.1	0	0	0	0	0	116.3	N1661	N1661-G1663 PolarHBondContact O-N 3.33Å
1664	N	32.8	Very low	36	Very low	157.2 Å²	157.2	124.3 Å²	124.3	84%	0.841	69%	0.692	S	S	*	*			trans	-163.3	119.1	131.4	-85.5	-33.6	0	0	0	112.1	T1666	N1664-T1666 PolarHBondContact O-N 2.78Å
1665	N	32	Very low	37	Very low	141 Å²	141	121.8 Å²	121.8	75%	0.754	68%	0.679	S	S	*	*			trans	-73.8	116.8	174.5	-70.1	-29.3	0	0	0	113.6	I1668	N1665-I1668 WeakPolarHBondContact OD1-CD1 3.08Å
1666	T	33.5	Very low	38.1	Very low	127 Å²	127	120.1 Å²	120.1	78%	0.779	67%	0.666	S	S	*	*			trans	-160.3	52.9	146.7	13.6	0	0	0	0	113.9	N1664	N1664-T1666 PolarHBondContact O-N 2.78Å
1667	T	37.6	Very low	39.2	Very low	94 Å²	94	119 Å²	119	58%	0.577	66%	0.656	S	S	*	*			trans	-137.6	55.3	167.9	39.4	0	0	0	0	115.3	T1670 K1671	T1667-T1670 WeakPolarHBondContact CB-OG1 3.42Å; T1667-T1670 WeakPolarHBondContact CG2-OG1 3.48Å; T1667-T1670 PolarHBondContact O-OG1 3.39Å; T1667-K1671 WeakPolarHBondContact O-CB 3.42Å; T1667-K1671 VanDerWaalsContact O-CG 3.22Å; T1667-K1671 WeakPolarHBondContact O-CG 3.35Å; T1667-K1671 PolarHBondContact O-N 3.03Å
1668	I	40.3	Very low	40.5	Very low	130.6 Å²	130.6	119.8 Å²	119.8	67%	0.67	65%	0.65	S	S	*	*	S	Bend	trans	-91	-26.5	174.6	-64.2	178.4	0	0	0	111.7	N1665 T1670 K1671 I1672	N1665-I1668 WeakPolarHBondContact OD1-CD1 3.08Å; I1668-T1670 VanDerWaalsContact C-N 3.35Å; I1668-T1670 PolarHBondContact O-N 2.71Å; I1668-K1671 PolarHBondContact O-N 2.96Å; I1668-I1672 HydrophobicContact CG2-CD1 4.14Å; I1668-I1672 HydrophobicContact CG2-CG1 4.41Å; I1668-I1672 WeakPolarHBondContact O-CG1 3.16Å; I1668-I1672 PolarHBondContact O-N 3.2Å; I1668-I1672 VanDerWaalsContact O-N 3.12Å
1669	T	40.1	Very low	41.7	Very low	104.4 Å²	104.4	120.1 Å²	120.1	64%	0.64	64%	0.641	S	S	*	*	H	α-helix	trans	-80.5	-44.5	175.8	25.4	0	0	0	0	111.9	K1671 I1672 E1673	T1669-K1671 VanDerWaalsContact C-N 3.32Å; T1669-K1671 PolarHBondContact O-N 3.39Å; T1669-K1671 VanDerWaalsContact O-N 3.16Å; T1669-I1672 WeakPolarHBondContact O-CB 3.45Å; T1669-I1672 PolarHBondContact O-N 2.94Å; T1669-I1672 VanDerWaalsContact O-N 3.07Å; T1669-E1673 WeakPolarHBondContact O-CG 3.35Å; T1669-E1673 PolarHBondContact O-N 2.81Å
1670	T	43.1	Very low	43.4	Very low	73.2 Å²	73.2	117.4 Å²	117.4	45%	0.449	63%	0.627	S	S	.	*	H	α-helix	trans	-84.7	-16.2	179.9	37.7	0	0	0	0	113.3	T1667 I1668 L1674 Q1677	T1667-T1670 WeakPolarHBondContact CB-OG1 3.42Å; T1667-T1670 WeakPolarHBondContact CG2-OG1 3.48Å; T1667-T1670 PolarHBondContact O-OG1 3.39Å; I1668-T1670 VanDerWaalsContact C-N 3.35Å; I1668-T1670 PolarHBondContact O-N 2.71Å; T1670-L1674 VanDerWaalsContact O-CB 3.29Å; T1670-L1674 WeakPolarHBondContact O-CB 3.44Å; T1670-L1674 PolarHBondContact O-N 3.15Å; T1670-Q1677 PolarHBondContact O-OE1 3.44Å
1671	K	42.6	Very low	45.4	Very low	153 Å²	153	113 Å²	113	67%	0.665	61%	0.612	S	S	*	*	H	α-helix	trans	-89.1	-16	172.7	-78.2	-174.4	177.7	-178.5	0	113.2	T1667 I1668 T1669 L1674 N1675	T1667-K1671 WeakPolarHBondContact O-CB 3.42Å; T1667-K1671 VanDerWaalsContact O-CG 3.22Å; T1667-K1671 WeakPolarHBondContact O-CG 3.35Å; T1667-K1671 PolarHBondContact O-N 3.03Å; I1668-K1671 PolarHBondContact O-N 2.96Å; T1669-K1671 VanDerWaalsContact C-N 3.32Å; T1669-K1671 PolarHBondContact O-N 3.39Å; T1669-K1671 VanDerWaalsContact O-N 3.16Å; K1671-L1674 HydrophobicContact CB-CD1 4.44Å; K1671-L1674 HydrophobicContact CB-CD2 3.88Å; K1671-L1674 HydrophobicContact CD-CD2 4.3Å; K1671-L1674 HydrophobicContact CG-CD1 3.9Å; K1671-L1674 HydrophobicContact CG-CD2 3.97Å; K1671-N1675 VanDerWaalsContact O-CB 3.27Å; K1671-N1675 WeakPolarHBondContact O-CB 3.33Å; K1671-N1675 VanDerWaalsContact O-CG 3.3Å; K1671-N1675 PolarHBondContact O-N 3.21Å; K1671-N1675 PolarHBondContact O-ND2 3.04Å
1672	I	48.6	Very low	47.7	Very low	113.4 Å²	113.4	109.3 Å²	109.3	58%	0.582	59%	0.592	S	S	*	*	H	α-helix	trans	-87	-37.7	170.3	-72.5	168.2	0	0	0	111.1	I1668 T1669 L1674 N1675 N1676	I1668-I1672 HydrophobicContact CG2-CD1 4.14Å; I1668-I1672 HydrophobicContact CG2-CG1 4.41Å; I1668-I1672 WeakPolarHBondContact O-CG1 3.16Å; I1668-I1672 PolarHBondContact O-N 3.2Å; I1668-I1672 VanDerWaalsContact O-N 3.12Å; T1669-I1672 WeakPolarHBondContact O-CB 3.45Å; T1669-I1672 PolarHBondContact O-N 2.94Å; T1669-I1672 VanDerWaalsContact O-N 3.07Å; I1672-L1674 VanDerWaalsContact C-N 3.32Å; I1672-L1674 PolarHBondContact O-N 3.02Å; I1672-N1675 PolarHBondContact O-N 2.96Å; I1672-N1676 WeakPolarHBondContact O-CB 3.26Å; I1672-N1676 PolarHBondContact O-N 3.17Å; I1672-N1676 PolarHBondContact O-OD1 3.03Å
1673	E	46	Very low	49.9	Very low	124.6 Å²	124.6	104.7 Å²	104.7	58%	0.582	57%	0.569	S	S	*	*	H	α-helix	trans	-64.1	-28.8	171.6	-69.5	-179.5	136.7	0	0	112.3	T1669 N1675 N1676 Q1677	T1669-E1673 WeakPolarHBondContact O-CG 3.35Å; T1669-E1673 PolarHBondContact O-N 2.81Å; E1673-N1675 VanDerWaalsContact C-N 3.31Å; E1673-N1675 PolarHBondContact O-N 3.1Å; E1673-N1676 PolarHBondContact O-N 3.18Å; E1673-Q1677 WeakPolarHBondContact O-CB 3.39Å; E1673-Q1677 VanDerWaalsContact O-CG 3.26Å; E1673-Q1677 WeakPolarHBondContact O-CG 3.31Å; E1673-Q1677 PolarHBondContact O-N 2.99Å; E1673-Q1677 PolarHBondContact O-OE1 3.08Å
1674	L	49.5	Very low	52.3	Low	81.6 Å²	81.6	106.8 Å²	106.8	43%	0.427	57%	0.567	S	S	.	*	H	α-helix	trans	-73.2	-29.7	-174.1	-158.6	96.4	0	0	0	112.7	T1670 K1671 I1672 K1678	T1670-L1674 VanDerWaalsContact O-CB 3.29Å; T1670-L1674 WeakPolarHBondContact O-CB 3.44Å; T1670-L1674 PolarHBondContact O-N 3.15Å; K1671-L1674 HydrophobicContact CB-CD1 4.44Å; K1671-L1674 HydrophobicContact CB-CD2 3.88Å; K1671-L1674 HydrophobicContact CD-CD2 4.3Å; K1671-L1674 HydrophobicContact CG-CD1 3.9Å; K1671-L1674 HydrophobicContact CG-CD2 3.97Å; I1672-L1674 VanDerWaalsContact C-N 3.32Å; I1672-L1674 PolarHBondContact O-N 3.02Å; L1674-K1678 HydrophobicContact CD1-CG 4.18Å; L1674-K1678 HydrophobicContact CG-CD 4.29Å; L1674-K1678 HydrophobicContact CG-CG 4.18Å; L1674-K1678 WeakPolarHBondContact O-CA 3.49Å; L1674-K1678 WeakPolarHBondContact O-CB 3.37Å; L1674-K1678 WeakPolarHBondContact O-CD 3.15Å; L1674-K1678 VanDerWaalsContact O-CG 3.26Å; L1674-K1678 WeakPolarHBondContact O-CG 3.28Å; L1674-K1678 PolarHBondContact O-N 3.04Å; L1674-K1678 VanDerWaalsContact O-N 3.09Å
1675	N	47.4	Very low	54.7	Low	100.4 Å²	100.4	102.7 Å²	102.7	54%	0.537	55%	0.545	S	S	.	.	H	α-helix	trans	-74.7	-39.8	176.7	-79.8	-3.9	0	0	0	111.9	K1671 I1672 E1673 Q1677 K1678 Q1679	K1671-N1675 VanDerWaalsContact O-CB 3.27Å; K1671-N1675 WeakPolarHBondContact O-CB 3.33Å; K1671-N1675 VanDerWaalsContact O-CG 3.3Å; K1671-N1675 PolarHBondContact O-N 3.21Å; K1671-N1675 PolarHBondContact O-ND2 3.04Å; I1672-N1675 PolarHBondContact O-N 2.96Å; E1673-N1675 VanDerWaalsContact C-N 3.31Å; E1673-N1675 PolarHBondContact O-N 3.1Å; N1675-Q1677 VanDerWaalsContact C-N 3.33Å; N1675-Q1677 PolarHBondContact O-N 3.02Å; N1675-K1678 PolarHBondContact O-N 3.28Å; N1675-K1678 VanDerWaalsContact O-N 3.16Å; N1675-K1678 PolarHBondContact OD1-NZ 3.21Å; N1675-Q1679 WeakPolarHBondContact O-CB 3.47Å; N1675-Q1679 WeakPolarHBondContact O-CG 3.38Å; N1675-Q1679 PolarHBondContact O-N 3.17Å
1676	N	52.2	Low	57.2	Low	91.4 Å²	91.4	96.2 Å²	96.2	49%	0.489	51%	0.51	S	S	.	.	H	α-helix	trans	-67.8	-39.8	173.2	-71.9	3	0	0	0	111.3	I1672 E1673 K1678 Q1679 N1680	I1672-N1676 WeakPolarHBondContact O-CB 3.26Å; I1672-N1676 PolarHBondContact O-N 3.17Å; I1672-N1676 PolarHBondContact O-OD1 3.03Å; E1673-N1676 PolarHBondContact O-N 3.18Å; N1676-K1678 VanDerWaalsContact C-N 3.34Å; N1676-K1678 PolarHBondContact O-N 3.03Å; N1676-Q1679 PolarHBondContact O-N 2.98Å; N1676-Q1679 VanDerWaalsContact O-N 3.09Å; N1676-N1680 WeakPolarHBondContact O-CB 3.35Å; N1676-N1680 VanDerWaalsContact O-CG 3.24Å; N1676-N1680 PolarHBondContact O-N 3.18Å; N1676-N1680 PolarHBondContact O-OD1 2.94Å
1677	Q	54.1	Low	59.6	Low	116.4 Å²	116.4	93.2 Å²	93.2	54%	0.544	49%	0.489	S	S	.	.	H	α-helix	trans	-60.7	-39.2	172.5	-76.6	174.7	-7.1	0	0	112	T1670 E1673 N1675 A1681	T1670-Q1677 PolarHBondContact O-OE1 3.44Å; E1673-Q1677 WeakPolarHBondContact O-CB 3.39Å; E1673-Q1677 VanDerWaalsContact O-CG 3.26Å; E1673-Q1677 WeakPolarHBondContact O-CG 3.31Å; E1673-Q1677 PolarHBondContact O-N 2.99Å; E1673-Q1677 PolarHBondContact O-OE1 3.08Å; N1675-Q1677 VanDerWaalsContact C-N 3.33Å; N1675-Q1677 PolarHBondContact O-N 3.02Å; Q1677-A1681 WeakPolarHBondContact O-CA 3.38Å; Q1677-A1681 VanDerWaalsContact O-CB 3.24Å; Q1677-A1681 WeakPolarHBondContact O-CB 3.3Å; Q1677-A1681 PolarHBondContact O-N 2.94Å
1678	K	58.5	Low	61.9	Low	133.4 Å²	133.4	92 Å²	92	58%	0.58	48%	0.482	S	S	*	.	H	α-helix	trans	-65.9	-39.4	174.2	-82.3	-179.8	176.4	-177.2	0	113.2	L1674 N1675 N1676 A1681 L1682	L1674-K1678 HydrophobicContact CD1-CG 4.18Å; L1674-K1678 HydrophobicContact CG-CD 4.29Å; L1674-K1678 HydrophobicContact CG-CG 4.18Å; L1674-K1678 WeakPolarHBondContact O-CA 3.49Å; L1674-K1678 WeakPolarHBondContact O-CB 3.37Å; L1674-K1678 WeakPolarHBondContact O-CD 3.15Å; L1674-K1678 VanDerWaalsContact O-CG 3.26Å; L1674-K1678 WeakPolarHBondContact O-CG 3.28Å; L1674-K1678 PolarHBondContact O-N 3.04Å; L1674-K1678 VanDerWaalsContact O-N 3.09Å; N1675-K1678 PolarHBondContact O-N 3.28Å; N1675-K1678 VanDerWaalsContact O-N 3.16Å; N1675-K1678 PolarHBondContact OD1-NZ 3.21Å; N1676-K1678 VanDerWaalsContact C-N 3.34Å; N1676-K1678 PolarHBondContact O-N 3.03Å; K1678-A1681 PolarHBondContact O-N 3.14Å; K1678-L1682 WeakPolarHBondContact O-CA 3.41Å; K1678-L1682 VanDerWaalsContact O-CB 3.27Å; K1678-L1682 WeakPolarHBondContact O-CB 3.39Å; K1678-L1682 PolarHBondContact O-N 3.15Å
1679	Q	59.6	Low	64	Low	124.4 Å²	124.4	86 Å²	86	58%	0.581	45%	0.451	S	S	*	.	H	α-helix	trans	-70.1	-42.3	179	-92.4	-179.7	-31	0	0	111.7	N1675 N1676 L1682 T1683	N1675-Q1679 WeakPolarHBondContact O-CB 3.47Å; N1675-Q1679 WeakPolarHBondContact O-CG 3.38Å; N1675-Q1679 PolarHBondContact O-N 3.17Å; N1676-Q1679 PolarHBondContact O-N 2.98Å; N1676-Q1679 VanDerWaalsContact O-N 3.09Å; Q1679-L1682 WeakPolarHBondContact O-CB 3.37Å; Q1679-L1682 PolarHBondContact O-N 3.19Å; Q1679-T1683 WeakPolarHBondContact O-CB 3.38Å; Q1679-T1683 PolarHBondContact O-N 3.04Å; Q1679-T1683 VanDerWaalsContact O-N 3.16Å; Q1679-T1683 PolarHBondContact O-OG1 3.15Å
1680	N	66.7	Low	66.3	Low	102.2 Å²	102.2	81 Å²	81	55%	0.547	42%	0.421	S	S	.	.	H	α-helix	trans	-62.3	-51.7	173.2	-68.7	7.7	0	0	0	110.3	N1676 L1682 T1683 D1684	N1676-N1680 WeakPolarHBondContact O-CB 3.35Å; N1676-N1680 VanDerWaalsContact O-CG 3.24Å; N1676-N1680 PolarHBondContact O-N 3.18Å; N1676-N1680 PolarHBondContact O-OD1 2.94Å; N1680-L1682 VanDerWaalsContact C-N 3.26Å; N1680-L1682 PolarHBondContact O-N 3.16Å; N1680-T1683 CarbonylContact O-C 3.54Å; N1680-T1683 WeakPolarHBondContact O-CA 3.38Å; N1680-T1683 WeakPolarHBondContact O-CB 3.23Å; N1680-T1683 PolarHBondContact O-N 3.14Å; N1680-T1683 VanDerWaalsContact O-N 3.13Å; N1680-D1684 VanDerWaalsContact C-OD2 3.29Å; N1680-D1684 WeakPolarHBondContact O-CB 3.38Å; N1680-D1684 VanDerWaalsContact O-CG 3.24Å; N1680-D1684 PolarHBondContact O-N 3.23Å; N1680-D1684 VanDerWaalsContact O-OD2 3.12Å
1681	A	73.9	Confident	68.4	Low	54.8 Å²	54.8	78.6 Å²	78.6	45%	0.453	41%	0.41	S	S	.	.	H	α-helix	trans	-61.5	-30.8	179	0	0	0	0	0	113.6	Q1677 K1678 L1685	Q1677-A1681 WeakPolarHBondContact O-CA 3.38Å; Q1677-A1681 VanDerWaalsContact O-CB 3.24Å; Q1677-A1681 WeakPolarHBondContact O-CB 3.3Å; Q1677-A1681 PolarHBondContact O-N 2.94Å; K1678-A1681 PolarHBondContact O-N 3.14Å; A1681-L1685 WeakPolarHBondContact O-CA 3.48Å; A1681-L1685 VanDerWaalsContact O-CB 3.22Å; A1681-L1685 WeakPolarHBondContact O-CB 3.3Å; A1681-L1685 PolarHBondContact O-N 3.1Å
1682	L	79.1	Confident	70.6	Confident	60.2 Å²	60.2	72.9 Å²	72.9	32%	0.315	39%	0.39	S	S	.	.	H	α-helix	trans	-69.6	-40.5	172.1	179.4	65.3	0	0	0	111.5	V1561 L1562 K1678 Q1679 N1680 L1685 L1686	V1561-L1682 HydrophobicContact CG1-CD1 3.72Å; L1562-L1682 HydrophobicContact CD2-CD1 4.48Å; L1562-L1682 HydrophobicContact CD2-CD2 3.98Å; K1678-L1682 WeakPolarHBondContact O-CA 3.41Å; K1678-L1682 VanDerWaalsContact O-CB 3.27Å; K1678-L1682 WeakPolarHBondContact O-CB 3.39Å; K1678-L1682 PolarHBondContact O-N 3.15Å; Q1679-L1682 WeakPolarHBondContact O-CB 3.37Å; Q1679-L1682 PolarHBondContact O-N 3.19Å; N1680-L1682 VanDerWaalsContact C-N 3.26Å; N1680-L1682 PolarHBondContact O-N 3.16Å; L1682-L1685 PolarHBondContact O-N 3.01Å; L1682-L1686 HydrophobicContact CD1-CD1 4.34Å; L1682-L1686 HydrophobicContact CD1-CG 4.34Å; L1682-L1686 HydrophobicContact CG-CD1 4.2Å; L1682-L1686 VanDerWaalsContact O-CB 3.31Å; L1682-L1686 WeakPolarHBondContact O-CB 3.29Å; L1682-L1686 WeakPolarHBondContact O-CD1 3.2Å; L1682-L1686 VanDerWaalsContact O-CG 3.27Å; L1682-L1686 WeakPolarHBondContact O-CG 3.32Å; L1682-L1686 PolarHBondContact O-N 3.23Å
1683	T	79.1	Confident	72.6	Confident	59.4 Å²	59.4	67.5 Å²	67.5	36%	0.364	36%	0.362	S	S	.	.	H	α-helix	trans	-67.9	-46.7	176.7	-51.8	0	0	0	0	110.7	Q1679 N1680 L1685 L1686 D1687 V1735	Q1679-T1683 WeakPolarHBondContact O-CB 3.38Å; Q1679-T1683 PolarHBondContact O-N 3.04Å; Q1679-T1683 VanDerWaalsContact O-N 3.16Å; Q1679-T1683 PolarHBondContact O-OG1 3.15Å; N1680-T1683 CarbonylContact O-C 3.54Å; N1680-T1683 WeakPolarHBondContact O-CA 3.38Å; N1680-T1683 WeakPolarHBondContact O-CB 3.23Å; N1680-T1683 PolarHBondContact O-N 3.14Å; N1680-T1683 VanDerWaalsContact O-N 3.13Å; T1683-L1685 VanDerWaalsContact C-N 3.3Å; T1683-L1685 PolarHBondContact O-N 3.15Å; T1683-L1686 PolarHBondContact O-N 3.15Å; T1683-L1686 VanDerWaalsContact O-N 3.11Å; T1683-D1687 WeakPolarHBondContact O-CB 3.39Å; T1683-D1687 PolarHBondContact O-N 3.19Å; T1683-V1735 HydrophobicContact CG2-CG2 4.37Å
1684	D	81	Confident	74.6	Confident	101.2 Å²	101.2	61.6 Å²	61.6	54%	0.541	34%	0.335	S	S	.	.	H	α-helix	trans	-58.9	-40.8	175.1	-62.4	-33.2	0	0	0	111.3	N1680 T1688	N1680-D1684 VanDerWaalsContact C-OD2 3.29Å; N1680-D1684 WeakPolarHBondContact O-CB 3.38Å; N1680-D1684 VanDerWaalsContact O-CG 3.24Å; N1680-D1684 PolarHBondContact O-N 3.23Å; N1680-D1684 VanDerWaalsContact O-OD2 3.12Å; D1684-T1688 VanDerWaalsContact O-CB 3.24Å; D1684-T1688 WeakPolarHBondContact O-CB 3.31Å; D1684-T1688 PolarHBondContact O-N 3.09Å; D1684-T1688 PolarHBondContact O-OG1 3.11Å
1685	L	83.3	Confident	76.6	Confident	70.6 Å²	70.6	61.8 Å²	61.8	37%	0.37	34%	0.336	S	S	.	.	H	α-helix	trans	-67.2	-40.3	174.9	-179.7	78.2	0	0	0	111.9	V1561 A1681 L1682 T1683 T1688 C1689	V1561-L1685 HydrophobicContact CB-CD2 4.37Å; V1561-L1685 HydrophobicContact CG1-CD2 3.84Å; V1561-L1685 HydrophobicContact CG1-CG 4.36Å; V1561-L1685 HydrophobicContact CG2-CD2 3.83Å; A1681-L1685 WeakPolarHBondContact O-CA 3.48Å; A1681-L1685 VanDerWaalsContact O-CB 3.22Å; A1681-L1685 WeakPolarHBondContact O-CB 3.3Å; A1681-L1685 PolarHBondContact O-N 3.1Å; L1682-L1685 PolarHBondContact O-N 3.01Å; T1683-L1685 VanDerWaalsContact C-N 3.3Å; T1683-L1685 PolarHBondContact O-N 3.15Å; L1685-T1688 PolarHBondContact O-N 3.13Å; L1685-C1689 VanDerWaalsContact CD1-SG 3.56Å; L1685-C1689 WeakPolarHBondContact O-CB 3.35Å; L1685-C1689 PolarHBondContact O-N 3.1Å; L1685-C1689 PolarHBondContact O-SG 3.2Å
1686	L	85.1	Confident	78.7	Confident	5 Å²	5	57.4 Å²	57.4	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-67.5	-45.8	177.2	-76.8	169.5	0	0	0	111.8	Y1558 V1561 L1562 L1682 T1683 T1688 C1689 L1690 V1735	Y1558-L1686 HydrophobicContact CD2-CD1 4.15Å; Y1558-L1686 HydrophobicContact CD2-CD2 3.75Å; Y1558-L1686 HydrophobicContact CE2-CD1 3.87Å; Y1558-L1686 HydrophobicContact CE2-CD2 4.33Å; V1561-L1686 HydrophobicContact CB-CD2 3.86Å; V1561-L1686 HydrophobicContact CG1-CD2 3.56Å; V1561-L1686 HydrophobicContact CG1-CG 3.92Å; V1561-L1686 HydrophobicContact CG2-CD2 4.36Å; L1562-L1686 HydrophobicContact CD2-CD1 4.39Å; L1682-L1686 HydrophobicContact CD1-CD1 4.34Å; L1682-L1686 HydrophobicContact CD1-CG 4.34Å; L1682-L1686 HydrophobicContact CG-CD1 4.2Å; L1682-L1686 VanDerWaalsContact O-CB 3.31Å; L1682-L1686 WeakPolarHBondContact O-CB 3.29Å; L1682-L1686 WeakPolarHBondContact O-CD1 3.2Å; L1682-L1686 VanDerWaalsContact O-CG 3.27Å; L1682-L1686 WeakPolarHBondContact O-CG 3.32Å; L1682-L1686 PolarHBondContact O-N 3.23Å; T1683-L1686 PolarHBondContact O-N 3.15Å; T1683-L1686 VanDerWaalsContact O-N 3.11Å; L1686-T1688 VanDerWaalsContact C-N 3.3Å; L1686-T1688 PolarHBondContact O-N 3.24Å; L1686-C1689 PolarHBondContact O-N 3.23Å; L1686-L1690 HydrophobicContact CD2-CD1 4.04Å; L1686-L1690 WeakPolarHBondContact O-CA 3.22Å; L1686-L1690 VanDerWaalsContact O-CB 3.31Å; L1686-L1690 WeakPolarHBondContact O-CB 3.4Å; L1686-L1690 VanDerWaalsContact O-CG 3.3Å; L1686-L1690 WeakPolarHBondContact O-CG 3.34Å; L1686-L1690 PolarHBondContact O-N 3.02Å; L1686-V1735 HydrophobicContact CB-CG2 4.28Å; L1686-V1735 HydrophobicContact CD1-CG2 4.09Å
1687	D	84.3	Confident	80.5	Confident	62.6 Å²	62.6	53 Å²	53	34%	0.335	29%	0.289	S	S	.	.	H	α-helix	trans	-65.6	-33.5	175.3	-78.8	-21.4	0	0	0	111.4	T1683 G1691 V1734	T1683-D1687 WeakPolarHBondContact O-CB 3.39Å; T1683-D1687 PolarHBondContact O-N 3.19Å; D1687-G1691 VanDerWaalsContact O-CA 3.22Å; D1687-G1691 WeakPolarHBondContact O-CA 3.41Å; D1687-G1691 PolarHBondContact O-N 2.93Å; D1687-V1734 VanDerWaalsContact OD1-CB 3.26Å; D1687-V1734 WeakPolarHBondContact OD1-CB 3.45Å; D1687-V1734 WeakPolarHBondContact OD1-CG1 3.41Å; D1687-V1734 VanDerWaalsContact OD1-CG2 3.25Å; D1687-V1734 WeakPolarHBondContact OD1-CG2 3.39Å; D1687-V1734 PolarHBondContact OD1-N 3.15Å; D1687-V1734 VanDerWaalsContact OD1-N 3.16Å
1688	T	84.8	Confident	82.2	Confident	69.8 Å²	69.8	48.3 Å²	48.3	43%	0.428	27%	0.266	S	S	.	.	H	α-helix	trans	-67.4	-49.4	171.3	-60	0	0	0	0	111.7	I1515 D1684 L1685 L1686 L1690	I1515-T1688 WeakPolarHBondContact CG2-O 3.3Å; D1684-T1688 VanDerWaalsContact O-CB 3.24Å; D1684-T1688 WeakPolarHBondContact O-CB 3.31Å; D1684-T1688 PolarHBondContact O-N 3.09Å; D1684-T1688 PolarHBondContact O-OG1 3.11Å; L1685-T1688 PolarHBondContact O-N 3.13Å; L1686-T1688 VanDerWaalsContact C-N 3.3Å; L1686-T1688 PolarHBondContact O-N 3.24Å; T1688-L1690 PolarHBondContact O-N 2.99Å
1689	C	85.7	Confident	83.7	Confident	3.4 Å²	3.4	45.2 Å²	45.2	2%	0.023	26%	0.256	C	S	.	.	H	α-helix	trans	-66.6	-36.6	-177.6	-77.8	0	0	0	0	113.5	E1514 L1516 K1557 L1685 L1686	E1514-C1689 WeakPolarHBondContact O-CA 3.4Å; E1514-C1689 PolarHBondContact O-SG 3.27Å; E1514-C1689 VanDerWaalsContact O-SG 3.33Å; L1516-C1689 WeakPolarHBondContact CB-O 3.48Å; L1516-C1689 PolarHBondContact N-O 3.14Å; K1557-C1689 VanDerWaalsContact CE-CB 3.47Å; K1557-C1689 VanDerWaalsContact CE-SG 3.54Å; K1557-C1689 WeakPolarHBondContact CE-SG 3.46Å; K1557-C1689 HydrophobicContact CG-CB 4.5Å; L1685-C1689 VanDerWaalsContact CD1-SG 3.56Å; L1685-C1689 WeakPolarHBondContact O-CB 3.35Å; L1685-C1689 PolarHBondContact O-N 3.1Å; L1685-C1689 PolarHBondContact O-SG 3.2Å; L1686-C1689 PolarHBondContact O-N 3.23Å
1690	L	88.7	Confident	85.1	Confident	0.2 Å²	0.2	39.4 Å²	39.4	0%	0.001	23%	0.229	C	C	.	.	H	α-helix	trans	-114.7	-16.3	-168.1	-59.3	173.8	0	0	0	113.5	L1516 M1554 K1557 Y1558 L1686 T1688 S1692 T1693 G1694 V1734 V1738	L1516-L1690 HydrophobicContact CB-CD2 4.24Å; L1516-L1690 HydrophobicContact CD2-CD2 3.66Å; L1516-L1690 HydrophobicContact CG-CD2 4.47Å; M1554-L1690 HydrophobicContact CB-CD2 4.4Å; M1554-L1690 HydrophobicContact CE-CB 4.35Å; M1554-L1690 HydrophobicContact CG-CD2 4.28Å; K1557-L1690 HydrophobicContact CB-CD2 3.92Å; K1557-L1690 HydrophobicContact CG-CD2 3.67Å; K1557-L1690 HydrophobicContact CG-CG 4.37Å; Y1558-L1690 HydrophobicContact CD2-CD1 4.3Å; L1686-L1690 HydrophobicContact CD2-CD1 4.04Å; L1686-L1690 WeakPolarHBondContact O-CA 3.22Å; L1686-L1690 VanDerWaalsContact O-CB 3.31Å; L1686-L1690 WeakPolarHBondContact O-CB 3.4Å; L1686-L1690 VanDerWaalsContact O-CG 3.3Å; L1686-L1690 WeakPolarHBondContact O-CG 3.34Å; L1686-L1690 PolarHBondContact O-N 3.02Å; T1688-L1690 PolarHBondContact O-N 2.99Å; L1690-S1692 PolarHBondContact O-N 3.04Å; L1690-T1693 CarbonylContact O-C 3.55Å; L1690-T1693 WeakPolarHBondContact O-CA 3.28Å; L1690-T1693 WeakPolarHBondContact O-CB 3.42Å; L1690-T1693 PolarHBondContact O-N 3.26Å; L1690-T1693 VanDerWaalsContact O-N 3.08Å; L1690-G1694 PolarHBondContact O-N 3.25Å; L1690-V1734 HydrophobicContact CB-CB 4.44Å; L1690-V1734 HydrophobicContact CB-CG1 3.58Å; L1690-V1734 VanDerWaalsContact CB-CG1 3.46Å; L1690-V1734 HydrophobicContact CB-CG2 4.3Å; L1690-V1734 HydrophobicContact CD1-CG1 4.15Å; L1690-V1734 HydrophobicContact CG-CG1 4.17Å; L1690-V1738 HydrophobicContact CD1-CG2 4.08Å
1691	G	86.8	Confident	86.2	Confident	21.6 Å²	21.6	34.5 Å²	34.5	22%	0.223	20%	0.203	C	C	.	.	H	α-helix	trans	-53.4	-49.6	-170.7	0	0	0	0	0	114.8	D1687 T1693 G1694 L1695	D1687-G1691 VanDerWaalsContact O-CA 3.22Å; D1687-G1691 WeakPolarHBondContact O-CA 3.41Å; D1687-G1691 PolarHBondContact O-N 2.93Å; G1691-T1693 VanDerWaalsContact C-N 3.28Å; G1691-T1693 PolarHBondContact O-N 3.02Å; G1691-G1694 PolarHBondContact O-N 3.4Å; G1691-L1695 VanDerWaalsContact O-CB 3.31Å; G1691-L1695 WeakPolarHBondContact O-CB 3.4Å; G1691-L1695 VanDerWaalsContact O-CG 3.28Å; G1691-L1695 WeakPolarHBondContact O-CG 3.48Å; G1691-L1695 PolarHBondContact O-N 3.09Å
1692	S	88.7	Confident	86.8	Confident	33.4 Å²	33.4	35.4 Å²	35.4	23%	0.234	20%	0.199	C	C	.	.	H	α-helix	trans	-62.3	-39.3	178.1	59.7	0	0	0	0	112.7	L1690 F1696	L1690-S1692 PolarHBondContact O-N 3.04Å; S1692-F1696 PolarHBondContact O-N 2.83Å; S1692-F1696 VanDerWaalsContact O-N 3.15Å
1693	T	90.1	Very high	87.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-77	-39	-178.3	-52.8	0	0	0	0	111.5	L1516 L1517 L1550 M1554 L1690 G1691 F1696 L1697	L1516-T1693 HydrophobicContact CD2-CG2 4.08Å; L1516-T1693 HydrophobicContact CG-CG2 4.47Å; L1517-T1693 HydrophobicContact CD1-CG2 4.01Å; L1517-T1693 HydrophobicContact CG-CG2 4.35Å; L1550-T1693 HydrophobicContact CD2-CG2 3.87Å; M1554-T1693 HydrophobicContact CG-CG2 3.84Å; M1554-T1693 HydrophobicContact SD-CG2 3.96Å; L1690-T1693 CarbonylContact O-C 3.55Å; L1690-T1693 WeakPolarHBondContact O-CA 3.28Å; L1690-T1693 WeakPolarHBondContact O-CB 3.42Å; L1690-T1693 PolarHBondContact O-N 3.26Å; L1690-T1693 VanDerWaalsContact O-N 3.08Å; G1691-T1693 VanDerWaalsContact C-N 3.28Å; G1691-T1693 PolarHBondContact O-N 3.02Å; T1693-F1696 PolarHBondContact O-N 3.13Å; T1693-L1697 VanDerWaalsContact O-CB 3.3Å; T1693-L1697 WeakPolarHBondContact O-CB 3.29Å; T1693-L1697 PolarHBondContact O-N 3.15Å
1694	G	89	Confident	87.6	Confident	1.4 Å²	1.4	35.7 Å²	35.7	1%	0.014	20%	0.195	C	C	.	.	H	α-helix	trans	-67.7	-37.1	175.9	0	0	0	0	0	112.7	L1690 G1691 L1697 K1698 L1737	L1690-G1694 PolarHBondContact O-N 3.25Å; G1691-G1694 PolarHBondContact O-N 3.4Å; G1694-L1697 PolarHBondContact O-N 3.14Å; G1694-K1698 VanDerWaalsContact O-CB 3.28Å; G1694-K1698 WeakPolarHBondContact O-CB 3.39Å; G1694-K1698 VanDerWaalsContact O-CG 3.29Å; G1694-K1698 WeakPolarHBondContact O-CG 3.34Å; G1694-K1698 PolarHBondContact O-N 3.15Å; G1694-L1737 WeakPolarHBondContact O-CD2 3.34Å
1695	L	89.9	Confident	87.9	Confident	86.2 Å²	86.2	33.9 Å²	33.9	45%	0.451	18%	0.184	S	C	.	.	H	α-helix	trans	-62.2	-50.6	171.4	-156.9	79.3	0	0	0	110.9	G1691 L1697 K1698 D1699 H1730	G1691-L1695 VanDerWaalsContact O-CB 3.31Å; G1691-L1695 WeakPolarHBondContact O-CB 3.4Å; G1691-L1695 VanDerWaalsContact O-CG 3.28Å; G1691-L1695 WeakPolarHBondContact O-CG 3.48Å; G1691-L1695 PolarHBondContact O-N 3.09Å; L1695-L1697 VanDerWaalsContact C-N 3.3Å; L1695-L1697 PolarHBondContact O-N 3.05Å; L1695-K1698 WeakPolarHBondContact O-CB 3.39Å; L1695-K1698 PolarHBondContact O-N 3.06Å; L1695-K1698 VanDerWaalsContact O-N 3.14Å; L1695-D1699 VanDerWaalsContact O-CG 3.27Å; L1695-D1699 PolarHBondContact O-N 3.01Å; L1695-H1730 HydrophobicContact CD1-CB 4.29Å; L1695-H1730 WeakPolarHBondContact CD1-ND1 3.27Å
1696	F	91.8	Very high	87.9	Confident	6.8 Å²	6.8	36.2 Å²	36.2	3%	0.03	20%	0.196	C	C	.	.	H	α-helix	trans	-60.8	-36.6	177.3	178.6	-133.1	0	0	0	113	I1522 L1525 N1526 I1529 T1546 L1550 S1692 T1693 D1699 L1700	I1522-F1696 HydrophobicContact CG1-CD1 4.47Å; I1522-F1696 HydrophobicContact CG2-CB 3.96Å; I1522-F1696 HydrophobicContact CG2-CD1 3.94Å; I1522-F1696 HydrophobicContact CG2-CD2 4.27Å; I1522-F1696 HydrophobicContact CG2-CE1 4.48Å; I1522-F1696 HydrophobicContact CG2-CG 3.8Å; L1525-F1696 HydrophobicContact CB-CE1 3.87Å; L1525-F1696 HydrophobicContact CB-CZ 3.9Å; L1525-F1696 HydrophobicContact CD1-CE1 4.23Å; N1526-F1696 HydrophobicContact CB-CD2 4.35Å; N1526-F1696 HydrophobicContact CB-CE2 3.64Å; N1526-F1696 HydrophobicContact CB-CZ 4.04Å; I1529-F1696 HydrophobicContact CD1-CZ 4.45Å; T1546-F1696 HydrophobicContact CG2-CE1 4.29Å; L1550-F1696 HydrophobicContact CD1-CD1 3.69Å; L1550-F1696 HydrophobicContact CD1-CE1 3.88Å; L1550-F1696 HydrophobicContact CD1-CG 4.49Å; L1550-F1696 HydrophobicContact CD2-CD1 4.39Å; L1550-F1696 HydrophobicContact CD2-CE1 4.49Å; S1692-F1696 PolarHBondContact O-N 2.83Å; S1692-F1696 VanDerWaalsContact O-N 3.15Å; T1693-F1696 PolarHBondContact O-N 3.13Å; F1696-D1699 PolarHBondContact O-N 3.12Å; F1696-L1700 HydrophobicContact CD1-CD1 4.39Å; F1696-L1700 HydrophobicContact CD2-CD1 4.42Å; F1696-L1700 HydrophobicContact CD2-CG 4.29Å; F1696-L1700 HydrophobicContact CE1-CD1 4.02Å; F1696-L1700 HydrophobicContact CE2-CD1 4.03Å; F1696-L1700 HydrophobicContact CE2-CD2 4.12Å; F1696-L1700 HydrophobicContact CE2-CG 3.89Å; F1696-L1700 HydrophobicContact CZ-CD1 3.78Å; F1696-L1700 HydrophobicContact CZ-CD2 4.35Å; F1696-L1700 HydrophobicContact CZ-CG 4.15Å; F1696-L1700 WeakPolarHBondContact O-CG 3.31Å; F1696-L1700 PolarHBondContact O-N 3.13Å
1697	L	91	Very high	88	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67.3	-39.7	174.7	-178.3	58.5	0	0	0	112.2	V1547 L1550 M1554 T1693 G1694 L1695 D1699 L1700 F1701 L1737 L1741	V1547-L1697 HydrophobicContact CB-CD1 4.33Å; V1547-L1697 HydrophobicContact CG1-CD1 4.19Å; V1547-L1697 HydrophobicContact CG2-CD1 3.95Å; L1550-L1697 HydrophobicContact CB-CD1 4.19Å; L1550-L1697 HydrophobicContact CB-CD2 4.47Å; L1550-L1697 HydrophobicContact CD1-CB 4.18Å; L1550-L1697 HydrophobicContact CD1-CD1 4.13Å; M1554-L1697 HydrophobicContact SD-CB 4.37Å; M1554-L1697 HydrophobicContact SD-CD2 3.65Å; T1693-L1697 VanDerWaalsContact O-CB 3.3Å; T1693-L1697 WeakPolarHBondContact O-CB 3.29Å; T1693-L1697 PolarHBondContact O-N 3.15Å; G1694-L1697 PolarHBondContact O-N 3.14Å; L1695-L1697 VanDerWaalsContact C-N 3.3Å; L1695-L1697 PolarHBondContact O-N 3.05Å; L1697-D1699 VanDerWaalsContact C-N 3.34Å; L1697-L1700 PolarHBondContact O-N 2.89Å; L1697-F1701 HydrophobicContact CD1-CD2 4.06Å; L1697-F1701 HydrophobicContact CD1-CE1 4.44Å; L1697-F1701 HydrophobicContact CD1-CE2 3.66Å; L1697-F1701 HydrophobicContact CD1-CZ 4.02Å; L1697-F1701 HydrophobicContact CD2-CE2 4.07Å; L1697-F1701 HydrophobicContact CG-CD2 3.92Å; L1697-F1701 HydrophobicContact CG-CE2 3.61Å; L1697-F1701 HydrophobicContact CG-CZ 4.35Å; L1697-F1701 WeakPolarHBondContact O-CB 3.45Å; L1697-F1701 VanDerWaalsContact O-CD2 3.29Å; L1697-F1701 WeakPolarHBondContact O-CD2 3.42Å; L1697-F1701 WeakPolarHBondContact O-CG 3.33Å; L1697-F1701 PolarHBondContact O-N 2.92Å; L1697-L1737 HydrophobicContact CB-CD2 4.47Å; L1697-L1737 HydrophobicContact CD2-CD2 4.28Å; L1697-L1737 HydrophobicContact CG-CD2 4.43Å; L1697-L1741 HydrophobicContact CD2-CD1 3.78Å; L1697-L1741 HydrophobicContact CD2-CD2 4.35Å
1698	K	89.5	Confident	88.2	Confident	17 Å²	17	36.2 Å²	36.2	7%	0.074	19%	0.192	C	C	.	.	H	α-helix	trans	-62.6	-43.7	172.3	-112.6	174	173.6	169.7	0	111.2	G1694 L1695 L1700 F1701 I1702 F1727 L1728 Q1729 T1731 S1732 L1737	G1694-K1698 VanDerWaalsContact O-CB 3.28Å; G1694-K1698 WeakPolarHBondContact O-CB 3.39Å; G1694-K1698 VanDerWaalsContact O-CG 3.29Å; G1694-K1698 WeakPolarHBondContact O-CG 3.34Å; G1694-K1698 PolarHBondContact O-N 3.15Å; L1695-K1698 WeakPolarHBondContact O-CB 3.39Å; L1695-K1698 PolarHBondContact O-N 3.06Å; L1695-K1698 VanDerWaalsContact O-N 3.14Å; K1698-L1700 PolarHBondContact O-N 3.27Å; K1698-F1701 PolarHBondContact O-N 3.05Å; K1698-I1702 HydrophobicContact CG-CD1 3.92Å; K1698-I1702 VanDerWaalsContact O-CG1 3.3Å; K1698-I1702 WeakPolarHBondContact O-CG1 3.38Å; K1698-I1702 PolarHBondContact O-N 2.97Å; K1698-F1727 WeakPolarHBondContact CE-O 3.4Å; K1698-F1727 PolarHBondContact NZ-O 3.24Å; K1698-L1728 HydrophobicContact CB-CD2 4.42Å; K1698-L1728 VanDerWaalsContact CD-O 3.3Å; K1698-L1728 WeakPolarHBondContact CD-O 3.37Å; K1698-L1728 WeakPolarHBondContact CE-O 3.44Å; K1698-L1728 HydrophobicContact CG-CD2 4.24Å; K1698-L1728 PolarHBondContact NZ-O 3.18Å; K1698-Q1729 PolarHBondContact NZ-O 3.29Å; K1698-T1731 PolarHBondContact NZ-O 3.41Å; K1698-S1732 WeakPolarHBondContact CE-OG 3.3Å; K1698-S1732 PolarHBondContact NZ-O 3.3Å; K1698-S1732 PolarHBondContact NZ-OG 3.12Å; K1698-L1737 HydrophobicContact CG-CD2 3.96Å
1699	D	89.6	Confident	88.2	Confident	68.8 Å²	68.8	33.8 Å²	33.8	37%	0.368	18%	0.178	S	C	.	.	H	α-helix	trans	-59.7	-48.2	177.5	-64.6	-22.1	0	0	0	111	L1695 F1696 L1697 F1701 I1702 E1703 H1730	L1695-D1699 VanDerWaalsContact O-CG 3.27Å; L1695-D1699 PolarHBondContact O-N 3.01Å; F1696-D1699 PolarHBondContact O-N 3.12Å; L1697-D1699 VanDerWaalsContact C-N 3.34Å; D1699-F1701 PolarHBondContact O-N 3.25Å; D1699-I1702 PolarHBondContact O-N 3.34Å; D1699-I1702 VanDerWaalsContact O-N 3.15Å; D1699-E1703 WeakPolarHBondContact O-CB 3.37Å; D1699-E1703 PolarHBondContact O-N 3.16Å; D1699-H1730 IonicContact OD1-CE1 2.94Å; D1699-H1730 PolarHBondContact OD1-CE1 3.24Å; D1699-H1730 VanDerWaalsContact OD1-CE1 3.25Å; D1699-H1730 IonicContact OD1-ND1 2.65Å
1700	L	89.5	Confident	88.2	Confident	1.8 Å²	1.8	40.3 Å²	40.3	1%	0.009	21%	0.205	C	C	.	.	H	α-helix	trans	-59.8	-43	174.9	-73.2	174.5	0	0	0	112.4	I1529 T1546 V1547 L1550 F1696 L1697 K1698 I1702 E1703 F1704 F1708	I1529-L1700 HydrophobicContact CD1-CD1 4.45Å; I1529-L1700 HydrophobicContact CD1-CD2 3.86Å; I1529-L1700 HydrophobicContact CG2-CD2 4.43Å; T1546-L1700 HydrophobicContact CG2-CD1 4.01Å; V1547-L1700 HydrophobicContact CG2-CB 4.24Å; V1547-L1700 HydrophobicContact CG2-CD1 4.29Å; L1550-L1700 HydrophobicContact CD1-CD1 3.88Å; F1696-L1700 HydrophobicContact CD1-CD1 4.39Å; F1696-L1700 HydrophobicContact CD2-CD1 4.42Å; F1696-L1700 HydrophobicContact CD2-CG 4.29Å; F1696-L1700 HydrophobicContact CE1-CD1 4.02Å; F1696-L1700 HydrophobicContact CE2-CD1 4.03Å; F1696-L1700 HydrophobicContact CE2-CD2 4.12Å; F1696-L1700 HydrophobicContact CE2-CG 3.89Å; F1696-L1700 HydrophobicContact CZ-CD1 3.78Å; F1696-L1700 HydrophobicContact CZ-CD2 4.35Å; F1696-L1700 HydrophobicContact CZ-CG 4.15Å; F1696-L1700 WeakPolarHBondContact O-CG 3.31Å; F1696-L1700 PolarHBondContact O-N 3.13Å; L1697-L1700 PolarHBondContact O-N 2.89Å; K1698-L1700 PolarHBondContact O-N 3.27Å; L1700-I1702 VanDerWaalsContact C-N 3.26Å; L1700-I1702 PolarHBondContact O-N 3.25Å; L1700-E1703 PolarHBondContact O-N 3.03Å; L1700-F1704 HydrophobicContact CD2-CD2 4.2Å; L1700-F1704 HydrophobicContact CD2-CE2 4.04Å; L1700-F1704 PolarHBondContact O-N 3.3Å; L1700-F1704 VanDerWaalsContact O-N 3.07Å; L1700-F1708 WeakPolarHBondContact O-CE2 3.28Å
1701	F	88.7	Confident	88	Confident	1.2 Å²	1.2	41.5 Å²	41.5	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-63.8	-30	177.3	-80.5	-45.9	0	0	0	113.2	V1547 L1697 K1698 D1699 M1705 F1708 L1712 F1721 L1728 L1741 W1746	V1547-F1701 HydrophobicContact CG1-CD1 4.46Å; V1547-F1701 HydrophobicContact CG1-CE1 3.66Å; V1547-F1701 HydrophobicContact CG1-CZ 3.81Å; V1547-F1701 HydrophobicContact CG2-CD1 4.47Å; V1547-F1701 HydrophobicContact CG2-CE1 4.32Å; L1697-F1701 HydrophobicContact CD1-CD2 4.06Å; L1697-F1701 HydrophobicContact CD1-CE1 4.44Å; L1697-F1701 HydrophobicContact CD1-CE2 3.66Å; L1697-F1701 HydrophobicContact CD1-CZ 4.02Å; L1697-F1701 HydrophobicContact CD2-CE2 4.07Å; L1697-F1701 HydrophobicContact CG-CD2 3.92Å; L1697-F1701 HydrophobicContact CG-CE2 3.61Å; L1697-F1701 HydrophobicContact CG-CZ 4.35Å; L1697-F1701 WeakPolarHBondContact O-CB 3.45Å; L1697-F1701 VanDerWaalsContact O-CD2 3.29Å; L1697-F1701 WeakPolarHBondContact O-CD2 3.42Å; L1697-F1701 WeakPolarHBondContact O-CG 3.33Å; L1697-F1701 PolarHBondContact O-N 2.92Å; K1698-F1701 PolarHBondContact O-N 3.05Å; D1699-F1701 PolarHBondContact O-N 3.25Å; F1701-M1705 VanDerWaalsContact O-CA 3.25Å; F1701-M1705 WeakPolarHBondContact O-CA 3.35Å; F1701-M1705 VanDerWaalsContact O-CB 3.3Å; F1701-M1705 WeakPolarHBondContact O-CB 3.28Å; F1701-M1705 PolarHBondContact O-N 3.17Å; F1701-F1708 AromaticContact CD1-CD2 3.81Å; F1701-F1708 HydrophobicContact CD1-CD2 3.81Å; F1701-F1708 HydrophobicContact CD1-CE2 4.08Å; F1701-F1708 HydrophobicContact CE1-CD2 4.41Å; F1701-L1712 HydrophobicContact CE1-CD1 4.05Å; F1701-F1721 HydrophobicContact CB-CE1 4.33Å; F1701-F1721 HydrophobicContact CD1-CE1 4.22Å; F1701-F1721 AromaticContact CD1-CZ 3.79Å; F1701-F1721 HydrophobicContact CD1-CZ 3.79Å; F1701-F1721 HydrophobicContact CE1-CZ 4.24Å; F1701-F1721 HydrophobicContact CG-CE1 4.43Å; F1701-F1721 HydrophobicContact CG-CZ 4.42Å; F1701-L1728 HydrophobicContact CB-CD1 4.15Å; F1701-L1728 HydrophobicContact CB-CD2 3.85Å; F1701-L1728 HydrophobicContact CD2-CD2 3.92Å; F1701-L1728 HydrophobicContact CG-CD2 4.04Å; F1701-L1741 HydrophobicContact CE2-CD2 4.43Å; F1701-L1741 HydrophobicContact CZ-CD2 4.34Å; F1701-W1746 AromaticContact CE1-CH2 3.92Å; F1701-W1746 HydrophobicContact CE1-CH2 4.33Å; F1701-W1746 AromaticContact CE1-CZ3 3.86Å; F1701-W1746 HydrophobicContact CE1-CZ3 3.9Å; F1701-W1746 HydrophobicContact CZ-CE3 4.47Å; F1701-W1746 HydrophobicContact CZ-CH2 4.15Å; F1701-W1746 AromaticContact CZ-CZ3 3.77Å; F1701-W1746 HydrophobicContact CZ-CZ3 3.83Å
1702	I	87.2	Confident	87.9	Confident	73 Å²	73	40.5 Å²	40.5	37%	0.374	20%	0.202	S	C	.	.	H	α-helix	trans	-80.5	-46.8	176.8	-67.9	165.1	0	0	0	110.8	K1698 D1699 L1700 F1704 M1705 L1728	K1698-I1702 HydrophobicContact CG-CD1 3.92Å; K1698-I1702 VanDerWaalsContact O-CG1 3.3Å; K1698-I1702 WeakPolarHBondContact O-CG1 3.38Å; K1698-I1702 PolarHBondContact O-N 2.97Å; D1699-I1702 PolarHBondContact O-N 3.34Å; D1699-I1702 VanDerWaalsContact O-N 3.15Å; L1700-I1702 VanDerWaalsContact C-N 3.26Å; L1700-I1702 PolarHBondContact O-N 3.25Å; I1702-F1704 PolarHBondContact O-N 3.13Å; I1702-M1705 WeakPolarHBondContact O-CB 3.34Å; I1702-M1705 PolarHBondContact O-N 3.08Å; I1702-L1728 HydrophobicContact CG1-CB 4.44Å
1703	E	87.6	Confident	87.7	Confident	109.8 Å²	109.8	41.2 Å²	41.2	51%	0.513	20%	0.203	S	C	.	.	H	α-helix	trans	-62.2	-44.1	-178.5	-174.8	178.5	-170.2	0	0	112	D1699 L1700	D1699-E1703 WeakPolarHBondContact O-CB 3.37Å; D1699-E1703 PolarHBondContact O-N 3.16Å; L1700-E1703 PolarHBondContact O-N 3.03Å
1704	F	87.3	Confident	87.3	Confident	16.4 Å²	16.4	41.4 Å²	41.4	7%	0.072	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	19.1	-178.2	-64.1	-86.3	0	0	0	113.2	I1529 P1539 D1540 A1543 L1700 I1702 D1706 Y1707 F1708	I1529-F1704 HydrophobicContact CG2-CE2 3.73Å; I1529-F1704 HydrophobicContact CG2-CZ 3.6Å; P1539-F1704 HydrophobicContact CB-CE1 3.92Å; P1539-F1704 HydrophobicContact CB-CZ 4.21Å; P1539-F1704 HydrophobicContact CG-CE1 4.03Å; D1540-F1704 WeakPolarHBondContact OD1-CD1 3.11Å; A1543-F1704 HydrophobicContact CB-CD1 4.11Å; A1543-F1704 HydrophobicContact CB-CD2 3.68Å; A1543-F1704 HydrophobicContact CB-CE1 4.2Å; A1543-F1704 HydrophobicContact CB-CE2 3.78Å; A1543-F1704 HydrophobicContact CB-CG 3.87Å; A1543-F1704 HydrophobicContact CB-CZ 4.05Å; L1700-F1704 HydrophobicContact CD2-CD2 4.2Å; L1700-F1704 HydrophobicContact CD2-CE2 4.04Å; L1700-F1704 PolarHBondContact O-N 3.3Å; L1700-F1704 VanDerWaalsContact O-N 3.07Å; I1702-F1704 PolarHBondContact O-N 3.13Å; F1704-D1706 VanDerWaalsContact C-N 3.27Å; F1704-D1706 PolarHBondContact O-N 3.26Å; F1704-D1706 VanDerWaalsContact O-N 3.13Å; F1704-Y1707 WeakPolarHBondContact O-CA 3.46Å; F1704-Y1707 PolarHBondContact O-N 3.33Å; F1704-F1708 HydrophobicContact CB-CD1 4.45Å; F1704-F1708 HydrophobicContact CB-CD2 3.77Å; F1704-F1708 HydrophobicContact CB-CE1 4.28Å; F1704-F1708 HydrophobicContact CB-CE2 3.49Å; F1704-F1708 VanDerWaalsContact CB-CE2 3.47Å; F1704-F1708 HydrophobicContact CB-CG 4.32Å; F1704-F1708 HydrophobicContact CB-CZ 3.76Å; F1704-F1708 HydrophobicContact CG-CE2 4.42Å; F1704-F1708 HydrophobicContact CG-CZ 4.36Å; F1704-F1708 WeakPolarHBondContact O-CG 3.32Å; F1704-F1708 PolarHBondContact O-N 3.13Å
1705	M	86.7	Confident	86.9	Confident	62.4 Å²	62.4	44.7 Å²	44.7	31%	0.307	23%	0.226	S	C	.	.	H	α-helix	trans	-53.5	-40.1	-176.2	-174.2	172.6	61.8	0	0	113.2	F1701 I1702 Y1707 F1708 S1709 F1721 L1725	F1701-M1705 VanDerWaalsContact O-CA 3.25Å; F1701-M1705 WeakPolarHBondContact O-CA 3.35Å; F1701-M1705 VanDerWaalsContact O-CB 3.3Å; F1701-M1705 WeakPolarHBondContact O-CB 3.28Å; F1701-M1705 PolarHBondContact O-N 3.17Å; I1702-M1705 WeakPolarHBondContact O-CB 3.34Å; I1702-M1705 PolarHBondContact O-N 3.08Å; M1705-Y1707 VanDerWaalsContact C-N 3.3Å; M1705-Y1707 PolarHBondContact O-N 3.22Å; M1705-F1708 PolarHBondContact O-N 3.18Å; M1705-S1709 VanDerWaalsContact O-CB 3.25Å; M1705-S1709 WeakPolarHBondContact O-CB 3.38Å; M1705-S1709 PolarHBondContact O-N 3.06Å; M1705-S1709 PolarHBondContact O-OG 3.27Å; M1705-F1721 HydrophobicContact CG-CD1 3.87Å; M1705-F1721 HydrophobicContact CG-CE1 4.23Å; M1705-F1721 HydrophobicContact SD-CD1 4.29Å; M1705-L1725 HydrophobicContact CE-CD2 4.42Å; M1705-L1725 HydrophobicContact SD-CD1 3.64Å; M1705-L1725 WeakPolarHBondContact SD-CD1 3.44Å; M1705-L1725 HydrophobicContact SD-CD2 3.74Å; M1705-L1725 HydrophobicContact SD-CG 4.2Å
1706	D	84.4	Confident	86.3	Confident	119.2 Å²	119.2	48.6 Å²	48.6	64%	0.637	24%	0.241	S	C	*	.	H	α-helix	trans	-66.2	-26.2	179	-92.5	13.7	0	0	0	113.3	F1704 S1709 K1710	F1704-D1706 VanDerWaalsContact C-N 3.27Å; F1704-D1706 PolarHBondContact O-N 3.26Å; F1704-D1706 VanDerWaalsContact O-N 3.13Å; D1706-S1709 PolarHBondContact O-OG 3.2Å; D1706-K1710 WeakPolarHBondContact O-CD 3.18Å; D1706-K1710 WeakPolarHBondContact O-CG 3.44Å; D1706-K1710 PolarHBondContact O-NZ 3.04Å; D1706-K1710 IonicContact OD2-NZ 3.62Å
1707	Y	86.5	Confident	85.6	Confident	68.8 Å²	68.8	51 Å²	51	27%	0.27	27%	0.268	S	S	.	.	H	α-helix	trans	-88.8	-45.4	174.9	174.4	-101.5	0	0	0	111.1	D1540 L1544 F1704 M1705 S1709 K1710 T1711	D1540-Y1707 HydrophobicContact CB-CD1 3.82Å; D1540-Y1707 HydrophobicContact CB-CD2 3.78Å; D1540-Y1707 HydrophobicContact CB-CE1 3.77Å; D1540-Y1707 HydrophobicContact CB-CE2 3.72Å; D1540-Y1707 HydrophobicContact CB-CG 3.83Å; D1540-Y1707 WeakPolarHBondContact OD2-CD2 3.42Å; L1544-Y1707 HydrophobicContact CB-CE1 4.23Å; L1544-Y1707 HydrophobicContact CD1-CE1 4.49Å; L1544-Y1707 HydrophobicContact CD2-CE1 4.22Å; F1704-Y1707 WeakPolarHBondContact O-CA 3.46Å; F1704-Y1707 PolarHBondContact O-N 3.33Å; M1705-Y1707 VanDerWaalsContact C-N 3.3Å; M1705-Y1707 PolarHBondContact O-N 3.22Å; Y1707-S1709 VanDerWaalsContact C-N 3.32Å; Y1707-S1709 PolarHBondContact O-N 3.19Å; Y1707-K1710 WeakPolarHBondContact O-CB 3.24Å; Y1707-K1710 PolarHBondContact O-N 3.01Å; Y1707-T1711 HydrophobicContact CE1-CG2 4.36Å; Y1707-T1711 WeakPolarHBondContact O-CB 3.3Å; Y1707-T1711 PolarHBondContact O-N 2.89Å; Y1707-T1711 VanDerWaalsContact O-N 3.15Å; Y1707-T1711 PolarHBondContact O-OG1 3.06Å
1708	F	88.3	Confident	85.3	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-68.6	-34.5	-177.9	-65.1	-32	0	0	0	113.5	A1543 L1544 V1547 L1700 F1701 F1704 M1705 K1710 T1711 L1712 F1721	A1543-F1708 HydrophobicContact CB-CE1 4.49Å; A1543-F1708 HydrophobicContact CB-CZ 3.95Å; L1544-F1708 HydrophobicContact CB-CE1 4.02Å; L1544-F1708 HydrophobicContact CD1-CD1 4.03Å; L1544-F1708 HydrophobicContact CD1-CE1 3.83Å; V1547-F1708 HydrophobicContact CB-CZ 4.4Å; V1547-F1708 HydrophobicContact CG2-CE2 3.86Å; V1547-F1708 HydrophobicContact CG2-CZ 3.65Å; L1700-F1708 WeakPolarHBondContact O-CE2 3.28Å; F1701-F1708 AromaticContact CD1-CD2 3.81Å; F1701-F1708 HydrophobicContact CD1-CD2 3.81Å; F1701-F1708 HydrophobicContact CD1-CE2 4.08Å; F1701-F1708 HydrophobicContact CE1-CD2 4.41Å; F1704-F1708 HydrophobicContact CB-CD1 4.45Å; F1704-F1708 HydrophobicContact CB-CD2 3.77Å; F1704-F1708 HydrophobicContact CB-CE1 4.28Å; F1704-F1708 HydrophobicContact CB-CE2 3.49Å; F1704-F1708 VanDerWaalsContact CB-CE2 3.47Å; F1704-F1708 HydrophobicContact CB-CG 4.32Å; F1704-F1708 HydrophobicContact CB-CZ 3.76Å; F1704-F1708 HydrophobicContact CG-CE2 4.42Å; F1704-F1708 HydrophobicContact CG-CZ 4.36Å; F1704-F1708 WeakPolarHBondContact O-CG 3.32Å; F1704-F1708 PolarHBondContact O-N 3.13Å; M1705-F1708 PolarHBondContact O-N 3.18Å; F1708-K1710 PolarHBondContact O-N 3.06Å; F1708-T1711 PolarHBondContact O-N 3.17Å; F1708-T1711 VanDerWaalsContact O-N 3.11Å; F1708-L1712 HydrophobicContact CB-CD1 4.21Å; F1708-L1712 HydrophobicContact CB-CG 4.44Å; F1708-L1712 HydrophobicContact CD1-CD1 4.48Å; F1708-L1712 HydrophobicContact CG-CD1 4.4Å; F1708-L1712 WeakPolarHBondContact O-CB 3.32Å; F1708-L1712 PolarHBondContact O-N 3.11Å; F1708-F1721 HydrophobicContact CB-CD2 4.43Å; F1708-F1721 HydrophobicContact CB-CE1 4.24Å; F1708-F1721 HydrophobicContact CB-CE2 3.55Å; F1708-F1721 VanDerWaalsContact CB-CE2 3.49Å; F1708-F1721 HydrophobicContact CB-CZ 3.36Å; F1708-F1721 VanDerWaalsContact CB-CZ 3.45Å; F1708-F1721 HydrophobicContact CD2-CZ 4.27Å; F1708-F1721 HydrophobicContact CG-CZ 4.27Å; F1708-F1721 WeakPolarHBondContact O-CE2 3.48Å
1709	S	84.8	Confident	84.9	Confident	17.8 Å²	17.8	59.7 Å²	59.7	12%	0.124	31%	0.309	C	S	.	.	H	α-helix	trans	-56.7	-36.8	172.5	50.2	0	0	0	0	113	M1705 D1706 Y1707 F1721	M1705-S1709 VanDerWaalsContact O-CB 3.25Å; M1705-S1709 WeakPolarHBondContact O-CB 3.38Å; M1705-S1709 PolarHBondContact O-N 3.06Å; M1705-S1709 PolarHBondContact O-OG 3.27Å; D1706-S1709 PolarHBondContact O-OG 3.2Å; Y1707-S1709 VanDerWaalsContact C-N 3.32Å; Y1707-S1709 PolarHBondContact O-N 3.19Å; S1709-F1721 VanDerWaalsContact CA-CD2 3.49Å
1710	K	84.9	Confident	84.6	Confident	139.6 Å²	139.6	56.8 Å²	56.8	61%	0.607	29%	0.293	S	S	*	.	H	α-helix	trans	-84.2	-14	179.1	-57.5	-178.2	-176.1	97.1	0	113.8	D1706 Y1707 F1708 I1713	D1706-K1710 WeakPolarHBondContact O-CD 3.18Å; D1706-K1710 WeakPolarHBondContact O-CG 3.44Å; D1706-K1710 PolarHBondContact O-NZ 3.04Å; D1706-K1710 IonicContact OD2-NZ 3.62Å; Y1707-K1710 WeakPolarHBondContact O-CB 3.24Å; Y1707-K1710 PolarHBondContact O-N 3.01Å; F1708-K1710 PolarHBondContact O-N 3.06Å; K1710-I1713 VanDerWaalsContact O-CD1 3.29Å; K1710-I1713 WeakPolarHBondContact O-CD1 3.37Å
1711	T	85.1	Confident	84.2	Confident	26 Å²	26	57 Å²	57	16%	0.16	29%	0.294	C	S	.	.	H	α-helix	trans	-111.9	-46.2	-172	-56.5	0	0	0	0	112.1	L1544 Y1707 F1708 I1713 Y1753	L1544-T1711 HydrophobicContact CD1-CG2 4.32Å; L1544-T1711 HydrophobicContact CD2-CG2 4.04Å; Y1707-T1711 HydrophobicContact CE1-CG2 4.36Å; Y1707-T1711 WeakPolarHBondContact O-CB 3.3Å; Y1707-T1711 PolarHBondContact O-N 2.89Å; Y1707-T1711 VanDerWaalsContact O-N 3.15Å; Y1707-T1711 PolarHBondContact O-OG1 3.06Å; F1708-T1711 PolarHBondContact O-N 3.17Å; F1708-T1711 VanDerWaalsContact O-N 3.11Å; T1711-I1713 VanDerWaalsContact C-N 3.31Å; T1711-I1713 PolarHBondContact O-N 3.36Å; T1711-Y1753 HydrophobicContact CG2-CD1 4.44Å; T1711-Y1753 HydrophobicContact CG2-CG 4.32Å; T1711-Y1753 VanDerWaalsContact O-CD2 3.22Å; T1711-Y1753 WeakPolarHBondContact O-CD2 3.4Å; T1711-Y1753 WeakPolarHBondContact O-CE2 3.4Å; T1711-Y1753 VanDerWaalsContact O-CG 3.27Å
1712	L	85.7	Confident	83.5	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.32	C	S	.	.	S	Bend	trans	-85.9	67.8	178.1	-58.6	-177.8	0	0	0	110.4	L1544 F1701 F1708 L1720 F1721 W1746 S1749 L1750 A1754	L1544-L1712 HydrophobicContact CD1-CD2 4.06Å; L1544-L1712 HydrophobicContact CD1-CG 4.45Å; F1701-L1712 HydrophobicContact CE1-CD1 4.05Å; F1708-L1712 HydrophobicContact CB-CD1 4.21Å; F1708-L1712 HydrophobicContact CB-CG 4.44Å; F1708-L1712 HydrophobicContact CD1-CD1 4.48Å; F1708-L1712 HydrophobicContact CG-CD1 4.4Å; F1708-L1712 WeakPolarHBondContact O-CB 3.32Å; F1708-L1712 PolarHBondContact O-N 3.11Å; L1712-L1720 WeakPolarHBondContact O-CG 3.27Å; L1712-F1721 HydrophobicContact CB-CE2 4.25Å; L1712-F1721 HydrophobicContact CD1-CE2 4.2Å; L1712-F1721 HydrophobicContact CD1-CZ 4.47Å; L1712-W1746 HydrophobicContact CD1-CH2 4.14Å; L1712-W1746 HydrophobicContact CD1-CZ3 3.99Å; L1712-S1749 VanDerWaalsContact CA-OG 3.24Å; L1712-S1749 WeakPolarHBondContact CA-OG 3.3Å; L1712-L1750 HydrophobicContact CD1-CD2 3.9Å; L1712-L1750 HydrophobicContact CD2-CD2 4.12Å; L1712-A1754 HydrophobicContact CD2-CB 4.33Å
1713	I	84.3	Confident	82.8	Confident	48 Å²	48	61.4 Å²	61.4	25%	0.246	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-87.7	140.1	178.9	-54.9	179.4	0	0	0	109.6	K1710 T1711 G1717 Q1718 S1749 Y1753	K1710-I1713 VanDerWaalsContact O-CD1 3.29Å; K1710-I1713 WeakPolarHBondContact O-CD1 3.37Å; T1711-I1713 VanDerWaalsContact C-N 3.31Å; T1711-I1713 PolarHBondContact O-N 3.36Å; I1713-G1717 VanDerWaalsContact CG2-CA 3.42Å; I1713-G1717 VanDerWaalsContact CG2-O 3.31Å; I1713-G1717 WeakPolarHBondContact CG2-O 3.35Å; I1713-Q1718 WeakPolarHBondContact CG2-O 3.28Å; I1713-S1749 PolarHBondContact N-OG 3.01Å; I1713-S1749 VanDerWaalsContact N-OG 3.15Å; I1713-S1749 VanDerWaalsContact O-CB 3.32Å; I1713-S1749 WeakPolarHBondContact O-CB 3.38Å; I1713-S1749 PolarHBondContact O-OG 2.95Å; I1713-Y1753 HydrophobicContact CB-CE2 4.4Å
1714	G	81	Confident	82.3	Confident	5.6 Å²	5.6	56.4 Å²	56.4	6%	0.058	31%	0.306	C	S	.	.			trans	-68.1	174.7	176.2	0	0	0	0	0	114.1	H1716 G1717 Q1718 E1745	G1714-H1716 PolarHBondContact O-N 2.87Å; G1714-H1716 VanDerWaalsContact O-N 3.13Å; G1714-G1717 PolarHBondContact O-N 3.28Å; G1714-G1717 VanDerWaalsContact O-N 3.12Å; G1714-Q1718 PolarHBondContact N-O 3.12Å; G1714-E1745 VanDerWaalsContact CA-OE2 3.29Å; G1714-E1745 WeakPolarHBondContact CA-OE2 3.36Å
1715	T	79.9	Confident	81.8	Confident	70.2 Å²	70.2	59.2 Å²	59.2	43%	0.431	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-29.1	-172.3	58.3	0	0	0	0	113.6	E1745 T1748	T1715-E1745 WeakPolarHBondContact CB-OE1 3.34Å; T1715-E1745 WeakPolarHBondContact CG2-OE1 3.37Å; T1715-E1745 PolarHBondContact N-OE2 3.13Å; T1715-E1745 VanDerWaalsContact OG1-CD 3.3Å; T1715-E1745 PolarHBondContact OG1-OE1 3.05Å; T1715-E1745 PolarHBondContact OG1-OE2 3.01Å; T1715-T1748 HydrophobicContact CG2-CG2 3.88Å; T1715-T1748 WeakPolarHBondContact CG2-OG1 3.35Å
1716	H	78.5	Confident	81.2	Confident	168 Å²	168	59.7 Å²	59.7	78%	0.778	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	10.8	179.9	-60.8	-58.9	0	0	0	114.4	G1714 Q1718	G1714-H1716 PolarHBondContact O-N 2.87Å; G1714-H1716 VanDerWaalsContact O-N 3.13Å; H1716-Q1718 VanDerWaalsContact C-N 3.3Å; H1716-Q1718 VanDerWaalsContact C-OE1 3.26Å; H1716-Q1718 VanDerWaalsContact N-OE1 3.11Å
1717	G	77.6	Confident	80.8	Confident	57 Å²	57	56.7 Å²	56.7	59%	0.588	31%	0.311	S	S	*	.	S	Bend	trans	87.3	7.9	-178.7	0	0	0	0	0	114.6	I1713 G1714	I1713-G1717 VanDerWaalsContact CG2-CA 3.42Å; I1713-G1717 VanDerWaalsContact CG2-O 3.31Å; I1713-G1717 WeakPolarHBondContact CG2-O 3.35Å; G1714-G1717 PolarHBondContact O-N 3.28Å; G1714-G1717 VanDerWaalsContact O-N 3.12Å
1718	Q	84	Confident	80.4	Confident	80 Å²	80	53.7 Å²	53.7	37%	0.374	30%	0.3	S	S	.	.			trans	-82.2	141.1	179.9	70.8	-107.6	4.3	0	0	112.7	I1713 G1714 H1716 L1720 E1745	I1713-Q1718 WeakPolarHBondContact CG2-O 3.28Å; G1714-Q1718 PolarHBondContact N-O 3.12Å; H1716-Q1718 VanDerWaalsContact C-N 3.3Å; H1716-Q1718 VanDerWaalsContact C-OE1 3.26Å; H1716-Q1718 VanDerWaalsContact N-OE1 3.11Å; Q1718-L1720 HydrophobicContact CG-CD2 4.4Å; Q1718-L1720 PolarHBondContact O-N 3.05Å; Q1718-E1745 VanDerWaalsContact NE2-CD 3.34Å; Q1718-E1745 PolarHBondContact NE2-OE2 2.93Å
1719	E	82	Confident	79.9	Confident	119.4 Å²	119.4	58.8 Å²	58.8	56%	0.558	32%	0.323	S	S	*	.	B	Isolated β-bridge	trans	-67.8	127.6	171.9	-63.1	-178.4	178.5	0	0	110.1	P1722	E1719-P1722 HydrophobicContact CB-CG 4.14Å; E1719-P1722 WeakPolarHBondContact O-CD 3.45Å
1720	L	81.5	Confident	79.4	Confident	8.6 Å²	8.6	64.3 Å²	64.3	5%	0.045	35%	0.347	C	S	.	.	S	Bend	trans	-83.1	-25.8	-178.9	-62.4	180	0	0	0	113.1	L1712 Q1718 P1722 S1723 V1724 E1745 W1746	L1712-L1720 WeakPolarHBondContact O-CG 3.27Å; Q1718-L1720 HydrophobicContact CG-CD2 4.4Å; Q1718-L1720 PolarHBondContact O-N 3.05Å; L1720-P1722 VanDerWaalsContact C-CD 3.47Å; L1720-S1723 WeakPolarHBondContact O-CB 3.37Å; L1720-S1723 PolarHBondContact O-N 3.16Å; L1720-S1723 PolarHBondContact O-OG 3.07Å; L1720-V1724 VanDerWaalsContact O-CG2 3.24Å; L1720-V1724 WeakPolarHBondContact O-CG2 3.39Å; L1720-E1745 HydrophobicContact CD2-CB 4.04Å; L1720-E1745 HydrophobicContact CD2-CG 4.47Å; L1720-W1746 HydrophobicContact CB-CH2 4.32Å; L1720-W1746 HydrophobicContact CB-CZ2 3.73Å; L1720-W1746 HydrophobicContact CD1-CD2 4.17Å; L1720-W1746 HydrophobicContact CD1-CG 4.27Å; L1720-W1746 HydrophobicContact CD1-CZ2 4.45Å
1721	F	81.5	Confident	78.7	Confident	6.4 Å²	6.4	62 Å²	62	3%	0.028	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-63.7	-39.8	-174.9	-84.1	-100.3	0	0	0	115.6	F1701 M1705 F1708 S1709 L1712 S1723 V1724 L1725 L1728 W1746	F1701-F1721 HydrophobicContact CB-CE1 4.33Å; F1701-F1721 HydrophobicContact CD1-CE1 4.22Å; F1701-F1721 AromaticContact CD1-CZ 3.79Å; F1701-F1721 HydrophobicContact CD1-CZ 3.79Å; F1701-F1721 HydrophobicContact CE1-CZ 4.24Å; F1701-F1721 HydrophobicContact CG-CE1 4.43Å; F1701-F1721 HydrophobicContact CG-CZ 4.42Å; M1705-F1721 HydrophobicContact CG-CD1 3.87Å; M1705-F1721 HydrophobicContact CG-CE1 4.23Å; M1705-F1721 HydrophobicContact SD-CD1 4.29Å; F1708-F1721 HydrophobicContact CB-CD2 4.43Å; F1708-F1721 HydrophobicContact CB-CE1 4.24Å; F1708-F1721 HydrophobicContact CB-CE2 3.55Å; F1708-F1721 VanDerWaalsContact CB-CE2 3.49Å; F1708-F1721 HydrophobicContact CB-CZ 3.36Å; F1708-F1721 VanDerWaalsContact CB-CZ 3.45Å; F1708-F1721 HydrophobicContact CD2-CZ 4.27Å; F1708-F1721 HydrophobicContact CG-CZ 4.27Å; F1708-F1721 WeakPolarHBondContact O-CE2 3.48Å; S1709-F1721 VanDerWaalsContact CA-CD2 3.49Å; L1712-F1721 HydrophobicContact CB-CE2 4.25Å; L1712-F1721 HydrophobicContact CD1-CE2 4.2Å; L1712-F1721 HydrophobicContact CD1-CZ 4.47Å; F1721-S1723 VanDerWaalsContact C-N 3.27Å; F1721-S1723 PolarHBondContact O-N 3.01Å; F1721-S1723 VanDerWaalsContact O-N 3.16Å; F1721-V1724 CarbonylContact O-C 3.58Å; F1721-V1724 WeakPolarHBondContact O-CA 3.43Å; F1721-V1724 WeakPolarHBondContact O-CB 3.49Å; F1721-V1724 PolarHBondContact O-N 3.21Å; F1721-L1725 WeakPolarHBondContact O-CB 3.34Å; F1721-L1725 VanDerWaalsContact O-CD1 3.23Å; F1721-L1725 WeakPolarHBondContact O-CD1 3.31Å; F1721-L1725 PolarHBondContact O-N 2.94Å; F1721-L1725 VanDerWaalsContact O-N 3.11Å; F1721-L1728 HydrophobicContact CD1-CD1 4.32Å; F1721-L1728 HydrophobicContact CE1-CD1 4.3Å; F1721-W1746 HydrophobicContact CD2-CH2 4.28Å; F1721-W1746 HydrophobicContact CE1-CH2 4.41Å; F1721-W1746 AromaticContact CE2-CH2 3.74Å; F1721-W1746 HydrophobicContact CE2-CH2 3.8Å; F1721-W1746 HydrophobicContact CE2-CZ2 4.43Å; F1721-W1746 HydrophobicContact CE2-CZ3 4.24Å; F1721-W1746 AromaticContact CZ-CH2 3.77Å; F1721-W1746 HydrophobicContact CZ-CH2 4Å; F1721-W1746 HydrophobicContact CZ-CZ3 4.36Å
1722	P	75.2	Confident	78.2	Confident	84.2 Å²	84.2	63.4 Å²	63.4	55%	0.547	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-57.5	-31.2	-179.7	-28.4	36.6	0	0	0	114.6	E1719 L1720 V1724	E1719-P1722 HydrophobicContact CB-CG 4.14Å; E1719-P1722 WeakPolarHBondContact O-CD 3.45Å; L1720-P1722 VanDerWaalsContact C-CD 3.47Å; P1722-V1724 VanDerWaalsContact C-N 3.29Å; P1722-V1724 PolarHBondContact O-N 3.47Å
1723	S	72	Confident	78.1	Confident	82.6 Å²	82.6	65 Å²	65	58%	0.578	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-80.3	-12.5	175.9	60.1	0	0	0	0	114	L1720 F1721 F1727	L1720-S1723 WeakPolarHBondContact O-CB 3.37Å; L1720-S1723 PolarHBondContact O-N 3.16Å; L1720-S1723 PolarHBondContact O-OG 3.07Å; F1721-S1723 VanDerWaalsContact C-N 3.27Å; F1721-S1723 PolarHBondContact O-N 3.01Å; F1721-S1723 VanDerWaalsContact O-N 3.16Å; S1723-F1727 WeakPolarHBondContact O-CE2 3.36Å
1724	V	75.9	Confident	78	Confident	4.8 Å²	4.8	63.2 Å²	63.2	3%	0.029	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-19.6	-165.7	172	0	0	0	0	113.2	L1720 F1721 P1722 P1726 F1727 L1728 L1740 W1746	L1720-V1724 VanDerWaalsContact O-CG2 3.24Å; L1720-V1724 WeakPolarHBondContact O-CG2 3.39Å; F1721-V1724 CarbonylContact O-C 3.58Å; F1721-V1724 WeakPolarHBondContact O-CA 3.43Å; F1721-V1724 WeakPolarHBondContact O-CB 3.49Å; F1721-V1724 PolarHBondContact O-N 3.21Å; P1722-V1724 VanDerWaalsContact C-N 3.29Å; P1722-V1724 PolarHBondContact O-N 3.47Å; V1724-P1726 VanDerWaalsContact C-CD 3.5Å; V1724-P1726 VanDerWaalsContact C-N 3.27Å; V1724-P1726 WeakPolarHBondContact O-CD 3.39Å; V1724-P1726 VanDerWaalsContact O-N 3.12Å; V1724-F1727 HydrophobicContact CG1-CD1 4.11Å; V1724-F1727 WeakPolarHBondContact O-CA 3.21Å; V1724-F1727 WeakPolarHBondContact O-CB 3.13Å; V1724-F1727 PolarHBondContact O-N 3.09Å; V1724-F1727 VanDerWaalsContact O-N 3.12Å; V1724-L1728 HydrophobicContact CG1-CD1 3.91Å; V1724-L1728 HydrophobicContact CG1-CD2 4.21Å; V1724-L1728 HydrophobicContact CG1-CG 3.84Å; V1724-L1728 PolarHBondContact O-N 3.17Å; V1724-L1740 HydrophobicContact CB-CD1 4.46Å; V1724-L1740 HydrophobicContact CB-CD2 4.09Å; V1724-L1740 HydrophobicContact CG1-CD1 3.72Å; V1724-L1740 HydrophobicContact CG1-CD2 3.5Å; V1724-L1740 VanDerWaalsContact CG1-CD2 3.46Å; V1724-L1740 HydrophobicContact CG1-CG 4.28Å; V1724-L1740 HydrophobicContact CG2-CD1 3.71Å; V1724-L1740 HydrophobicContact CG2-CD2 3.59Å; V1724-L1740 HydrophobicContact CG2-CG 4.18Å; V1724-W1746 HydrophobicContact CB-CZ2 4.17Å; V1724-W1746 HydrophobicContact CG1-CH2 4.4Å; V1724-W1746 HydrophobicContact CG1-CZ2 4.07Å; V1724-W1746 HydrophobicContact CG2-CH2 4.44Å; V1724-W1746 HydrophobicContact CG2-CZ2 3.74Å; V1724-W1746 VanDerWaalsContact CG2-CZ2 3.43Å; V1724-W1746 VanDerWaalsContact CG2-NE1 3.3Å
1725	L	77.5	Confident	78.1	Confident	75.6 Å²	75.6	64.3 Å²	64.3	40%	0.396	36%	0.363	S	S	.	.	H	α-helix	trans	-50.5	-39.5	177.8	-140.7	74.3	0	0	0	114.9	M1705 F1721 F1727 L1728 Q1729	M1705-L1725 HydrophobicContact CE-CD2 4.42Å; M1705-L1725 HydrophobicContact SD-CD1 3.64Å; M1705-L1725 WeakPolarHBondContact SD-CD1 3.44Å; M1705-L1725 HydrophobicContact SD-CD2 3.74Å; M1705-L1725 HydrophobicContact SD-CG 4.2Å; F1721-L1725 WeakPolarHBondContact O-CB 3.34Å; F1721-L1725 VanDerWaalsContact O-CD1 3.23Å; F1721-L1725 WeakPolarHBondContact O-CD1 3.31Å; F1721-L1725 PolarHBondContact O-N 2.94Å; F1721-L1725 VanDerWaalsContact O-N 3.11Å; L1725-F1727 VanDerWaalsContact C-N 3.31Å; L1725-F1727 PolarHBondContact O-N 3.32Å; L1725-L1728 PolarHBondContact O-N 3.05Å; L1725-Q1729 HydrophobicContact CD1-CG 4.02Å; L1725-Q1729 HydrophobicContact CG-CG 4.47Å; L1725-Q1729 WeakPolarHBondContact O-CB 3.2Å; L1725-Q1729 WeakPolarHBondContact O-CG 3.38Å; L1725-Q1729 PolarHBondContact O-N 3.23Å
1726	P	74.9	Confident	78.4	Confident	72 Å²	72	64.7 Å²	64.7	47%	0.468	36%	0.36	S	S	.	.	H	α-helix	trans	-63.1	-39.1	175.7	-22.6	34.9	0	0	0	113	V1724 L1728 Q1729 H1730 S1732	V1724-P1726 VanDerWaalsContact C-CD 3.5Å; V1724-P1726 VanDerWaalsContact C-N 3.27Å; V1724-P1726 WeakPolarHBondContact O-CD 3.39Å; V1724-P1726 VanDerWaalsContact O-N 3.12Å; P1726-L1728 VanDerWaalsContact C-N 3.33Å; P1726-L1728 PolarHBondContact O-N 3.18Å; P1726-Q1729 WeakPolarHBondContact O-CB 3.36Å; P1726-Q1729 WeakPolarHBondContact O-CG 3.45Å; P1726-Q1729 PolarHBondContact O-N 3.38Å; P1726-H1730 WeakPolarHBondContact O-CB 3.18Å; P1726-H1730 PolarHBondContact O-CD2 2.93Å; P1726-H1730 VanDerWaalsContact O-CD2 3.23Å; P1726-H1730 PolarHBondContact O-N 2.88Å; P1726-S1732 PolarHBondContact O-OG 3.16Å
1727	F	76	Confident	78.8	Confident	57 Å²	57	56.9 Å²	56.9	25%	0.25	32%	0.324	C	S	.	.	H	α-helix	trans	-73	-32	179.1	-92.1	-77.6	0	0	0	112.3	K1698 S1723 V1724 L1725 Q1729 H1730 T1731 S1732 E1736 L1737 L1740	K1698-F1727 WeakPolarHBondContact CE-O 3.4Å; K1698-F1727 PolarHBondContact NZ-O 3.24Å; S1723-F1727 WeakPolarHBondContact O-CE2 3.36Å; V1724-F1727 HydrophobicContact CG1-CD1 4.11Å; V1724-F1727 WeakPolarHBondContact O-CA 3.21Å; V1724-F1727 WeakPolarHBondContact O-CB 3.13Å; V1724-F1727 PolarHBondContact O-N 3.09Å; V1724-F1727 VanDerWaalsContact O-N 3.12Å; L1725-F1727 VanDerWaalsContact C-N 3.31Å; L1725-F1727 PolarHBondContact O-N 3.32Å; F1727-Q1729 VanDerWaalsContact C-N 3.27Å; F1727-Q1729 PolarHBondContact O-N 3.25Å; F1727-H1730 PolarHBondContact O-N 3.05Å; F1727-T1731 HydrophobicContact CD2-CG2 4.05Å; F1727-T1731 HydrophobicContact CE2-CG2 3.59Å; F1727-T1731 HydrophobicContact CZ-CG2 4.5Å; F1727-T1731 WeakPolarHBondContact O-CB 3.36Å; F1727-T1731 PolarHBondContact O-N 3.21Å; F1727-S1732 PolarHBondContact O-OG 3.43Å; F1727-E1736 HydrophobicContact CD1-CB 3.88Å; F1727-E1736 HydrophobicContact CD1-CG 4.22Å; F1727-E1736 HydrophobicContact CD2-CB 4.42Å; F1727-E1736 HydrophobicContact CE1-CB 4.24Å; F1727-E1736 HydrophobicContact CE1-CG 4.42Å; F1727-E1736 HydrophobicContact CE2-CB 3.4Å; F1727-E1736 VanDerWaalsContact CE2-CB 3.43Å; F1727-E1736 HydrophobicContact CE2-CG 4.35Å; F1727-E1736 WeakPolarHBondContact CE2-OE2 3.23Å; F1727-E1736 HydrophobicContact CZ-CB 3.68Å; F1727-L1737 HydrophobicContact CE1-CD1 4.32Å; F1727-L1737 HydrophobicContact CZ-CB 4.26Å; F1727-L1740 HydrophobicContact CB-CD2 4.23Å; F1727-L1740 HydrophobicContact CD1-CD2 4.37Å; F1727-L1740 HydrophobicContact CD2-CD1 4.25Å; F1727-L1740 HydrophobicContact CD2-CD2 4.11Å; F1727-L1740 HydrophobicContact CD2-CG 4.49Å; F1727-L1740 HydrophobicContact CE1-CB 4.4Å; F1727-L1740 HydrophobicContact CE1-CD2 4.06Å; F1727-L1740 HydrophobicContact CE2-CD1 4.45Å; F1727-L1740 HydrophobicContact CG-CD2 4.33Å
1728	L	76.8	Confident	79.2	Confident	5.2 Å²	5.2	54.2 Å²	54.2	3%	0.027	30%	0.296	C	S	.	.	H	α-helix	trans	-71.3	-18.6	176.1	-71.9	175.3	0	0	0	113.2	K1698 F1701 I1702 F1721 V1724 L1725 P1726 H1730 L1737	K1698-L1728 HydrophobicContact CB-CD2 4.42Å; K1698-L1728 VanDerWaalsContact CD-O 3.3Å; K1698-L1728 WeakPolarHBondContact CD-O 3.37Å; K1698-L1728 WeakPolarHBondContact CE-O 3.44Å; K1698-L1728 HydrophobicContact CG-CD2 4.24Å; K1698-L1728 PolarHBondContact NZ-O 3.18Å; F1701-L1728 HydrophobicContact CB-CD1 4.15Å; F1701-L1728 HydrophobicContact CB-CD2 3.85Å; F1701-L1728 HydrophobicContact CD2-CD2 3.92Å; F1701-L1728 HydrophobicContact CG-CD2 4.04Å; I1702-L1728 HydrophobicContact CG1-CB 4.44Å; F1721-L1728 HydrophobicContact CD1-CD1 4.32Å; F1721-L1728 HydrophobicContact CE1-CD1 4.3Å; V1724-L1728 HydrophobicContact CG1-CD1 3.91Å; V1724-L1728 HydrophobicContact CG1-CD2 4.21Å; V1724-L1728 HydrophobicContact CG1-CG 3.84Å; V1724-L1728 PolarHBondContact O-N 3.17Å; L1725-L1728 PolarHBondContact O-N 3.05Å; P1726-L1728 VanDerWaalsContact C-N 3.33Å; P1726-L1728 PolarHBondContact O-N 3.18Å; L1728-H1730 PolarHBondContact O-N 2.96Å; L1728-L1737 HydrophobicContact CD2-CD1 4.11Å
1729	Q	78.1	Confident	79.3	Confident	106.6 Å²	106.6	55.8 Å²	55.8	50%	0.498	31%	0.305	S	S	.	.	S	Bend	trans	-68.9	159.1	174.4	-65.6	-177.6	-0.7	0	0	110.9	K1698 L1725 P1726 F1727 T1731 S1732	K1698-Q1729 PolarHBondContact NZ-O 3.29Å; L1725-Q1729 HydrophobicContact CD1-CG 4.02Å; L1725-Q1729 HydrophobicContact CG-CG 4.47Å; L1725-Q1729 WeakPolarHBondContact O-CB 3.2Å; L1725-Q1729 WeakPolarHBondContact O-CG 3.38Å; L1725-Q1729 PolarHBondContact O-N 3.23Å; P1726-Q1729 WeakPolarHBondContact O-CB 3.36Å; P1726-Q1729 WeakPolarHBondContact O-CG 3.45Å; P1726-Q1729 PolarHBondContact O-N 3.38Å; F1727-Q1729 VanDerWaalsContact C-N 3.27Å; F1727-Q1729 PolarHBondContact O-N 3.25Å; Q1729-T1731 PolarHBondContact O-N 3.28Å; Q1729-S1732 WeakPolarHBondContact O-CB 3.29Å; Q1729-S1732 PolarHBondContact O-N 3.05Å; Q1729-S1732 PolarHBondContact O-OG 2.82Å
1730	H	73.7	Confident	79.6	Confident	133.6 Å²	133.6	51.2 Å²	51.2	62%	0.619	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-20.1	-175	-57.7	-68.7	0	0	0	114.3	L1695 D1699 P1726 F1727 L1728	L1695-H1730 HydrophobicContact CD1-CB 4.29Å; L1695-H1730 WeakPolarHBondContact CD1-ND1 3.27Å; D1699-H1730 IonicContact OD1-CE1 2.94Å; D1699-H1730 PolarHBondContact OD1-CE1 3.24Å; D1699-H1730 VanDerWaalsContact OD1-CE1 3.25Å; D1699-H1730 IonicContact OD1-ND1 2.65Å; P1726-H1730 WeakPolarHBondContact O-CB 3.18Å; P1726-H1730 PolarHBondContact O-CD2 2.93Å; P1726-H1730 VanDerWaalsContact O-CD2 3.23Å; P1726-H1730 PolarHBondContact O-N 2.88Å; F1727-H1730 PolarHBondContact O-N 3.05Å; L1728-H1730 PolarHBondContact O-N 2.96Å
1731	T	71.7	Confident	79.9	Confident	91.2 Å²	91.2	51 Å²	51	56%	0.56	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	21.4	179.1	9.7	0	0	0	0	113.7	K1698 F1727 Q1729	K1698-T1731 PolarHBondContact NZ-O 3.41Å; F1727-T1731 HydrophobicContact CD2-CG2 4.05Å; F1727-T1731 HydrophobicContact CE2-CG2 3.59Å; F1727-T1731 HydrophobicContact CZ-CG2 4.5Å; F1727-T1731 WeakPolarHBondContact O-CB 3.36Å; F1727-T1731 PolarHBondContact O-N 3.21Å; Q1729-T1731 PolarHBondContact O-N 3.28Å
1732	S	74	Confident	80.1	Confident	55 Å²	55	53 Å²	53	39%	0.385	30%	0.298	S	S	.	.	S	Bend	trans	-93	107	176.3	62.2	0	0	0	0	112.1	K1698 P1726 F1727 Q1729 V1734 E1736	K1698-S1732 WeakPolarHBondContact CE-OG 3.3Å; K1698-S1732 PolarHBondContact NZ-O 3.3Å; K1698-S1732 PolarHBondContact NZ-OG 3.12Å; P1726-S1732 PolarHBondContact O-OG 3.16Å; F1727-S1732 PolarHBondContact O-OG 3.43Å; Q1729-S1732 WeakPolarHBondContact O-CB 3.29Å; Q1729-S1732 PolarHBondContact O-N 3.05Å; Q1729-S1732 PolarHBondContact O-OG 2.82Å; S1732-V1734 PolarHBondContact O-N 2.96Å; S1732-E1736 VanDerWaalsContact CB-OE2 3.31Å; S1732-E1736 WeakPolarHBondContact CB-OE2 3.34Å; S1732-E1736 PolarHBondContact OG-OE2 3.08Å
1733	S	83	Confident	80.7	Confident	34.2 Å²	34.2	51.4 Å²	51.4	24%	0.239	29%	0.288	C	S	.	.			trans	-62.3	136.4	-178.6	137.3	0	0	0	0	111.6	V1735 E1736 L1737	S1733-V1735 VanDerWaalsContact C-N 3.26Å; S1733-V1735 PolarHBondContact O-N 3.3Å; S1733-V1735 PolarHBondContact OG-N 3.27Å; S1733-E1736 WeakPolarHBondContact CB-OE1 3.42Å; S1733-E1736 PolarHBondContact N-OE1 2.94Å; S1733-E1736 PolarHBondContact N-OE2 3.07Å; S1733-E1736 WeakPolarHBondContact O-CB 3.47Å; S1733-E1736 PolarHBondContact O-N 3.13Å; S1733-E1736 VanDerWaalsContact O-N 3.12Å; S1733-E1736 WeakPolarHBondContact OG-CB 3.32Å; S1733-E1736 VanDerWaalsContact OG-CG 3.29Å; S1733-E1736 WeakPolarHBondContact OG-CG 3.4Å; S1733-E1736 PolarHBondContact OG-N 3.15Å; S1733-E1736 VanDerWaalsContact OG-N 3.14Å; S1733-E1736 PolarHBondContact OG-OE1 3.28Å; S1733-E1736 PolarHBondContact OG-OE2 2.83Å; S1733-L1737 PolarHBondContact O-N 3.19Å
1734	V	83.4	Confident	81.4	Confident	10.4 Å²	10.4	54.3 Å²	54.3	6%	0.063	29%	0.293	C	S	.	.	H	α-helix	trans	-68.6	-29.2	175.4	171.2	0	0	0	0	110.8	M1554 D1687 L1690 S1732 E1736 L1737 V1738	M1554-V1734 HydrophobicContact CE-CG1 3.67Å; M1554-V1734 HydrophobicContact CE-CG2 4.27Å; D1687-V1734 VanDerWaalsContact OD1-CB 3.26Å; D1687-V1734 WeakPolarHBondContact OD1-CB 3.45Å; D1687-V1734 WeakPolarHBondContact OD1-CG1 3.41Å; D1687-V1734 VanDerWaalsContact OD1-CG2 3.25Å; D1687-V1734 WeakPolarHBondContact OD1-CG2 3.39Å; D1687-V1734 PolarHBondContact OD1-N 3.15Å; D1687-V1734 VanDerWaalsContact OD1-N 3.16Å; L1690-V1734 HydrophobicContact CB-CB 4.44Å; L1690-V1734 HydrophobicContact CB-CG1 3.58Å; L1690-V1734 VanDerWaalsContact CB-CG1 3.46Å; L1690-V1734 HydrophobicContact CB-CG2 4.3Å; L1690-V1734 HydrophobicContact CD1-CG1 4.15Å; L1690-V1734 HydrophobicContact CG-CG1 4.17Å; S1732-V1734 PolarHBondContact O-N 2.96Å; V1734-E1736 VanDerWaalsContact C-N 3.34Å; V1734-E1736 PolarHBondContact O-N 2.9Å; V1734-L1737 WeakPolarHBondContact O-CB 3.26Å; V1734-L1737 PolarHBondContact O-N 3.35Å; V1734-L1737 VanDerWaalsContact O-N 3.14Å; V1734-V1738 HydrophobicContact CG1-CG2 4.45Å; V1734-V1738 WeakPolarHBondContact O-CG2 3.48Å; V1734-V1738 PolarHBondContact O-N 3.23Å
1735	V	83.2	Confident	81.9	Confident	27.8 Å²	27.8	56.2 Å²	56.2	17%	0.168	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-45.2	176.1	-179.2	0	0	0	0	111.2	Y1558 T1683 L1686 S1733 L1737 V1738 M1739	Y1558-V1735 HydrophobicContact CE2-CB 4.47Å; Y1558-V1735 HydrophobicContact CE2-CG1 4.18Å; Y1558-V1735 HydrophobicContact CE2-CG2 4.47Å; T1683-V1735 HydrophobicContact CG2-CG2 4.37Å; L1686-V1735 HydrophobicContact CB-CG2 4.28Å; L1686-V1735 HydrophobicContact CD1-CG2 4.09Å; S1733-V1735 VanDerWaalsContact C-N 3.26Å; S1733-V1735 PolarHBondContact O-N 3.3Å; S1733-V1735 PolarHBondContact OG-N 3.27Å; V1735-L1737 VanDerWaalsContact C-N 3.32Å; V1735-L1737 PolarHBondContact O-N 3.05Å; V1735-V1738 PolarHBondContact O-N 3.11Å; V1735-M1739 HydrophobicContact CG1-CE 4.24Å; V1735-M1739 HydrophobicContact CG1-CG 4.46Å; V1735-M1739 HydrophobicContact CG1-SD 4.23Å; V1735-M1739 WeakPolarHBondContact O-CB 3.25Å; V1735-M1739 VanDerWaalsContact O-CG 3.32Å; V1735-M1739 WeakPolarHBondContact O-CG 3.34Å; V1735-M1739 PolarHBondContact O-N 3.07Å
1736	E	84.9	Confident	82.4	Confident	80 Å²	80	52.9 Å²	52.9	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-63.8	-38.1	176	-71.5	163.3	-154.6	0	0	112.1	F1727 S1732 S1733 V1734 M1739 L1740	F1727-E1736 HydrophobicContact CD1-CB 3.88Å; F1727-E1736 HydrophobicContact CD1-CG 4.22Å; F1727-E1736 HydrophobicContact CD2-CB 4.42Å; F1727-E1736 HydrophobicContact CE1-CB 4.24Å; F1727-E1736 HydrophobicContact CE1-CG 4.42Å; F1727-E1736 HydrophobicContact CE2-CB 3.4Å; F1727-E1736 VanDerWaalsContact CE2-CB 3.43Å; F1727-E1736 HydrophobicContact CE2-CG 4.35Å; F1727-E1736 WeakPolarHBondContact CE2-OE2 3.23Å; F1727-E1736 HydrophobicContact CZ-CB 3.68Å; S1732-E1736 VanDerWaalsContact CB-OE2 3.31Å; S1732-E1736 WeakPolarHBondContact CB-OE2 3.34Å; S1732-E1736 PolarHBondContact OG-OE2 3.08Å; S1733-E1736 WeakPolarHBondContact CB-OE1 3.42Å; S1733-E1736 PolarHBondContact N-OE1 2.94Å; S1733-E1736 PolarHBondContact N-OE2 3.07Å; S1733-E1736 WeakPolarHBondContact O-CB 3.47Å; S1733-E1736 PolarHBondContact O-N 3.13Å; S1733-E1736 VanDerWaalsContact O-N 3.12Å; S1733-E1736 WeakPolarHBondContact OG-CB 3.32Å; S1733-E1736 VanDerWaalsContact OG-CG 3.29Å; S1733-E1736 WeakPolarHBondContact OG-CG 3.4Å; S1733-E1736 PolarHBondContact OG-N 3.15Å; S1733-E1736 VanDerWaalsContact OG-N 3.14Å; S1733-E1736 PolarHBondContact OG-OE1 3.28Å; S1733-E1736 PolarHBondContact OG-OE2 2.83Å; V1734-E1736 VanDerWaalsContact C-N 3.34Å; V1734-E1736 PolarHBondContact O-N 2.9Å; E1736-M1739 HydrophobicContact CG-CE 4.25Å; E1736-M1739 PolarHBondContact O-N 3.3Å; E1736-L1740 WeakPolarHBondContact O-CB 3.38Å; E1736-L1740 PolarHBondContact O-N 3.23Å
1737	L	87.4	Confident	83	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-64.2	-41.2	175.5	-178.7	63.1	0	0	0	111.3	M1554 G1694 L1697 K1698 F1727 L1728 S1733 V1734 V1735 L1740 L1741	M1554-L1737 HydrophobicContact CE-CD2 4.2Å; M1554-L1737 HydrophobicContact CE-CG 4.46Å; G1694-L1737 WeakPolarHBondContact O-CD2 3.34Å; L1697-L1737 HydrophobicContact CB-CD2 4.47Å; L1697-L1737 HydrophobicContact CD2-CD2 4.28Å; L1697-L1737 HydrophobicContact CG-CD2 4.43Å; K1698-L1737 HydrophobicContact CG-CD2 3.96Å; F1727-L1737 HydrophobicContact CE1-CD1 4.32Å; F1727-L1737 HydrophobicContact CZ-CB 4.26Å; L1728-L1737 HydrophobicContact CD2-CD1 4.11Å; S1733-L1737 PolarHBondContact O-N 3.19Å; V1734-L1737 WeakPolarHBondContact O-CB 3.26Å; V1734-L1737 PolarHBondContact O-N 3.35Å; V1734-L1737 VanDerWaalsContact O-N 3.14Å; V1735-L1737 VanDerWaalsContact C-N 3.32Å; V1735-L1737 PolarHBondContact O-N 3.05Å; L1737-L1740 HydrophobicContact CD1-CD2 4.28Å; L1737-L1740 WeakPolarHBondContact O-CB 3.41Å; L1737-L1740 PolarHBondContact O-N 3.25Å; L1737-L1741 HydrophobicContact CG-CD1 4.42Å; L1737-L1741 VanDerWaalsContact O-CG 3.29Å; L1737-L1741 WeakPolarHBondContact O-CG 3.35Å; L1737-L1741 PolarHBondContact O-N 3.18Å; L1737-L1741 VanDerWaalsContact O-N 3.11Å
1738	V	86.9	Confident	83.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-70.4	-38.2	175.4	-179.2	0	0	0	0	111.8	M1554 V1555 Y1558 L1690 V1734 V1735 L1740 L1741 C1742	M1554-V1738 HydrophobicContact CB-CG2 4.43Å; M1554-V1738 HydrophobicContact CE-CG2 3.94Å; V1555-V1738 HydrophobicContact CG2-CG1 4.27Å; Y1558-V1738 HydrophobicContact CD1-CB 4.46Å; Y1558-V1738 HydrophobicContact CD1-CG1 3.73Å; Y1558-V1738 HydrophobicContact CD2-CB 4.09Å; Y1558-V1738 HydrophobicContact CD2-CG1 3.91Å; Y1558-V1738 HydrophobicContact CD2-CG2 4.25Å; Y1558-V1738 HydrophobicContact CE1-CG1 4.29Å; Y1558-V1738 HydrophobicContact CE2-CB 4.4Å; Y1558-V1738 HydrophobicContact CE2-CG1 4.42Å; Y1558-V1738 HydrophobicContact CG-CB 4.21Å; Y1558-V1738 HydrophobicContact CG-CG1 3.52Å; Y1558-V1738 VanDerWaalsContact CG-CG1 3.47Å; Y1558-V1738 HydrophobicContact CG-CG2 4.34Å; L1690-V1738 HydrophobicContact CD1-CG2 4.08Å; V1734-V1738 HydrophobicContact CG1-CG2 4.45Å; V1734-V1738 WeakPolarHBondContact O-CG2 3.48Å; V1734-V1738 PolarHBondContact O-N 3.23Å; V1735-V1738 PolarHBondContact O-N 3.11Å; V1738-L1740 VanDerWaalsContact C-N 3.28Å; V1738-L1740 PolarHBondContact O-N 2.96Å; V1738-L1741 CarbonylContact O-C 3.55Å; V1738-L1741 WeakPolarHBondContact O-CB 3.49Å; V1738-L1741 PolarHBondContact O-N 3.05Å; V1738-L1741 VanDerWaalsContact O-N 3.12Å; V1738-C1742 WeakPolarHBondContact O-CB 3.32Å; V1738-C1742 PolarHBondContact O-N 3.34Å; V1738-C1742 PolarHBondContact O-SG 2.98Å; V1738-C1742 VanDerWaalsContact O-SG 3.38Å
1739	M	85.6	Confident	84.1	Confident	113.6 Å²	113.6	53.4 Å²	53.4	56%	0.56	28%	0.284	S	S	*	.	H	α-helix	trans	-58.9	-38.3	172.4	-74.5	178.1	43.2	0	0	112	V1735 E1736 C1742 S1743	V1735-M1739 HydrophobicContact CG1-CE 4.24Å; V1735-M1739 HydrophobicContact CG1-CG 4.46Å; V1735-M1739 HydrophobicContact CG1-SD 4.23Å; V1735-M1739 WeakPolarHBondContact O-CB 3.25Å; V1735-M1739 VanDerWaalsContact O-CG 3.32Å; V1735-M1739 WeakPolarHBondContact O-CG 3.34Å; V1735-M1739 PolarHBondContact O-N 3.07Å; E1736-M1739 HydrophobicContact CG-CE 4.25Å; E1736-M1739 PolarHBondContact O-N 3.3Å; M1739-C1742 CarbonylContact O-C 3.56Å; M1739-C1742 WeakPolarHBondContact O-CB 3.37Å; M1739-C1742 PolarHBondContact O-N 3.2Å; M1739-S1743 PolarHBondContact O-N 3.28Å; M1739-S1743 VanDerWaalsContact O-N 3.13Å
1740	L	87.4	Confident	84.7	Confident	23 Å²	23	48.6 Å²	48.6	12%	0.12	26%	0.262	C	S	.	.	H	α-helix	trans	-63.4	-48.2	172.7	179.7	74.3	0	0	0	111.6	V1724 F1727 E1736 L1737 V1738 C1742 S1743 W1746	V1724-L1740 HydrophobicContact CB-CD1 4.46Å; V1724-L1740 HydrophobicContact CB-CD2 4.09Å; V1724-L1740 HydrophobicContact CG1-CD1 3.72Å; V1724-L1740 HydrophobicContact CG1-CD2 3.5Å; V1724-L1740 VanDerWaalsContact CG1-CD2 3.46Å; V1724-L1740 HydrophobicContact CG1-CG 4.28Å; V1724-L1740 HydrophobicContact CG2-CD1 3.71Å; V1724-L1740 HydrophobicContact CG2-CD2 3.59Å; V1724-L1740 HydrophobicContact CG2-CG 4.18Å; F1727-L1740 HydrophobicContact CB-CD2 4.23Å; F1727-L1740 HydrophobicContact CD1-CD2 4.37Å; F1727-L1740 HydrophobicContact CD2-CD1 4.25Å; F1727-L1740 HydrophobicContact CD2-CD2 4.11Å; F1727-L1740 HydrophobicContact CD2-CG 4.49Å; F1727-L1740 HydrophobicContact CE1-CB 4.4Å; F1727-L1740 HydrophobicContact CE1-CD2 4.06Å; F1727-L1740 HydrophobicContact CE2-CD1 4.45Å; F1727-L1740 HydrophobicContact CG-CD2 4.33Å; E1736-L1740 WeakPolarHBondContact O-CB 3.38Å; E1736-L1740 PolarHBondContact O-N 3.23Å; L1737-L1740 HydrophobicContact CD1-CD2 4.28Å; L1737-L1740 WeakPolarHBondContact O-CB 3.41Å; L1737-L1740 PolarHBondContact O-N 3.25Å; V1738-L1740 VanDerWaalsContact C-N 3.28Å; V1738-L1740 PolarHBondContact O-N 2.96Å; L1740-C1742 PolarHBondContact O-N 3.07Å; L1740-S1743 VanDerWaalsContact O-CB 3.25Å; L1740-S1743 WeakPolarHBondContact O-CB 3.39Å; L1740-S1743 PolarHBondContact O-N 3.12Å; L1740-S1743 PolarHBondContact O-OG 2.9Å; L1740-W1746 HydrophobicContact CD1-CD2 4.44Å; L1740-W1746 HydrophobicContact CD1-CG 4.41Å; L1740-W1746 HydrophobicContact CD2-CD2 4.49Å; L1740-W1746 HydrophobicContact CD2-CZ2 4.41Å; L1740-W1746 HydrophobicContact CG-CD2 4.37Å; L1740-W1746 HydrophobicContact CG-CG 4.34Å; L1740-W1746 VanDerWaalsContact O-CB 3.3Å; L1740-W1746 WeakPolarHBondContact O-CB 3.39Å
1741	L	87.7	Confident	85.4	Confident	3.8 Å²	3.8	48.3 Å²	48.3	2%	0.02	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-26.1	175.7	-65.3	172.3	0	0	0	112.8	S1551 M1554 V1555 L1697 F1701 L1737 V1738 S1743 W1746 Q1747 L1750	S1551-L1741 WeakPolarHBondContact OG-CD2 3.3Å; M1554-L1741 HydrophobicContact CB-CD1 4.42Å; M1554-L1741 HydrophobicContact SD-CD1 4.42Å; V1555-L1741 HydrophobicContact CG2-CB 3.93Å; V1555-L1741 HydrophobicContact CG2-CD1 4.49Å; L1697-L1741 HydrophobicContact CD2-CD1 3.78Å; L1697-L1741 HydrophobicContact CD2-CD2 4.35Å; F1701-L1741 HydrophobicContact CE2-CD2 4.43Å; F1701-L1741 HydrophobicContact CZ-CD2 4.34Å; L1737-L1741 HydrophobicContact CG-CD1 4.42Å; L1737-L1741 VanDerWaalsContact O-CG 3.29Å; L1737-L1741 WeakPolarHBondContact O-CG 3.35Å; L1737-L1741 PolarHBondContact O-N 3.18Å; L1737-L1741 VanDerWaalsContact O-N 3.11Å; V1738-L1741 CarbonylContact O-C 3.55Å; V1738-L1741 WeakPolarHBondContact O-CB 3.49Å; V1738-L1741 PolarHBondContact O-N 3.05Å; V1738-L1741 VanDerWaalsContact O-N 3.12Å; L1741-S1743 VanDerWaalsContact C-N 3.35Å; L1741-W1746 HydrophobicContact CD2-CE3 4.46Å; L1741-Q1747 WeakPolarHBondContact O-CG 3.27Å; L1741-L1750 HydrophobicContact CD2-CD1 3.68Å
1742	C	87.1	Confident	86.2	Confident	49.2 Å²	49.2	49.6 Å²	49.6	33%	0.332	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-5.5	173.1	-71.5	0	0	0	0	114.2	V1738 M1739 L1740 Q1744	V1738-C1742 WeakPolarHBondContact O-CB 3.32Å; V1738-C1742 PolarHBondContact O-N 3.34Å; V1738-C1742 PolarHBondContact O-SG 2.98Å; V1738-C1742 VanDerWaalsContact O-SG 3.38Å; M1739-C1742 CarbonylContact O-C 3.56Å; M1739-C1742 WeakPolarHBondContact O-CB 3.37Å; M1739-C1742 PolarHBondContact O-N 3.2Å; L1740-C1742 PolarHBondContact O-N 3.07Å; C1742-Q1744 PolarHBondContact O-N 2.86Å
1743	S	87.6	Confident	86.9	Confident	50 Å²	50	50.3 Å²	50.3	35%	0.35	25%	0.254	S	S	.	.	S	Bend	trans	-68.1	136.5	175.7	168.1	0	0	0	0	110.9	M1739 L1740 L1741 E1745 W1746 Q1747	M1739-S1743 PolarHBondContact O-N 3.28Å; M1739-S1743 VanDerWaalsContact O-N 3.13Å; L1740-S1743 VanDerWaalsContact O-CB 3.25Å; L1740-S1743 WeakPolarHBondContact O-CB 3.39Å; L1740-S1743 PolarHBondContact O-N 3.12Å; L1740-S1743 PolarHBondContact O-OG 2.9Å; L1741-S1743 VanDerWaalsContact C-N 3.35Å; S1743-E1745 VanDerWaalsContact C-N 3.27Å; S1743-E1745 PolarHBondContact O-N 3.23Å; S1743-E1745 VanDerWaalsContact O-N 3.15Å; S1743-W1746 WeakPolarHBondContact O-CA 3.31Å; S1743-W1746 PolarHBondContact O-N 3.14Å; S1743-W1746 WeakPolarHBondContact OG-CB 3.34Å; S1743-Q1747 PolarHBondContact O-N 3.23Å
1744	Q	86.1	Confident	87.2	Confident	143.6 Å²	143.6	48.7 Å²	48.7	67%	0.671	24%	0.242	S	C	*	.	H	α-helix	trans	-54.1	-39.7	-174.4	-174.8	135.5	9.5	0	0	113.2	C1742 T1748	C1742-Q1744 PolarHBondContact O-N 2.86Å; Q1744-T1748 PolarHBondContact NE2-OG1 3.03Å; Q1744-T1748 VanDerWaalsContact O-CB 3.3Å; Q1744-T1748 WeakPolarHBondContact O-CB 3.36Å; Q1744-T1748 WeakPolarHBondContact O-CG2 3.31Å; Q1744-T1748 PolarHBondContact O-N 3.15Å; Q1744-T1748 VanDerWaalsContact O-N 3.07Å; Q1744-T1748 PolarHBondContact O-OG1 3.15Å
1745	E	86.3	Confident	87.5	Confident	45.4 Å²	45.4	48.3 Å²	48.3	21%	0.212	24%	0.241	C	C	.	.	H	α-helix	trans	-65.8	-43.4	176.6	-72.8	-65.1	117.1	0	0	112.1	G1714 T1715 Q1718 L1720 S1743 T1748 S1749	G1714-E1745 VanDerWaalsContact CA-OE2 3.29Å; G1714-E1745 WeakPolarHBondContact CA-OE2 3.36Å; T1715-E1745 WeakPolarHBondContact CB-OE1 3.34Å; T1715-E1745 WeakPolarHBondContact CG2-OE1 3.37Å; T1715-E1745 PolarHBondContact N-OE2 3.13Å; T1715-E1745 VanDerWaalsContact OG1-CD 3.3Å; T1715-E1745 PolarHBondContact OG1-OE1 3.05Å; T1715-E1745 PolarHBondContact OG1-OE2 3.01Å; Q1718-E1745 VanDerWaalsContact NE2-CD 3.34Å; Q1718-E1745 PolarHBondContact NE2-OE2 2.93Å; L1720-E1745 HydrophobicContact CD2-CB 4.04Å; L1720-E1745 HydrophobicContact CD2-CG 4.47Å; S1743-E1745 VanDerWaalsContact C-N 3.27Å; S1743-E1745 PolarHBondContact O-N 3.23Å; S1743-E1745 VanDerWaalsContact O-N 3.15Å; E1745-T1748 PolarHBondContact O-N 3.43Å; E1745-T1748 PolarHBondContact O-OG1 3.42Å; E1745-S1749 VanDerWaalsContact O-CB 3.26Å; E1745-S1749 WeakPolarHBondContact O-CB 3.4Å; E1745-S1749 PolarHBondContact O-N 3.07Å
1746	W	87.7	Confident	87.8	Confident	5.8 Å²	5.8	55.9 Å²	55.9	2%	0.022	27%	0.266	C	S	.	.	H	α-helix	trans	-71	-43.1	179	-86.1	87.7	0	0	0	112.2	F1701 L1712 L1720 F1721 V1724 L1740 L1741 S1743 T1748 S1749 L1750	F1701-W1746 AromaticContact CE1-CH2 3.92Å; F1701-W1746 HydrophobicContact CE1-CH2 4.33Å; F1701-W1746 AromaticContact CE1-CZ3 3.86Å; F1701-W1746 HydrophobicContact CE1-CZ3 3.9Å; F1701-W1746 HydrophobicContact CZ-CE3 4.47Å; F1701-W1746 HydrophobicContact CZ-CH2 4.15Å; F1701-W1746 AromaticContact CZ-CZ3 3.77Å; F1701-W1746 HydrophobicContact CZ-CZ3 3.83Å; L1712-W1746 HydrophobicContact CD1-CH2 4.14Å; L1712-W1746 HydrophobicContact CD1-CZ3 3.99Å; L1720-W1746 HydrophobicContact CB-CH2 4.32Å; L1720-W1746 HydrophobicContact CB-CZ2 3.73Å; L1720-W1746 HydrophobicContact CD1-CD2 4.17Å; L1720-W1746 HydrophobicContact CD1-CG 4.27Å; L1720-W1746 HydrophobicContact CD1-CZ2 4.45Å; F1721-W1746 HydrophobicContact CD2-CH2 4.28Å; F1721-W1746 HydrophobicContact CE1-CH2 4.41Å; F1721-W1746 AromaticContact CE2-CH2 3.74Å; F1721-W1746 HydrophobicContact CE2-CH2 3.8Å; F1721-W1746 HydrophobicContact CE2-CZ2 4.43Å; F1721-W1746 HydrophobicContact CE2-CZ3 4.24Å; F1721-W1746 AromaticContact CZ-CH2 3.77Å; F1721-W1746 HydrophobicContact CZ-CH2 4Å; F1721-W1746 HydrophobicContact CZ-CZ3 4.36Å; V1724-W1746 HydrophobicContact CB-CZ2 4.17Å; V1724-W1746 HydrophobicContact CG1-CH2 4.4Å; V1724-W1746 HydrophobicContact CG1-CZ2 4.07Å; V1724-W1746 HydrophobicContact CG2-CH2 4.44Å; V1724-W1746 HydrophobicContact CG2-CZ2 3.74Å; V1724-W1746 VanDerWaalsContact CG2-CZ2 3.43Å; V1724-W1746 VanDerWaalsContact CG2-NE1 3.3Å; L1740-W1746 HydrophobicContact CD1-CD2 4.44Å; L1740-W1746 HydrophobicContact CD1-CG 4.41Å; L1740-W1746 HydrophobicContact CD2-CD2 4.49Å; L1740-W1746 HydrophobicContact CD2-CZ2 4.41Å; L1740-W1746 HydrophobicContact CG-CD2 4.37Å; L1740-W1746 HydrophobicContact CG-CG 4.34Å; L1740-W1746 VanDerWaalsContact O-CB 3.3Å; L1740-W1746 WeakPolarHBondContact O-CB 3.39Å; L1741-W1746 HydrophobicContact CD2-CE3 4.46Å; S1743-W1746 WeakPolarHBondContact O-CA 3.31Å; S1743-W1746 PolarHBondContact O-N 3.14Å; S1743-W1746 WeakPolarHBondContact OG-CB 3.34Å; W1746-T1748 VanDerWaalsContact C-N 3.33Å; W1746-T1748 PolarHBondContact O-N 3.19Å; W1746-S1749 PolarHBondContact O-N 3.19Å; W1746-L1750 HydrophobicContact CE3-CD1 4.11Å; W1746-L1750 HydrophobicContact CE3-CD2 4.36Å; W1746-L1750 HydrophobicContact CE3-CG 4.21Å; W1746-L1750 HydrophobicContact CZ3-CD2 4.39Å; W1746-L1750 VanDerWaalsContact O-CB 3.24Å; W1746-L1750 WeakPolarHBondContact O-CB 3.36Å; W1746-L1750 VanDerWaalsContact O-CG 3.27Å; W1746-L1750 WeakPolarHBondContact O-CG 3.37Å; W1746-L1750 PolarHBondContact O-N 3.15Å
1747	Q	88.4	Confident	87.9	Confident	87.2 Å²	87.2	52.3 Å²	52.3	41%	0.407	25%	0.25	S	S	.	.	H	α-helix	trans	-57.6	-48.9	173.7	-71.7	-171.3	-21.7	0	0	111.2	L1741 S1743 S1749 Q1751	L1741-Q1747 WeakPolarHBondContact O-CG 3.27Å; S1743-Q1747 PolarHBondContact O-N 3.23Å; Q1747-S1749 VanDerWaalsContact C-N 3.35Å; Q1747-S1749 PolarHBondContact O-N 3.08Å; Q1747-Q1751 VanDerWaalsContact O-CB 3.23Å; Q1747-Q1751 WeakPolarHBondContact O-CB 3.4Å; Q1747-Q1751 PolarHBondContact O-N 3.16Å
1748	T	87.7	Confident	88.2	Confident	53 Å²	53	52.7 Å²	52.7	33%	0.325	25%	0.252	S	S	.	.	H	α-helix	trans	-64.3	-41.6	-179.6	-38.7	0	0	0	0	111.6	T1715 Q1744 E1745 W1746 K1752	T1715-T1748 HydrophobicContact CG2-CG2 3.88Å; T1715-T1748 WeakPolarHBondContact CG2-OG1 3.35Å; Q1744-T1748 PolarHBondContact NE2-OG1 3.03Å; Q1744-T1748 VanDerWaalsContact O-CB 3.3Å; Q1744-T1748 WeakPolarHBondContact O-CB 3.36Å; Q1744-T1748 WeakPolarHBondContact O-CG2 3.31Å; Q1744-T1748 PolarHBondContact O-N 3.15Å; Q1744-T1748 VanDerWaalsContact O-N 3.07Å; Q1744-T1748 PolarHBondContact O-OG1 3.15Å; E1745-T1748 PolarHBondContact O-N 3.43Å; E1745-T1748 PolarHBondContact O-OG1 3.42Å; W1746-T1748 VanDerWaalsContact C-N 3.33Å; W1746-T1748 PolarHBondContact O-N 3.19Å; T1748-K1752 WeakPolarHBondContact O-CB 3.41Å; T1748-K1752 PolarHBondContact O-N 3.04Å
1749	S	89	Confident	88.3	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-69.6	-48.2	179.2	-165.2	0	0	0	0	112.6	L1712 I1713 E1745 W1746 Q1747 Q1751 K1752 Y1753	L1712-S1749 VanDerWaalsContact CA-OG 3.24Å; L1712-S1749 WeakPolarHBondContact CA-OG 3.3Å; I1713-S1749 PolarHBondContact N-OG 3.01Å; I1713-S1749 VanDerWaalsContact N-OG 3.15Å; I1713-S1749 VanDerWaalsContact O-CB 3.32Å; I1713-S1749 WeakPolarHBondContact O-CB 3.38Å; I1713-S1749 PolarHBondContact O-OG 2.95Å; E1745-S1749 VanDerWaalsContact O-CB 3.26Å; E1745-S1749 WeakPolarHBondContact O-CB 3.4Å; E1745-S1749 PolarHBondContact O-N 3.07Å; W1746-S1749 PolarHBondContact O-N 3.19Å; Q1747-S1749 VanDerWaalsContact C-N 3.35Å; Q1747-S1749 PolarHBondContact O-N 3.08Å; S1749-Q1751 VanDerWaalsContact C-N 3.34Å; S1749-Q1751 PolarHBondContact O-N 3.2Å; S1749-K1752 PolarHBondContact O-N 3.1Å; S1749-Y1753 VanDerWaalsContact O-CD2 3.3Å; S1749-Y1753 WeakPolarHBondContact O-CD2 3.34Å; S1749-Y1753 PolarHBondContact O-N 3.19Å
1750	L	90.2	Very high	88.5	Confident	7.6 Å²	7.6	55.6 Å²	55.6	4%	0.04	27%	0.266	C	S	.	.	I	π-helix	trans	-59.6	-44.8	175.9	-73.7	169.1	0	0	0	111.1	V1547 L1712 L1741 W1746 K1752 A1754 G1755	V1547-L1750 HydrophobicContact CG1-CD2 3.8Å; L1712-L1750 HydrophobicContact CD1-CD2 3.9Å; L1712-L1750 HydrophobicContact CD2-CD2 4.12Å; L1741-L1750 HydrophobicContact CD2-CD1 3.68Å; W1746-L1750 HydrophobicContact CE3-CD1 4.11Å; W1746-L1750 HydrophobicContact CE3-CD2 4.36Å; W1746-L1750 HydrophobicContact CE3-CG 4.21Å; W1746-L1750 HydrophobicContact CZ3-CD2 4.39Å; W1746-L1750 VanDerWaalsContact O-CB 3.24Å; W1746-L1750 WeakPolarHBondContact O-CB 3.36Å; W1746-L1750 VanDerWaalsContact O-CG 3.27Å; W1746-L1750 WeakPolarHBondContact O-CG 3.37Å; W1746-L1750 PolarHBondContact O-N 3.15Å; L1750-K1752 PolarHBondContact O-N 2.9Å; L1750-A1754 HydrophobicContact CD2-CB 4.18Å; L1750-A1754 CarbonylContact O-C 3.53Å; L1750-A1754 VanDerWaalsContact O-CA 3.31Å; L1750-A1754 WeakPolarHBondContact O-CA 3.34Å; L1750-A1754 VanDerWaalsContact O-CB 3.28Å; L1750-A1754 WeakPolarHBondContact O-CB 3.35Å; L1750-A1754 PolarHBondContact O-N 3.29Å; L1750-G1755 PolarHBondContact O-N 3.02Å
1751	Q	88.5	Confident	88.7	Confident	125.6 Å²	125.6	55 Å²	55	59%	0.587	26%	0.263	S	S	*	.	I	π-helix	trans	-65.8	-40.5	178.1	-169.2	162.9	21.6	0	0	112.3	Y1548 Q1747 S1749 G1755	Y1548-Q1751 PolarHBondContact OH-NE2 3.31Å; Y1548-Q1751 PolarHBondContact OH-OE1 2.91Å; Q1747-Q1751 VanDerWaalsContact O-CB 3.23Å; Q1747-Q1751 WeakPolarHBondContact O-CB 3.4Å; Q1747-Q1751 PolarHBondContact O-N 3.16Å; S1749-Q1751 VanDerWaalsContact C-N 3.34Å; S1749-Q1751 PolarHBondContact O-N 3.2Å; Q1751-G1755 WeakPolarHBondContact O-CA 3.32Å
1752	K	88	Confident	88.7	Confident	118.8 Å²	118.8	55.7 Å²	55.7	52%	0.517	27%	0.267	S	S	.	.	I	π-helix	trans	-71.9	-38.5	-177.8	-176.9	-177.5	175.1	-161.7	0	113.5	T1748 S1749 L1750 W1756	T1748-K1752 WeakPolarHBondContact O-CB 3.41Å; T1748-K1752 PolarHBondContact O-N 3.04Å; S1749-K1752 PolarHBondContact O-N 3.1Å; L1750-K1752 PolarHBondContact O-N 2.9Å; K1752-W1756 WeakPolarHBondContact O-CB 3.36Å
1753	Y	87.8	Confident	88.8	Confident	70.6 Å²	70.6	57.1 Å²	57.1	28%	0.277	27%	0.271	S	S	.	.	I	π-helix	trans	-108.2	-52.5	-173.5	-60.9	-71.7	0	0	0	112.3	T1711 I1713 S1749 W1756 A1757	T1711-Y1753 HydrophobicContact CG2-CD1 4.44Å; T1711-Y1753 HydrophobicContact CG2-CG 4.32Å; T1711-Y1753 VanDerWaalsContact O-CD2 3.22Å; T1711-Y1753 WeakPolarHBondContact O-CD2 3.4Å; T1711-Y1753 WeakPolarHBondContact O-CE2 3.4Å; T1711-Y1753 VanDerWaalsContact O-CG 3.27Å; I1713-Y1753 HydrophobicContact CB-CE2 4.4Å; S1749-Y1753 VanDerWaalsContact O-CD2 3.3Å; S1749-Y1753 WeakPolarHBondContact O-CD2 3.34Å; S1749-Y1753 PolarHBondContact O-N 3.19Å; Y1753-W1756 PolarHBondContact O-N 3.33Å; Y1753-A1757 PolarHBondContact O-N 3.15Å; Y1753-A1757 VanDerWaalsContact O-N 3.16Å
1754	A	89.6	Confident	88.8	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.267	C	S	.	.	I	π-helix	trans	-76.3	-34.6	-178.6	0	0	0	0	0	112.7	L1544 Y1548 L1712 L1750 W1756 A1757 F1758	L1544-A1754 HydrophobicContact CD1-CB 3.59Å; L1544-A1754 HydrophobicContact CG-CB 3.94Å; Y1548-A1754 HydrophobicContact CD2-CB 4.33Å; Y1548-A1754 HydrophobicContact CG-CB 4.46Å; L1712-A1754 HydrophobicContact CD2-CB 4.33Å; L1750-A1754 HydrophobicContact CD2-CB 4.18Å; L1750-A1754 CarbonylContact O-C 3.53Å; L1750-A1754 VanDerWaalsContact O-CA 3.31Å; L1750-A1754 WeakPolarHBondContact O-CA 3.34Å; L1750-A1754 VanDerWaalsContact O-CB 3.28Å; L1750-A1754 WeakPolarHBondContact O-CB 3.35Å; L1750-A1754 PolarHBondContact O-N 3.29Å; A1754-W1756 VanDerWaalsContact C-N 3.33Å; A1754-W1756 PolarHBondContact O-N 3.15Å; A1754-A1757 PolarHBondContact O-N 3.07Å; A1754-F1758 WeakPolarHBondContact O-CB 3.43Å; A1754-F1758 PolarHBondContact O-N 3.34Å
1755	G	89.7	Confident	88.7	Confident	3 Å²	3	51 Å²	51	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-64.5	-35.4	173.1	0	0	0	0	0	112.6	Y1548 L1750 Q1751 F1758 I1759	Y1548-G1755 VanDerWaalsContact CD2-CA 3.44Å; Y1548-G1755 VanDerWaalsContact CD2-N 3.33Å; Y1548-G1755 VanDerWaalsContact CE2-CA 3.48Å; L1750-G1755 PolarHBondContact O-N 3.02Å; Q1751-G1755 WeakPolarHBondContact O-CA 3.32Å; G1755-F1758 PolarHBondContact O-N 3.06Å; G1755-I1759 WeakPolarHBondContact O-CB 3.35Å; G1755-I1759 WeakPolarHBondContact O-CD1 3.37Å; G1755-I1759 VanDerWaalsContact O-CG1 3.25Å; G1755-I1759 WeakPolarHBondContact O-CG1 3.42Å; G1755-I1759 PolarHBondContact O-N 3.05Å
1756	W	89.3	Confident	88.7	Confident	186 Å²	186	55.3 Å²	55.3	71%	0.705	26%	0.255	S	S	*	.	H	α-helix	trans	-65.7	-45.4	173.4	-102.9	71.9	0	0	0	112	K1752 Y1753 A1754 F1758 I1759 E1760	K1752-W1756 WeakPolarHBondContact O-CB 3.36Å; Y1753-W1756 PolarHBondContact O-N 3.33Å; A1754-W1756 VanDerWaalsContact C-N 3.33Å; A1754-W1756 PolarHBondContact O-N 3.15Å; W1756-F1758 VanDerWaalsContact C-N 3.3Å; W1756-F1758 PolarHBondContact O-N 2.91Å; W1756-I1759 PolarHBondContact O-N 3.19Å; W1756-I1759 VanDerWaalsContact O-N 3.15Å; W1756-E1760 WeakPolarHBondContact O-CB 3.39Å; W1756-E1760 PolarHBondContact O-N 3.16Å
1757	A	88.8	Confident	88.5	Confident	5 Å²	5	61.2 Å²	61.2	4%	0.041	29%	0.286	C	S	.	.	H	α-helix	trans	-60.3	-39	174.5	0	0	0	0	0	112.3	F1541 L1544 A1545 Y1753 A1754 E1760 L1761	F1541-A1757 HydrophobicContact CD2-CB 4.17Å; F1541-A1757 HydrophobicContact CE2-CB 3.85Å; F1541-A1757 HydrophobicContact CZ-CB 4.34Å; F1541-A1757 VanDerWaalsContact CZ-O 3.3Å; F1541-A1757 WeakPolarHBondContact CZ-O 3.26Å; L1544-A1757 HydrophobicContact CD2-CB 3.8Å; L1544-A1757 HydrophobicContact CG-CB 4.1Å; A1545-A1757 HydrophobicContact CB-CB 4.41Å; Y1753-A1757 PolarHBondContact O-N 3.15Å; Y1753-A1757 VanDerWaalsContact O-N 3.16Å; A1754-A1757 PolarHBondContact O-N 3.07Å; A1757-E1760 PolarHBondContact O-N 2.72Å; A1757-L1761 VanDerWaalsContact O-CB 3.28Å; A1757-L1761 WeakPolarHBondContact O-CB 3.36Å; A1757-L1761 PolarHBondContact O-N 3.18Å; A1757-L1761 VanDerWaalsContact O-N 3.09Å
1758	F	91.9	Very high	88.2	Confident	12.2 Å²	12.2	59.1 Å²	59.1	5%	0.054	28%	0.277	C	S	.	.	H	α-helix	trans	-66.5	-41	174.4	-174.9	-91	0	0	0	112.9	L1217 L1218 L1221 L1290 Y1548 F1549 A1754 G1755 W1756 L1761 V1762	L1217-F1758 HydrophobicContact CD2-CE2 4.36Å; L1217-F1758 HydrophobicContact CD2-CZ 4.08Å; L1217-F1758 HydrophobicContact CG-CZ 4.21Å; L1218-F1758 HydrophobicContact CD1-CE1 4.35Å; L1221-F1758 HydrophobicContact CD2-CE1 3.72Å; L1221-F1758 HydrophobicContact CD2-CE2 4.42Å; L1221-F1758 HydrophobicContact CD2-CZ 3.56Å; L1221-F1758 VanDerWaalsContact CD2-CZ 3.45Å; L1290-F1758 HydrophobicContact CD1-CE2 4.09Å; Y1548-F1758 HydrophobicContact CD1-CB 3.46Å; Y1548-F1758 VanDerWaalsContact CD1-CB 3.43Å; Y1548-F1758 AromaticContact CD1-CD1 3.87Å; Y1548-F1758 HydrophobicContact CD1-CD1 3.95Å; Y1548-F1758 AromaticContact CD1-CD2 3.9Å; Y1548-F1758 HydrophobicContact CD1-CD2 3.95Å; Y1548-F1758 AromaticContact CD1-CG 3.52Å; Y1548-F1758 HydrophobicContact CD1-CG 3.52Å; Y1548-F1758 VanDerWaalsContact CD1-CG 3.47Å; Y1548-F1758 HydrophobicContact CE1-CB 4.08Å; Y1548-F1758 AromaticContact CE1-CD1 3.82Å; Y1548-F1758 HydrophobicContact CE1-CD1 3.92Å; Y1548-F1758 HydrophobicContact CE1-CE1 4.39Å; Y1548-F1758 AromaticContact CE1-CG 3.94Å; Y1548-F1758 HydrophobicContact CE1-CG 3.98Å; Y1548-F1758 HydrophobicContact CG-CB 4.12Å; Y1548-F1758 HydrophobicContact CG-CG 4.46Å; F1549-F1758 HydrophobicContact CB-CD2 4.33Å; F1549-F1758 HydrophobicContact CB-CE2 4.03Å; F1549-F1758 HydrophobicContact CD2-CE2 4.47Å; A1754-F1758 WeakPolarHBondContact O-CB 3.43Å; A1754-F1758 PolarHBondContact O-N 3.34Å; G1755-F1758 PolarHBondContact O-N 3.06Å; W1756-F1758 VanDerWaalsContact C-N 3.3Å; W1756-F1758 PolarHBondContact O-N 2.91Å; F1758-L1761 WeakPolarHBondContact O-CB 3.38Å; F1758-L1761 PolarHBondContact O-N 2.88Å; F1758-V1762 HydrophobicContact CD1-CG2 4.21Å; F1758-V1762 HydrophobicContact CE1-CG2 3.84Å; F1758-V1762 HydrophobicContact CE2-CG2 4.35Å; F1758-V1762 HydrophobicContact CZ-CG2 4.09Å; F1758-V1762 WeakPolarHBondContact O-CB 3.5Å; F1758-V1762 VanDerWaalsContact O-CG2 3.28Å; F1758-V1762 WeakPolarHBondContact O-CG2 3.44Å; F1758-V1762 PolarHBondContact O-N 3.2Å
1759	I	90.8	Very high	87.9	Confident	71.8 Å²	71.8	57.5 Å²	57.5	37%	0.368	27%	0.268	S	S	.	.	H	α-helix	trans	-68.2	-39.6	176.7	-70	-106.4	0	0	0	111.3	L1218 G1755 W1756 L1761 V1762 N1763	L1218-I1759 HydrophobicContact CD1-CD1 4.06Å; L1218-I1759 HydrophobicContact CD2-CD1 4.43Å; G1755-I1759 WeakPolarHBondContact O-CB 3.35Å; G1755-I1759 WeakPolarHBondContact O-CD1 3.37Å; G1755-I1759 VanDerWaalsContact O-CG1 3.25Å; G1755-I1759 WeakPolarHBondContact O-CG1 3.42Å; G1755-I1759 PolarHBondContact O-N 3.05Å; W1756-I1759 PolarHBondContact O-N 3.19Å; W1756-I1759 VanDerWaalsContact O-N 3.15Å; I1759-L1761 VanDerWaalsContact C-N 3.33Å; I1759-V1762 PolarHBondContact O-N 3.15Å; I1759-N1763 WeakPolarHBondContact CG2-ND2 3.28Å; I1759-N1763 VanDerWaalsContact O-CB 3.31Å; I1759-N1763 WeakPolarHBondContact O-CB 3.34Å; I1759-N1763 VanDerWaalsContact O-CG 3.25Å; I1759-N1763 PolarHBondContact O-N 3.26Å; I1759-N1763 PolarHBondContact O-ND2 3.26Å; I1759-N1763 VanDerWaalsContact O-ND2 3.16Å
1760	E	89.8	Confident	87.5	Confident	103.4 Å²	103.4	62.2 Å²	62.2	48%	0.483	29%	0.29	S	S	.	.	H	α-helix	trans	-60.5	-47	173	-174.7	177.1	176.1	0	0	111	F1541 W1756 A1757 V1762 N1763 E1764	F1541-E1760 HydrophobicContact CE2-CB 4.4Å; F1541-E1760 HydrophobicContact CE2-CG 4.36Å; F1541-E1760 WeakPolarHBondContact CE2-OE2 3.32Å; F1541-E1760 HydrophobicContact CZ-CB 4.26Å; F1541-E1760 HydrophobicContact CZ-CG 4.27Å; W1756-E1760 WeakPolarHBondContact O-CB 3.39Å; W1756-E1760 PolarHBondContact O-N 3.16Å; A1757-E1760 PolarHBondContact O-N 2.72Å; E1760-V1762 VanDerWaalsContact C-N 3.34Å; E1760-V1762 PolarHBondContact O-N 3.1Å; E1760-N1763 WeakPolarHBondContact O-CB 3.41Å; E1760-N1763 PolarHBondContact O-N 3.22Å; E1760-N1763 VanDerWaalsContact O-N 3.08Å; E1760-E1764 HydrophobicContact CG-CG 4.48Å; E1760-E1764 WeakPolarHBondContact O-CB 3.4Å; E1760-E1764 PolarHBondContact O-N 3.02Å
1761	L	90.2	Very high	87.1	Confident	10.6 Å²	10.6	65 Å²	65	6%	0.055	31%	0.309	C	S	.	.	H	α-helix	trans	-56.7	-44.9	174.7	-178	86.9	0	0	0	111.8	R1283 L1286 R1287 L1290 F1541 A1545 A1757 F1758 I1759 G1765	R1283-L1761 HydrophobicContact CB-CD1 3.59Å; R1283-L1761 HydrophobicContact CG-CD1 3.84Å; L1286-L1761 HydrophobicContact CD2-CD1 4.3Å; L1286-L1761 HydrophobicContact CD2-CD2 3.74Å; L1286-L1761 HydrophobicContact CG-CD2 4.06Å; R1287-L1761 VanDerWaalsContact CD-O 3.28Å; R1287-L1761 WeakPolarHBondContact CD-O 3.32Å; R1287-L1761 HydrophobicContact CG-CD1 4.12Å; R1287-L1761 HydrophobicContact CG-CD2 4.19Å; R1287-L1761 HydrophobicContact CG-CG 3.8Å; R1287-L1761 PolarHBondContact NH1-O 3.1Å; L1290-L1761 HydrophobicContact CD1-CD2 3.88Å; F1541-L1761 HydrophobicContact CE1-CB 4.19Å; F1541-L1761 HydrophobicContact CE1-CD1 4.13Å; F1541-L1761 HydrophobicContact CZ-CB 4.26Å; A1545-L1761 HydrophobicContact CB-CD2 4.05Å; A1757-L1761 VanDerWaalsContact O-CB 3.28Å; A1757-L1761 WeakPolarHBondContact O-CB 3.36Å; A1757-L1761 PolarHBondContact O-N 3.18Å; A1757-L1761 VanDerWaalsContact O-N 3.09Å; F1758-L1761 WeakPolarHBondContact O-CB 3.38Å; F1758-L1761 PolarHBondContact O-N 2.88Å; I1759-L1761 VanDerWaalsContact C-N 3.33Å; L1761-G1765 PolarHBondContact O-N 3.16Å
1762	V	89.1	Confident	86.8	Confident	17.6 Å²	17.6	60.3 Å²	60.3	11%	0.107	29%	0.288	C	S	.	.	H	α-helix	trans	-65.6	-41	176.8	168.9	0	0	0	0	111.9	L1217 L1218 F1758 I1759 E1760 G1765 R1766	L1217-V1762 HydrophobicContact CD2-CG2 4.08Å; L1217-V1762 HydrophobicContact CG-CG2 4.41Å; L1218-V1762 HydrophobicContact CB-CG1 4.21Å; F1758-V1762 HydrophobicContact CD1-CG2 4.21Å; F1758-V1762 HydrophobicContact CE1-CG2 3.84Å; F1758-V1762 HydrophobicContact CE2-CG2 4.35Å; F1758-V1762 HydrophobicContact CZ-CG2 4.09Å; F1758-V1762 WeakPolarHBondContact O-CB 3.5Å; F1758-V1762 VanDerWaalsContact O-CG2 3.28Å; F1758-V1762 WeakPolarHBondContact O-CG2 3.44Å; F1758-V1762 PolarHBondContact O-N 3.2Å; I1759-V1762 PolarHBondContact O-N 3.15Å; E1760-V1762 VanDerWaalsContact C-N 3.34Å; E1760-V1762 PolarHBondContact O-N 3.1Å; V1762-G1765 PolarHBondContact O-N 3.21Å; V1762-R1766 WeakPolarHBondContact O-CB 3.49Å; V1762-R1766 WeakPolarHBondContact O-CG 3.2Å; V1762-R1766 PolarHBondContact O-N 3.16Å; V1762-R1766 VanDerWaalsContact O-N 3.1Å
1763	N	88.9	Confident	86.4	Confident	78.8 Å²	78.8	58.5 Å²	58.5	42%	0.421	28%	0.278	S	S	.	.	H	α-helix	trans	-72.2	-38.1	-177.7	-73.4	-24.3	0	0	0	112.6	I1759 E1760 G1765 R1766 L1767	I1759-N1763 WeakPolarHBondContact CG2-ND2 3.28Å; I1759-N1763 VanDerWaalsContact O-CB 3.31Å; I1759-N1763 WeakPolarHBondContact O-CB 3.34Å; I1759-N1763 VanDerWaalsContact O-CG 3.25Å; I1759-N1763 PolarHBondContact O-N 3.26Å; I1759-N1763 PolarHBondContact O-ND2 3.26Å; I1759-N1763 VanDerWaalsContact O-ND2 3.16Å; E1760-N1763 WeakPolarHBondContact O-CB 3.41Å; E1760-N1763 PolarHBondContact O-N 3.22Å; E1760-N1763 VanDerWaalsContact O-N 3.08Å; N1763-G1765 VanDerWaalsContact C-N 3.3Å; N1763-G1765 PolarHBondContact O-N 3.19Å; N1763-R1766 WeakPolarHBondContact O-CB 3.25Å; N1763-R1766 PolarHBondContact O-N 2.99Å; N1763-R1766 PolarHBondContact OD1-NH1 3.01Å; N1763-L1767 WeakPolarHBondContact O-CB 3.47Å; N1763-L1767 WeakPolarHBondContact O-CG 3.07Å; N1763-L1767 PolarHBondContact O-N 3.1Å
1764	E	86.5	Confident	86.1	Confident	55 Å²	55	58.3 Å²	58.3	26%	0.257	28%	0.282	S	S	.	.	H	α-helix	trans	-57.5	-44.9	172.1	-138.2	-168.7	-174.1	0	0	111.1	S1280 R1283 R1287 E1760 R1766 L1767 L1768	S1280-E1764 PolarHBondContact OG-OE1 3.38Å; S1280-E1764 VanDerWaalsContact OG-OE1 3.07Å; R1283-E1764 VanDerWaalsContact CB-OE2 3.25Å; R1283-E1764 WeakPolarHBondContact CB-OE2 3.27Å; R1283-E1764 VanDerWaalsContact CD-OE2 3.29Å; R1283-E1764 WeakPolarHBondContact CD-OE2 3.46Å; R1283-E1764 IonicContact CZ-OE1 3.04Å; R1283-E1764 VanDerWaalsContact CZ-OE1 3.27Å; R1283-E1764 IonicContact CZ-OE2 3.94Å; R1283-E1764 VanDerWaalsContact NE-CD 3.3Å; R1283-E1764 IonicContact NE-OE1 3.13Å; R1283-E1764 PolarHBondContact NE-OE1 2.78Å; R1283-E1764 IonicContact NE-OE2 2.96Å; R1283-E1764 PolarHBondContact NE-OE2 2.96Å; R1283-E1764 IonicContact NH2-OE1 2.93Å; R1283-E1764 PolarHBondContact NH2-OE1 3.23Å; R1287-E1764 IonicContact CZ-OE2 3.3Å; R1287-E1764 IonicContact NH1-OE2 3.49Å; R1287-E1764 PolarHBondContact NH1-OE2 3.21Å; R1287-E1764 IonicContact NH2-OE2 3.16Å; R1287-E1764 PolarHBondContact NH2-OE2 2.91Å; R1287-E1764 VanDerWaalsContact NH2-OE2 3.13Å; E1760-E1764 HydrophobicContact CG-CG 4.48Å; E1760-E1764 WeakPolarHBondContact O-CB 3.4Å; E1760-E1764 PolarHBondContact O-N 3.02Å; E1764-R1766 VanDerWaalsContact C-N 3.35Å; E1764-R1766 PolarHBondContact O-N 3.16Å; E1764-L1767 PolarHBondContact O-N 3.1Å; E1764-L1768 VanDerWaalsContact O-CB 3.23Å; E1764-L1768 WeakPolarHBondContact O-CB 3.32Å; E1764-L1768 PolarHBondContact O-N 3.09Å; E1764-L1768 VanDerWaalsContact O-N 3.1Å
1765	G	84.5	Confident	85.8	Confident	11.4 Å²	11.4	62.7 Å²	62.7	12%	0.118	30%	0.302	C	S	.	.	H	α-helix	trans	-62.2	-38.6	178	0	0	0	0	0	113.6	D1208 R1287 L1761 V1762 N1763 L1768 S1769	D1208-G1765 WeakPolarHBondContact CB-O 3.39Å; D1208-G1765 VanDerWaalsContact OD1-CA 3.29Å; D1208-G1765 WeakPolarHBondContact OD1-CA 3.35Å; R1287-G1765 VanDerWaalsContact CZ-CA 3.45Å; R1287-G1765 VanDerWaalsContact NE-CA 3.32Å; L1761-G1765 PolarHBondContact O-N 3.16Å; V1762-G1765 PolarHBondContact O-N 3.21Å; N1763-G1765 VanDerWaalsContact C-N 3.3Å; N1763-G1765 PolarHBondContact O-N 3.19Å; G1765-L1768 PolarHBondContact O-N 3.11Å; G1765-S1769 VanDerWaalsContact O-CB 3.27Å; G1765-S1769 WeakPolarHBondContact O-CB 3.44Å; G1765-S1769 PolarHBondContact O-N 3.1Å
1766	R	85.6	Confident	85.4	Confident	135.4 Å²	135.4	65.2 Å²	65.2	51%	0.511	32%	0.315	S	S	.	.	H	α-helix	trans	-64.4	-44.5	174.2	-74.9	174.8	149.2	163.2	-5	112.2	E1235 V1762 N1763 E1764 L1768 S1769 H1770	E1235-R1766 IonicContact OE1-NE 2.71Å; E1235-R1766 IonicContact OE2-CZ 3.71Å; E1235-R1766 IonicContact OE2-NE 3.69Å; E1235-R1766 PolarHBondContact OE2-NE 3.46Å; E1235-R1766 IonicContact OE2-NH2 3.83Å; E1235-R1766 PolarHBondContact OE2-NH2 2.9Å; V1762-R1766 WeakPolarHBondContact O-CB 3.49Å; V1762-R1766 WeakPolarHBondContact O-CG 3.2Å; V1762-R1766 PolarHBondContact O-N 3.16Å; V1762-R1766 VanDerWaalsContact O-N 3.1Å; N1763-R1766 WeakPolarHBondContact O-CB 3.25Å; N1763-R1766 PolarHBondContact O-N 2.99Å; N1763-R1766 PolarHBondContact OD1-NH1 3.01Å; E1764-R1766 VanDerWaalsContact C-N 3.35Å; E1764-R1766 PolarHBondContact O-N 3.16Å; R1766-L1768 VanDerWaalsContact C-N 3.33Å; R1766-L1768 PolarHBondContact O-N 3.21Å; R1766-S1769 WeakPolarHBondContact O-CB 3.26Å; R1766-S1769 PolarHBondContact O-N 3.17Å; R1766-H1770 PolarHBondContact O-CD2 2.92Å; R1766-H1770 PolarHBondContact O-N 3.38Å; R1766-H1770 VanDerWaalsContact O-N 3.15Å
1767	L	84.7	Confident	85.1	Confident	130.2 Å²	130.2	61.6 Å²	61.6	68%	0.682	30%	0.302	S	S	*	.	H	α-helix	trans	-64.8	-41.8	178.8	-158.1	81.1	0	0	0	111.4	N1763 E1764 H1770 S1771	N1763-L1767 WeakPolarHBondContact O-CB 3.47Å; N1763-L1767 WeakPolarHBondContact O-CG 3.07Å; N1763-L1767 PolarHBondContact O-N 3.1Å; E1764-L1767 PolarHBondContact O-N 3.1Å; L1767-H1770 PolarHBondContact O-N 3.32Å; L1767-S1771 VanDerWaalsContact O-CB 3.3Å; L1767-S1771 WeakPolarHBondContact O-CB 3.33Å; L1767-S1771 PolarHBondContact O-N 3.13Å; L1767-S1771 VanDerWaalsContact O-N 3.12Å; L1767-S1771 PolarHBondContact O-OG 2.91Å
1768	L	82.5	Confident	84.9	Confident	42.2 Å²	42.2	67.8 Å²	67.8	22%	0.221	32%	0.324	C	S	.	.	H	α-helix	trans	-65.8	-42.1	176.7	-174.4	56.4	0	0	0	111.8	D1208 L1276 Q1284 E1764 G1765 R1766 H1770 S1771 I1772	D1208-L1768 WeakPolarHBondContact OD2-CD2 3.48Å; L1276-L1768 HydrophobicContact CD2-CD1 4.15Å; L1276-L1768 HydrophobicContact CD2-CD2 4.41Å; Q1284-L1768 VanDerWaalsContact CD-CD2 3.4Å; Q1284-L1768 HydrophobicContact CG-CD2 3.9Å; E1764-L1768 VanDerWaalsContact O-CB 3.23Å; E1764-L1768 WeakPolarHBondContact O-CB 3.32Å; E1764-L1768 PolarHBondContact O-N 3.09Å; E1764-L1768 VanDerWaalsContact O-N 3.1Å; G1765-L1768 PolarHBondContact O-N 3.11Å; R1766-L1768 VanDerWaalsContact C-N 3.33Å; R1766-L1768 PolarHBondContact O-N 3.21Å; L1768-H1770 VanDerWaalsContact C-N 3.3Å; L1768-H1770 PolarHBondContact O-N 3.07Å; L1768-S1771 PolarHBondContact O-N 3.23Å; L1768-I1772 HydrophobicContact CD1-CD1 3.97Å; L1768-I1772 HydrophobicContact CD1-CG1 4.15Å; L1768-I1772 HydrophobicContact CD2-CD1 4.42Å; L1768-I1772 HydrophobicContact CG-CD1 3.84Å; L1768-I1772 HydrophobicContact CG-CG1 4.39Å; L1768-I1772 WeakPolarHBondContact O-CB 3.38Å; L1768-I1772 WeakPolarHBondContact O-CD1 3.34Å; L1768-I1772 WeakPolarHBondContact O-CG1 3.34Å; L1768-I1772 PolarHBondContact O-N 3Å; L1768-I1772 VanDerWaalsContact O-N 3.13Å
1769	S	80.5	Confident	84.5	Confident	19 Å²	19	69.8 Å²	69.8	13%	0.133	34%	0.337	C	S	.	.	H	α-helix	trans	-59.3	-40.9	174.6	-174.8	0	0	0	0	112.8	D1208 M1209 G1765 R1766 I1772 R1773	D1208-S1769 WeakPolarHBondContact O-CB 3.25Å; D1208-S1769 PolarHBondContact O-OG 3.05Å; D1208-S1769 VanDerWaalsContact O-OG 3.04Å; M1209-S1769 WeakPolarHBondContact CA-OG 3.47Å; G1765-S1769 VanDerWaalsContact O-CB 3.27Å; G1765-S1769 WeakPolarHBondContact O-CB 3.44Å; G1765-S1769 PolarHBondContact O-N 3.1Å; R1766-S1769 WeakPolarHBondContact O-CB 3.26Å; R1766-S1769 PolarHBondContact O-N 3.17Å; S1769-I1772 PolarHBondContact O-N 3.05Å; S1769-R1773 WeakPolarHBondContact O-CB 3.34Å; S1769-R1773 WeakPolarHBondContact O-CG 3.21Å; S1769-R1773 PolarHBondContact O-N 3.2Å; S1769-R1773 VanDerWaalsContact O-N 3.1Å; S1769-R1773 PolarHBondContact O-NE 2.84Å
1770	H	81.4	Confident	84.1	Confident	103 Å²	103	68.1 Å²	68.1	48%	0.477	33%	0.334	S	S	.	.	H	α-helix	trans	-65.8	-47.6	173.4	-136.3	-77.1	0	0	0	111.9	R1766 L1767 L1768 I1772 R1773 D1774	R1766-H1770 PolarHBondContact O-CD2 2.92Å; R1766-H1770 PolarHBondContact O-N 3.38Å; R1766-H1770 VanDerWaalsContact O-N 3.15Å; L1767-H1770 PolarHBondContact O-N 3.32Å; L1768-H1770 VanDerWaalsContact C-N 3.3Å; L1768-H1770 PolarHBondContact O-N 3.07Å; H1770-I1772 VanDerWaalsContact C-N 3.29Å; H1770-I1772 PolarHBondContact O-N 3.14Å; H1770-R1773 PolarHBondContact CD2-NH1 2.8Å; H1770-R1773 PolarHBondContact CE1-NH1 2.87Å; H1770-R1773 PolarHBondContact ND1-NH1 2.81Å; H1770-R1773 PolarHBondContact NE2-NH1 2.73Å; H1770-R1773 VanDerWaalsContact NE2-NH1 3.1Å; H1770-R1773 WeakPolarHBondContact O-CB 3.32Å; H1770-R1773 PolarHBondContact O-N 3.11Å; H1770-R1773 VanDerWaalsContact O-N 3.13Å; H1770-D1774 IonicContact CE1-OD1 2.82Å; H1770-D1774 IonicContact CE1-OD2 3.77Å; H1770-D1774 PolarHBondContact CE1-OD2 3.09Å; H1770-D1774 VanDerWaalsContact CE1-OD2 3.28Å; H1770-D1774 IonicContact ND1-OD1 2.63Å; H1770-D1774 IonicContact ND1-OD2 3.55Å; H1770-D1774 PolarHBondContact ND1-OD2 2.86Å; H1770-D1774 VanDerWaalsContact O-CB 3.25Å; H1770-D1774 WeakPolarHBondContact O-CB 3.4Å; H1770-D1774 VanDerWaalsContact O-CG 3.25Å; H1770-D1774 PolarHBondContact O-N 3.03Å; H1770-D1774 VanDerWaalsContact O-N 3.11Å
1771	S	81.3	Confident	83.8	Confident	65.2 Å²	65.2	66 Å²	66	46%	0.456	33%	0.328	S	S	.	.	H	α-helix	trans	-59.6	-39.8	179.7	-161.4	0	0	0	0	112.5	L1767 L1768 D1774 H1775	L1767-S1771 VanDerWaalsContact O-CB 3.3Å; L1767-S1771 WeakPolarHBondContact O-CB 3.33Å; L1767-S1771 PolarHBondContact O-N 3.13Å; L1767-S1771 VanDerWaalsContact O-N 3.12Å; L1767-S1771 PolarHBondContact O-OG 2.91Å; L1768-S1771 PolarHBondContact O-N 3.23Å; S1771-D1774 PolarHBondContact O-N 2.99Å; S1771-H1775 VanDerWaalsContact O-CB 3.24Å; S1771-H1775 WeakPolarHBondContact O-CB 3.31Å; S1771-H1775 PolarHBondContact O-N 3.32Å
1772	I	81.2	Confident	83.6	Confident	26.4 Å²	26.4	71.4 Å²	71.4	14%	0.135	35%	0.353	C	S	.	.	H	α-helix	trans	-68.9	-42	177.3	-68.6	166.5	0	0	0	111.2	Y1205 M1209 L1768 S1769 H1770 D1774 H1775 L1776	Y1205-I1772 HydrophobicContact CD1-CG1 4.43Å; Y1205-I1772 HydrophobicContact CD1-CG2 3.88Å; Y1205-I1772 HydrophobicContact CE1-CG2 3.42Å; Y1205-I1772 VanDerWaalsContact CE1-CG2 3.46Å; Y1205-I1772 HydrophobicContact CE2-CG2 4.23Å; Y1205-I1772 HydrophobicContact CG-CG2 4.45Å; M1209-I1772 HydrophobicContact CG-CB 4.45Å; M1209-I1772 HydrophobicContact CG-CG2 4.06Å; M1209-I1772 HydrophobicContact SD-CB 4.38Å; M1209-I1772 HydrophobicContact SD-CG2 3.7Å; M1209-I1772 WeakPolarHBondContact SD-CG2 3.36Å; L1768-I1772 HydrophobicContact CD1-CD1 3.97Å; L1768-I1772 HydrophobicContact CD1-CG1 4.15Å; L1768-I1772 HydrophobicContact CD2-CD1 4.42Å; L1768-I1772 HydrophobicContact CG-CD1 3.84Å; L1768-I1772 HydrophobicContact CG-CG1 4.39Å; L1768-I1772 WeakPolarHBondContact O-CB 3.38Å; L1768-I1772 WeakPolarHBondContact O-CD1 3.34Å; L1768-I1772 WeakPolarHBondContact O-CG1 3.34Å; L1768-I1772 PolarHBondContact O-N 3Å; L1768-I1772 VanDerWaalsContact O-N 3.13Å; S1769-I1772 PolarHBondContact O-N 3.05Å; H1770-I1772 VanDerWaalsContact C-N 3.29Å; H1770-I1772 PolarHBondContact O-N 3.14Å; I1772-D1774 VanDerWaalsContact C-N 3.34Å; I1772-D1774 PolarHBondContact O-N 3.09Å; I1772-H1775 WeakPolarHBondContact O-CB 3.48Å; I1772-H1775 PolarHBondContact O-N 3Å; I1772-L1776 HydrophobicContact CG2-CD1 4.02Å; I1772-L1776 HydrophobicContact CG2-CG 4.26Å; I1772-L1776 VanDerWaalsContact O-CB 3.32Å; I1772-L1776 WeakPolarHBondContact O-CB 3.4Å; I1772-L1776 WeakPolarHBondContact O-CD1 3.32Å; I1772-L1776 WeakPolarHBondContact O-CG 3.44Å; I1772-L1776 PolarHBondContact O-N 2.92Å
1773	R	80.4	Confident	83.4	Confident	82.6 Å²	82.6	71.7 Å²	71.7	31%	0.312	36%	0.359	S	S	.	.	H	α-helix	trans	-62.1	-44	176.5	-135	-170.5	-47.7	154.2	0.8	112.1	F1051 M1209 S1769 H1770 H1775 L1776 Y1777	F1051-R1773 HydrophobicContact CB-CB 4.31Å; F1051-R1773 HydrophobicContact CB-CG 4.44Å; F1051-R1773 HydrophobicContact CD1-CG 4.16Å; M1209-R1773 HydrophobicContact CE-CG 3.67Å; M1209-R1773 HydrophobicContact SD-CG 4.17Å; S1769-R1773 WeakPolarHBondContact O-CB 3.34Å; S1769-R1773 WeakPolarHBondContact O-CG 3.21Å; S1769-R1773 PolarHBondContact O-N 3.2Å; S1769-R1773 VanDerWaalsContact O-N 3.1Å; S1769-R1773 PolarHBondContact O-NE 2.84Å; H1770-R1773 PolarHBondContact CD2-NH1 2.8Å; H1770-R1773 PolarHBondContact CE1-NH1 2.87Å; H1770-R1773 PolarHBondContact ND1-NH1 2.81Å; H1770-R1773 PolarHBondContact NE2-NH1 2.73Å; H1770-R1773 VanDerWaalsContact NE2-NH1 3.1Å; H1770-R1773 WeakPolarHBondContact O-CB 3.32Å; H1770-R1773 PolarHBondContact O-N 3.11Å; H1770-R1773 VanDerWaalsContact O-N 3.13Å; R1773-H1775 VanDerWaalsContact C-N 3.3Å; R1773-H1775 PolarHBondContact O-N 3.09Å; R1773-L1776 PolarHBondContact O-N 3.08Å; R1773-Y1777 VanDerWaalsContact O-CB 3.3Å; R1773-Y1777 WeakPolarHBondContact O-CB 3.44Å; R1773-Y1777 PolarHBondContact O-N 3.03Å
1774	D	81.7	Confident	83.2	Confident	66.2 Å²	66.2	71.7 Å²	71.7	35%	0.354	36%	0.359	S	S	.	.	H	α-helix	trans	-67.9	-32.5	178	-114.1	25.9	0	0	0	112.2	H1770 S1771 I1772 R1778	H1770-D1774 IonicContact CE1-OD1 2.82Å; H1770-D1774 IonicContact CE1-OD2 3.77Å; H1770-D1774 PolarHBondContact CE1-OD2 3.09Å; H1770-D1774 VanDerWaalsContact CE1-OD2 3.28Å; H1770-D1774 IonicContact ND1-OD1 2.63Å; H1770-D1774 IonicContact ND1-OD2 3.55Å; H1770-D1774 PolarHBondContact ND1-OD2 2.86Å; H1770-D1774 VanDerWaalsContact O-CB 3.25Å; H1770-D1774 WeakPolarHBondContact O-CB 3.4Å; H1770-D1774 VanDerWaalsContact O-CG 3.25Å; H1770-D1774 PolarHBondContact O-N 3.03Å; H1770-D1774 VanDerWaalsContact O-N 3.11Å; S1771-D1774 PolarHBondContact O-N 2.99Å; I1772-D1774 VanDerWaalsContact C-N 3.34Å; I1772-D1774 PolarHBondContact O-N 3.09Å; D1774-R1778 WeakPolarHBondContact O-CG 3.43Å; D1774-R1778 VanDerWaalsContact O-CZ 3.28Å; D1774-R1778 PolarHBondContact O-N 3.2Å; D1774-R1778 PolarHBondContact O-NE 3.04Å; D1774-R1778 PolarHBondContact O-NH1 3.19Å; D1774-R1778 PolarHBondContact O-NH2 3.08Å; D1774-R1778 IonicContact OD1-CZ 3.01Å; D1774-R1778 IonicContact OD1-NH1 3.29Å; D1774-R1778 PolarHBondContact OD1-NH1 3.08Å; D1774-R1778 IonicContact OD1-NH2 3.64Å; D1774-R1778 IonicContact OD2-CZ 3.47Å; D1774-R1778 IonicContact OD2-NH1 3.35Å; D1774-R1778 PolarHBondContact OD2-NH1 3.2Å; D1774-R1778 IonicContact OD2-NH2 3.13Å; D1774-R1778 PolarHBondContact OD2-NH2 3.46Å
1775	H	82.7	Confident	83.2	Confident	91 Å²	91	73 Å²	73	42%	0.421	37%	0.371	S	S	.	.	H	α-helix	trans	-67.9	-48.6	170	176.3	2.5	0	0	0	111.7	Y1205 S1771 I1772 R1773 Y1777 R1778 V1779	Y1205-H1775 AromaticContact CE2-ND1 3.9Å; Y1205-H1775 AromaticContact CZ-ND1 3.85Å; Y1205-H1775 PolarHBondContact OH-ND1 3.32Å; Y1205-H1775 VanDerWaalsContact OH-ND1 3.08Å; S1771-H1775 VanDerWaalsContact O-CB 3.24Å; S1771-H1775 WeakPolarHBondContact O-CB 3.31Å; S1771-H1775 PolarHBondContact O-N 3.32Å; I1772-H1775 WeakPolarHBondContact O-CB 3.48Å; I1772-H1775 PolarHBondContact O-N 3Å; R1773-H1775 VanDerWaalsContact C-N 3.3Å; R1773-H1775 PolarHBondContact O-N 3.09Å; H1775-Y1777 VanDerWaalsContact C-N 3.28Å; H1775-Y1777 PolarHBondContact O-N 3.2Å; H1775-R1778 WeakPolarHBondContact O-CB 3.33Å; H1775-R1778 PolarHBondContact O-N 3.25Å; H1775-R1778 VanDerWaalsContact O-N 3.1Å; H1775-V1779 VanDerWaalsContact CE1-CG2 3.47Å; H1775-V1779 WeakPolarHBondContact CE1-CG2 3.43Å; H1775-V1779 WeakPolarHBondContact O-CG2 3.38Å; H1775-V1779 PolarHBondContact O-N 3.19Å
1776	L	81.3	Confident	83.3	Confident	56.8 Å²	56.8	76.2 Å²	76.2	30%	0.297	39%	0.385	S	S	.	.	H	α-helix	trans	-59.5	-39.2	178	-125.1	105.8	0	0	0	111.9	V868 L871 A872 F1051 M1209 I1772 R1773 R1778 V1779 A1780	V868-L1776 HydrophobicContact CG1-CD1 3.94Å; V868-L1776 WeakPolarHBondContact O-CD1 3.16Å; L871-L1776 HydrophobicContact CB-CD1 4.09Å; L871-L1776 HydrophobicContact CB-CD2 4.35Å; A872-L1776 HydrophobicContact CB-CD1 3.92Å; F1051-L1776 HydrophobicContact CD1-CD2 4.15Å; F1051-L1776 HydrophobicContact CD2-CD2 3.53Å; F1051-L1776 VanDerWaalsContact CD2-CD2 3.48Å; F1051-L1776 HydrophobicContact CD2-CG 3.94Å; F1051-L1776 HydrophobicContact CE1-CD2 4Å; F1051-L1776 HydrophobicContact CE2-CD2 3.33Å; F1051-L1776 HydrophobicContact CE2-CG 4.08Å; F1051-L1776 HydrophobicContact CG-CD2 3.94Å; F1051-L1776 HydrophobicContact CG-CG 4.43Å; F1051-L1776 HydrophobicContact CZ-CD2 3.59Å; M1209-L1776 HydrophobicContact SD-CD1 4.01Å; I1772-L1776 HydrophobicContact CG2-CD1 4.02Å; I1772-L1776 HydrophobicContact CG2-CG 4.26Å; I1772-L1776 VanDerWaalsContact O-CB 3.32Å; I1772-L1776 WeakPolarHBondContact O-CB 3.4Å; I1772-L1776 WeakPolarHBondContact O-CD1 3.32Å; I1772-L1776 WeakPolarHBondContact O-CG 3.44Å; I1772-L1776 PolarHBondContact O-N 2.92Å; R1773-L1776 PolarHBondContact O-N 3.08Å; L1776-R1778 PolarHBondContact O-N 3.06Å; L1776-V1779 PolarHBondContact O-N 2.93Å; L1776-A1780 VanDerWaalsContact O-CB 3.28Å; L1776-A1780 WeakPolarHBondContact O-CB 3.43Å; L1776-A1780 PolarHBondContact O-N 3.16Å; L1776-A1780 VanDerWaalsContact O-N 3.13Å
1777	Y	82.9	Confident	83.2	Confident	109.4 Å²	109.4	73.7 Å²	73.7	43%	0.429	38%	0.381	S	S	.	.	H	α-helix	trans	-61.8	-46.2	173.2	178.1	-95.6	0	0	0	112.3	L1048 P1049 R1773 H1775 V1779 A1780 V1781	L1048-Y1777 HydrophobicContact CB-CD2 4.2Å; L1048-Y1777 HydrophobicContact CB-CE2 3.5Å; L1048-Y1777 HydrophobicContact CD2-CD2 3.96Å; L1048-Y1777 HydrophobicContact CD2-CE2 3.73Å; L1048-Y1777 HydrophobicContact CG-CD2 4.34Å; L1048-Y1777 HydrophobicContact CG-CE2 3.81Å; L1048-Y1777 VanDerWaalsContact O-CE2 3.26Å; L1048-Y1777 WeakPolarHBondContact O-CE2 3.45Å; L1048-Y1777 PolarHBondContact O-OH 3.41Å; P1049-Y1777 VanDerWaalsContact O-CD2 3.31Å; P1049-Y1777 WeakPolarHBondContact O-CD2 3.41Å; P1049-Y1777 WeakPolarHBondContact O-CE2 3.39Å; R1773-Y1777 VanDerWaalsContact O-CB 3.3Å; R1773-Y1777 WeakPolarHBondContact O-CB 3.44Å; R1773-Y1777 PolarHBondContact O-N 3.03Å; H1775-Y1777 VanDerWaalsContact C-N 3.28Å; H1775-Y1777 PolarHBondContact O-N 3.2Å; Y1777-V1779 VanDerWaalsContact C-N 3.33Å; Y1777-V1779 PolarHBondContact O-N 3.09Å; Y1777-A1780 WeakPolarHBondContact O-CB 3.19Å; Y1777-A1780 PolarHBondContact O-N 3.24Å; Y1777-V1781 HydrophobicContact CD1-CG2 4.38Å; Y1777-V1781 HydrophobicContact CD2-CG2 4.4Å; Y1777-V1781 HydrophobicContact CE1-CG2 3.93Å; Y1777-V1781 HydrophobicContact CE2-CG2 4.12Å; Y1777-V1781 VanDerWaalsContact CZ-CG2 3.42Å; Y1777-V1781 WeakPolarHBondContact O-CG2 3.35Å; Y1777-V1781 PolarHBondContact O-N 3.21Å; Y1777-V1781 VanDerWaalsContact O-N 3.09Å
1778	R	83.9	Confident	83.3	Confident	135 Å²	135	71.1 Å²	71.1	51%	0.509	37%	0.368	S	S	.	.	H	α-helix	trans	-60.8	-44.6	176.1	-81.7	-175	-69.6	-94.5	-1.9	112.2	D1774 H1775 L1776 A1780 V1781 E1782	D1774-R1778 WeakPolarHBondContact O-CG 3.43Å; D1774-R1778 VanDerWaalsContact O-CZ 3.28Å; D1774-R1778 PolarHBondContact O-N 3.2Å; D1774-R1778 PolarHBondContact O-NE 3.04Å; D1774-R1778 PolarHBondContact O-NH1 3.19Å; D1774-R1778 PolarHBondContact O-NH2 3.08Å; D1774-R1778 IonicContact OD1-CZ 3.01Å; D1774-R1778 IonicContact OD1-NH1 3.29Å; D1774-R1778 PolarHBondContact OD1-NH1 3.08Å; D1774-R1778 IonicContact OD1-NH2 3.64Å; D1774-R1778 IonicContact OD2-CZ 3.47Å; D1774-R1778 IonicContact OD2-NH1 3.35Å; D1774-R1778 PolarHBondContact OD2-NH1 3.2Å; D1774-R1778 IonicContact OD2-NH2 3.13Å; D1774-R1778 PolarHBondContact OD2-NH2 3.46Å; H1775-R1778 WeakPolarHBondContact O-CB 3.33Å; H1775-R1778 PolarHBondContact O-N 3.25Å; H1775-R1778 VanDerWaalsContact O-N 3.1Å; L1776-R1778 PolarHBondContact O-N 3.06Å; R1778-A1780 VanDerWaalsContact C-N 3.29Å; R1778-A1780 PolarHBondContact O-N 3.02Å; R1778-V1781 PolarHBondContact O-N 3.18Å; R1778-V1781 VanDerWaalsContact O-N 3.17Å; R1778-E1782 VanDerWaalsContact O-CB 3.3Å; R1778-E1782 WeakPolarHBondContact O-CB 3.38Å; R1778-E1782 PolarHBondContact O-N 3.14Å
1779	V	84.3	Confident	83.6	Confident	54.4 Å²	54.4	75.6 Å²	75.6	33%	0.33	39%	0.388	S	S	.	.	H	α-helix	trans	-64.4	-36	177.8	175.3	0	0	0	0	111.4	A872 H1775 L1776 Y1777 E1782 G1783	A872-V1779 HydrophobicContact CB-CB 4.06Å; A872-V1779 HydrophobicContact CB-CG1 3.65Å; H1775-V1779 VanDerWaalsContact CE1-CG2 3.47Å; H1775-V1779 WeakPolarHBondContact CE1-CG2 3.43Å; H1775-V1779 WeakPolarHBondContact O-CG2 3.38Å; H1775-V1779 PolarHBondContact O-N 3.19Å; L1776-V1779 PolarHBondContact O-N 2.93Å; Y1777-V1779 VanDerWaalsContact C-N 3.33Å; Y1777-V1779 PolarHBondContact O-N 3.09Å; V1779-E1782 PolarHBondContact O-N 3.32Å; V1779-G1783 PolarHBondContact O-N 3.19Å
1780	A	83	Confident	83.9	Confident	37.2 Å²	37.2	78.3 Å²	78.3	31%	0.307	40%	0.4	S	S	.	.	H	α-helix	trans	-66.3	-42.5	175	0	0	0	0	0	112.3	A872 L876 L1048 L1776 Y1777 R1778 G1783 D1784	A872-A1780 HydrophobicContact CB-CB 4.15Å; L876-A1780 HydrophobicContact CB-CB 4.45Å; L1048-A1780 HydrophobicContact CD2-CB 4.08Å; L1776-A1780 VanDerWaalsContact O-CB 3.28Å; L1776-A1780 WeakPolarHBondContact O-CB 3.43Å; L1776-A1780 PolarHBondContact O-N 3.16Å; L1776-A1780 VanDerWaalsContact O-N 3.13Å; Y1777-A1780 WeakPolarHBondContact O-CB 3.19Å; Y1777-A1780 PolarHBondContact O-N 3.24Å; R1778-A1780 VanDerWaalsContact C-N 3.29Å; R1778-A1780 PolarHBondContact O-N 3.02Å; A1780-G1783 PolarHBondContact O-N 3.2Å; A1780-D1784 WeakPolarHBondContact O-CB 3.28Å; A1780-D1784 PolarHBondContact O-N 2.91Å; A1780-D1784 VanDerWaalsContact O-N 3.13Å
1781	V	83.4	Confident	84.1	Confident	59.6 Å²	59.6	78.3 Å²	78.3	36%	0.361	40%	0.4	S	S	.	.	H	α-helix	trans	-67.3	-40	176	173.3	0	0	0	0	111.6	L1048 Y1777 R1778 G1783 D1784 V1785	L1048-V1781 HydrophobicContact CB-CG2 4.43Å; L1048-V1781 HydrophobicContact CD2-CG2 3.93Å; Y1777-V1781 HydrophobicContact CD1-CG2 4.38Å; Y1777-V1781 HydrophobicContact CD2-CG2 4.4Å; Y1777-V1781 HydrophobicContact CE1-CG2 3.93Å; Y1777-V1781 HydrophobicContact CE2-CG2 4.12Å; Y1777-V1781 VanDerWaalsContact CZ-CG2 3.42Å; Y1777-V1781 WeakPolarHBondContact O-CG2 3.35Å; Y1777-V1781 PolarHBondContact O-N 3.21Å; Y1777-V1781 VanDerWaalsContact O-N 3.09Å; R1778-V1781 PolarHBondContact O-N 3.18Å; R1778-V1781 VanDerWaalsContact O-N 3.17Å; V1781-G1783 VanDerWaalsContact C-N 3.34Å; V1781-D1784 PolarHBondContact O-N 3.08Å; V1781-V1785 WeakPolarHBondContact O-CG2 3.43Å; V1781-V1785 PolarHBondContact O-N 3.14Å; V1781-V1785 VanDerWaalsContact O-N 3.16Å
1782	E	85.1	Confident	84.4	Confident	123.2 Å²	123.2	80 Å²	80	58%	0.576	40%	0.402	S	S	*	.	H	α-helix	trans	-65.2	-40.6	174.5	-173.8	171.6	-175.7	0	0	111.4	R1778 V1779 D1784 V1785 I1786	R1778-E1782 VanDerWaalsContact O-CB 3.3Å; R1778-E1782 WeakPolarHBondContact O-CB 3.38Å; R1778-E1782 PolarHBondContact O-N 3.14Å; V1779-E1782 PolarHBondContact O-N 3.32Å; E1782-D1784 PolarHBondContact O-N 3.22Å; E1782-V1785 PolarHBondContact O-N 3.05Å; E1782-I1786 HydrophobicContact CG-CD1 4.08Å; E1782-I1786 HydrophobicContact CG-CG1 4.37Å; E1782-I1786 WeakPolarHBondContact O-CB 3.41Å; E1782-I1786 VanDerWaalsContact O-CG1 3.29Å; E1782-I1786 WeakPolarHBondContact O-CG1 3.29Å; E1782-I1786 PolarHBondContact O-N 3.06Å; E1782-I1786 VanDerWaalsContact O-N 3.13Å
1783	G	85.7	Confident	84.7	Confident	23 Å²	23	81 Å²	81	24%	0.237	41%	0.411	C	S	.	.	H	α-helix	trans	-59.5	-45	172.9	0	0	0	0	0	113.1	V1779 A1780 V1781 V1785 I1786 L1787	V1779-G1783 PolarHBondContact O-N 3.19Å; A1780-G1783 PolarHBondContact O-N 3.2Å; V1781-G1783 VanDerWaalsContact C-N 3.34Å; G1783-V1785 VanDerWaalsContact C-N 3.34Å; G1783-V1785 PolarHBondContact O-N 3.3Å; G1783-I1786 PolarHBondContact O-N 3.17Å; G1783-L1787 VanDerWaalsContact O-CB 3.28Å; G1783-L1787 WeakPolarHBondContact O-CB 3.37Å; G1783-L1787 VanDerWaalsContact O-CG 3.3Å; G1783-L1787 WeakPolarHBondContact O-CG 3.33Å; G1783-L1787 PolarHBondContact O-N 3.25Å
1784	D	84.5	Confident	85.1	Confident	78.6 Å²	78.6	80.6 Å²	80.6	42%	0.42	42%	0.415	S	S	.	.	H	α-helix	trans	-61	-43.5	175.4	-178.3	44.6	0	0	0	112	L876 A1780 V1781 E1782 I1786 L1787 N1788	L876-D1784 HydrophobicContact CD1-CB 4.32Å; L876-D1784 HydrophobicContact CD2-CB 4.03Å; A1780-D1784 WeakPolarHBondContact O-CB 3.28Å; A1780-D1784 PolarHBondContact O-N 2.91Å; A1780-D1784 VanDerWaalsContact O-N 3.13Å; V1781-D1784 PolarHBondContact O-N 3.08Å; E1782-D1784 PolarHBondContact O-N 3.22Å; D1784-I1786 VanDerWaalsContact C-N 3.34Å; D1784-I1786 PolarHBondContact O-N 3.36Å; D1784-L1787 PolarHBondContact O-N 3.16Å; D1784-N1788 VanDerWaalsContact CG-ND2 3.32Å; D1784-N1788 VanDerWaalsContact O-CB 3.28Å; D1784-N1788 WeakPolarHBondContact O-CB 3.38Å; D1784-N1788 VanDerWaalsContact O-CG 3.29Å; D1784-N1788 PolarHBondContact O-N 3.17Å; D1784-N1788 PolarHBondContact O-ND2 3.08Å; D1784-N1788 PolarHBondContact OD1-ND2 3.27Å; D1784-N1788 VanDerWaalsContact OD1-ND2 3.15Å; D1784-N1788 PolarHBondContact OD2-ND2 2.78Å
1785	V	86.6	Confident	85.4	Confident	84 Å²	84	81 Å²	81	51%	0.509	42%	0.417	S	S	.	.	H	α-helix	trans	-61.4	-44.1	175.5	172.1	0	0	0	0	111.5	V1781 E1782 G1783 N1788 Q1789	V1781-V1785 WeakPolarHBondContact O-CG2 3.43Å; V1781-V1785 PolarHBondContact O-N 3.14Å; V1781-V1785 VanDerWaalsContact O-N 3.16Å; E1782-V1785 PolarHBondContact O-N 3.05Å; G1783-V1785 VanDerWaalsContact C-N 3.34Å; G1783-V1785 PolarHBondContact O-N 3.3Å; V1785-N1788 PolarHBondContact O-N 2.79Å; V1785-Q1789 VanDerWaalsContact O-CB 3.29Å; V1785-Q1789 WeakPolarHBondContact O-CB 3.31Å; V1785-Q1789 WeakPolarHBondContact O-CG 3.39Å; V1785-Q1789 PolarHBondContact O-N 2.95Å; V1785-Q1789 VanDerWaalsContact O-N 3.13Å
1786	I	85.7	Confident	85.7	Confident	78.6 Å²	78.6	83.3 Å²	83.3	40%	0.403	43%	0.427	S	S	.	.	H	α-helix	trans	-66.2	-44.3	178.6	-68.9	167.6	0	0	0	111	E1782 G1783 D1784 N1788 Q1789 I1790	E1782-I1786 HydrophobicContact CG-CD1 4.08Å; E1782-I1786 HydrophobicContact CG-CG1 4.37Å; E1782-I1786 WeakPolarHBondContact O-CB 3.41Å; E1782-I1786 VanDerWaalsContact O-CG1 3.29Å; E1782-I1786 WeakPolarHBondContact O-CG1 3.29Å; E1782-I1786 PolarHBondContact O-N 3.06Å; E1782-I1786 VanDerWaalsContact O-N 3.13Å; G1783-I1786 PolarHBondContact O-N 3.17Å; D1784-I1786 VanDerWaalsContact C-N 3.34Å; D1784-I1786 PolarHBondContact O-N 3.36Å; I1786-N1788 PolarHBondContact O-N 3.42Å; I1786-Q1789 PolarHBondContact O-N 3.07Å; I1786-I1790 HydrophobicContact CG2-CD1 3.78Å; I1786-I1790 HydrophobicContact CG2-CG1 4.43Å; I1786-I1790 WeakPolarHBondContact O-CB 3.42Å; I1786-I1790 VanDerWaalsContact O-CG1 3.3Å; I1786-I1790 WeakPolarHBondContact O-CG1 3.27Å; I1786-I1790 PolarHBondContact O-N 3.22Å
1787	L	84.2	Confident	86.1	Confident	82.2 Å²	82.2	85.6 Å²	85.6	43%	0.43	44%	0.437	S	S	.	.	H	α-helix	trans	-61.3	-45	177.3	-76	169.7	0	0	0	111.6	V820 L873 G1783 D1784 Q1789 I1790 H1791	V820-L1787 HydrophobicContact CB-CD2 4.23Å; V820-L1787 HydrophobicContact CG1-CD2 4.17Å; V820-L1787 HydrophobicContact CG2-CD2 4.06Å; L873-L1787 HydrophobicContact CD2-CD1 4.38Å; G1783-L1787 VanDerWaalsContact O-CB 3.28Å; G1783-L1787 WeakPolarHBondContact O-CB 3.37Å; G1783-L1787 VanDerWaalsContact O-CG 3.3Å; G1783-L1787 WeakPolarHBondContact O-CG 3.33Å; G1783-L1787 PolarHBondContact O-N 3.25Å; D1784-L1787 PolarHBondContact O-N 3.16Å; L1787-Q1789 VanDerWaalsContact C-N 3.32Å; L1787-Q1789 PolarHBondContact O-N 2.91Å; L1787-I1790 PolarHBondContact O-N 3.12Å; L1787-H1791 VanDerWaalsContact O-CB 3.28Å; L1787-H1791 WeakPolarHBondContact O-CB 3.39Å; L1787-H1791 PolarHBondContact O-N 3.21Å
1788	N	86.2	Confident	86.5	Confident	75.2 Å²	75.2	84.6 Å²	84.6	40%	0.402	44%	0.436	S	S	.	.	H	α-helix	trans	-63.5	-39.6	175.4	-79	-67.6	0	0	0	112.1	D1784 V1785 I1786 H1791 M1792	D1784-N1788 VanDerWaalsContact CG-ND2 3.32Å; D1784-N1788 VanDerWaalsContact O-CB 3.28Å; D1784-N1788 WeakPolarHBondContact O-CB 3.38Å; D1784-N1788 VanDerWaalsContact O-CG 3.29Å; D1784-N1788 PolarHBondContact O-N 3.17Å; D1784-N1788 PolarHBondContact O-ND2 3.08Å; D1784-N1788 PolarHBondContact OD1-ND2 3.27Å; D1784-N1788 VanDerWaalsContact OD1-ND2 3.15Å; D1784-N1788 PolarHBondContact OD2-ND2 2.78Å; V1785-N1788 PolarHBondContact O-N 2.79Å; I1786-N1788 PolarHBondContact O-N 3.42Å; N1788-H1791 PolarHBondContact O-N 3.14Å; N1788-M1792 WeakPolarHBondContact O-CB 3.29Å; N1788-M1792 VanDerWaalsContact O-CG 3.27Å; N1788-M1792 WeakPolarHBondContact O-CG 3.38Å; N1788-M1792 PolarHBondContact O-N 3.12Å
1789	Q	88.9	Confident	86.7	Confident	137 Å²	137	81.9 Å²	81.9	64%	0.64	43%	0.434	S	S	*	.	H	α-helix	trans	-64.7	-42.6	175.7	-160.4	176.5	-1.7	0	0	112.2	V1785 I1786 L1787 H1791 M1792 S1793	V1785-Q1789 VanDerWaalsContact O-CB 3.29Å; V1785-Q1789 WeakPolarHBondContact O-CB 3.31Å; V1785-Q1789 WeakPolarHBondContact O-CG 3.39Å; V1785-Q1789 PolarHBondContact O-N 2.95Å; V1785-Q1789 VanDerWaalsContact O-N 3.13Å; I1786-Q1789 PolarHBondContact O-N 3.07Å; L1787-Q1789 VanDerWaalsContact C-N 3.32Å; L1787-Q1789 PolarHBondContact O-N 2.91Å; Q1789-H1791 VanDerWaalsContact C-N 3.35Å; Q1789-M1792 PolarHBondContact O-N 3.07Å; Q1789-S1793 WeakPolarHBondContact O-CB 3.31Å; Q1789-S1793 PolarHBondContact O-N 3.06Å
1790	I	87.3	Confident	87	Confident	75.8 Å²	75.8	85.4 Å²	85.4	39%	0.389	45%	0.445	S	S	.	.	H	α-helix	trans	-63.1	-44.6	174.8	-69	167.6	0	0	0	110.2	I1786 L1787 M1792 S1793 N1794	I1786-I1790 HydrophobicContact CG2-CD1 3.78Å; I1786-I1790 HydrophobicContact CG2-CG1 4.43Å; I1786-I1790 WeakPolarHBondContact O-CB 3.42Å; I1786-I1790 VanDerWaalsContact O-CG1 3.3Å; I1786-I1790 WeakPolarHBondContact O-CG1 3.27Å; I1786-I1790 PolarHBondContact O-N 3.22Å; L1787-I1790 PolarHBondContact O-N 3.12Å; I1790-M1792 PolarHBondContact O-N 2.94Å; I1790-S1793 WeakPolarHBondContact O-CB 3.43Å; I1790-S1793 PolarHBondContact O-N 3.2Å; I1790-S1793 VanDerWaalsContact O-N 3.16Å; I1790-N1794 WeakPolarHBondContact O-CB 3.4Å; I1790-N1794 VanDerWaalsContact O-CG 3.29Å; I1790-N1794 PolarHBondContact O-N 3.24Å; I1790-N1794 PolarHBondContact O-ND2 3.34Å; I1790-N1794 PolarHBondContact O-OD1 3.06Å
1791	H	86.9	Confident	87.4	Confident	102.8 Å²	102.8	89.9 Å²	89.9	48%	0.476	46%	0.458	S	S	.	.	H	α-helix	trans	-61	-46.5	178.2	-177.4	-134.6	0	0	0	112.1	L1787 N1788 Q1789 S1793 N1794 I1795	L1787-H1791 VanDerWaalsContact O-CB 3.28Å; L1787-H1791 WeakPolarHBondContact O-CB 3.39Å; L1787-H1791 PolarHBondContact O-N 3.21Å; N1788-H1791 PolarHBondContact O-N 3.14Å; Q1789-H1791 VanDerWaalsContact C-N 3.35Å; H1791-S1793 VanDerWaalsContact C-N 3.33Å; H1791-S1793 PolarHBondContact O-N 3.15Å; H1791-N1794 PolarHBondContact O-N 3.17Å; H1791-I1795 WeakPolarHBondContact CE1-CD1 3.43Å; H1791-I1795 WeakPolarHBondContact O-CG1 3.31Å; H1791-I1795 PolarHBondContact O-N 3.08Å; H1791-I1795 VanDerWaalsContact O-N 3.08Å
1792	M	86.6	Confident	87.7	Confident	100.4 Å²	100.4	92 Å²	92	50%	0.495	46%	0.464	S	S	.	.	H	α-helix	trans	-62.4	-39.3	175.1	-69	-61.4	114.4	0	0	112.5	N1788 Q1789 I1790 I1795 Q1796	N1788-M1792 WeakPolarHBondContact O-CB 3.29Å; N1788-M1792 VanDerWaalsContact O-CG 3.27Å; N1788-M1792 WeakPolarHBondContact O-CG 3.38Å; N1788-M1792 PolarHBondContact O-N 3.12Å; Q1789-M1792 PolarHBondContact O-N 3.07Å; I1790-M1792 PolarHBondContact O-N 2.94Å; M1792-I1795 HydrophobicContact CE-CD1 3.9Å; M1792-I1795 PolarHBondContact O-N 2.99Å; M1792-I1795 HydrophobicContact SD-CD1 4.44Å; M1792-Q1796 WeakPolarHBondContact O-CB 3.39Å; M1792-Q1796 WeakPolarHBondContact O-CG 3.44Å; M1792-Q1796 PolarHBondContact O-N 3.02Å; M1792-Q1796 VanDerWaalsContact O-N 3.08Å
1793	S	87.9	Confident	87.9	Confident	48 Å²	48	92 Å²	92	34%	0.336	46%	0.464	S	S	.	.	H	α-helix	trans	-64.1	-42.4	174.7	-175.2	0	0	0	0	111.9	Q1789 I1790 H1791 I1795 Q1796 Q1797	Q1789-S1793 WeakPolarHBondContact O-CB 3.31Å; Q1789-S1793 PolarHBondContact O-N 3.06Å; I1790-S1793 WeakPolarHBondContact O-CB 3.43Å; I1790-S1793 PolarHBondContact O-N 3.2Å; I1790-S1793 VanDerWaalsContact O-N 3.16Å; H1791-S1793 VanDerWaalsContact C-N 3.33Å; H1791-S1793 PolarHBondContact O-N 3.15Å; S1793-I1795 PolarHBondContact O-N 2.97Å; S1793-Q1796 PolarHBondContact O-N 3.07Å; S1793-Q1797 WeakPolarHBondContact O-CB 3.41Å; S1793-Q1797 VanDerWaalsContact O-CG 3.26Å; S1793-Q1797 WeakPolarHBondContact O-CG 3.31Å; S1793-Q1797 PolarHBondContact O-N 3.17Å; S1793-Q1797 PolarHBondContact O-NE2 3.43Å; S1793-Q1797 PolarHBondContact OG-NE2 3.06Å; S1793-Q1797 VanDerWaalsContact OG-NE2 3.16Å
1794	N	88.9	Confident	88.2	Confident	75.2 Å²	75.2	95.5 Å²	95.5	40%	0.402	48%	0.476	S	S	.	.	H	α-helix	trans	-63.6	-42.7	177.9	-71.4	-8.5	0	0	0	111.6	I1790 H1791 Q1796 Q1797 H1798	I1790-N1794 WeakPolarHBondContact O-CB 3.4Å; I1790-N1794 VanDerWaalsContact O-CG 3.29Å; I1790-N1794 PolarHBondContact O-N 3.24Å; I1790-N1794 PolarHBondContact O-ND2 3.34Å; I1790-N1794 PolarHBondContact O-OD1 3.06Å; H1791-N1794 PolarHBondContact O-N 3.17Å; N1794-Q1796 VanDerWaalsContact C-N 3.32Å; N1794-Q1796 PolarHBondContact O-N 2.93Å; N1794-Q1797 CarbonylContact O-C 3.44Å; N1794-Q1797 WeakPolarHBondContact O-CA 3.34Å; N1794-Q1797 WeakPolarHBondContact O-CB 3.35Å; N1794-Q1797 PolarHBondContact O-N 3.11Å; N1794-H1798 WeakPolarHBondContact O-CB 3.36Å; N1794-H1798 PolarHBondContact O-CD2 3.41Å; N1794-H1798 PolarHBondContact O-N 3.03Å
1795	I	88.5	Confident	88.5	Confident	74 Å²	74	93.9 Å²	93.9	38%	0.379	47%	0.469	S	S	.	.	H	α-helix	trans	-58.9	-47.6	174.5	-68.6	167.4	0	0	0	110.7	H1791 M1792 S1793 Q1797 H1798 T1799	H1791-I1795 WeakPolarHBondContact CE1-CD1 3.43Å; H1791-I1795 WeakPolarHBondContact O-CG1 3.31Å; H1791-I1795 PolarHBondContact O-N 3.08Å; H1791-I1795 VanDerWaalsContact O-N 3.08Å; M1792-I1795 HydrophobicContact CE-CD1 3.9Å; M1792-I1795 PolarHBondContact O-N 2.99Å; M1792-I1795 HydrophobicContact SD-CD1 4.44Å; S1793-I1795 PolarHBondContact O-N 2.97Å; I1795-Q1797 VanDerWaalsContact C-N 3.3Å; I1795-Q1797 PolarHBondContact O-N 3.21Å; I1795-H1798 WeakPolarHBondContact O-CB 3.28Å; I1795-H1798 PolarHBondContact O-N 3.09Å; I1795-H1798 VanDerWaalsContact O-N 3.11Å; I1795-T1799 WeakPolarHBondContact O-CB 3.4Å; I1795-T1799 PolarHBondContact O-N 3.26Å; I1795-T1799 VanDerWaalsContact O-N 3.11Å; I1795-T1799 PolarHBondContact O-OG1 3.14Å; I1795-T1799 VanDerWaalsContact O-OG1 3.09Å
1796	Q	88	Confident	88.7	Confident	138.2 Å²	138.2	92.8 Å²	92.8	65%	0.646	47%	0.469	S	S	*	.	H	α-helix	trans	-62	-37.8	178.4	-85.2	-179.5	6.6	0	0	112.7	M1792 S1793 N1794 K1800	M1792-Q1796 WeakPolarHBondContact O-CB 3.39Å; M1792-Q1796 WeakPolarHBondContact O-CG 3.44Å; M1792-Q1796 PolarHBondContact O-N 3.02Å; M1792-Q1796 VanDerWaalsContact O-N 3.08Å; S1793-Q1796 PolarHBondContact O-N 3.07Å; N1794-Q1796 VanDerWaalsContact C-N 3.32Å; N1794-Q1796 PolarHBondContact O-N 2.93Å; Q1796-K1800 WeakPolarHBondContact O-CB 3.27Å; Q1796-K1800 WeakPolarHBondContact O-CD 3.27Å; Q1796-K1800 WeakPolarHBondContact O-CG 3.23Å; Q1796-K1800 PolarHBondContact O-N 3.07Å; Q1796-K1800 VanDerWaalsContact O-N 3.08Å
1797	Q	89.7	Confident	88.9	Confident	105 Å²	105	94.7 Å²	94.7	49%	0.491	48%	0.476	S	S	.	.	H	α-helix	trans	-68.9	-38.8	175.1	-71.3	177.7	38.4	0	0	111.9	S1793 N1794 I1795 K1800 F1801	S1793-Q1797 WeakPolarHBondContact O-CB 3.41Å; S1793-Q1797 VanDerWaalsContact O-CG 3.26Å; S1793-Q1797 WeakPolarHBondContact O-CG 3.31Å; S1793-Q1797 PolarHBondContact O-N 3.17Å; S1793-Q1797 PolarHBondContact O-NE2 3.43Å; S1793-Q1797 PolarHBondContact OG-NE2 3.06Å; S1793-Q1797 VanDerWaalsContact OG-NE2 3.16Å; N1794-Q1797 CarbonylContact O-C 3.44Å; N1794-Q1797 WeakPolarHBondContact O-CA 3.34Å; N1794-Q1797 WeakPolarHBondContact O-CB 3.35Å; N1794-Q1797 PolarHBondContact O-N 3.11Å; I1795-Q1797 VanDerWaalsContact C-N 3.3Å; I1795-Q1797 PolarHBondContact O-N 3.21Å; Q1797-K1800 PolarHBondContact O-N 3.22Å; Q1797-F1801 WeakPolarHBondContact O-CB 3.38Å; Q1797-F1801 PolarHBondContact O-N 3.04Å
1798	H	90.3	Very high	89.2	Confident	90.2 Å²	90.2	94.2 Å²	94.2	42%	0.418	48%	0.476	S	S	.	.	H	α-helix	trans	-64.5	-50.4	177.1	-148.1	82.3	0	0	0	111.4	N1794 I1795 K1800 F1801 E1802	N1794-H1798 WeakPolarHBondContact O-CB 3.36Å; N1794-H1798 PolarHBondContact O-CD2 3.41Å; N1794-H1798 PolarHBondContact O-N 3.03Å; I1795-H1798 WeakPolarHBondContact O-CB 3.28Å; I1795-H1798 PolarHBondContact O-N 3.09Å; I1795-H1798 VanDerWaalsContact O-N 3.11Å; H1798-K1800 VanDerWaalsContact C-N 3.28Å; H1798-K1800 PolarHBondContact O-N 3.13Å; H1798-F1801 CarbonylContact O-C 3.38Å; H1798-F1801 WeakPolarHBondContact O-CA 3.3Å; H1798-F1801 WeakPolarHBondContact O-CB 3.36Å; H1798-F1801 PolarHBondContact O-N 3.18Å; H1798-F1801 VanDerWaalsContact O-N 3.09Å; H1798-E1802 IonicContact CD2-OE1 3.2Å; H1798-E1802 IonicContact CD2-OE2 3.12Å; H1798-E1802 PolarHBondContact CD2-OE2 2.72Å; H1798-E1802 IonicContact NE2-OE1 3.76Å; H1798-E1802 PolarHBondContact NE2-OE1 3.07Å; H1798-E1802 IonicContact NE2-OE2 2.67Å; H1798-E1802 WeakPolarHBondContact O-CG 3.43Å; H1798-E1802 PolarHBondContact O-N 2.95Å
1799	T	89.5	Confident	89.3	Confident	77.2 Å²	77.2	95.3 Å²	95.3	47%	0.474	48%	0.48	S	S	.	.	H	α-helix	trans	-57.6	-40.3	177.6	-54.8	0	0	0	0	112	I1795 F1801 E1802 E1803	I1795-T1799 WeakPolarHBondContact O-CB 3.4Å; I1795-T1799 PolarHBondContact O-N 3.26Å; I1795-T1799 VanDerWaalsContact O-N 3.11Å; I1795-T1799 PolarHBondContact O-OG1 3.14Å; I1795-T1799 VanDerWaalsContact O-OG1 3.09Å; T1799-F1801 VanDerWaalsContact C-N 3.32Å; T1799-F1801 PolarHBondContact O-N 3.38Å; T1799-E1802 WeakPolarHBondContact CA-OE2 3.4Å; T1799-E1802 PolarHBondContact O-N 3.08Å; T1799-E1803 WeakPolarHBondContact O-CB 3.45Å; T1799-E1803 WeakPolarHBondContact O-CG 3.43Å; T1799-E1803 PolarHBondContact O-N 3.43Å
1800	K	90.3	Very high	89.3	Confident	127.6 Å²	127.6	90.9 Å²	90.9	56%	0.555	47%	0.467	S	S	*	.	H	α-helix	trans	-67	-36.7	175.1	-159.1	175.9	-179.2	177.2	0	112.6	Q1796 Q1797 H1798 I1804	Q1796-K1800 WeakPolarHBondContact O-CB 3.27Å; Q1796-K1800 WeakPolarHBondContact O-CD 3.27Å; Q1796-K1800 WeakPolarHBondContact O-CG 3.23Å; Q1796-K1800 PolarHBondContact O-N 3.07Å; Q1796-K1800 VanDerWaalsContact O-N 3.08Å; Q1797-K1800 PolarHBondContact O-N 3.22Å; H1798-K1800 VanDerWaalsContact C-N 3.28Å; H1798-K1800 PolarHBondContact O-N 3.13Å; K1800-I1804 HydrophobicContact CG-CD1 4.04Å; K1800-I1804 WeakPolarHBondContact O-CB 3.29Å; K1800-I1804 WeakPolarHBondContact O-CD1 3.32Å; K1800-I1804 VanDerWaalsContact O-CG1 3.25Å; K1800-I1804 WeakPolarHBondContact O-CG1 3.36Å; K1800-I1804 PolarHBondContact O-N 3.12Å; K1800-I1804 VanDerWaalsContact O-N 3.1Å
1801	F	91.5	Very high	89.2	Confident	132.2 Å²	132.2	91.4 Å²	91.4	58%	0.58	47%	0.471	S	S	*	.	H	α-helix	trans	-67	-40.9	174.6	176.2	-96.1	0	0	0	111.6	Q1797 H1798 T1799 I1804 T1805	Q1797-F1801 WeakPolarHBondContact O-CB 3.38Å; Q1797-F1801 PolarHBondContact O-N 3.04Å; H1798-F1801 CarbonylContact O-C 3.38Å; H1798-F1801 WeakPolarHBondContact O-CA 3.3Å; H1798-F1801 WeakPolarHBondContact O-CB 3.36Å; H1798-F1801 PolarHBondContact O-N 3.18Å; H1798-F1801 VanDerWaalsContact O-N 3.09Å; T1799-F1801 VanDerWaalsContact C-N 3.32Å; T1799-F1801 PolarHBondContact O-N 3.38Å; F1801-I1804 PolarHBondContact O-N 3.17Å; F1801-T1805 VanDerWaalsContact O-CB 3.27Å; F1801-T1805 WeakPolarHBondContact O-CB 3.27Å; F1801-T1805 PolarHBondContact O-N 3.03Å; F1801-T1805 PolarHBondContact O-OG1 3.14Å
1802	E	88.7	Confident	89.2	Confident	104.4 Å²	104.4	91 Å²	91	49%	0.488	47%	0.471	S	S	.	.	H	α-helix	trans	-61.6	-46.2	173.9	-69.9	179.2	130.4	0	0	111.7	H1798 T1799 I1804 T1805 A1806	H1798-E1802 IonicContact CD2-OE1 3.2Å; H1798-E1802 IonicContact CD2-OE2 3.12Å; H1798-E1802 PolarHBondContact CD2-OE2 2.72Å; H1798-E1802 IonicContact NE2-OE1 3.76Å; H1798-E1802 PolarHBondContact NE2-OE1 3.07Å; H1798-E1802 IonicContact NE2-OE2 2.67Å; H1798-E1802 WeakPolarHBondContact O-CG 3.43Å; H1798-E1802 PolarHBondContact O-N 2.95Å; T1799-E1802 WeakPolarHBondContact CA-OE2 3.4Å; T1799-E1802 PolarHBondContact O-N 3.08Å; E1802-I1804 PolarHBondContact O-N 2.75Å; E1802-T1805 PolarHBondContact O-N 3.16Å; E1802-A1806 VanDerWaalsContact O-CB 3.27Å; E1802-A1806 WeakPolarHBondContact O-CB 3.31Å; E1802-A1806 PolarHBondContact O-N 2.97Å
1803	E	89.7	Confident	89.2	Confident	121.6 Å²	121.6	93.8 Å²	93.8	57%	0.568	48%	0.477	S	S	*	.	H	α-helix	trans	-58.4	-50	176.3	-163.2	-178.2	-165.1	0	0	111.8	T1799 T1805 A1806 H1807	T1799-E1803 WeakPolarHBondContact O-CB 3.45Å; T1799-E1803 WeakPolarHBondContact O-CG 3.43Å; T1799-E1803 PolarHBondContact O-N 3.43Å; E1803-T1805 VanDerWaalsContact C-N 3.32Å; E1803-T1805 PolarHBondContact O-N 2.98Å; E1803-A1806 PolarHBondContact O-N 3.15Å; E1803-H1807 WeakPolarHBondContact O-CB 3.31Å; E1803-H1807 PolarHBondContact O-CD2 3.36Å; E1803-H1807 PolarHBondContact O-N 3.03Å
1804	I	91.8	Very high	88.7	Confident	97.8 Å²	97.8	98.1 Å²	98.1	50%	0.502	49%	0.491	S	S	.	.	H	α-helix	trans	-62.3	-42.1	177.6	-68.9	167.3	0	0	0	110.8	K1800 F1801 E1802 A1806 H1807 T1808	K1800-I1804 HydrophobicContact CG-CD1 4.04Å; K1800-I1804 WeakPolarHBondContact O-CB 3.29Å; K1800-I1804 WeakPolarHBondContact O-CD1 3.32Å; K1800-I1804 VanDerWaalsContact O-CG1 3.25Å; K1800-I1804 WeakPolarHBondContact O-CG1 3.36Å; K1800-I1804 PolarHBondContact O-N 3.12Å; K1800-I1804 VanDerWaalsContact O-N 3.1Å; F1801-I1804 PolarHBondContact O-N 3.17Å; E1802-I1804 PolarHBondContact O-N 2.75Å; I1804-A1806 PolarHBondContact O-N 2.96Å; I1804-H1807 PolarHBondContact O-N 3.1Å; I1804-T1808 WeakPolarHBondContact O-CB 3.3Å; I1804-T1808 PolarHBondContact O-N 3.13Å; I1804-T1808 PolarHBondContact O-OG1 3.1Å; I1804-T1808 VanDerWaalsContact O-OG1 3.11Å
1805	T	91.2	Very high	88.1	Confident	45.2 Å²	45.2	99.6 Å²	99.6	28%	0.277	50%	0.496	S	S	.	.	H	α-helix	trans	-66.4	-42.3	179.3	-58.4	0	0	0	0	111.1	F1801 E1802 E1803 H1807 T1808 M1809	F1801-T1805 VanDerWaalsContact O-CB 3.27Å; F1801-T1805 WeakPolarHBondContact O-CB 3.27Å; F1801-T1805 PolarHBondContact O-N 3.03Å; F1801-T1805 PolarHBondContact O-OG1 3.14Å; E1802-T1805 PolarHBondContact O-N 3.16Å; E1803-T1805 VanDerWaalsContact C-N 3.32Å; E1803-T1805 PolarHBondContact O-N 2.98Å; T1805-H1807 PolarHBondContact O-N 2.95Å; T1805-T1808 PolarHBondContact O-N 3.08Å; T1805-M1809 HydrophobicContact CG2-CE 3.75Å; T1805-M1809 VanDerWaalsContact CG2-CE 3.42Å; T1805-M1809 HydrophobicContact CG2-CG 4.45Å; T1805-M1809 HydrophobicContact CG2-SD 4.44Å; T1805-M1809 WeakPolarHBondContact O-CB 3.39Å; T1805-M1809 VanDerWaalsContact O-CG 3.32Å; T1805-M1809 WeakPolarHBondContact O-CG 3.35Å; T1805-M1809 PolarHBondContact O-N 3.11Å
1806	A	90.4	Very high	87.8	Confident	59.6 Å²	59.6	102.6 Å²	102.6	49%	0.493	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-44.1	176.8	0	0	0	0	0	111.8	E1802 E1803 I1804 M1809 A1810	E1802-A1806 VanDerWaalsContact O-CB 3.27Å; E1802-A1806 WeakPolarHBondContact O-CB 3.31Å; E1802-A1806 PolarHBondContact O-N 2.97Å; E1803-A1806 PolarHBondContact O-N 3.15Å; I1804-A1806 PolarHBondContact O-N 2.96Å; A1806-M1809 PolarHBondContact O-N 3.24Å; A1806-A1810 WeakPolarHBondContact O-CB 3.41Å; A1806-A1810 PolarHBondContact O-N 3Å
1807	H	90.3	Very high	87.3	Confident	118.6 Å²	118.6	101.1 Å²	101.1	55%	0.549	50%	0.499	S	S	.	.	H	α-helix	trans	-63.9	-42.9	174.6	-111.2	-1.2	0	0	0	112.2	E1803 I1804 T1805 M1809 A1810 N1811	E1803-H1807 WeakPolarHBondContact O-CB 3.31Å; E1803-H1807 PolarHBondContact O-CD2 3.36Å; E1803-H1807 PolarHBondContact O-N 3.03Å; I1804-H1807 PolarHBondContact O-N 3.1Å; T1805-H1807 PolarHBondContact O-N 2.95Å; H1807-M1809 PolarHBondContact O-N 3.22Å; H1807-A1810 WeakPolarHBondContact O-CB 3.12Å; H1807-A1810 PolarHBondContact O-N 3.13Å; H1807-N1811 PolarHBondContact CE1-ND2 2.9Å; H1807-N1811 PolarHBondContact CE1-OD1 3.26Å; H1807-N1811 VanDerWaalsContact CE1-OD1 3.24Å; H1807-N1811 PolarHBondContact NE2-ND2 3.31Å; H1807-N1811 VanDerWaalsContact NE2-ND2 3.12Å; H1807-N1811 VanDerWaalsContact O-CG 3.25Å; H1807-N1811 PolarHBondContact O-N 3.06Å; H1807-N1811 PolarHBondContact O-ND2 3.09Å; H1807-N1811 PolarHBondContact O-OD1 3.29Å
1808	T	89.7	Confident	86.6	Confident	71.2 Å²	71.2	99.4 Å²	99.4	44%	0.437	49%	0.494	S	S	.	.	H	α-helix	trans	-63.2	-43.3	176.4	-56.4	0	0	0	0	111.4	I1804 T1805 A1810 N1811 L1812	I1804-T1808 WeakPolarHBondContact O-CB 3.3Å; I1804-T1808 PolarHBondContact O-N 3.13Å; I1804-T1808 PolarHBondContact O-OG1 3.1Å; I1804-T1808 VanDerWaalsContact O-OG1 3.11Å; T1805-T1808 PolarHBondContact O-N 3.08Å; T1808-A1810 VanDerWaalsContact C-N 3.33Å; T1808-A1810 PolarHBondContact O-N 3.37Å; T1808-N1811 PolarHBondContact O-N 2.84Å; T1808-L1812 HydrophobicContact CG2-CD1 4.12Å; T1808-L1812 HydrophobicContact CG2-CG 4.32Å; T1808-L1812 WeakPolarHBondContact O-CB 3.32Å; T1808-L1812 VanDerWaalsContact O-CG 3.29Å; T1808-L1812 WeakPolarHBondContact O-CG 3.28Å; T1808-L1812 PolarHBondContact O-N 3.28Å; T1808-L1812 VanDerWaalsContact O-N 3.08Å
1809	M	89.5	Confident	85.9	Confident	100 Å²	100	100.1 Å²	100.1	49%	0.493	50%	0.497	S	S	.	.	H	α-helix	trans	-65.4	-34.7	175.5	-89	-169.5	-165.1	0	0	112.8	T1805 A1806 H1807 L1812 R1813	T1805-M1809 HydrophobicContact CG2-CE 3.75Å; T1805-M1809 VanDerWaalsContact CG2-CE 3.42Å; T1805-M1809 HydrophobicContact CG2-CG 4.45Å; T1805-M1809 HydrophobicContact CG2-SD 4.44Å; T1805-M1809 WeakPolarHBondContact O-CB 3.39Å; T1805-M1809 VanDerWaalsContact O-CG 3.32Å; T1805-M1809 WeakPolarHBondContact O-CG 3.35Å; T1805-M1809 PolarHBondContact O-N 3.11Å; A1806-M1809 PolarHBondContact O-N 3.24Å; H1807-M1809 PolarHBondContact O-N 3.22Å; M1809-L1812 PolarHBondContact O-N 3.03Å; M1809-R1813 WeakPolarHBondContact O-CD 3.29Å; M1809-R1813 VanDerWaalsContact O-CG 3.27Å; M1809-R1813 WeakPolarHBondContact O-CG 3.36Å; M1809-R1813 PolarHBondContact O-N 3Å; M1809-R1813 VanDerWaalsContact O-N 3.12Å
1810	A	87.9	Confident	85.5	Confident	43 Å²	43	101.5 Å²	101.5	36%	0.355	50%	0.496	S	S	.	.	H	α-helix	trans	-65.1	-49.5	174.8	0	0	0	0	0	111.1	A1806 H1807 T1808 L1812 R1813 E1814	A1806-A1810 WeakPolarHBondContact O-CB 3.41Å; A1806-A1810 PolarHBondContact O-N 3Å; H1807-A1810 WeakPolarHBondContact O-CB 3.12Å; H1807-A1810 PolarHBondContact O-N 3.13Å; T1808-A1810 VanDerWaalsContact C-N 3.33Å; T1808-A1810 PolarHBondContact O-N 3.37Å; A1810-L1812 VanDerWaalsContact C-N 3.33Å; A1810-L1812 PolarHBondContact O-N 3.04Å; A1810-R1813 WeakPolarHBondContact O-CB 3.38Å; A1810-R1813 PolarHBondContact O-N 3.17Å; A1810-R1813 VanDerWaalsContact O-N 3.09Å; A1810-E1814 PolarHBondContact O-N 3.26Å; A1810-E1814 VanDerWaalsContact O-N 3.11Å
1811	N	85.5	Confident	84.7	Confident	88 Å²	88	97 Å²	97	47%	0.471	48%	0.478	S	S	.	.	H	α-helix	trans	-59.9	-43.8	178.1	-65.3	-8	0	0	0	111.7	H1807 T1808 R1813 E1814 E1815	H1807-N1811 PolarHBondContact CE1-ND2 2.9Å; H1807-N1811 PolarHBondContact CE1-OD1 3.26Å; H1807-N1811 VanDerWaalsContact CE1-OD1 3.24Å; H1807-N1811 PolarHBondContact NE2-ND2 3.31Å; H1807-N1811 VanDerWaalsContact NE2-ND2 3.12Å; H1807-N1811 VanDerWaalsContact O-CG 3.25Å; H1807-N1811 PolarHBondContact O-N 3.06Å; H1807-N1811 PolarHBondContact O-ND2 3.09Å; H1807-N1811 PolarHBondContact O-OD1 3.29Å; T1808-N1811 PolarHBondContact O-N 2.84Å; N1811-R1813 VanDerWaalsContact C-N 3.3Å; N1811-R1813 PolarHBondContact O-N 3.25Å; N1811-E1814 PolarHBondContact O-N 3.09Å; N1811-E1814 VanDerWaalsContact O-N 3.12Å; N1811-E1815 PolarHBondContact O-N 3.2Å
1812	L	87.6	Confident	83.8	Confident	94.4 Å²	94.4	92.4 Å²	92.4	49%	0.494	46%	0.459	S	S	.	.	H	α-helix	trans	-61.9	-34.1	176.9	-73.3	171.5	0	0	0	112.9	T1808 M1809 A1810 E1815 E1816	T1808-L1812 HydrophobicContact CG2-CD1 4.12Å; T1808-L1812 HydrophobicContact CG2-CG 4.32Å; T1808-L1812 WeakPolarHBondContact O-CB 3.32Å; T1808-L1812 VanDerWaalsContact O-CG 3.29Å; T1808-L1812 WeakPolarHBondContact O-CG 3.28Å; T1808-L1812 PolarHBondContact O-N 3.28Å; T1808-L1812 VanDerWaalsContact O-N 3.08Å; M1809-L1812 PolarHBondContact O-N 3.03Å; A1810-L1812 VanDerWaalsContact C-N 3.33Å; A1810-L1812 PolarHBondContact O-N 3.04Å; L1812-E1815 PolarHBondContact O-N 3.47Å; L1812-E1816 VanDerWaalsContact O-CB 3.29Å; L1812-E1816 WeakPolarHBondContact O-CB 3.35Å; L1812-E1816 VanDerWaalsContact O-CG 3.31Å; L1812-E1816 WeakPolarHBondContact O-CG 3.47Å; L1812-E1816 PolarHBondContact O-N 3.24Å
1813	R	85.5	Confident	83.3	Confident	159.4 Å²	159.4	91.2 Å²	91.2	60%	0.602	46%	0.455	S	S	*	.	H	α-helix	trans	-69.7	-34.6	174.5	-73.2	169.5	-178	164.5	3.1	112.4	M1809 A1810 N1811 K1817	M1809-R1813 WeakPolarHBondContact O-CD 3.29Å; M1809-R1813 VanDerWaalsContact O-CG 3.27Å; M1809-R1813 WeakPolarHBondContact O-CG 3.36Å; M1809-R1813 PolarHBondContact O-N 3Å; M1809-R1813 VanDerWaalsContact O-N 3.12Å; A1810-R1813 WeakPolarHBondContact O-CB 3.38Å; A1810-R1813 PolarHBondContact O-N 3.17Å; A1810-R1813 VanDerWaalsContact O-N 3.09Å; N1811-R1813 VanDerWaalsContact C-N 3.3Å; N1811-R1813 PolarHBondContact O-N 3.25Å; R1813-K1817 WeakPolarHBondContact O-CB 3.4Å; R1813-K1817 WeakPolarHBondContact O-CD 3.38Å; R1813-K1817 VanDerWaalsContact O-CG 3.28Å; R1813-K1817 WeakPolarHBondContact O-CG 3.41Å; R1813-K1817 PolarHBondContact O-N 3.17Å; R1813-K1817 VanDerWaalsContact O-N 3.1Å
1814	E	78.3	Confident	82.6	Confident	137.4 Å²	137.4	87.4 Å²	87.4	64%	0.642	44%	0.439	S	S	*	.	H	α-helix	trans	-70.1	-42.2	174.2	-66.5	-153.9	161.9	0	0	111.3	A1810 N1811 E1816 K1817 L1818	A1810-E1814 PolarHBondContact O-N 3.26Å; A1810-E1814 VanDerWaalsContact O-N 3.11Å; N1811-E1814 PolarHBondContact O-N 3.09Å; N1811-E1814 VanDerWaalsContact O-N 3.12Å; E1814-E1816 PolarHBondContact O-N 3.38Å; E1814-K1817 PolarHBondContact O-N 3.22Å; E1814-L1818 WeakPolarHBondContact O-CB 3.44Å; E1814-L1818 PolarHBondContact O-N 3.08Å
1815	E	76.6	Confident	81.6	Confident	107.6 Å²	107.6	83.1 Å²	83.1	50%	0.503	42%	0.417	S	S	.	.	H	α-helix	trans	-62.3	-42.3	172.1	-71.2	-172.6	164.1	0	0	112.1	N1811 L1812 K1817 L1818 H1819	N1811-E1815 PolarHBondContact O-N 3.2Å; L1812-E1815 PolarHBondContact O-N 3.47Å; E1815-K1817 VanDerWaalsContact C-N 3.34Å; E1815-K1817 PolarHBondContact O-N 2.85Å; E1815-L1818 WeakPolarHBondContact O-CB 3.5Å; E1815-L1818 PolarHBondContact O-N 3.13Å; E1815-H1819 WeakPolarHBondContact O-CB 3.41Å; E1815-H1819 VanDerWaalsContact O-CG 3.27Å; E1815-H1819 PolarHBondContact O-N 3.14Å; E1815-H1819 PolarHBondContact O-ND1 3.14Å; E1815-H1819 VanDerWaalsContact O-ND1 3.17Å
1816	E	80.9	Confident	80.7	Confident	136.8 Å²	136.8	81.8 Å²	81.8	64%	0.639	41%	0.411	S	S	*	.	H	α-helix	trans	-61.5	-43.9	175.4	-158.7	-177.5	-178.2	0	0	111.6	L1812 E1814 L1818 H1819 K1820	L1812-E1816 VanDerWaalsContact O-CB 3.29Å; L1812-E1816 WeakPolarHBondContact O-CB 3.35Å; L1812-E1816 VanDerWaalsContact O-CG 3.31Å; L1812-E1816 WeakPolarHBondContact O-CG 3.47Å; L1812-E1816 PolarHBondContact O-N 3.24Å; E1814-E1816 PolarHBondContact O-N 3.38Å; E1816-L1818 VanDerWaalsContact C-N 3.35Å; E1816-L1818 PolarHBondContact O-N 3.15Å; E1816-H1819 PolarHBondContact O-N 3.26Å; E1816-K1820 VanDerWaalsContact O-CB 3.3Å; E1816-K1820 WeakPolarHBondContact O-CB 3.34Å; E1816-K1820 PolarHBondContact O-N 3.05Å
1817	K	78.4	Confident	80.1	Confident	105.4 Å²	105.4	86.6 Å²	86.6	46%	0.458	42%	0.417	S	S	.	.	H	α-helix	trans	-61.1	-43.7	174.9	-133.9	-177.5	177.6	-172.3	0	111.4	R1813 E1814 E1815 K1820 N1821 D2038	R1813-K1817 WeakPolarHBondContact O-CB 3.4Å; R1813-K1817 WeakPolarHBondContact O-CD 3.38Å; R1813-K1817 VanDerWaalsContact O-CG 3.28Å; R1813-K1817 WeakPolarHBondContact O-CG 3.41Å; R1813-K1817 PolarHBondContact O-N 3.17Å; R1813-K1817 VanDerWaalsContact O-N 3.1Å; E1814-K1817 PolarHBondContact O-N 3.22Å; E1815-K1817 VanDerWaalsContact C-N 3.34Å; E1815-K1817 PolarHBondContact O-N 2.85Å; K1817-K1820 PolarHBondContact O-N 3.24Å; K1817-N1821 WeakPolarHBondContact O-CB 3.39Å; K1817-N1821 PolarHBondContact O-N 3.1Å; K1817-N1821 PolarHBondContact O-OD1 3.06Å; K1817-D2038 WeakPolarHBondContact CE-OD1 3.44Å; K1817-D2038 IonicContact NZ-OD1 2.9Å; K1817-D2038 PolarHBondContact NZ-OD1 3.14Å; K1817-D2038 IonicContact NZ-OD2 3.46Å; K1817-D2038 PolarHBondContact NZ-OD2 3.09Å
1818	L	74.2	Confident	79.3	Confident	70.8 Å²	70.8	83.6 Å²	83.6	37%	0.371	40%	0.404	S	S	.	.	H	α-helix	trans	-61.7	-48.6	176.7	-176.9	97.5	0	0	0	111.2	E1814 E1815 E1816 K1820 N1821 I1822 T2025 E2036	E1814-L1818 WeakPolarHBondContact O-CB 3.44Å; E1814-L1818 PolarHBondContact O-N 3.08Å; E1815-L1818 WeakPolarHBondContact O-CB 3.5Å; E1815-L1818 PolarHBondContact O-N 3.13Å; E1816-L1818 VanDerWaalsContact C-N 3.35Å; E1816-L1818 PolarHBondContact O-N 3.15Å; L1818-K1820 VanDerWaalsContact C-N 3.34Å; L1818-K1820 PolarHBondContact O-N 3.17Å; L1818-N1821 PolarHBondContact O-N 3.21Å; L1818-N1821 VanDerWaalsContact O-N 3.16Å; L1818-I1822 HydrophobicContact CD1-CD1 4.47Å; L1818-I1822 HydrophobicContact CD2-CD1 3.58Å; L1818-I1822 HydrophobicContact CD2-CG1 4.45Å; L1818-I1822 HydrophobicContact CG-CD1 4.18Å; L1818-I1822 VanDerWaalsContact O-CG1 3.3Å; L1818-I1822 WeakPolarHBondContact O-CG1 3.34Å; L1818-I1822 PolarHBondContact O-N 3.16Å; L1818-T2025 HydrophobicContact CD1-CG2 4.34Å; L1818-E2036 VanDerWaalsContact CD1-OE2 3.27Å; L1818-E2036 WeakPolarHBondContact CD1-OE2 3.32Å
1819	H	77.4	Confident	78.4	Confident	103.6 Å²	103.6	81.8 Å²	81.8	48%	0.48	39%	0.39	S	S	.	.	H	α-helix	trans	-61.8	-40.4	177.2	-68.6	134.7	0	0	0	112.5	E1815 E1816 I1822 I1823	E1815-H1819 WeakPolarHBondContact O-CB 3.41Å; E1815-H1819 VanDerWaalsContact O-CG 3.27Å; E1815-H1819 PolarHBondContact O-N 3.14Å; E1815-H1819 PolarHBondContact O-ND1 3.14Å; E1815-H1819 VanDerWaalsContact O-ND1 3.17Å; E1816-H1819 PolarHBondContact O-N 3.26Å; H1819-I1822 PolarHBondContact O-N 2.97Å; H1819-I1823 WeakPolarHBondContact O-CB 3.34Å; H1819-I1823 WeakPolarHBondContact O-CD1 3.46Å; H1819-I1823 VanDerWaalsContact O-CG1 3.28Å; H1819-I1823 WeakPolarHBondContact O-CG1 3.39Å; H1819-I1823 PolarHBondContact O-N 3.16Å
1820	K	79.3	Confident	77.7	Confident	106.4 Å²	106.4	81.3 Å²	81.3	46%	0.463	39%	0.389	S	S	.	.	H	α-helix	trans	-59.8	-49.7	173.3	-178.9	-173.5	173.2	-174.9	0	111.1	E1816 K1817 L1818 I1822 I1823 D1824 D2040	E1816-K1820 VanDerWaalsContact O-CB 3.3Å; E1816-K1820 WeakPolarHBondContact O-CB 3.34Å; E1816-K1820 PolarHBondContact O-N 3.05Å; K1817-K1820 PolarHBondContact O-N 3.24Å; L1818-K1820 VanDerWaalsContact C-N 3.34Å; L1818-K1820 PolarHBondContact O-N 3.17Å; K1820-I1822 VanDerWaalsContact C-N 3.29Å; K1820-I1822 PolarHBondContact O-N 3.29Å; K1820-I1823 PolarHBondContact O-N 3.29Å; K1820-I1823 VanDerWaalsContact O-N 3.13Å; K1820-D1824 WeakPolarHBondContact CE-OD2 3.47Å; K1820-D1824 WeakPolarHBondContact CG-OD2 3.35Å; K1820-D1824 WeakPolarHBondContact O-CB 3.29Å; K1820-D1824 PolarHBondContact O-N 3.09Å; K1820-D2040 IonicContact NZ-OD1 3.22Å; K1820-D2040 IonicContact NZ-OD2 3.27Å; K1820-D2040 PolarHBondContact NZ-OD2 3.47Å
1821	N	73.4	Confident	77.1	Confident	33.2 Å²	33.2	81.4 Å²	81.4	18%	0.178	39%	0.39	C	S	.	.	H	α-helix	trans	-60.7	-37.9	179.1	-73.7	-0.1	0	0	0	111.9	K1817 L1818 I1823 D1824 S1825 D2038	K1817-N1821 WeakPolarHBondContact O-CB 3.39Å; K1817-N1821 PolarHBondContact O-N 3.1Å; K1817-N1821 PolarHBondContact O-OD1 3.06Å; L1818-N1821 PolarHBondContact O-N 3.21Å; L1818-N1821 VanDerWaalsContact O-N 3.16Å; N1821-I1823 PolarHBondContact O-N 3.34Å; N1821-D1824 PolarHBondContact O-N 3.08Å; N1821-S1825 VanDerWaalsContact O-CB 3.22Å; N1821-S1825 WeakPolarHBondContact O-CB 3.33Å; N1821-S1825 PolarHBondContact O-N 3.08Å; N1821-S1825 PolarHBondContact O-OG 3.04Å; N1821-D2038 PolarHBondContact ND2-OD1 2.97Å
1822	I	74.4	Confident	76.3	Confident	36 Å²	36	79.6 Å²	79.6	19%	0.185	38%	0.378	C	S	.	.	H	α-helix	trans	-63	-46.5	173.4	-69.6	167.2	0	0	0	111.3	L1818 H1819 K1820 A1826 F2003 E2036	L1818-I1822 HydrophobicContact CD1-CD1 4.47Å; L1818-I1822 HydrophobicContact CD2-CD1 3.58Å; L1818-I1822 HydrophobicContact CD2-CG1 4.45Å; L1818-I1822 HydrophobicContact CG-CD1 4.18Å; L1818-I1822 VanDerWaalsContact O-CG1 3.3Å; L1818-I1822 WeakPolarHBondContact O-CG1 3.34Å; L1818-I1822 PolarHBondContact O-N 3.16Å; H1819-I1822 PolarHBondContact O-N 2.97Å; K1820-I1822 VanDerWaalsContact C-N 3.29Å; K1820-I1822 PolarHBondContact O-N 3.29Å; I1822-A1826 VanDerWaalsContact O-CB 3.3Å; I1822-A1826 WeakPolarHBondContact O-CB 3.29Å; I1822-A1826 PolarHBondContact O-N 3.2Å; I1822-F2003 HydrophobicContact CG2-CE1 4.08Å; I1822-E2036 VanDerWaalsContact CG1-CD 3.44Å; I1822-E2036 HydrophobicContact CG1-CG 4.25Å; I1822-E2036 WeakPolarHBondContact CG1-OE1 3.32Å; I1822-E2036 VanDerWaalsContact CG1-OE2 3.25Å; I1822-E2036 WeakPolarHBondContact CG1-OE2 3.29Å
1823	I	77	Confident	75.5	Confident	78.8 Å²	78.8	78 Å²	78	40%	0.404	37%	0.37	S	S	.	.	H	α-helix	trans	-65.1	-46.4	-179.4	-70.5	165.1	0	0	0	110.9	H1819 K1820 N1821 A1826 R1827	H1819-I1823 WeakPolarHBondContact O-CB 3.34Å; H1819-I1823 WeakPolarHBondContact O-CD1 3.46Å; H1819-I1823 VanDerWaalsContact O-CG1 3.28Å; H1819-I1823 WeakPolarHBondContact O-CG1 3.39Å; H1819-I1823 PolarHBondContact O-N 3.16Å; K1820-I1823 PolarHBondContact O-N 3.29Å; K1820-I1823 VanDerWaalsContact O-N 3.13Å; N1821-I1823 PolarHBondContact O-N 3.34Å; I1823-A1826 WeakPolarHBondContact O-CB 3.34Å; I1823-A1826 PolarHBondContact O-N 2.97Å; I1823-R1827 HydrophobicContact CG2-CG 4.43Å; I1823-R1827 WeakPolarHBondContact O-CG 3.37Å; I1823-R1827 PolarHBondContact O-N 3.12Å
1824	D	75.5	Confident	74.9	Confident	43.2 Å²	43.2	73.9 Å²	73.9	23%	0.231	37%	0.366	C	S	.	.	H	α-helix	trans	-70	-38.8	-179.6	-70.8	-24.5	0	0	0	111	K1820 N1821 A1826 R1827 L1828	K1820-D1824 WeakPolarHBondContact CE-OD2 3.47Å; K1820-D1824 WeakPolarHBondContact CG-OD2 3.35Å; K1820-D1824 WeakPolarHBondContact O-CB 3.29Å; K1820-D1824 PolarHBondContact O-N 3.09Å; N1821-D1824 PolarHBondContact O-N 3.08Å; D1824-A1826 VanDerWaalsContact C-N 3.3Å; D1824-A1826 PolarHBondContact O-N 3.15Å; D1824-R1827 PolarHBondContact O-N 3.34Å; D1824-R1827 WeakPolarHBondContact OD1-CD 3.46Å; D1824-R1827 IonicContact OD1-CZ 3.06Å; D1824-R1827 IonicContact OD1-NE 2.84Å; D1824-R1827 IonicContact OD1-NH1 3.31Å; D1824-R1827 PolarHBondContact OD1-NH1 3Å; D1824-L1828 WeakPolarHBondContact O-CB 3.4Å; D1824-L1828 WeakPolarHBondContact O-CD1 3.27Å; D1824-L1828 VanDerWaalsContact O-CG 3.26Å; D1824-L1828 WeakPolarHBondContact O-CG 3.4Å; D1824-L1828 PolarHBondContact O-N 3.21Å
1825	S	70.3	Confident	74.5	Confident	6.2 Å²	6.2	70.7 Å²	70.7	4%	0.043	35%	0.353	C	S	.	.	H	α-helix	trans	-60.8	-36	169.5	-68.5	0	0	0	0	112.8	N1821 L1828 R1829 H2037	N1821-S1825 VanDerWaalsContact O-CB 3.22Å; N1821-S1825 WeakPolarHBondContact O-CB 3.33Å; N1821-S1825 PolarHBondContact O-N 3.08Å; N1821-S1825 PolarHBondContact O-OG 3.04Å; S1825-L1828 PolarHBondContact O-N 3.15Å; S1825-R1829 WeakPolarHBondContact O-CB 3.29Å; S1825-R1829 WeakPolarHBondContact O-CG 3.27Å; S1825-R1829 PolarHBondContact O-N 3.16Å; S1825-R1829 PolarHBondContact O-NE 3.26Å; S1825-H2037 PolarHBondContact OG-N 3.13Å
1826	A	72.9	Confident	74.2	Confident	17.2 Å²	17.2	69.2 Å²	69.2	14%	0.142	34%	0.344	C	S	.	.	H	α-helix	trans	-68.9	-45.9	175.3	0	0	0	0	0	111.9	I1822 I1823 D1824 L1828 R1829 D1830	I1822-A1826 VanDerWaalsContact O-CB 3.3Å; I1822-A1826 WeakPolarHBondContact O-CB 3.29Å; I1822-A1826 PolarHBondContact O-N 3.2Å; I1823-A1826 WeakPolarHBondContact O-CB 3.34Å; I1823-A1826 PolarHBondContact O-N 2.97Å; D1824-A1826 VanDerWaalsContact C-N 3.3Å; D1824-A1826 PolarHBondContact O-N 3.15Å; A1826-L1828 VanDerWaalsContact C-N 3.31Å; A1826-L1828 PolarHBondContact O-N 3Å; A1826-R1829 VanDerWaalsContact CA-NH2 3.32Å; A1826-R1829 VanDerWaalsContact O-CB 3.23Å; A1826-R1829 WeakPolarHBondContact O-CB 3.38Å; A1826-R1829 PolarHBondContact O-N 3.03Å; A1826-R1829 VanDerWaalsContact O-N 3.1Å; A1826-D1830 PolarHBondContact O-N 3.01Å
1827	R	78.2	Confident	73.8	Confident	161.2 Å²	161.2	66.8 Å²	66.8	61%	0.608	33%	0.334	S	S	*	.	H	α-helix	trans	-59.6	-41.2	175	-72.1	167.7	171.5	169.7	-3.7	112.2	I1823 D1824 D1830 A1831	I1823-R1827 HydrophobicContact CG2-CG 4.43Å; I1823-R1827 WeakPolarHBondContact O-CG 3.37Å; I1823-R1827 PolarHBondContact O-N 3.12Å; D1824-R1827 PolarHBondContact O-N 3.34Å; D1824-R1827 WeakPolarHBondContact OD1-CD 3.46Å; D1824-R1827 IonicContact OD1-CZ 3.06Å; D1824-R1827 IonicContact OD1-NE 2.84Å; D1824-R1827 IonicContact OD1-NH1 3.31Å; D1824-R1827 PolarHBondContact OD1-NH1 3Å; R1827-D1830 PolarHBondContact O-N 3.11Å; R1827-A1831 WeakPolarHBondContact O-CB 3.34Å; R1827-A1831 PolarHBondContact O-N 3.33Å
1828	L	73.1	Confident	73.7	Confident	56 Å²	56	65.8 Å²	65.8	29%	0.293	33%	0.334	S	S	.	.	H	α-helix	trans	-67.2	-41.2	177.6	-71.3	165.1	0	0	0	111.2	D1824 S1825 A1826 D1830 A1831 Q1832 T2039 Y2059	D1824-L1828 WeakPolarHBondContact O-CB 3.4Å; D1824-L1828 WeakPolarHBondContact O-CD1 3.27Å; D1824-L1828 VanDerWaalsContact O-CG 3.26Å; D1824-L1828 WeakPolarHBondContact O-CG 3.4Å; D1824-L1828 PolarHBondContact O-N 3.21Å; S1825-L1828 PolarHBondContact O-N 3.15Å; A1826-L1828 VanDerWaalsContact C-N 3.31Å; A1826-L1828 PolarHBondContact O-N 3Å; L1828-D1830 VanDerWaalsContact C-N 3.32Å; L1828-D1830 PolarHBondContact O-N 2.94Å; L1828-A1831 CarbonylContact O-C 3.58Å; L1828-A1831 WeakPolarHBondContact O-CA 3.42Å; L1828-A1831 WeakPolarHBondContact O-CB 3.36Å; L1828-A1831 PolarHBondContact O-N 3.18Å; L1828-A1831 VanDerWaalsContact O-N 3.11Å; L1828-Q1832 WeakPolarHBondContact O-CB 3.36Å; L1828-Q1832 VanDerWaalsContact O-CG 3.28Å; L1828-Q1832 WeakPolarHBondContact O-CG 3.32Å; L1828-Q1832 PolarHBondContact O-N 2.85Å; L1828-T2039 HydrophobicContact CD1-CG2 4.42Å; L1828-Y2059 HydrophobicContact CB-CD1 4.06Å; L1828-Y2059 HydrophobicContact CB-CD2 4.2Å; L1828-Y2059 HydrophobicContact CB-CE1 3.75Å; L1828-Y2059 VanDerWaalsContact CB-CE1 3.43Å; L1828-Y2059 HydrophobicContact CB-CE2 4.25Å; L1828-Y2059 HydrophobicContact CB-CG 4.27Å; L1828-Y2059 HydrophobicContact CD1-CD1 4.28Å; L1828-Y2059 HydrophobicContact CD1-CE1 3.63Å; L1828-Y2059 VanDerWaalsContact CD1-CE1 3.41Å; L1828-Y2059 WeakPolarHBondContact CD1-OH 3.37Å; L1828-Y2059 HydrophobicContact CG-CE1 4.22Å
1829	R	71.3	Confident	73.5	Confident	33.4 Å²	33.4	65.2 Å²	65.2	13%	0.126	33%	0.331	C	S	.	.	H	α-helix	trans	-56.1	-49.2	169.5	-84.1	-175.5	-74	-103.4	-2	112.3	S1825 A1826 A1831 Q1832 L1833 E2036 Y2059	S1825-R1829 WeakPolarHBondContact O-CB 3.29Å; S1825-R1829 WeakPolarHBondContact O-CG 3.27Å; S1825-R1829 PolarHBondContact O-N 3.16Å; S1825-R1829 PolarHBondContact O-NE 3.26Å; A1826-R1829 VanDerWaalsContact CA-NH2 3.32Å; A1826-R1829 VanDerWaalsContact O-CB 3.23Å; A1826-R1829 WeakPolarHBondContact O-CB 3.38Å; A1826-R1829 PolarHBondContact O-N 3.03Å; A1826-R1829 VanDerWaalsContact O-N 3.1Å; R1829-A1831 VanDerWaalsContact C-N 3.31Å; R1829-A1831 PolarHBondContact O-N 3.16Å; R1829-Q1832 WeakPolarHBondContact O-CB 3.07Å; R1829-Q1832 PolarHBondContact O-N 3Å; R1829-L1833 WeakPolarHBondContact O-CB 3.34Å; R1829-L1833 PolarHBondContact O-N 3.11Å; R1829-E2036 IonicContact NH1-OE1 3.13Å; R1829-Y2059 VanDerWaalsContact CD-O 3.25Å; R1829-Y2059 WeakPolarHBondContact CD-O 3.34Å; R1829-Y2059 VanDerWaalsContact CG-CB 3.5Å; R1829-Y2059 HydrophobicContact CG-CG 4.18Å; R1829-Y2059 WeakPolarHBondContact CG-O 3.37Å; R1829-Y2059 PolarHBondContact NH1-O 2.84Å
1830	D	74.6	Confident	73.2	Confident	89 Å²	89	64.1 Å²	64.1	48%	0.476	33%	0.325	S	S	.	.	H	α-helix	trans	-65.7	-39.1	-177.6	-69.8	-19.4	0	0	0	111.3	A1826 R1827 L1828 Q1832 L1833 S1834	A1826-D1830 PolarHBondContact O-N 3.01Å; R1827-D1830 PolarHBondContact O-N 3.11Å; L1828-D1830 VanDerWaalsContact C-N 3.32Å; L1828-D1830 PolarHBondContact O-N 2.94Å; D1830-Q1832 VanDerWaalsContact C-N 3.34Å; D1830-Q1832 PolarHBondContact O-N 3.32Å; D1830-L1833 PolarHBondContact O-N 2.94Å; D1830-S1834 VanDerWaalsContact O-CB 3.25Å; D1830-S1834 WeakPolarHBondContact O-CB 3.39Å; D1830-S1834 PolarHBondContact O-N 3.19Å
1831	A	74.3	Confident	73	Confident	45.8 Å²	45.8	62.4 Å²	62.4	38%	0.379	33%	0.327	S	S	.	.	H	α-helix	trans	-64.1	-43.2	172.7	0	0	0	0	0	112.2	R1827 L1828 R1829 L1833 S1834 N1835	R1827-A1831 WeakPolarHBondContact O-CB 3.34Å; R1827-A1831 PolarHBondContact O-N 3.33Å; L1828-A1831 CarbonylContact O-C 3.58Å; L1828-A1831 WeakPolarHBondContact O-CA 3.42Å; L1828-A1831 WeakPolarHBondContact O-CB 3.36Å; L1828-A1831 PolarHBondContact O-N 3.18Å; L1828-A1831 VanDerWaalsContact O-N 3.11Å; R1829-A1831 VanDerWaalsContact C-N 3.31Å; R1829-A1831 PolarHBondContact O-N 3.16Å; A1831-L1833 VanDerWaalsContact C-N 3.35Å; A1831-L1833 PolarHBondContact O-N 3.03Å; A1831-S1834 PolarHBondContact O-N 3.22Å; A1831-N1835 VanDerWaalsContact O-CB 3.27Å; A1831-N1835 WeakPolarHBondContact O-CB 3.39Å; A1831-N1835 VanDerWaalsContact O-CG 3.28Å; A1831-N1835 PolarHBondContact O-N 3.09Å; A1831-N1835 PolarHBondContact O-ND2 3.01Å
1832	Q	68.7	Low	73	Confident	49.6 Å²	49.6	64.3 Å²	64.3	23%	0.232	34%	0.337	C	S	.	.	H	α-helix	trans	-64.1	-44.7	175.9	-72.7	-172.5	-22.1	0	0	112	L1828 R1829 D1830 S1834 N1835 Y1836 W1988 F1989 Q1990 Y2059	L1828-Q1832 WeakPolarHBondContact O-CB 3.36Å; L1828-Q1832 VanDerWaalsContact O-CG 3.28Å; L1828-Q1832 WeakPolarHBondContact O-CG 3.32Å; L1828-Q1832 PolarHBondContact O-N 2.85Å; R1829-Q1832 WeakPolarHBondContact O-CB 3.07Å; R1829-Q1832 PolarHBondContact O-N 3Å; D1830-Q1832 VanDerWaalsContact C-N 3.34Å; D1830-Q1832 PolarHBondContact O-N 3.32Å; Q1832-S1834 VanDerWaalsContact C-N 3.35Å; Q1832-N1835 CarbonylContact O-C 3.43Å; Q1832-N1835 PolarHBondContact O-N 3.28Å; Q1832-Y1836 WeakPolarHBondContact O-CB 3.23Å; Q1832-Y1836 PolarHBondContact O-N 2.92Å; Q1832-W1988 WeakPolarHBondContact CA-O 3.34Å; Q1832-W1988 HydrophobicContact CB-CB 3.68Å; Q1832-W1988 HydrophobicContact CB-CG 3.84Å; Q1832-W1988 VanDerWaalsContact CD-CG 3.49Å; Q1832-W1988 HydrophobicContact CG-CB 3.81Å; Q1832-W1988 HydrophobicContact CG-CD2 4.19Å; Q1832-W1988 HydrophobicContact CG-CG 3.54Å; Q1832-W1988 WeakPolarHBondContact CG-O 3.39Å; Q1832-F1989 PolarHBondContact NE2-O 3.11Å; Q1832-Q1990 HydrophobicContact CB-CB 4.43Å; Q1832-Q1990 HydrophobicContact CG-CB 4.35Å; Q1832-Y2059 VanDerWaalsContact CD-CD2 3.45Å; Q1832-Y2059 HydrophobicContact CG-CD2 4.46Å; Q1832-Y2059 VanDerWaalsContact NE2-CD2 3.34Å; Q1832-Y2059 VanDerWaalsContact OE1-CD2 3.29Å
1833	L	71	Confident	72.7	Confident	61.6 Å²	61.6	65.8 Å²	65.8	32%	0.323	34%	0.34	S	S	.	.	H	α-helix	trans	-64.2	-42.2	177.1	-179	61.9	0	0	0	111.3	R1829 D1830 A1831 Y1836 L1837 L1994 Y1995 L1999	R1829-L1833 WeakPolarHBondContact O-CB 3.34Å; R1829-L1833 PolarHBondContact O-N 3.11Å; D1830-L1833 PolarHBondContact O-N 2.94Å; A1831-L1833 VanDerWaalsContact C-N 3.35Å; A1831-L1833 PolarHBondContact O-N 3.03Å; L1833-Y1836 HydrophobicContact CD1-CD1 4.4Å; L1833-Y1836 WeakPolarHBondContact O-CB 3.36Å; L1833-Y1836 PolarHBondContact O-N 3.05Å; L1833-L1837 HydrophobicContact CD1-CD1 4.29Å; L1833-L1837 HydrophobicContact CD1-CG 4.3Å; L1833-L1837 HydrophobicContact CG-CD1 4.11Å; L1833-L1837 HydrophobicContact CG-CG 4.37Å; L1833-L1837 WeakPolarHBondContact O-CB 3.35Å; L1833-L1837 VanDerWaalsContact O-CG 3.26Å; L1833-L1837 WeakPolarHBondContact O-CG 3.34Å; L1833-L1837 PolarHBondContact O-N 3.19Å; L1833-L1994 HydrophobicContact CD1-CD1 4.49Å; L1833-L1994 HydrophobicContact CD2-CD1 4.37Å; L1833-Y1995 HydrophobicContact CD1-CD1 3.28Å; L1833-Y1995 HydrophobicContact CD1-CD2 3.88Å; L1833-Y1995 HydrophobicContact CD1-CE1 3.69Å; L1833-Y1995 HydrophobicContact CD1-CE2 4.22Å; L1833-Y1995 HydrophobicContact CD1-CG 3.39Å; L1833-Y1995 HydrophobicContact CD2-CG 4.26Å; L1833-Y1995 HydrophobicContact CG-CG 4.48Å; L1833-L1999 HydrophobicContact CD2-CD1 3.68Å; L1833-L1999 HydrophobicContact CD2-CD2 3.44Å; L1833-L1999 VanDerWaalsContact CD2-CD2 3.44Å; L1833-L1999 HydrophobicContact CD2-CG 4.22Å
1834	S	73	Confident	72.6	Confident	73 Å²	73	65.6 Å²	65.6	51%	0.51	34%	0.34	S	S	.	.	H	α-helix	trans	-59.7	-47.6	173.8	-177.7	0	0	0	0	111.5	D1830 A1831 Q1832 Y1836 L1837 N1838	D1830-S1834 VanDerWaalsContact O-CB 3.25Å; D1830-S1834 WeakPolarHBondContact O-CB 3.39Å; D1830-S1834 PolarHBondContact O-N 3.19Å; A1831-S1834 PolarHBondContact O-N 3.22Å; Q1832-S1834 VanDerWaalsContact C-N 3.35Å; S1834-Y1836 VanDerWaalsContact C-N 3.34Å; S1834-Y1836 PolarHBondContact O-N 3.11Å; S1834-L1837 PolarHBondContact O-N 2.99Å; S1834-N1838 WeakPolarHBondContact O-CB 3.38Å; S1834-N1838 PolarHBondContact O-N 3.1Å
1835	N	69.7	Low	72.5	Confident	69.4 Å²	69.4	66 Å²	66	37%	0.371	35%	0.349	S	S	.	.	H	α-helix	trans	-62.7	-41.4	176.3	-77.3	-40	0	0	0	112.4	A1831 Q1832 N1838 N1839 L1986 T1987 F1989	A1831-N1835 VanDerWaalsContact O-CB 3.27Å; A1831-N1835 WeakPolarHBondContact O-CB 3.39Å; A1831-N1835 VanDerWaalsContact O-CG 3.28Å; A1831-N1835 PolarHBondContact O-N 3.09Å; A1831-N1835 PolarHBondContact O-ND2 3.01Å; Q1832-N1835 CarbonylContact O-C 3.43Å; Q1832-N1835 PolarHBondContact O-N 3.28Å; N1835-N1838 PolarHBondContact O-N 3.07Å; N1835-N1839 VanDerWaalsContact O-CB 3.3Å; N1835-N1839 WeakPolarHBondContact O-CB 3.33Å; N1835-N1839 VanDerWaalsContact O-CG 3.24Å; N1835-N1839 PolarHBondContact O-N 3.02Å; N1835-N1839 PolarHBondContact O-ND2 3.16Å; N1835-L1986 PolarHBondContact ND2-O 3.48Å; N1835-T1987 HydrophobicContact CB-CG2 3.71Å; N1835-T1987 WeakPolarHBondContact OD1-CB 3.35Å; N1835-T1987 PolarHBondContact OD1-OG1 2.84Å; N1835-F1989 VanDerWaalsContact C-CE1 3.43Å; N1835-F1989 HydrophobicContact CB-CE1 3.88Å; N1835-F1989 HydrophobicContact CB-CE2 3.86Å; N1835-F1989 HydrophobicContact CB-CZ 3.46Å; N1835-F1989 VanDerWaalsContact CB-CZ 3.46Å; N1835-F1989 WeakPolarHBondContact O-CE1 3.45Å
1836	Y	69.7	Low	72.5	Confident	77.4 Å²	77.4	70.2 Å²	70.2	30%	0.304	37%	0.368	S	S	.	.	H	α-helix	trans	-60.4	-49.3	174.2	171	-93	0	0	0	111.7	Q1832 L1833 S1834 N1838 N1839 K1840 W1988 Q1990 E1991 Y1995 E2726	Q1832-Y1836 WeakPolarHBondContact O-CB 3.23Å; Q1832-Y1836 PolarHBondContact O-N 2.92Å; L1833-Y1836 HydrophobicContact CD1-CD1 4.4Å; L1833-Y1836 WeakPolarHBondContact O-CB 3.36Å; L1833-Y1836 PolarHBondContact O-N 3.05Å; S1834-Y1836 VanDerWaalsContact C-N 3.34Å; S1834-Y1836 PolarHBondContact O-N 3.11Å; Y1836-N1838 VanDerWaalsContact C-N 3.32Å; Y1836-N1838 PolarHBondContact O-N 2.84Å; Y1836-N1839 PolarHBondContact O-N 3.3Å; Y1836-K1840 HydrophobicContact CE1-CD 3.93Å; Y1836-K1840 VanDerWaalsContact O-CB 3.28Å; Y1836-K1840 WeakPolarHBondContact O-CB 3.32Å; Y1836-K1840 PolarHBondContact O-N 3.02Å; Y1836-K1840 WeakPolarHBondContact OH-CD 3.08Å; Y1836-K1840 PolarHBondContact OH-NZ 3.02Å; Y1836-K1840 VanDerWaalsContact OH-NZ 3.11Å; Y1836-W1988 VanDerWaalsContact CB-O 3.31Å; Y1836-W1988 WeakPolarHBondContact CB-O 3.47Å; Y1836-Q1990 WeakPolarHBondContact CE1-O 3.21Å; Y1836-Q1990 WeakPolarHBondContact CE2-O 3.37Å; Y1836-Q1990 VanDerWaalsContact CZ-C 3.46Å; Y1836-Q1990 PolarHBondContact OH-O 2.8Å; Y1836-E1991 HydrophobicContact CE2-CG 4.04Å; Y1836-E1991 WeakPolarHBondContact OH-CA 3.33Å; Y1836-E1991 WeakPolarHBondContact OH-CG 3.49Å; Y1836-Y1995 AromaticContact CD1-CE1 3.78Å; Y1836-Y1995 HydrophobicContact CD1-CE1 3.78Å; Y1836-Y1995 AromaticContact CE1-CE1 3.43Å; Y1836-Y1995 HydrophobicContact CE1-CE1 3.43Å; Y1836-Y1995 VanDerWaalsContact CE1-CE1 3.43Å; Y1836-Y1995 AromaticContact CE1-CZ 3.78Å; Y1836-Y1995 WeakPolarHBondContact CE1-OH 3.15Å; Y1836-E2726 HydrophobicContact CE2-CG 4.24Å; Y1836-E2726 WeakPolarHBondContact CE2-OE1 3.36Å; Y1836-E2726 WeakPolarHBondContact OH-CG 3.43Å; Y1836-E2726 PolarHBondContact OH-OE1 2.77Å
1837	L	73.4	Confident	72.4	Confident	85.6 Å²	85.6	73.7 Å²	73.7	45%	0.448	38%	0.38	S	S	.	.	H	α-helix	trans	-64.5	-39.9	179	-71	173.3	0	0	0	111.8	L1833 S1834 K1840 S1841 Y1995	L1833-L1837 HydrophobicContact CD1-CD1 4.29Å; L1833-L1837 HydrophobicContact CD1-CG 4.3Å; L1833-L1837 HydrophobicContact CG-CD1 4.11Å; L1833-L1837 HydrophobicContact CG-CG 4.37Å; L1833-L1837 WeakPolarHBondContact O-CB 3.35Å; L1833-L1837 VanDerWaalsContact O-CG 3.26Å; L1833-L1837 WeakPolarHBondContact O-CG 3.34Å; L1833-L1837 PolarHBondContact O-N 3.19Å; S1834-L1837 PolarHBondContact O-N 2.99Å; L1837-K1840 PolarHBondContact O-N 3.14Å; L1837-S1841 VanDerWaalsContact O-CB 3.26Å; L1837-S1841 WeakPolarHBondContact O-CB 3.3Å; L1837-S1841 PolarHBondContact O-N 3.15Å; L1837-S1841 PolarHBondContact O-OG 3.24Å; L1837-S1841 VanDerWaalsContact O-OG 3.12Å; L1837-Y1995 HydrophobicContact CD2-CE2 3.95Å; L1837-Y1995 VanDerWaalsContact CD2-OH 3.25Å; L1837-Y1995 WeakPolarHBondContact CD2-OH 3.25Å
1838	N	75.6	Confident	72.1	Confident	83.4 Å²	83.4	69.3 Å²	69.3	45%	0.446	37%	0.368	S	S	.	.	H	α-helix	trans	-62	-47.8	174.5	-173	24.3	0	0	0	111.1	S1834 N1835 Y1836 K1840 S1841 N1842	S1834-N1838 WeakPolarHBondContact O-CB 3.38Å; S1834-N1838 PolarHBondContact O-N 3.1Å; N1835-N1838 PolarHBondContact O-N 3.07Å; Y1836-N1838 VanDerWaalsContact C-N 3.32Å; Y1836-N1838 PolarHBondContact O-N 2.84Å; N1838-K1840 VanDerWaalsContact C-N 3.34Å; N1838-K1840 PolarHBondContact O-N 3.22Å; N1838-S1841 WeakPolarHBondContact O-CB 3.46Å; N1838-S1841 PolarHBondContact O-N 3.11Å; N1838-N1842 WeakPolarHBondContact O-CB 3.3Å; N1838-N1842 VanDerWaalsContact O-CG 3.3Å; N1838-N1842 PolarHBondContact O-N 3.24Å; N1838-N1842 PolarHBondContact O-ND2 3.05Å; N1838-N1842 VanDerWaalsContact O-ND2 3.12Å; N1838-N1842 PolarHBondContact OD1-ND2 3.2Å; N1838-N1842 VanDerWaalsContact OD1-ND2 3.07Å
1839	N	69.9	Low	71.8	Confident	58.4 Å²	58.4	71.7 Å²	71.7	31%	0.312	38%	0.379	S	S	.	.	H	α-helix	trans	-62.7	-40.5	176.3	-76.8	-30.6	0	0	0	112.5	N1835 Y1836 S1841 N1842 R1843 P1901 T1987 F1989	N1835-N1839 VanDerWaalsContact O-CB 3.3Å; N1835-N1839 WeakPolarHBondContact O-CB 3.33Å; N1835-N1839 VanDerWaalsContact O-CG 3.24Å; N1835-N1839 PolarHBondContact O-N 3.02Å; N1835-N1839 PolarHBondContact O-ND2 3.16Å; Y1836-N1839 PolarHBondContact O-N 3.3Å; N1839-S1841 VanDerWaalsContact C-N 3.31Å; N1839-S1841 PolarHBondContact O-N 2.78Å; N1839-N1842 PolarHBondContact O-N 3.23Å; N1839-R1843 VanDerWaalsContact O-CB 3.29Å; N1839-R1843 WeakPolarHBondContact O-CB 3.4Å; N1839-R1843 WeakPolarHBondContact O-CG 3.43Å; N1839-R1843 PolarHBondContact O-N 3.1Å; N1839-P1901 HydrophobicContact CB-CB 4.37Å; N1839-P1901 WeakPolarHBondContact ND2-CB 3.37Å; N1839-P1901 WeakPolarHBondContact ND2-CG 3.46Å; N1839-P1901 WeakPolarHBondContact OD1-CB 3.47Å; N1839-T1987 WeakPolarHBondContact ND2-CB 3.31Å; N1839-T1987 PolarHBondContact ND2-OG1 3.26Å; N1839-T1987 VanDerWaalsContact ND2-OG1 3.13Å; N1839-F1989 HydrophobicContact CB-CE1 4.36Å; N1839-F1989 WeakPolarHBondContact ND2-CE1 3.41Å; N1839-F1989 WeakPolarHBondContact ND2-CZ 3.25Å
1840	K	71.8	Confident	71.5	Confident	80.6 Å²	80.6	75.6 Å²	75.6	35%	0.35	40%	0.397	S	S	.	.	H	α-helix	trans	-63.2	-42.5	174.9	-171.5	175.2	-174.8	168.4	0	111.6	Y1836 L1837 N1838 R1843 L1844 E1991 G2725	Y1836-K1840 HydrophobicContact CE1-CD 3.93Å; Y1836-K1840 VanDerWaalsContact O-CB 3.28Å; Y1836-K1840 WeakPolarHBondContact O-CB 3.32Å; Y1836-K1840 PolarHBondContact O-N 3.02Å; Y1836-K1840 WeakPolarHBondContact OH-CD 3.08Å; Y1836-K1840 PolarHBondContact OH-NZ 3.02Å; Y1836-K1840 VanDerWaalsContact OH-NZ 3.11Å; L1837-K1840 PolarHBondContact O-N 3.14Å; N1838-K1840 VanDerWaalsContact C-N 3.34Å; N1838-K1840 PolarHBondContact O-N 3.22Å; K1840-R1843 PolarHBondContact O-N 3.15Å; K1840-L1844 HydrophobicContact CG-CD1 4.1Å; K1840-L1844 WeakPolarHBondContact O-CB 3.41Å; K1840-L1844 PolarHBondContact O-N 2.87Å; K1840-L1844 VanDerWaalsContact O-N 3.13Å; K1840-E1991 IonicContact NZ-OE1 2.9Å; K1840-G2725 WeakPolarHBondContact CE-O 3.41Å; K1840-G2725 PolarHBondContact NZ-O 3.25Å
1841	S	74.8	Confident	71	Confident	71.6 Å²	71.6	73.4 Å²	73.4	50%	0.501	39%	0.385	S	S	.	.	H	α-helix	trans	-65.6	-46.3	176.3	-135.1	0	0	0	0	111.8	L1837 N1838 N1839 R1843 L1844 A1845	L1837-S1841 VanDerWaalsContact O-CB 3.26Å; L1837-S1841 WeakPolarHBondContact O-CB 3.3Å; L1837-S1841 PolarHBondContact O-N 3.15Å; L1837-S1841 PolarHBondContact O-OG 3.24Å; L1837-S1841 VanDerWaalsContact O-OG 3.12Å; N1838-S1841 WeakPolarHBondContact O-CB 3.46Å; N1838-S1841 PolarHBondContact O-N 3.11Å; N1839-S1841 VanDerWaalsContact C-N 3.31Å; N1839-S1841 PolarHBondContact O-N 2.78Å; S1841-R1843 VanDerWaalsContact C-N 3.33Å; S1841-R1843 PolarHBondContact O-N 3.22Å; S1841-L1844 WeakPolarHBondContact O-CB 3.47Å; S1841-L1844 PolarHBondContact O-N 3.12Å; S1841-L1844 VanDerWaalsContact O-N 3.13Å; S1841-A1845 VanDerWaalsContact O-CB 3.31Å; S1841-A1845 WeakPolarHBondContact O-CB 3.35Å; S1841-A1845 PolarHBondContact O-N 2.99Å
1842	N	73	Confident	70.4	Confident	73.8 Å²	73.8	79.3 Å²	79.3	40%	0.395	40%	0.398	S	S	.	.	H	α-helix	trans	-61	-41.5	176.2	-74.2	-40.3	0	0	0	111.8	N1838 N1839 L1844 A1845 Q1846	N1838-N1842 WeakPolarHBondContact O-CB 3.3Å; N1838-N1842 VanDerWaalsContact O-CG 3.3Å; N1838-N1842 PolarHBondContact O-N 3.24Å; N1838-N1842 PolarHBondContact O-ND2 3.05Å; N1838-N1842 VanDerWaalsContact O-ND2 3.12Å; N1838-N1842 PolarHBondContact OD1-ND2 3.2Å; N1838-N1842 VanDerWaalsContact OD1-ND2 3.07Å; N1839-N1842 PolarHBondContact O-N 3.23Å; N1842-L1844 PolarHBondContact O-N 2.91Å; N1842-A1845 PolarHBondContact O-N 2.88Å; N1842-Q1846 WeakPolarHBondContact O-CB 3.25Å; N1842-Q1846 VanDerWaalsContact O-CG 3.26Å; N1842-Q1846 WeakPolarHBondContact O-CG 3.27Å; N1842-Q1846 PolarHBondContact O-N 3.09Å
1843	R	69.9	Low	70	Confident	67.6 Å²	67.6	81.8 Å²	81.8	26%	0.255	41%	0.411	S	S	.	.	H	α-helix	trans	-63.5	-43.3	174.3	-112.6	167.4	-173.4	155.8	1.4	112.4	N1839 K1840 S1841 A1845 Q1846 F1847 D1880 P1899 N1900 P1901 E1991 L2727 L2728	N1839-R1843 VanDerWaalsContact O-CB 3.29Å; N1839-R1843 WeakPolarHBondContact O-CB 3.4Å; N1839-R1843 WeakPolarHBondContact O-CG 3.43Å; N1839-R1843 PolarHBondContact O-N 3.1Å; K1840-R1843 PolarHBondContact O-N 3.15Å; S1841-R1843 VanDerWaalsContact C-N 3.33Å; S1841-R1843 PolarHBondContact O-N 3.22Å; R1843-A1845 VanDerWaalsContact C-N 3.31Å; R1843-A1845 PolarHBondContact O-N 3.48Å; R1843-Q1846 PolarHBondContact O-N 3.29Å; R1843-F1847 VanDerWaalsContact O-CB 3.24Å; R1843-F1847 WeakPolarHBondContact O-CB 3.34Å; R1843-F1847 PolarHBondContact O-N 3.16Å; R1843-D1880 IonicContact CZ-OD1 3.52Å; R1843-D1880 IonicContact CZ-OD2 3.3Å; R1843-D1880 VanDerWaalsContact CZ-OD2 3.26Å; R1843-D1880 IonicContact NE-OD1 2.79Å; R1843-D1880 VanDerWaalsContact NH1-CG 3.28Å; R1843-D1880 IonicContact NH1-OD1 2.78Å; R1843-D1880 PolarHBondContact NH1-OD1 3.35Å; R1843-D1880 IonicContact NH1-OD2 3.35Å; R1843-D1880 PolarHBondContact NH1-OD2 2.98Å; R1843-D1880 IonicContact NH2-OD1 3.2Å; R1843-D1880 IonicContact NH2-OD2 3.16Å; R1843-D1880 PolarHBondContact NH2-OD2 3.4Å; R1843-P1899 VanDerWaalsContact NE-CG 3.28Å; R1843-P1899 PolarHBondContact NH1-O 3.1Å; R1843-P1899 PolarHBondContact NH2-O 2.94Å; R1843-N1900 PolarHBondContact NH2-O 2.9Å; R1843-P1901 VanDerWaalsContact NH2-CG 3.33Å; R1843-E1991 IonicContact NH1-OE1 2.88Å; R1843-L2727 WeakPolarHBondContact CG-O 3.44Å; R1843-L2728 PolarHBondContact NH2-O 3.3Å
1844	L	74	Confident	69.3	Low	73.8 Å²	73.8	87.3 Å²	87.3	39%	0.386	43%	0.427	S	S	.	.	H	α-helix	trans	-62.9	-43.6	175.7	-130	124.1	0	0	0	111.3	K1840 S1841 N1842 F1847 I1848 N2691 L2727	K1840-L1844 HydrophobicContact CG-CD1 4.1Å; K1840-L1844 WeakPolarHBondContact O-CB 3.41Å; K1840-L1844 PolarHBondContact O-N 2.87Å; K1840-L1844 VanDerWaalsContact O-N 3.13Å; S1841-L1844 WeakPolarHBondContact O-CB 3.47Å; S1841-L1844 PolarHBondContact O-N 3.12Å; S1841-L1844 VanDerWaalsContact O-N 3.13Å; N1842-L1844 PolarHBondContact O-N 2.91Å; L1844-F1847 PolarHBondContact O-N 3.04Å; L1844-I1848 HydrophobicContact CD1-CD1 4.1Å; L1844-I1848 HydrophobicContact CD1-CG1 4.42Å; L1844-I1848 HydrophobicContact CD2-CD1 3.8Å; L1844-I1848 HydrophobicContact CD2-CG1 4.29Å; L1844-I1848 HydrophobicContact CG-CD1 3.94Å; L1844-I1848 WeakPolarHBondContact O-CB 3.36Å; L1844-I1848 WeakPolarHBondContact O-CD1 3.34Å; L1844-I1848 VanDerWaalsContact O-CG1 3.32Å; L1844-I1848 WeakPolarHBondContact O-CG1 3.36Å; L1844-I1848 PolarHBondContact O-N 3.14Å; L1844-N2691 HydrophobicContact CD1-CB 4.34Å; L1844-N2691 HydrophobicContact CD2-CB 3.99Å; L1844-L2727 HydrophobicContact CD1-CD2 4.16Å
1845	A	73.8	Confident	68.3	Low	51.8 Å²	51.8	87.9 Å²	87.9	43%	0.428	43%	0.431	S	S	.	.	H	α-helix	trans	-62.8	-45.6	176.3	0	0	0	0	0	112	S1841 N1842 R1843 F1847 I1848 M1849	S1841-A1845 VanDerWaalsContact O-CB 3.31Å; S1841-A1845 WeakPolarHBondContact O-CB 3.35Å; S1841-A1845 PolarHBondContact O-N 2.99Å; N1842-A1845 PolarHBondContact O-N 2.88Å; R1843-A1845 VanDerWaalsContact C-N 3.31Å; R1843-A1845 PolarHBondContact O-N 3.48Å; A1845-F1847 VanDerWaalsContact C-N 3.3Å; A1845-F1847 PolarHBondContact O-N 3.1Å; A1845-I1848 PolarHBondContact O-N 3.14Å; A1845-M1849 VanDerWaalsContact O-CB 3.25Å; A1845-M1849 WeakPolarHBondContact O-CB 3.32Å; A1845-M1849 WeakPolarHBondContact O-CG 3.46Å; A1845-M1849 PolarHBondContact O-N 3.19Å
1846	Q	69.4	Low	67.3	Low	93.8 Å²	93.8	88.4 Å²	88.4	44%	0.438	44%	0.441	S	S	.	.	H	α-helix	trans	-59.8	-43.6	174.3	-75.5	171.9	-3.5	0	0	111.7	N1842 R1843 M1849 F1850	N1842-Q1846 WeakPolarHBondContact O-CB 3.25Å; N1842-Q1846 VanDerWaalsContact O-CG 3.26Å; N1842-Q1846 WeakPolarHBondContact O-CG 3.27Å; N1842-Q1846 PolarHBondContact O-N 3.09Å; R1843-Q1846 PolarHBondContact O-N 3.29Å; Q1846-M1849 PolarHBondContact O-N 3.07Å; Q1846-F1850 VanDerWaalsContact O-CB 3.23Å; Q1846-F1850 WeakPolarHBondContact O-CB 3.35Å; Q1846-F1850 PolarHBondContact O-N 2.99Å
1847	F	70.3	Confident	66.1	Low	90 Å²	90	90.2 Å²	90.2	40%	0.395	46%	0.459	S	S	.	.	H	α-helix	trans	-65.8	-43.2	178.6	-176.3	-104.6	0	0	0	112.4	R1843 L1844 A1845 F1850 N1851 G2692 T2717 L2719 L2727 C2730	R1843-F1847 VanDerWaalsContact O-CB 3.24Å; R1843-F1847 WeakPolarHBondContact O-CB 3.34Å; R1843-F1847 PolarHBondContact O-N 3.16Å; L1844-F1847 PolarHBondContact O-N 3.04Å; A1845-F1847 VanDerWaalsContact C-N 3.3Å; A1845-F1847 PolarHBondContact O-N 3.1Å; F1847-F1850 PolarHBondContact O-N 2.89Å; F1847-N1851 WeakPolarHBondContact CD1-ND2 3.4Å; F1847-N1851 WeakPolarHBondContact CE1-ND2 3.37Å; F1847-N1851 WeakPolarHBondContact CE2-ND2 3.19Å; F1847-N1851 WeakPolarHBondContact CZ-ND2 3.3Å; F1847-N1851 WeakPolarHBondContact CZ-OD1 3.22Å; F1847-N1851 WeakPolarHBondContact O-CB 3.36Å; F1847-N1851 PolarHBondContact O-N 3.05Å; F1847-N1851 VanDerWaalsContact O-N 3.11Å; F1847-N1851 PolarHBondContact O-ND2 3.24Å; F1847-G2692 WeakPolarHBondContact CE1-O 3.28Å; F1847-T2717 HydrophobicContact CZ-CG2 4.33Å; F1847-L2719 HydrophobicContact CE1-CD1 4.21Å; F1847-L2719 HydrophobicContact CE1-CD2 4.03Å; F1847-L2719 HydrophobicContact CE2-CD2 4Å; F1847-L2719 HydrophobicContact CZ-CD1 4.46Å; F1847-L2719 HydrophobicContact CZ-CD2 3.48Å; F1847-L2719 VanDerWaalsContact CZ-CD2 3.48Å; F1847-L2727 HydrophobicContact CB-CD2 3.75Å; F1847-L2727 HydrophobicContact CD1-CD2 3.81Å; F1847-L2727 HydrophobicContact CD2-CD2 4.4Å; F1847-L2727 HydrophobicContact CG-CD2 3.69Å; F1847-C2730 HydrophobicContact CD2-CB 4.31Å; F1847-C2730 HydrophobicContact CE2-CB 3.48Å; F1847-C2730 VanDerWaalsContact CE2-CB 3.48Å; F1847-C2730 HydrophobicContact CZ-CB 4.17Å
1848	I	72.1	Confident	64.3	Low	69.6 Å²	69.6	91 Å²	91	36%	0.357	47%	0.472	S	S	.	.	H	α-helix	trans	-62.7	-48.4	175.1	-69.2	165.6	0	0	0	110.1	L1844 A1845 F1850 N1851 W1852	L1844-I1848 HydrophobicContact CD1-CD1 4.1Å; L1844-I1848 HydrophobicContact CD1-CG1 4.42Å; L1844-I1848 HydrophobicContact CD2-CD1 3.8Å; L1844-I1848 HydrophobicContact CD2-CG1 4.29Å; L1844-I1848 HydrophobicContact CG-CD1 3.94Å; L1844-I1848 WeakPolarHBondContact O-CB 3.36Å; L1844-I1848 WeakPolarHBondContact O-CD1 3.34Å; L1844-I1848 VanDerWaalsContact O-CG1 3.32Å; L1844-I1848 WeakPolarHBondContact O-CG1 3.36Å; L1844-I1848 PolarHBondContact O-N 3.14Å; A1845-I1848 PolarHBondContact O-N 3.14Å; I1848-F1850 VanDerWaalsContact C-N 3.32Å; I1848-F1850 PolarHBondContact O-N 3.01Å; I1848-N1851 PolarHBondContact O-N 3.07Å; I1848-W1852 HydrophobicContact CG2-CD2 3.93Å; I1848-W1852 VanDerWaalsContact CG2-CE2 3.45Å; I1848-W1852 HydrophobicContact CG2-CE3 4.4Å; I1848-W1852 HydrophobicContact CG2-CG 4.47Å; I1848-W1852 HydrophobicContact CG2-CH2 4.04Å; I1848-W1852 HydrophobicContact CG2-CZ2 3.51Å; I1848-W1852 VanDerWaalsContact CG2-CZ2 3.5Å; I1848-W1852 HydrophobicContact CG2-CZ3 4.36Å; I1848-W1852 WeakPolarHBondContact O-CB 3.41Å; I1848-W1852 PolarHBondContact O-N 3.11Å
1849	M	67.5	Low	62.5	Low	105.8 Å²	105.8	93.7 Å²	93.7	52%	0.521	49%	0.485	S	S	.	.	H	α-helix	trans	-60.3	-41.2	178	-137	-139	-108.9	0	0	112.1	A1845 Q1846 N1851 W1852 M1853 L1877	A1845-M1849 VanDerWaalsContact O-CB 3.25Å; A1845-M1849 WeakPolarHBondContact O-CB 3.32Å; A1845-M1849 WeakPolarHBondContact O-CG 3.46Å; A1845-M1849 PolarHBondContact O-N 3.19Å; Q1846-M1849 PolarHBondContact O-N 3.07Å; M1849-N1851 PolarHBondContact O-N 3.27Å; M1849-W1852 PolarHBondContact O-N 3.06Å; M1849-W1852 HydrophobicContact SD-CE3 3.95Å; M1849-W1852 HydrophobicContact SD-CZ3 4.24Å; M1849-M1853 HydrophobicContact CE-CE 3.87Å; M1849-M1853 HydrophobicContact CG-CE 4.48Å; M1849-M1853 WeakPolarHBondContact O-CB 3.34Å; M1849-M1853 VanDerWaalsContact O-CG 3.29Å; M1849-M1853 WeakPolarHBondContact O-CG 3.27Å; M1849-M1853 PolarHBondContact O-N 3.09Å; M1849-L1877 HydrophobicContact CE-CD2 4.35Å; M1849-L1877 HydrophobicContact SD-CD2 4.29Å
1850	F	65.5	Low	60.8	Low	116.4 Å²	116.4	95.1 Å²	95.1	51%	0.511	50%	0.499	S	S	.	.	H	α-helix	trans	-63.9	-43.7	176.6	-175.5	-95.3	0	0	0	112	Q1846 F1847 I1848 M1853 R1854 L1877	Q1846-F1850 VanDerWaalsContact O-CB 3.23Å; Q1846-F1850 WeakPolarHBondContact O-CB 3.35Å; Q1846-F1850 PolarHBondContact O-N 2.99Å; F1847-F1850 PolarHBondContact O-N 2.89Å; I1848-F1850 VanDerWaalsContact C-N 3.32Å; I1848-F1850 PolarHBondContact O-N 3.01Å; F1850-M1853 PolarHBondContact O-N 2.92Å; F1850-R1854 WeakPolarHBondContact O-CB 3.33Å; F1850-R1854 PolarHBondContact O-N 3.26Å; F1850-L1877 HydrophobicContact CB-CD1 4.06Å; F1850-L1877 HydrophobicContact CD2-CD1 4.21Å
1851	N	62.5	Low	59.1	Low	42.2 Å²	42.2	97.6 Å²	97.6	23%	0.226	52%	0.524	C	S	.	.	H	α-helix	trans	-67	-38.8	176.4	-72.8	-44.6	0	0	0	112.4	F1847 I1848 M1849 R1854 S1855	F1847-N1851 WeakPolarHBondContact CD1-ND2 3.4Å; F1847-N1851 WeakPolarHBondContact CE1-ND2 3.37Å; F1847-N1851 WeakPolarHBondContact CE2-ND2 3.19Å; F1847-N1851 WeakPolarHBondContact CZ-ND2 3.3Å; F1847-N1851 WeakPolarHBondContact CZ-OD1 3.22Å; F1847-N1851 WeakPolarHBondContact O-CB 3.36Å; F1847-N1851 PolarHBondContact O-N 3.05Å; F1847-N1851 VanDerWaalsContact O-N 3.11Å; F1847-N1851 PolarHBondContact O-ND2 3.24Å; I1848-N1851 PolarHBondContact O-N 3.07Å; M1849-N1851 PolarHBondContact O-N 3.27Å; N1851-R1854 PolarHBondContact O-N 2.93Å; N1851-S1855 WeakPolarHBondContact O-CB 3.12Å; N1851-S1855 PolarHBondContact O-N 3.29Å; N1851-S1855 PolarHBondContact O-OG 3.04Å
1852	W	63	Low	57.1	Low	169.8 Å²	169.8	99.8 Å²	99.8	64%	0.643	53%	0.534	S	S	*	.	H	α-helix	trans	-64.7	-43.1	174.9	-84	23.7	0	0	0	112	I1848 M1849 R1854 S1855 S1856 E2694	I1848-W1852 HydrophobicContact CG2-CD2 3.93Å; I1848-W1852 VanDerWaalsContact CG2-CE2 3.45Å; I1848-W1852 HydrophobicContact CG2-CE3 4.4Å; I1848-W1852 HydrophobicContact CG2-CG 4.47Å; I1848-W1852 HydrophobicContact CG2-CH2 4.04Å; I1848-W1852 HydrophobicContact CG2-CZ2 3.51Å; I1848-W1852 VanDerWaalsContact CG2-CZ2 3.5Å; I1848-W1852 HydrophobicContact CG2-CZ3 4.36Å; I1848-W1852 WeakPolarHBondContact O-CB 3.41Å; I1848-W1852 PolarHBondContact O-N 3.11Å; M1849-W1852 PolarHBondContact O-N 3.06Å; M1849-W1852 HydrophobicContact SD-CE3 3.95Å; M1849-W1852 HydrophobicContact SD-CZ3 4.24Å; W1852-R1854 VanDerWaalsContact C-N 3.31Å; W1852-R1854 PolarHBondContact O-N 2.94Å; W1852-S1855 PolarHBondContact O-N 3.02Å; W1852-S1856 WeakPolarHBondContact O-CB 3.42Å; W1852-S1856 PolarHBondContact O-N 3.11Å; W1852-S1856 PolarHBondContact O-OG 3.23Å; W1852-E2694 PolarHBondContact NE1-OE1 2.84Å
1853	M	60.2	Low	55.3	Low	102.4 Å²	102.4	101.5 Å²	101.5	50%	0.504	55%	0.552	S	S	.	*	H	α-helix	trans	-61.8	-39.6	172.6	-77.6	-153.5	-164.7	0	0	111.9	M1849 F1850 S1855 S1856 V1857 V1874 L1877	M1849-M1853 HydrophobicContact CE-CE 3.87Å; M1849-M1853 HydrophobicContact CG-CE 4.48Å; M1849-M1853 WeakPolarHBondContact O-CB 3.34Å; M1849-M1853 VanDerWaalsContact O-CG 3.29Å; M1849-M1853 WeakPolarHBondContact O-CG 3.27Å; M1849-M1853 PolarHBondContact O-N 3.09Å; F1850-M1853 PolarHBondContact O-N 2.92Å; M1853-S1855 VanDerWaalsContact C-N 3.28Å; M1853-S1855 PolarHBondContact O-N 3.08Å; M1853-S1856 WeakPolarHBondContact CA-OG 3.44Å; M1853-S1856 PolarHBondContact O-N 2.88Å; M1853-S1856 PolarHBondContact O-OG 3.08Å; M1853-S1856 VanDerWaalsContact O-OG 3.09Å; M1853-V1857 WeakPolarHBondContact O-CG2 3.36Å; M1853-V1857 PolarHBondContact O-N 3.2Å; M1853-V1857 VanDerWaalsContact O-N 3.12Å; M1853-V1874 HydrophobicContact CE-CG1 3.98Å; M1853-V1874 HydrophobicContact SD-CG1 4.08Å; M1853-L1877 HydrophobicContact SD-CD1 4.33Å
1854	R	55.7	Low	53.4	Low	176.2 Å²	176.2	103.4 Å²	103.4	67%	0.665	58%	0.576	S	S	*	*	H	α-helix	trans	-66.7	-37.5	176.9	-154.2	177.2	-175.9	-164.8	1	112.6	F1850 N1851 W1852 S1856 V1857	F1850-R1854 WeakPolarHBondContact O-CB 3.33Å; F1850-R1854 PolarHBondContact O-N 3.26Å; N1851-R1854 PolarHBondContact O-N 2.93Å; W1852-R1854 VanDerWaalsContact C-N 3.31Å; W1852-R1854 PolarHBondContact O-N 2.94Å; R1854-S1856 VanDerWaalsContact C-N 3.32Å; R1854-S1856 PolarHBondContact O-N 3.15Å; R1854-V1857 PolarHBondContact O-N 3.04Å; R1854-V1857 VanDerWaalsContact O-N 3.13Å
1855	S	52	Low	51.4	Low	86 Å²	86	105.5 Å²	105.5	60%	0.601	60%	0.596	S	S	*	*	H	α-helix	trans	-72.1	-28.7	177.5	-67	0	0	0	0	113.4	N1851 W1852 M1853 V1857 S1858	N1851-S1855 WeakPolarHBondContact O-CB 3.12Å; N1851-S1855 PolarHBondContact O-N 3.29Å; N1851-S1855 PolarHBondContact O-OG 3.04Å; W1852-S1855 PolarHBondContact O-N 3.02Å; M1853-S1855 VanDerWaalsContact C-N 3.28Å; M1853-S1855 PolarHBondContact O-N 3.08Å; S1855-V1857 VanDerWaalsContact C-N 3.31Å; S1855-V1857 PolarHBondContact O-N 3.2Å; S1855-S1858 WeakPolarHBondContact O-CB 3.44Å; S1855-S1858 PolarHBondContact O-N 3.22Å; S1855-S1858 PolarHBondContact O-OG 3.2Å
1856	S	48.9	Very low	49.4	Very low	80.8 Å²	80.8	107.7 Å²	107.7	57%	0.565	61%	0.609	S	S	*	*	H	α-helix	trans	-78.7	-16.4	178	57.6	0	0	0	0	114.1	W1852 M1853 R1854 S1858 I1859	W1852-S1856 WeakPolarHBondContact O-CB 3.42Å; W1852-S1856 PolarHBondContact O-N 3.11Å; W1852-S1856 PolarHBondContact O-OG 3.23Å; M1853-S1856 WeakPolarHBondContact CA-OG 3.44Å; M1853-S1856 PolarHBondContact O-N 2.88Å; M1853-S1856 PolarHBondContact O-OG 3.08Å; M1853-S1856 VanDerWaalsContact O-OG 3.09Å; R1854-S1856 VanDerWaalsContact C-N 3.32Å; R1854-S1856 PolarHBondContact O-N 3.15Å; S1856-S1858 VanDerWaalsContact C-N 3.26Å; S1856-S1858 PolarHBondContact O-N 3.14Å; S1856-I1859 WeakPolarHBondContact O-CD1 3.43Å; S1856-I1859 WeakPolarHBondContact O-CG1 3.42Å; S1856-I1859 PolarHBondContact O-N 2.9Å
1857	V	45	Very low	47.5	Very low	114 Å²	114	108.8 Å²	108.8	69%	0.691	63%	0.627	S	S	*	*			trans	-91.4	35.2	175.9	-175.8	0	0	0	0	111.3	M1853 R1854 S1855 I1859	M1853-V1857 WeakPolarHBondContact O-CG2 3.36Å; M1853-V1857 PolarHBondContact O-N 3.2Å; M1853-V1857 VanDerWaalsContact O-N 3.12Å; R1854-V1857 PolarHBondContact O-N 3.04Å; R1854-V1857 VanDerWaalsContact O-N 3.13Å; S1855-V1857 VanDerWaalsContact C-N 3.31Å; S1855-V1857 PolarHBondContact O-N 3.2Å; V1857-I1859 VanDerWaalsContact C-N 3.29Å; V1857-I1859 HydrophobicContact CG1-CD1 4.09Å; V1857-I1859 HydrophobicContact CG1-CG1 4.31Å; V1857-I1859 PolarHBondContact O-N 2.94Å
1858	S	36.1	Very low	45.5	Very low	103 Å²	103	113.2 Å²	113.2	72%	0.72	65%	0.646	S	S	*	*			trans	-92.6	39.6	172.8	73.3	0	0	0	0	112.6	S1855 S1856 S1860	S1855-S1858 WeakPolarHBondContact O-CB 3.44Å; S1855-S1858 PolarHBondContact O-N 3.22Å; S1855-S1858 PolarHBondContact O-OG 3.2Å; S1856-S1858 VanDerWaalsContact C-N 3.26Å; S1856-S1858 PolarHBondContact O-N 3.14Å; S1858-S1860 PolarHBondContact O-N 3.08Å
1859	I	37.3	Very low	43.5	Very low	141 Å²	141	116 Å²	116	72%	0.723	67%	0.666	S	S	*	*			trans	-98.8	122	179.9	-61.5	175.7	0	0	0	110.3	S1856 V1857	S1856-I1859 WeakPolarHBondContact O-CD1 3.43Å; S1856-I1859 WeakPolarHBondContact O-CG1 3.42Å; S1856-I1859 PolarHBondContact O-N 2.9Å; V1857-I1859 VanDerWaalsContact C-N 3.29Å; V1857-I1859 HydrophobicContact CG1-CD1 4.09Å; V1857-I1859 HydrophobicContact CG1-CG1 4.31Å; V1857-I1859 PolarHBondContact O-N 2.94Å
1860	S	34.1	Very low	41.8	Very low	86 Å²	86	117.1 Å²	117.1	60%	0.601	68%	0.679	S	S	*	*			trans	-15.5	123.5	174.5	7.4	0	0	0	0	115.8	S1858 T1862	S1858-S1860 PolarHBondContact O-N 3.08Å; S1860-T1862 PolarHBondContact O-N 3.21Å
1861	P	35.2	Very low	40	Very low	134 Å²	134	115.4 Å²	115.4	87%	0.87	68%	0.682	S	S	*	*			trans	-80.8	72.6	177	24.3	-22.5	0	0	0	112.4	S1863	P1861-S1863 PolarHBondContact O-N 2.69Å
1862	T	34.2	Very low	38.5	Very low	118 Å²	118	125.1 Å²	125.1	72%	0.724	72%	0.715	S	S	*	*			trans	-121.1	98.3	175.9	54.7	0	0	0	0	112.2	S1860	S1860-T1862 PolarHBondContact O-N 3.21Å
1863	S	34.5	Very low	37	Very low	109 Å²	109	122.1 Å²	122.1	76%	0.762	72%	0.716	S	S	*	*			trans	101.1	109	153.6	31.7	0	0	0	0	115.9	P1861	P1861-S1863 PolarHBondContact O-N 2.69Å
1864	S	31	Very low	35.8	Very low	107.8 Å²	107.8	122.4 Å²	122.4	75%	0.754	72%	0.723	S	S	*	*			trans	13.5	121.3	151	54.4	0	0	0	0	116.9	S1866	S1864-S1866 PolarHBondContact O-N 3.44Å
1865	S	30.5	Very low	34.7	Very low	117.2 Å²	117.2	121.4 Å²	121.4	82%	0.82	73%	0.726	S	S	*	*			trans	76	110.6	145.4	32.3	0	0	0	0	117.5
1866	S	31.6	Very low	33.9	Very low	98.4 Å²	98.4	122.7 Å²	122.7	69%	0.688	73%	0.732	S	S	*	*			trans	170.9	137.2	148.5	59.3	0	0	0	0	112.6	S1864 F1868	S1864-S1866 PolarHBondContact O-N 3.44Å; S1866-F1868 VanDerWaalsContact O-CD2 3.32Å; S1866-F1868 WeakPolarHBondContact O-CD2 3.31Å; S1866-F1868 PolarHBondContact O-N 3.07Å; S1866-F1868 VanDerWaalsContact O-N 3.16Å; S1866-F1868 VanDerWaalsContact OG-CE2 3.28Å; S1866-F1868 WeakPolarHBondContact OG-CE2 3.36Å
1867	S	29.7	Very low	33.7	Very low	118 Å²	118	125.1 Å²	125.1	83%	0.825	74%	0.738	S	S	*	*			trans	-59.9	87.1	170.8	18.1	0	0	0	0	112.4	T1869	S1867-T1869 PolarHBondContact O-N 3.28Å; S1867-T1869 VanDerWaalsContact O-N 3.15Å
1868	F	29.1	Very low	34.1	Very low	181.2 Å²	181.2	125.6 Å²	125.6	80%	0.795	74%	0.736	S	S	*	*			trans	-94.6	102.3	161.5	-103.8	-90.3	0	0	0	108.7	S1866 V1870	S1866-F1868 VanDerWaalsContact O-CD2 3.32Å; S1866-F1868 WeakPolarHBondContact O-CD2 3.31Å; S1866-F1868 PolarHBondContact O-N 3.07Å; S1866-F1868 VanDerWaalsContact O-N 3.16Å; S1866-F1868 VanDerWaalsContact OG-CE2 3.28Å; S1866-F1868 WeakPolarHBondContact OG-CE2 3.36Å; F1868-V1870 HydrophobicContact CB-CG2 4.41Å; F1868-V1870 HydrophobicContact CD1-CG2 4.26Å; F1868-V1870 PolarHBondContact O-N 3.05Å
1869	T	29.4	Very low	35.4	Very low	128.2 Å²	128.2	124.5 Å²	124.5	79%	0.787	72%	0.718	S	S	*	*			trans	-69	99.6	161	47	0	0	0	0	108.1	S1867 S1871	S1867-T1869 PolarHBondContact O-N 3.28Å; S1867-T1869 VanDerWaalsContact O-N 3.15Å; T1869-S1871 VanDerWaalsContact C-N 3.33Å; T1869-S1871 PolarHBondContact O-N 2.94Å
1870	V	33	Very low	37.1	Very low	129.4 Å²	129.4	122.1 Å²	122.1	78%	0.784	71%	0.707	S	S	*	*			trans	-71.4	107	169.4	177.8	0	0	0	0	106.7	F1868 R1872	F1868-V1870 HydrophobicContact CB-CG2 4.41Å; F1868-V1870 HydrophobicContact CD1-CG2 4.26Å; F1868-V1870 PolarHBondContact O-N 3.05Å; V1870-R1872 PolarHBondContact O-N 2.95Å
1871	S	27.7	Very low	39.3	Very low	81.8 Å²	81.8	120.3 Å²	120.3	57%	0.572	69%	0.687	S	S	*	*			trans	-45.8	115.2	178.2	-152.7	0	0	0	0	110.1	T1869 T1873	T1869-S1871 VanDerWaalsContact C-N 3.33Å; T1869-S1871 PolarHBondContact O-N 2.94Å; S1871-T1873 WeakPolarHBondContact CB-OG1 3.44Å; S1871-T1873 PolarHBondContact O-N 3.08Å; S1871-T1873 VanDerWaalsContact O-N 3.12Å; S1871-T1873 PolarHBondContact O-OG1 3.22Å; S1871-T1873 WeakPolarHBondContact OG-CG2 3.31Å; S1871-T1873 PolarHBondContact OG-N 3.37Å; S1871-T1873 PolarHBondContact OG-OG1 3.11Å
1872	R	30.4	Very low	41.7	Very low	245 Å²	245	117.1 Å²	117.1	93%	0.925	66%	0.66	S	S	*	*			trans	-72.6	53.8	170.3	-97.6	-174.2	-171.3	-174	-1.1	110.7	V1870 V1874	V1870-R1872 PolarHBondContact O-N 2.95Å; R1872-V1874 HydrophobicContact CB-CG2 4.2Å; R1872-V1874 HydrophobicContact CG-CG2 4.5Å; R1872-V1874 PolarHBondContact O-N 3.1Å
1873	T	31	Very low	44.3	Very low	105.8 Å²	105.8	112.9 Å²	112.9	65%	0.649	63%	0.631	S	S	*	*			trans	-104.1	78.2	170.1	51.8	0	0	0	0	109.2	S1871 H1875	S1871-T1873 WeakPolarHBondContact CB-OG1 3.44Å; S1871-T1873 PolarHBondContact O-N 3.08Å; S1871-T1873 VanDerWaalsContact O-N 3.12Å; S1871-T1873 PolarHBondContact O-OG1 3.22Å; S1871-T1873 WeakPolarHBondContact OG-CG2 3.31Å; S1871-T1873 PolarHBondContact OG-N 3.37Å; S1871-T1873 PolarHBondContact OG-OG1 3.11Å; T1873-H1875 VanDerWaalsContact C-N 3.33Å; T1873-H1875 PolarHBondContact O-N 2.88Å
1874	V	34.8	Very low	46.9	Very low	109.8 Å²	109.8	109.1 Å²	109.1	67%	0.665	60%	0.602	S	S	*	*	S	Bend	trans	-61.4	107.2	161.1	179.6	0	0	0	0	106.6	M1853 R1872 P1876 L1877 L1878	M1853-V1874 HydrophobicContact CE-CG1 3.98Å; M1853-V1874 HydrophobicContact SD-CG1 4.08Å; R1872-V1874 HydrophobicContact CB-CG2 4.2Å; R1872-V1874 HydrophobicContact CG-CG2 4.5Å; R1872-V1874 PolarHBondContact O-N 3.1Å; V1874-P1876 VanDerWaalsContact O-N 3.13Å; V1874-L1877 HydrophobicContact CG1-CG 4.47Å; V1874-L1878 HydrophobicContact CG1-CB 3.59Å
1875	H	32.6	Very low	49.6	Very low	154.6 Å²	154.6	104.8 Å²	104.8	72%	0.716	57%	0.57	S	S	*	*			trans	-16.3	119.8	175.3	-100.6	-86.7	0	0	0	112.7	T1873 L1877 L1878	T1873-H1875 VanDerWaalsContact C-N 3.33Å; T1873-H1875 PolarHBondContact O-N 2.88Å; H1875-L1877 PolarHBondContact O-N 3.13Å; H1875-L1877 VanDerWaalsContact O-N 3.08Å; H1875-L1878 HydrophobicContact CB-CD1 3.65Å; H1875-L1878 HydrophobicContact CB-CG 4.07Å; H1875-L1878 WeakPolarHBondContact O-CA 3.24Å; H1875-L1878 VanDerWaalsContact O-CB 3.28Å; H1875-L1878 WeakPolarHBondContact O-CB 3.41Å; H1875-L1878 PolarHBondContact O-N 3.32Å
1876	P	36	Very low	52.2	Low	113.6 Å²	113.6	101.7 Å²	101.7	74%	0.738	55%	0.546	S	S	*	.			trans	-67.4	79.7	-177.8	26.1	-32.9	0	0	0	112.2	V1874 L1878	V1874-P1876 VanDerWaalsContact O-N 3.13Å; P1876-L1878 VanDerWaalsContact C-N 3.35Å; P1876-L1878 PolarHBondContact O-N 3.21Å
1877	L	43.7	Very low	54.9	Low	132.2 Å²	132.2	99 Å²	99	69%	0.692	52%	0.521	S	S	*	.			trans	-58.9	63.5	168.9	-67.7	171.6	0	0	0	111.9	M1849 F1850 M1853 V1874 H1875 K1879	M1849-L1877 HydrophobicContact CE-CD2 4.35Å; M1849-L1877 HydrophobicContact SD-CD2 4.29Å; F1850-L1877 HydrophobicContact CB-CD1 4.06Å; F1850-L1877 HydrophobicContact CD2-CD1 4.21Å; M1853-L1877 HydrophobicContact SD-CD1 4.33Å; V1874-L1877 HydrophobicContact CG1-CG 4.47Å; H1875-L1877 PolarHBondContact O-N 3.13Å; H1875-L1877 VanDerWaalsContact O-N 3.08Å; L1877-K1879 VanDerWaalsContact C-N 3.34Å; L1877-K1879 PolarHBondContact O-N 3.13Å
1878	L	53.4	Low	57.7	Low	123.8 Å²	123.8	93.8 Å²	93.8	65%	0.648	48%	0.484	S	S	*	.			trans	-76.3	100.1	174.5	-78.1	162.1	0	0	0	109.9	V1874 H1875 P1876 D1880	V1874-L1878 HydrophobicContact CG1-CB 3.59Å; H1875-L1878 HydrophobicContact CB-CD1 3.65Å; H1875-L1878 HydrophobicContact CB-CG 4.07Å; H1875-L1878 WeakPolarHBondContact O-CA 3.24Å; H1875-L1878 VanDerWaalsContact O-CB 3.28Å; H1875-L1878 WeakPolarHBondContact O-CB 3.41Å; H1875-L1878 PolarHBondContact O-N 3.32Å; P1876-L1878 VanDerWaalsContact C-N 3.35Å; P1876-L1878 PolarHBondContact O-N 3.21Å; L1878-D1880 PolarHBondContact O-N 3.02Å; L1878-D1880 VanDerWaalsContact O-N 3.09Å
1879	K	63.7	Low	60.5	Low	80 Å²	80	85.8 Å²	85.8	35%	0.348	45%	0.449	S	S	.	.			trans	-70.8	118.4	174.5	-178.4	-179.3	173.3	-178.8	0	108	L1877 Y1881 N1905 L2303 N2304 D2305	L1877-K1879 VanDerWaalsContact C-N 3.34Å; L1877-K1879 PolarHBondContact O-N 3.13Å; K1879-Y1881 HydrophobicContact CB-CE2 4.29Å; K1879-Y1881 HydrophobicContact CD-CE1 4.09Å; K1879-Y1881 HydrophobicContact CD-CE2 4.37Å; K1879-Y1881 HydrophobicContact CG-CE2 4.42Å; K1879-Y1881 VanDerWaalsContact O-CD2 3.29Å; K1879-Y1881 WeakPolarHBondContact O-CD2 3.36Å; K1879-Y1881 VanDerWaalsContact O-CE2 3.3Å; K1879-Y1881 WeakPolarHBondContact O-CE2 3.4Å; K1879-Y1881 PolarHBondContact O-N 3.01Å; K1879-N1905 PolarHBondContact NZ-OD1 2.97Å; K1879-L2303 PolarHBondContact NZ-O 2.75Å; K1879-N2304 PolarHBondContact NZ-O 2.98Å; K1879-D2305 VanDerWaalsContact CE-OD2 3.22Å; K1879-D2305 WeakPolarHBondContact CE-OD2 3.45Å; K1879-D2305 VanDerWaalsContact NZ-CB 3.28Å; K1879-D2305 VanDerWaalsContact NZ-CG 3.27Å; K1879-D2305 VanDerWaalsContact NZ-N 3.17Å; K1879-D2305 IonicContact NZ-OD1 3.28Å; K1879-D2305 PolarHBondContact NZ-OD1 3.14Å; K1879-D2305 IonicContact NZ-OD2 3.23Å; K1879-D2305 PolarHBondContact NZ-OD2 3.27Å
1880	D	72.5	Confident	63.2	Low	90.4 Å²	90.4	82.7 Å²	82.7	48%	0.483	43%	0.428	S	S	.	.			trans	-70.3	112.7	174.8	-82.9	-23.7	0	0	0	109.5	R1843 L1878 F1882	R1843-D1880 IonicContact CZ-OD1 3.52Å; R1843-D1880 IonicContact CZ-OD2 3.3Å; R1843-D1880 VanDerWaalsContact CZ-OD2 3.26Å; R1843-D1880 IonicContact NE-OD1 2.79Å; R1843-D1880 VanDerWaalsContact NH1-CG 3.28Å; R1843-D1880 IonicContact NH1-OD1 2.78Å; R1843-D1880 PolarHBondContact NH1-OD1 3.35Å; R1843-D1880 IonicContact NH1-OD2 3.35Å; R1843-D1880 PolarHBondContact NH1-OD2 2.98Å; R1843-D1880 IonicContact NH2-OD1 3.2Å; R1843-D1880 IonicContact NH2-OD2 3.16Å; R1843-D1880 PolarHBondContact NH2-OD2 3.4Å; L1878-D1880 PolarHBondContact O-N 3.02Å; L1878-D1880 VanDerWaalsContact O-N 3.09Å; D1880-F1882 HydrophobicContact CB-CE1 4.34Å; D1880-F1882 HydrophobicContact CB-CE2 3.92Å; D1880-F1882 HydrophobicContact CB-CZ 4.03Å; D1880-F1882 WeakPolarHBondContact O-CD2 3.17Å; D1880-F1882 WeakPolarHBondContact O-CE2 3.18Å
1881	Y	82.2	Confident	65.9	Low	48.4 Å²	48.4	77.3 Å²	77.3	19%	0.19	40%	0.396	C	S	.	.			trans	-89.5	151.2	168.3	-64.8	-84.7	0	0	0	109.7	K1879 P1899 N1900 G1903 T1904 N1905 N2304	K1879-Y1881 HydrophobicContact CB-CE2 4.29Å; K1879-Y1881 HydrophobicContact CD-CE1 4.09Å; K1879-Y1881 HydrophobicContact CD-CE2 4.37Å; K1879-Y1881 HydrophobicContact CG-CE2 4.42Å; K1879-Y1881 VanDerWaalsContact O-CD2 3.29Å; K1879-Y1881 WeakPolarHBondContact O-CD2 3.36Å; K1879-Y1881 VanDerWaalsContact O-CE2 3.3Å; K1879-Y1881 WeakPolarHBondContact O-CE2 3.4Å; K1879-Y1881 PolarHBondContact O-N 3.01Å; Y1881-P1899 CarbonylContact O-C 3.57Å; Y1881-P1899 VanDerWaalsContact O-CA 3.32Å; Y1881-P1899 WeakPolarHBondContact O-CA 3.42Å; Y1881-N1900 PolarHBondContact O-N 3.19Å; Y1881-G1903 VanDerWaalsContact CD2-C 3.49Å; Y1881-G1903 VanDerWaalsContact CD2-O 3.27Å; Y1881-G1903 WeakPolarHBondContact CD2-O 3.36Å; Y1881-G1903 VanDerWaalsContact CE2-O 3.25Å; Y1881-G1903 WeakPolarHBondContact CE2-O 3.32Å; Y1881-T1904 WeakPolarHBondContact CE1-O 3.24Å; Y1881-N1905 HydrophobicContact CE1-CB 4.36Å; Y1881-N1905 PolarHBondContact OH-N 3.35Å; Y1881-N1905 VanDerWaalsContact OH-N 3.12Å; Y1881-N1905 PolarHBondContact OH-ND2 2.81Å; Y1881-N1905 VanDerWaalsContact OH-ND2 3.14Å; Y1881-N1905 PolarHBondContact OH-OD1 2.87Å; Y1881-N2304 WeakPolarHBondContact CA-OD1 3.45Å; Y1881-N2304 WeakPolarHBondContact CB-OD1 3.37Å; Y1881-N2304 HydrophobicContact CD1-CB 4.11Å; Y1881-N2304 WeakPolarHBondContact CD1-OD1 3.31Å; Y1881-N2304 WeakPolarHBondContact CE1-O 3.24Å
1882	F	85.1	Confident	68.9	Low	65.6 Å²	65.6	74.1 Å²	74.1	29%	0.288	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.4	-179.7	-65	-87.2	0	0	0	111.5	D1880 L1897 I1898 P1899 N2304 R2729	D1880-F1882 HydrophobicContact CB-CE1 4.34Å; D1880-F1882 HydrophobicContact CB-CE2 3.92Å; D1880-F1882 HydrophobicContact CB-CZ 4.03Å; D1880-F1882 WeakPolarHBondContact O-CD2 3.17Å; D1880-F1882 WeakPolarHBondContact O-CE2 3.18Å; F1882-L1897 HydrophobicContact CB-CB 4.29Å; F1882-L1897 HydrophobicContact CB-CD1 4.26Å; F1882-L1897 HydrophobicContact CD1-CB 4.32Å; F1882-I1898 WeakPolarHBondContact CA-O 3.34Å; F1882-P1899 HydrophobicContact CD1-CB 4.14Å; F1882-P1899 HydrophobicContact CD1-CG 4.48Å; F1882-P1899 HydrophobicContact CE1-CB 4.21Å; F1882-P1899 HydrophobicContact CE1-CG 4.14Å; F1882-N2304 PolarHBondContact N-OD1 3.13Å; F1882-N2304 PolarHBondContact O-ND2 2.91Å; F1882-N2304 VanDerWaalsContact O-ND2 3.16Å; F1882-N2304 PolarHBondContact O-OD1 2.83Å; F1882-R2729 VanDerWaalsContact CE1-CZ 3.49Å
1883	R	88.1	Confident	71.8	Confident	31.6 Å²	31.6	64.1 Å²	64.1	12%	0.119	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	158.4	170.5	69.2	177	-169.7	135.2	8.9	110.1	L1897 I1898 N1900 F1989 E1991 Y2054 E2056 E2248	R1883-L1897 WeakPolarHBondContact O-CA 3.4Å; R1883-L1897 WeakPolarHBondContact O-CD2 3.42Å; R1883-I1898 HydrophobicContact CG-CD1 4.25Å; R1883-I1898 HydrophobicContact CG-CG1 3.74Å; R1883-I1898 VanDerWaalsContact CZ-CD1 3.47Å; R1883-I1898 PolarHBondContact N-O 2.92Å; R1883-I1898 VanDerWaalsContact NH2-CD1 3.31Å; R1883-I1898 PolarHBondContact O-N 3.14Å; R1883-I1898 VanDerWaalsContact O-O 3.14Å; R1883-N1900 HydrophobicContact CB-CB 4Å; R1883-N1900 HydrophobicContact CG-CB 4.13Å; R1883-F1989 VanDerWaalsContact NH2-CG 3.27Å; R1883-E1991 IonicContact CZ-OE1 2.69Å; R1883-E1991 VanDerWaalsContact NH2-CD 3.35Å; R1883-E1991 IonicContact NH2-OE1 3.82Å; R1883-E1991 PolarHBondContact NH2-OE1 3.34Å; R1883-Y2054 HydrophobicContact CB-CE1 4.46Å; R1883-E2056 IonicContact CZ-OE1 3.19Å; R1883-E2056 IonicContact NH1-OE1 2.87Å; R1883-E2056 PolarHBondContact NH1-OE1 3.03Å; R1883-E2056 IonicContact NH2-OE1 2.99Å; R1883-E2056 PolarHBondContact NH2-OE1 2.95Å; R1883-E2248 CarbonylContact C-O 3.56Å; R1883-E2248 VanDerWaalsContact CA-O 3.27Å; R1883-E2248 WeakPolarHBondContact CA-O 3.34Å; R1883-E2248 HydrophobicContact CB-CB 3.76Å; R1883-E2248 WeakPolarHBondContact CB-O 3.4Å
1884	L	89.4	Confident	74.7	Confident	28.8 Å²	28.8	60.1 Å²	60.1	15%	0.151	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	136.7	171.9	-168.4	63	0	0	0	110.5	H1894 L1897 I2247 E2248 F2250 F2296	L1884-H1894 HydrophobicContact CD1-CB 3.97Å; L1884-H1894 HydrophobicContact CD2-CB 3.88Å; L1884-H1894 HydrophobicContact CG-CB 4Å; L1884-L1897 HydrophobicContact CB-CD2 4.47Å; L1884-L1897 HydrophobicContact CD1-CD2 4.37Å; L1884-I2247 HydrophobicContact CB-CG2 3.85Å; L1884-E2248 PolarHBondContact N-O 3.05Å; L1884-F2250 HydrophobicContact CD2-CE2 3.77Å; L1884-F2250 HydrophobicContact CD2-CZ 4.23Å; L1884-F2296 HydrophobicContact CD1-CE1 4.11Å; L1884-F2296 HydrophobicContact CD1-CE2 4.03Å; L1884-F2296 HydrophobicContact CD1-CZ 3.6Å; L1884-F2296 VanDerWaalsContact CD1-CZ 3.49Å
1885	D	87.7	Confident	77.3	Confident	17.6 Å²	17.6	59.7 Å²	59.7	9%	0.094	29%	0.294	C	S	.	.			trans	-81.3	143.6	173.3	-165.6	-11	0	0	0	110.9	W1887 H1894 R1896 I1898	D1885-W1887 PolarHBondContact O-N 3.11Å; D1885-W1887 WeakPolarHBondContact OD1-CB 3.19Å; D1885-W1887 PolarHBondContact OD1-N 3.09Å; D1885-W1887 VanDerWaalsContact OD1-N 3.13Å; D1885-W1887 VanDerWaalsContact OD2-CB 3.3Å; D1885-W1887 WeakPolarHBondContact OD2-CB 3.31Å; D1885-H1894 PolarHBondContact O-CD2 2.93Å; D1885-H1894 VanDerWaalsContact O-CD2 3.24Å; D1885-R1896 HydrophobicContact CB-CB 3.8Å; D1885-R1896 HydrophobicContact CB-CG 4.42Å; D1885-R1896 VanDerWaalsContact CB-O 3.27Å; D1885-R1896 WeakPolarHBondContact CB-O 3.36Å; D1885-R1896 PolarHBondContact N-O 3.04Å; D1885-R1896 IonicContact OD1-CZ 3.58Å; D1885-R1896 IonicContact OD1-NH2 3.13Å; D1885-R1896 PolarHBondContact OD1-NH2 3.36Å; D1885-R1896 VanDerWaalsContact OD1-NH2 3.13Å; D1885-R1896 WeakPolarHBondContact OD2-CB 3.49Å; D1885-R1896 WeakPolarHBondContact OD2-CD 3.43Å; D1885-R1896 IonicContact OD2-CZ 3.32Å; D1885-R1896 IonicContact OD2-NE 3.52Å; D1885-R1896 PolarHBondContact OD2-NE 3.03Å; D1885-R1896 IonicContact OD2-NH1 2.76Å; D1885-R1896 PolarHBondContact OD2-NH1 3.31Å; D1885-R1896 IonicContact OD2-NH2 3.23Å; D1885-R1896 PolarHBondContact OD2-NH2 3.25Å; D1885-I1898 HydrophobicContact CB-CD1 4.24Å; D1885-I1898 HydrophobicContact CB-CG1 4.24Å; D1885-I1898 HydrophobicContact CB-CG2 4.08Å; D1885-I1898 WeakPolarHBondContact OD2-CG2 3.34Å
1886	T	84.6	Confident	79.9	Confident	51.2 Å²	51.2	55 Å²	55	31%	0.314	27%	0.27	S	S	.	.			trans	-77.2	-0.2	177.4	53	0	0	0	0	113.3	E1888 H1894 E2056 G2090	T1886-E1888 PolarHBondContact O-N 3.18Å; T1886-E1888 VanDerWaalsContact O-N 3.16Å; T1886-H1894 PolarHBondContact O-NE2 3.31Å; T1886-E2056 WeakPolarHBondContact CB-OE2 3.4Å; T1886-E2056 WeakPolarHBondContact CG2-OE2 3.37Å; T1886-E2056 PolarHBondContact OG1-OE2 3.18Å; T1886-G2090 WeakPolarHBondContact O-CA 3.19Å
1887	W	88.1	Confident	82.3	Confident	42 Å²	42	51.7 Å²	51.7	16%	0.159	25%	0.246	C	C	.	.			trans	-71.5	111.4	178.7	-169.9	71.6	0	0	0	112.8	D1885 D1889 H1894 R1896 S2088 R2089 A2704 E2705 T2723	D1885-W1887 PolarHBondContact O-N 3.11Å; D1885-W1887 WeakPolarHBondContact OD1-CB 3.19Å; D1885-W1887 PolarHBondContact OD1-N 3.09Å; D1885-W1887 VanDerWaalsContact OD1-N 3.13Å; D1885-W1887 VanDerWaalsContact OD2-CB 3.3Å; D1885-W1887 WeakPolarHBondContact OD2-CB 3.31Å; W1887-D1889 HydrophobicContact CE3-CB 4.29Å; W1887-D1889 HydrophobicContact CH2-CB 4.04Å; W1887-D1889 HydrophobicContact CZ3-CB 3.63Å; W1887-D1889 VanDerWaalsContact CZ3-CB 3.47Å; W1887-H1894 PolarHBondContact O-CD2 3.39Å; W1887-R1896 VanDerWaalsContact CD1-NH1 3.35Å; W1887-R1896 VanDerWaalsContact CD2-CZ 3.43Å; W1887-R1896 VanDerWaalsContact CD2-NH1 3.32Å; W1887-R1896 HydrophobicContact CE3-CG 4.4Å; W1887-R1896 VanDerWaalsContact CE3-CZ 3.45Å; W1887-R1896 VanDerWaalsContact CE3-NE 3.28Å; W1887-R1896 VanDerWaalsContact CG-NH1 3.31Å; W1887-R1896 VanDerWaalsContact CZ2-NH2 3.29Å; W1887-S2088 VanDerWaalsContact CE3-O 3.24Å; W1887-S2088 WeakPolarHBondContact CZ3-O 3.36Å; W1887-R2089 HydrophobicContact CD2-CB 4.16Å; W1887-R2089 HydrophobicContact CD2-CG 3.94Å; W1887-R2089 HydrophobicContact CE3-CB 4.11Å; W1887-R2089 HydrophobicContact CE3-CG 4.47Å; W1887-R2089 HydrophobicContact CG-CB 4.13Å; W1887-R2089 HydrophobicContact CG-CG 4.43Å; W1887-R2089 HydrophobicContact CH2-CG 4.05Å; W1887-R2089 HydrophobicContact CZ2-CB 4.13Å; W1887-R2089 HydrophobicContact CZ2-CG 3.98Å; W1887-R2089 VanDerWaalsContact CZ2-CG 3.45Å; W1887-A2704 WeakPolarHBondContact CZ2-O 3.45Å; W1887-E2705 PolarHBondContact NE1-O 3.26Å; W1887-T2723 WeakPolarHBondContact CH2-OG1 3.4Å
1888	E	89.2	Confident	84.3	Confident	9.6 Å²	9.6	46.6 Å²	46.6	5%	0.045	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-85.7	130.4	174.7	-81.2	-173.8	-172.1	0	0	112.2	T1886 R1892 H1894 R2089 S2091 Y2166	T1886-E1888 PolarHBondContact O-N 3.18Å; T1886-E1888 VanDerWaalsContact O-N 3.16Å; E1888-R1892 VanDerWaalsContact CG-CA 3.45Å; E1888-R1892 HydrophobicContact CG-CB 4.22Å; E1888-R1892 WeakPolarHBondContact OE1-CG 3.43Å; E1888-R1892 IonicContact OE1-CZ 3.44Å; E1888-R1892 IonicContact OE1-NE 3.19Å; E1888-R1892 PolarHBondContact OE1-NE 3.32Å; E1888-R1892 VanDerWaalsContact OE1-NE 3.1Å; E1888-R1892 IonicContact OE1-NH2 3.05Å; E1888-R1892 PolarHBondContact OE1-NH2 3Å; E1888-R1892 WeakPolarHBondContact OE2-CA 3.47Å; E1888-R1892 VanDerWaalsContact OE2-CB 3.24Å; E1888-R1892 WeakPolarHBondContact OE2-CB 3.44Å; E1888-R1892 WeakPolarHBondContact OE2-CG 3.32Å; E1888-R1892 IonicContact OE2-CZ 3.01Å; E1888-R1892 IonicContact OE2-NE 3.14Å; E1888-R1892 PolarHBondContact OE2-NE 3.24Å; E1888-R1892 IonicContact OE2-NH2 3.44Å; E1888-R1892 PolarHBondContact OE2-NH2 3.37Å; E1888-H1894 VanDerWaalsContact CG-NE2 3.28Å; E1888-H1894 WeakPolarHBondContact CG-NE2 3.37Å; E1888-R2089 WeakPolarHBondContact CA-O 3.4Å; E1888-R2089 VanDerWaalsContact CB-O 3.31Å; E1888-R2089 WeakPolarHBondContact CB-O 3.34Å; E1888-R2089 PolarHBondContact N-O 3.15Å; E1888-R2089 VanDerWaalsContact O-CB 3.25Å; E1888-R2089 WeakPolarHBondContact O-CB 3.32Å; E1888-R2089 VanDerWaalsContact O-CD 3.24Å; E1888-R2089 WeakPolarHBondContact O-CD 3.44Å; E1888-S2091 PolarHBondContact OE1-OG 3.27Å; E1888-Y2166 WeakPolarHBondContact OE1-CD2 3.38Å
1889	D	88.6	Confident	85.5	Confident	13.4 Å²	13.4	43 Å²	43	7%	0.072	20%	0.203	C	C	.	.			trans	-76	-179.4	169.8	81.5	0.8	0	0	0	113.1	W1887 S1891 R1892 R1893 R1895 E2705	W1887-D1889 HydrophobicContact CE3-CB 4.29Å; W1887-D1889 HydrophobicContact CH2-CB 4.04Å; W1887-D1889 HydrophobicContact CZ3-CB 3.63Å; W1887-D1889 VanDerWaalsContact CZ3-CB 3.47Å; D1889-S1891 PolarHBondContact O-N 3.28Å; D1889-S1891 VanDerWaalsContact O-N 3.09Å; D1889-S1891 VanDerWaalsContact OD1-C 3.26Å; D1889-S1891 VanDerWaalsContact OD1-CA 3.3Å; D1889-S1891 WeakPolarHBondContact OD1-CA 3.33Å; D1889-S1891 WeakPolarHBondContact OD1-CB 3.42Å; D1889-S1891 PolarHBondContact OD1-N 3.06Å; D1889-R1892 WeakPolarHBondContact O-CA 3.24Å; D1889-R1892 PolarHBondContact O-N 2.95Å; D1889-R1892 PolarHBondContact OD1-N 3.07Å; D1889-R1892 VanDerWaalsContact OD1-N 3.12Å; D1889-R1893 WeakPolarHBondContact CB-O 3.46Å; D1889-R1893 PolarHBondContact N-O 3.28Å; D1889-R1893 VanDerWaalsContact N-O 3.1Å; D1889-R1893 VanDerWaalsContact OD1-CB 3.29Å; D1889-R1893 WeakPolarHBondContact OD1-CB 3.3Å; D1889-R1893 IonicContact OD1-CZ 3.59Å; D1889-R1893 PolarHBondContact OD1-N 3.16Å; D1889-R1893 IonicContact OD1-NE 3.21Å; D1889-R1893 PolarHBondContact OD1-NE 3.13Å; D1889-R1893 IonicContact OD1-NH2 3.62Å; D1889-R1893 IonicContact OD2-CZ 3.6Å; D1889-R1893 VanDerWaalsContact OD2-CZ 3.24Å; D1889-R1893 IonicContact OD2-NE 3.5Å; D1889-R1893 PolarHBondContact OD2-NE 3.09Å; D1889-R1893 IonicContact OD2-NH2 3.05Å; D1889-R1893 PolarHBondContact OD2-NH2 3.11Å; D1889-R1895 VanDerWaalsContact OD2-CD 3.22Å; D1889-R1895 WeakPolarHBondContact OD2-CD 3.42Å; D1889-R1895 IonicContact OD2-CZ 2.81Å; D1889-R1895 IonicContact OD2-NE 3.48Å; D1889-R1895 PolarHBondContact OD2-NE 3.32Å; D1889-R1895 IonicContact OD2-NH2 3.85Å; D1889-R1895 PolarHBondContact OD2-NH2 3.03Å; D1889-E2705 HydrophobicContact CB-CG 4.09Å
1890	D	85.3	Confident	86.3	Confident	62 Å²	62	39.7 Å²	39.7	33%	0.332	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-17	-179.3	-86.4	-24	0	0	0	114.2	R1892 R2089 R2117 H2649 E2705	D1890-R1892 VanDerWaalsContact C-N 3.3Å; D1890-R2089 IonicContact OD1-CZ 3.23Å; D1890-R2089 VanDerWaalsContact OD1-CZ 3.27Å; D1890-R2089 IonicContact OD1-NH1 3Å; D1890-R2089 PolarHBondContact OD1-NH1 2.85Å; D1890-R2089 IonicContact OD1-NH2 3.28Å; D1890-R2089 PolarHBondContact OD1-NH2 3.21Å; D1890-R2089 IonicContact OD2-NH2 3.1Å; D1890-R2117 PolarHBondContact O-NH1 3.07Å; D1890-R2117 PolarHBondContact O-NH2 2.92Å; D1890-R2117 IonicContact OD1-NH2 3.35Å; D1890-R2117 PolarHBondContact OD1-NH2 3.22Å; D1890-R2117 IonicContact OD2-NH2 2.68Å; D1890-H2649 IonicContact OD2-CE1 3.26Å; D1890-H2649 PolarHBondContact OD2-CE1 2.99Å; D1890-H2649 IonicContact OD2-ND1 2.87Å; D1890-H2649 IonicContact OD2-NE2 3.48Å; D1890-H2649 PolarHBondContact OD2-NE2 3.01Å; D1890-E2705 HydrophobicContact CB-CG 4.32Å
1891	S	88.9	Confident	86.3	Confident	16.4 Å²	16.4	38.3 Å²	38.3	12%	0.115	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	10.9	172.9	-62.4	0	0	0	0	112.7	D1889 R1893 D2153	D1889-S1891 PolarHBondContact O-N 3.28Å; D1889-S1891 VanDerWaalsContact O-N 3.09Å; D1889-S1891 VanDerWaalsContact OD1-C 3.26Å; D1889-S1891 VanDerWaalsContact OD1-CA 3.3Å; D1889-S1891 WeakPolarHBondContact OD1-CA 3.33Å; D1889-S1891 WeakPolarHBondContact OD1-CB 3.42Å; D1889-S1891 PolarHBondContact OD1-N 3.06Å; S1891-R1893 VanDerWaalsContact C-N 3.32Å; S1891-R1893 VanDerWaalsContact CB-NH2 3.34Å; S1891-R1893 PolarHBondContact O-N 2.98Å; S1891-R1893 VanDerWaalsContact OG-CZ 3.29Å; S1891-R1893 PolarHBondContact OG-NH1 2.72Å; S1891-R1893 PolarHBondContact OG-NH2 3.07Å; S1891-D2153 VanDerWaalsContact CB-OD1 3.24Å; S1891-D2153 WeakPolarHBondContact CB-OD1 3.3Å; S1891-D2153 PolarHBondContact OG-OD1 3.04Å
1892	R	91.3	Very high	85.8	Confident	13.4 Å²	13.4	39.5 Å²	39.5	5%	0.051	19%	0.192	C	C	.	.	S	Bend	trans	62.3	33.8	-173.3	-56.7	-163.3	65.4	-155.8	-5.6	114.7	E1888 D1889 D1890 M2156 T2160 Y2166	E1888-R1892 VanDerWaalsContact CG-CA 3.45Å; E1888-R1892 HydrophobicContact CG-CB 4.22Å; E1888-R1892 WeakPolarHBondContact OE1-CG 3.43Å; E1888-R1892 IonicContact OE1-CZ 3.44Å; E1888-R1892 IonicContact OE1-NE 3.19Å; E1888-R1892 PolarHBondContact OE1-NE 3.32Å; E1888-R1892 VanDerWaalsContact OE1-NE 3.1Å; E1888-R1892 IonicContact OE1-NH2 3.05Å; E1888-R1892 PolarHBondContact OE1-NH2 3Å; E1888-R1892 WeakPolarHBondContact OE2-CA 3.47Å; E1888-R1892 VanDerWaalsContact OE2-CB 3.24Å; E1888-R1892 WeakPolarHBondContact OE2-CB 3.44Å; E1888-R1892 WeakPolarHBondContact OE2-CG 3.32Å; E1888-R1892 IonicContact OE2-CZ 3.01Å; E1888-R1892 IonicContact OE2-NE 3.14Å; E1888-R1892 PolarHBondContact OE2-NE 3.24Å; E1888-R1892 IonicContact OE2-NH2 3.44Å; E1888-R1892 PolarHBondContact OE2-NH2 3.37Å; D1889-R1892 WeakPolarHBondContact O-CA 3.24Å; D1889-R1892 PolarHBondContact O-N 2.95Å; D1889-R1892 PolarHBondContact OD1-N 3.07Å; D1889-R1892 VanDerWaalsContact OD1-N 3.12Å; D1890-R1892 VanDerWaalsContact C-N 3.3Å; R1892-M2156 HydrophobicContact CB-CE 3.96Å; R1892-M2156 VanDerWaalsContact CB-CE 3.48Å; R1892-M2156 HydrophobicContact CB-CG 3.82Å; R1892-M2156 HydrophobicContact CB-SD 3.97Å; R1892-M2156 HydrophobicContact CG-CG 4.03Å; R1892-M2156 HydrophobicContact CG-SD 4.49Å; R1892-T2160 WeakPolarHBondContact CD-OG1 3.37Å; R1892-T2160 PolarHBondContact NH1-OG1 2.81Å; R1892-Y2166 HydrophobicContact CB-CE2 4.38Å; R1892-Y2166 VanDerWaalsContact O-CE2 3.28Å; R1892-Y2166 WeakPolarHBondContact O-CE2 3.4Å; R1892-Y2166 PolarHBondContact O-OH 2.99Å; R1892-Y2166 VanDerWaalsContact O-OH 3.11Å
1893	R	92.4	Very high	85.1	Confident	35.2 Å²	35.2	37.1 Å²	37.1	13%	0.133	19%	0.186	C	C	.	.			trans	-100.5	131	179.7	-56.1	175.8	-66.9	-156.8	-6.6	111.4	D1889 S1891 R1895 F2152 Y2295 E2770	D1889-R1893 WeakPolarHBondContact CB-O 3.46Å; D1889-R1893 PolarHBondContact N-O 3.28Å; D1889-R1893 VanDerWaalsContact N-O 3.1Å; D1889-R1893 VanDerWaalsContact OD1-CB 3.29Å; D1889-R1893 WeakPolarHBondContact OD1-CB 3.3Å; D1889-R1893 IonicContact OD1-CZ 3.59Å; D1889-R1893 PolarHBondContact OD1-N 3.16Å; D1889-R1893 IonicContact OD1-NE 3.21Å; D1889-R1893 PolarHBondContact OD1-NE 3.13Å; D1889-R1893 IonicContact OD1-NH2 3.62Å; D1889-R1893 IonicContact OD2-CZ 3.6Å; D1889-R1893 VanDerWaalsContact OD2-CZ 3.24Å; D1889-R1893 IonicContact OD2-NE 3.5Å; D1889-R1893 PolarHBondContact OD2-NE 3.09Å; D1889-R1893 IonicContact OD2-NH2 3.05Å; D1889-R1893 PolarHBondContact OD2-NH2 3.11Å; S1891-R1893 VanDerWaalsContact C-N 3.32Å; S1891-R1893 VanDerWaalsContact CB-NH2 3.34Å; S1891-R1893 PolarHBondContact O-N 2.98Å; S1891-R1893 VanDerWaalsContact OG-CZ 3.29Å; S1891-R1893 PolarHBondContact OG-NH1 2.72Å; S1891-R1893 PolarHBondContact OG-NH2 3.07Å; R1893-R1895 HydrophobicContact CB-CG 3.83Å; R1893-R1895 PolarHBondContact O-N 3.05Å; R1893-R1895 VanDerWaalsContact O-N 3.16Å; R1893-F2152 HydrophobicContact CG-CE1 3.69Å; R1893-F2152 HydrophobicContact CG-CZ 3.72Å; R1893-Y2295 HydrophobicContact CB-CD1 4.07Å; R1893-Y2295 HydrophobicContact CB-CD2 3.83Å; R1893-Y2295 HydrophobicContact CB-CE1 3.91Å; R1893-Y2295 HydrophobicContact CB-CE2 3.72Å; R1893-Y2295 HydrophobicContact CB-CG 4.01Å; R1893-Y2295 HydrophobicContact CG-CD1 3.63Å; R1893-Y2295 HydrophobicContact CG-CD2 4.21Å; R1893-Y2295 HydrophobicContact CG-CE1 3.74Å; R1893-Y2295 HydrophobicContact CG-CE2 4.36Å; R1893-Y2295 HydrophobicContact CG-CG 3.85Å; R1893-E2770 IonicContact CZ-OE2 2.75Å; R1893-E2770 IonicContact NH1-OE1 3.85Å; R1893-E2770 IonicContact NH1-OE2 2.93Å; R1893-E2770 PolarHBondContact NH1-OE2 3.27Å; R1893-E2770 IonicContact NH2-OE1 2.63Å; R1893-E2770 IonicContact NH2-OE2 2.81Å
1894	H	91.1	Very high	84.4	Confident	23.2 Å²	23.2	38.6 Å²	38.6	11%	0.107	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-85.7	101.3	167.8	-62.5	134.7	0	0	0	109.9	L1884 D1885 T1886 W1887 E1888 Y2166 Y2295	L1884-H1894 HydrophobicContact CD1-CB 3.97Å; L1884-H1894 HydrophobicContact CD2-CB 3.88Å; L1884-H1894 HydrophobicContact CG-CB 4Å; D1885-H1894 PolarHBondContact O-CD2 2.93Å; D1885-H1894 VanDerWaalsContact O-CD2 3.24Å; T1886-H1894 PolarHBondContact O-NE2 3.31Å; W1887-H1894 PolarHBondContact O-CD2 3.39Å; E1888-H1894 VanDerWaalsContact CG-NE2 3.28Å; E1888-H1894 WeakPolarHBondContact CG-NE2 3.37Å; H1894-Y2166 AromaticContact CE1-CD1 3.88Å; H1894-Y2166 AromaticContact CE1-CD2 3.52Å; H1894-Y2166 VanDerWaalsContact CE1-CD2 3.44Å; H1894-Y2166 WeakPolarHBondContact CE1-CD2 3.33Å; H1894-Y2166 AromaticContact CE1-CE2 3.84Å; H1894-Y2166 AromaticContact CE1-CG 3.63Å; H1894-Y2166 AromaticContact ND1-CD2 3.69Å; H1894-Y2166 AromaticContact ND1-CE2 3.89Å; H1894-Y2166 AromaticContact ND1-CG 3.84Å; H1894-Y2166 AromaticContact ND1-CZ 3.97Å; H1894-Y2166 AromaticContact NE2-CD2 3.99Å; H1894-Y2295 PolarHBondContact N-OH 3.24Å; H1894-Y2295 VanDerWaalsContact N-OH 3.08Å; H1894-Y2295 VanDerWaalsContact O-CE2 3.32Å; H1894-Y2295 WeakPolarHBondContact O-CE2 3.37Å
1895	R	88.4	Confident	83.5	Confident	100.6 Å²	100.6	40 Å²	40	38%	0.38	21%	0.206	S	C	.	.			trans	-115.1	-3.8	-171.7	-65.2	-172	54	-162.4	-1.6	115	D1889 R1893 Y2295 R2769 E2770 G2771 L2787 N2788	D1889-R1895 VanDerWaalsContact OD2-CD 3.22Å; D1889-R1895 WeakPolarHBondContact OD2-CD 3.42Å; D1889-R1895 IonicContact OD2-CZ 2.81Å; D1889-R1895 IonicContact OD2-NE 3.48Å; D1889-R1895 PolarHBondContact OD2-NE 3.32Å; D1889-R1895 IonicContact OD2-NH2 3.85Å; D1889-R1895 PolarHBondContact OD2-NH2 3.03Å; R1893-R1895 HydrophobicContact CB-CG 3.83Å; R1893-R1895 PolarHBondContact O-N 3.05Å; R1893-R1895 VanDerWaalsContact O-N 3.16Å; R1895-Y2295 HydrophobicContact CG-CD2 3.62Å; R1895-Y2295 VanDerWaalsContact CG-CD2 3.48Å; R1895-Y2295 HydrophobicContact CG-CE2 3.93Å; R1895-Y2295 PolarHBondContact NE-O 3.5Å; R1895-R2769 VanDerWaalsContact CZ-O 3.23Å; R1895-R2769 PolarHBondContact NH1-O 3.43Å; R1895-R2769 PolarHBondContact NH2-O 2.83Å; R1895-E2770 PolarHBondContact NH1-O 2.74Å; R1895-G2771 VanDerWaalsContact NH1-N 3.12Å; R1895-L2787 HydrophobicContact CB-CD1 4.46Å; R1895-L2787 HydrophobicContact CB-CD2 4.41Å; R1895-N2788 PolarHBondContact O-ND2 3.45Å
1896	R	87.6	Confident	82.6	Confident	56.2 Å²	56.2	41.7 Å²	41.7	21%	0.212	21%	0.212	C	C	.	.			trans	-104.4	133	-174	-101.3	174.5	145.7	-174.2	2.2	109.7	D1885 W1887 I1898 L2706 G2707 L2728 L2787	D1885-R1896 HydrophobicContact CB-CB 3.8Å; D1885-R1896 HydrophobicContact CB-CG 4.42Å; D1885-R1896 VanDerWaalsContact CB-O 3.27Å; D1885-R1896 WeakPolarHBondContact CB-O 3.36Å; D1885-R1896 PolarHBondContact N-O 3.04Å; D1885-R1896 IonicContact OD1-CZ 3.58Å; D1885-R1896 IonicContact OD1-NH2 3.13Å; D1885-R1896 PolarHBondContact OD1-NH2 3.36Å; D1885-R1896 VanDerWaalsContact OD1-NH2 3.13Å; D1885-R1896 WeakPolarHBondContact OD2-CB 3.49Å; D1885-R1896 WeakPolarHBondContact OD2-CD 3.43Å; D1885-R1896 IonicContact OD2-CZ 3.32Å; D1885-R1896 IonicContact OD2-NE 3.52Å; D1885-R1896 PolarHBondContact OD2-NE 3.03Å; D1885-R1896 IonicContact OD2-NH1 2.76Å; D1885-R1896 PolarHBondContact OD2-NH1 3.31Å; D1885-R1896 IonicContact OD2-NH2 3.23Å; D1885-R1896 PolarHBondContact OD2-NH2 3.25Å; W1887-R1896 VanDerWaalsContact CD1-NH1 3.35Å; W1887-R1896 VanDerWaalsContact CD2-CZ 3.43Å; W1887-R1896 VanDerWaalsContact CD2-NH1 3.32Å; W1887-R1896 HydrophobicContact CE3-CG 4.4Å; W1887-R1896 VanDerWaalsContact CE3-CZ 3.45Å; W1887-R1896 VanDerWaalsContact CE3-NE 3.28Å; W1887-R1896 VanDerWaalsContact CG-NH1 3.31Å; W1887-R1896 VanDerWaalsContact CZ2-NH2 3.29Å; R1896-I1898 HydrophobicContact CG-CG2 4.41Å; R1896-L2706 PolarHBondContact NH1-O 2.67Å; R1896-L2706 VanDerWaalsContact NH1-O 3.1Å; R1896-G2707 VanDerWaalsContact NH1-C 3.27Å; R1896-G2707 PolarHBondContact NH1-O 2.91Å; R1896-L2728 HydrophobicContact CG-CD1 4.38Å; R1896-L2787 HydrophobicContact CB-CD2 3.89Å; R1896-L2787 HydrophobicContact CG-CD2 4.13Å
1897	L	87.8	Confident	81.5	Confident	43.4 Å²	43.4	42.9 Å²	42.9	23%	0.227	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	133	166.1	-71.3	179.8	0	0	0	108.9	F1882 R1883 L1884 I2247 F2296 E2298 L2303 R2729 N2788	F1882-L1897 HydrophobicContact CB-CB 4.29Å; F1882-L1897 HydrophobicContact CB-CD1 4.26Å; F1882-L1897 HydrophobicContact CD1-CB 4.32Å; R1883-L1897 WeakPolarHBondContact O-CA 3.4Å; R1883-L1897 WeakPolarHBondContact O-CD2 3.42Å; L1884-L1897 HydrophobicContact CB-CD2 4.47Å; L1884-L1897 HydrophobicContact CD1-CD2 4.37Å; L1897-I2247 HydrophobicContact CD2-CD1 4.45Å; L1897-I2247 HydrophobicContact CD2-CG2 4.47Å; L1897-F2296 HydrophobicContact CD2-CE2 4.48Å; L1897-F2296 HydrophobicContact CD2-CZ 4Å; L1897-F2296 HydrophobicContact CG-CE2 4.45Å; L1897-F2296 HydrophobicContact CG-CZ 4.35Å; L1897-E2298 HydrophobicContact CD1-CB 4.04Å; L1897-E2298 HydrophobicContact CD1-CG 3.82Å; L1897-L2303 HydrophobicContact CD1-CD1 3.44Å; L1897-L2303 VanDerWaalsContact CD1-CD1 3.44Å; L1897-R2729 VanDerWaalsContact CB-NH2 3.26Å; L1897-R2729 PolarHBondContact O-NH2 2.99Å; L1897-N2788 PolarHBondContact N-OD1 2.97Å
1898	I	84	Confident	80	Confident	25.4 Å²	25.4	45.3 Å²	45.3	13%	0.13	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	148.2	176.3	53.1	174.9	0	0	0	110.1	F1882 R1883 D1885 R1896 N1900 E1991 L2728	F1882-I1898 WeakPolarHBondContact CA-O 3.34Å; R1883-I1898 HydrophobicContact CG-CD1 4.25Å; R1883-I1898 HydrophobicContact CG-CG1 3.74Å; R1883-I1898 VanDerWaalsContact CZ-CD1 3.47Å; R1883-I1898 PolarHBondContact N-O 2.92Å; R1883-I1898 VanDerWaalsContact NH2-CD1 3.31Å; R1883-I1898 PolarHBondContact O-N 3.14Å; R1883-I1898 VanDerWaalsContact O-O 3.14Å; D1885-I1898 HydrophobicContact CB-CD1 4.24Å; D1885-I1898 HydrophobicContact CB-CG1 4.24Å; D1885-I1898 HydrophobicContact CB-CG2 4.08Å; D1885-I1898 WeakPolarHBondContact OD2-CG2 3.34Å; R1896-I1898 HydrophobicContact CG-CG2 4.41Å; I1898-N1900 PolarHBondContact O-N 3.27Å; I1898-E1991 WeakPolarHBondContact CD1-OE1 3.35Å; I1898-L2728 HydrophobicContact CG2-CD2 3.86Å
1899	P	80.1	Confident	78.5	Confident	48 Å²	48	45.8 Å²	45.8	31%	0.312	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	132.5	179.8	-12.5	20.8	0	0	0	111.2	R1843 Y1881 F1882 P1901	R1843-P1899 VanDerWaalsContact NE-CG 3.28Å; R1843-P1899 PolarHBondContact NH1-O 3.1Å; R1843-P1899 PolarHBondContact NH2-O 2.94Å; Y1881-P1899 CarbonylContact O-C 3.57Å; Y1881-P1899 VanDerWaalsContact O-CA 3.32Å; Y1881-P1899 WeakPolarHBondContact O-CA 3.42Å; F1882-P1899 HydrophobicContact CD1-CB 4.14Å; F1882-P1899 HydrophobicContact CD1-CG 4.48Å; F1882-P1899 HydrophobicContact CE1-CB 4.21Å; F1882-P1899 HydrophobicContact CE1-CG 4.14Å; P1899-P1901 WeakPolarHBondContact O-CD 3.36Å
1900	N	80.7	Confident	76.9	Confident	10.4 Å²	10.4	47 Å²	47	6%	0.056	26%	0.262	C	S	.	.			trans	-98.8	109.1	-176.1	-177.9	7.9	0	0	0	110.4	R1843 Y1881 R1883 I1898 H1902 G1903 Y2054	R1843-N1900 PolarHBondContact NH2-O 2.9Å; Y1881-N1900 PolarHBondContact O-N 3.19Å; R1883-N1900 HydrophobicContact CB-CB 4Å; R1883-N1900 HydrophobicContact CG-CB 4.13Å; I1898-N1900 PolarHBondContact O-N 3.27Å; N1900-H1902 VanDerWaalsContact C-N 3.29Å; N1900-H1902 PolarHBondContact O-N 3.06Å; N1900-H1902 PolarHBondContact OD1-N 3.18Å; N1900-H1902 VanDerWaalsContact OD1-N 3.1Å; N1900-G1903 VanDerWaalsContact ND2-CA 3.32Å; N1900-G1903 WeakPolarHBondContact ND2-CA 3.36Å; N1900-G1903 PolarHBondContact ND2-N 3.38Å; N1900-G1903 PolarHBondContact O-N 3.08Å; N1900-G1903 VanDerWaalsContact O-N 3.11Å; N1900-G1903 PolarHBondContact OD1-N 3.16Å; N1900-Y2054 VanDerWaalsContact CG-OH 3.22Å; N1900-Y2054 PolarHBondContact ND2-OH 3.38Å; N1900-Y2054 PolarHBondContact OD1-OH 3.22Å
1901	P	71.5	Confident	75	Confident	62.6 Å²	62.6	49.2 Å²	49.2	41%	0.406	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-17.2	178.8	31	-36.1	0	0	0	113.5	N1839 R1843 P1899 F1989	N1839-P1901 HydrophobicContact CB-CB 4.37Å; N1839-P1901 WeakPolarHBondContact ND2-CB 3.37Å; N1839-P1901 WeakPolarHBondContact ND2-CG 3.46Å; N1839-P1901 WeakPolarHBondContact OD1-CB 3.47Å; R1843-P1901 VanDerWaalsContact NH2-CG 3.33Å; P1899-P1901 WeakPolarHBondContact O-CD 3.36Å; P1901-F1989 HydrophobicContact CG-CD1 4.45Å; P1901-F1989 HydrophobicContact CG-CE1 4.39Å; P1901-F1989 HydrophobicContact CG-CZ 4.49Å
1902	H	72.7	Confident	72.9	Confident	72.8 Å²	72.8	56.8 Å²	56.8	34%	0.337	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	7.7	179.5	-56	-59.8	0	0	0	112.7	N1900 T1904 T1987 F1989	N1900-H1902 VanDerWaalsContact C-N 3.29Å; N1900-H1902 PolarHBondContact O-N 3.06Å; N1900-H1902 PolarHBondContact OD1-N 3.18Å; N1900-H1902 VanDerWaalsContact OD1-N 3.1Å; H1902-T1904 PolarHBondContact O-N 3.15Å; H1902-T1987 PolarHBondContact CE1-O 2.73Å; H1902-T1987 PolarHBondContact NE2-O 3.13Å; H1902-F1989 AromaticContact CE1-CD2 3.21Å; H1902-F1989 WeakPolarHBondContact CE1-CD2 3.46Å; H1902-F1989 AromaticContact CE1-CE2 3.41Å; H1902-F1989 VanDerWaalsContact CE1-CE2 3.41Å; H1902-F1989 WeakPolarHBondContact CE1-CE2 3.35Å; H1902-F1989 AromaticContact NE2-CD2 3.06Å; H1902-F1989 WeakPolarHBondContact NE2-CD2 3.32Å; H1902-F1989 AromaticContact NE2-CE2 3.69Å; H1902-F1989 AromaticContact NE2-CG 3.65Å
1903	G	70.7	Confident	70.3	Confident	14.6 Å²	14.6	61.9 Å²	61.9	15%	0.151	32%	0.324	C	S	.	.			trans	-65.8	136.4	-173.6	0	0	0	0	0	113.2	Y1881 N1900	Y1881-G1903 VanDerWaalsContact CD2-C 3.49Å; Y1881-G1903 VanDerWaalsContact CD2-O 3.27Å; Y1881-G1903 WeakPolarHBondContact CD2-O 3.36Å; Y1881-G1903 VanDerWaalsContact CE2-O 3.25Å; Y1881-G1903 WeakPolarHBondContact CE2-O 3.32Å; N1900-G1903 VanDerWaalsContact ND2-CA 3.32Å; N1900-G1903 WeakPolarHBondContact ND2-CA 3.36Å; N1900-G1903 PolarHBondContact ND2-N 3.38Å; N1900-G1903 PolarHBondContact O-N 3.08Å; N1900-G1903 VanDerWaalsContact O-N 3.11Å; N1900-G1903 PolarHBondContact OD1-N 3.16Å
1904	T	72.4	Confident	67.6	Low	64 Å²	64	66 Å²	66	39%	0.393	35%	0.349	S	S	.	.			trans	-136.2	161.7	172	75	0	0	0	0	109.6	Y1881 H1902 Y1906 S1909	Y1881-T1904 WeakPolarHBondContact CE1-O 3.24Å; H1902-T1904 PolarHBondContact O-N 3.15Å; T1904-Y1906 VanDerWaalsContact C-N 3.3Å; T1904-Y1906 WeakPolarHBondContact O-CD2 3.37Å; T1904-Y1906 WeakPolarHBondContact O-CE2 3.38Å; T1904-Y1906 PolarHBondContact O-N 3.18Å; T1904-Y1906 WeakPolarHBondContact OG1-CD2 3.44Å; T1904-Y1906 WeakPolarHBondContact OG1-CE2 3.36Å; T1904-Y1906 PolarHBondContact OG1-N 2.97Å; T1904-S1909 PolarHBondContact OG1-OG 3.13Å
1905	N	70	Confident	64.8	Low	58.4 Å²	58.4	71.4 Å²	71.4	31%	0.312	38%	0.379	S	S	.	.			trans	-81.5	13.3	171.8	52.9	-9.7	0	0	0	112.4	K1879 Y1881 S1907 S1908 S1909 D2305	K1879-N1905 PolarHBondContact NZ-OD1 2.97Å; Y1881-N1905 HydrophobicContact CE1-CB 4.36Å; Y1881-N1905 PolarHBondContact OH-N 3.35Å; Y1881-N1905 VanDerWaalsContact OH-N 3.12Å; Y1881-N1905 PolarHBondContact OH-ND2 2.81Å; Y1881-N1905 VanDerWaalsContact OH-ND2 3.14Å; Y1881-N1905 PolarHBondContact OH-OD1 2.87Å; N1905-S1907 PolarHBondContact O-N 3.12Å; N1905-S1907 VanDerWaalsContact O-N 3.09Å; N1905-S1907 VanDerWaalsContact OD1-CB 3.27Å; N1905-S1907 WeakPolarHBondContact OD1-CB 3.31Å; N1905-S1907 PolarHBondContact OD1-N 3.1Å; N1905-S1907 VanDerWaalsContact OD1-N 3.12Å; N1905-S1907 PolarHBondContact OD1-OG 2.87Å; N1905-S1907 VanDerWaalsContact OD1-OG 3.13Å; N1905-S1908 WeakPolarHBondContact O-CB 3.3Å; N1905-S1908 PolarHBondContact O-N 3.01Å; N1905-S1909 PolarHBondContact O-N 2.88Å; N1905-D2305 WeakPolarHBondContact CB-O 3.44Å
1906	Y	69.5	Low	62.2	Low	53.4 Å²	53.4	74.9 Å²	74.9	21%	0.209	40%	0.402	C	S	.	.			trans	32.5	24.7	-176.3	-76	-84.4	0	0	0	114.2	T1904 S1908 S1909 A1910 E2248 T2251 T2252 L2255 L2306	T1904-Y1906 VanDerWaalsContact C-N 3.3Å; T1904-Y1906 WeakPolarHBondContact O-CD2 3.37Å; T1904-Y1906 WeakPolarHBondContact O-CE2 3.38Å; T1904-Y1906 PolarHBondContact O-N 3.18Å; T1904-Y1906 WeakPolarHBondContact OG1-CD2 3.44Å; T1904-Y1906 WeakPolarHBondContact OG1-CE2 3.36Å; T1904-Y1906 PolarHBondContact OG1-N 2.97Å; Y1906-S1908 PolarHBondContact O-N 3.24Å; Y1906-S1908 VanDerWaalsContact O-N 3.07Å; Y1906-S1909 WeakPolarHBondContact O-CA 3.37Å; Y1906-S1909 WeakPolarHBondContact O-CB 3.23Å; Y1906-S1909 PolarHBondContact O-N 3.17Å; Y1906-A1910 PolarHBondContact O-N 3.11Å; Y1906-E2248 VanDerWaalsContact CE2-OE1 3.29Å; Y1906-E2248 WeakPolarHBondContact CE2-OE1 3.33Å; Y1906-E2248 PolarHBondContact OH-OE1 3.12Å; Y1906-T2251 HydrophobicContact CD2-CG2 4.09Å; Y1906-T2251 HydrophobicContact CE2-CG2 4.07Å; Y1906-T2252 PolarHBondContact OH-OG1 3.26Å; Y1906-L2255 HydrophobicContact CD1-CD1 3.31Å; Y1906-L2255 HydrophobicContact CD2-CD1 4.1Å; Y1906-L2255 HydrophobicContact CE1-CD1 3.65Å; Y1906-L2255 HydrophobicContact CE2-CD1 4.37Å; Y1906-L2255 HydrophobicContact CG-CD1 3.56Å; Y1906-L2306 HydrophobicContact CD2-CD2 3.8Å; Y1906-L2306 HydrophobicContact CE2-CD2 4.43Å
1907	S	60.3	Low	59.6	Low	76.6 Å²	76.6	83 Å²	83	54%	0.536	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-56.3	-29.3	-179.4	53.4	0	0	0	0	114.2	N1905 S1909 A1910 F1911	N1905-S1907 PolarHBondContact O-N 3.12Å; N1905-S1907 VanDerWaalsContact O-N 3.09Å; N1905-S1907 VanDerWaalsContact OD1-CB 3.27Å; N1905-S1907 WeakPolarHBondContact OD1-CB 3.31Å; N1905-S1907 PolarHBondContact OD1-N 3.1Å; N1905-S1907 VanDerWaalsContact OD1-N 3.12Å; N1905-S1907 PolarHBondContact OD1-OG 2.87Å; N1905-S1907 VanDerWaalsContact OD1-OG 3.13Å; S1907-S1909 VanDerWaalsContact C-N 3.34Å; S1907-A1910 PolarHBondContact O-N 3.37Å; S1907-F1911 WeakPolarHBondContact O-CD2 3.4Å
1908	S	57.9	Low	57	Low	91.8 Å²	91.8	90 Å²	90	64%	0.642	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-76.9	-17.9	175.8	40.9	0	0	0	0	114.2	N1905 Y1906 A1910 F1911	N1905-S1908 WeakPolarHBondContact O-CB 3.3Å; N1905-S1908 PolarHBondContact O-N 3.01Å; Y1906-S1908 PolarHBondContact O-N 3.24Å; Y1906-S1908 VanDerWaalsContact O-N 3.07Å; S1908-A1910 VanDerWaalsContact C-N 3.33Å; S1908-A1910 PolarHBondContact O-N 3.08Å; S1908-F1911 VanDerWaalsContact O-CD2 3.28Å; S1908-F1911 WeakPolarHBondContact O-CD2 3.28Å; S1908-F1911 PolarHBondContact O-N 3.26Å
1909	S	56.6	Low	54.5	Low	19.8 Å²	19.8	100 Å²	100	14%	0.138	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-88.4	-5.9	-177.5	-57	0	0	0	0	113.4	T1904 N1905 Y1906 S1907 F1911 G2260 K2261 F2262	T1904-S1909 PolarHBondContact OG1-OG 3.13Å; N1905-S1909 PolarHBondContact O-N 2.88Å; Y1906-S1909 WeakPolarHBondContact O-CA 3.37Å; Y1906-S1909 WeakPolarHBondContact O-CB 3.23Å; Y1906-S1909 PolarHBondContact O-N 3.17Å; S1907-S1909 VanDerWaalsContact C-N 3.34Å; S1909-F1911 VanDerWaalsContact C-N 3.3Å; S1909-F1911 PolarHBondContact O-N 2.85Å; S1909-G2260 WeakPolarHBondContact CB-O 3.24Å; S1909-G2260 PolarHBondContact OG-O 3.01Å; S1909-K2261 WeakPolarHBondContact O-CA 3.49Å; S1909-F2262 PolarHBondContact O-N 3.11Å
1910	A	55	Low	52.3	Low	39.8 Å²	39.8	101.6 Å²	101.6	33%	0.329	50%	0.504	S	S	.	.			trans	-68.5	115.4	-179.6	0	0	0	0	0	113.3	Y1906 S1907 S1908 Y1912 K2261 G2307	Y1906-A1910 PolarHBondContact O-N 3.11Å; S1907-A1910 PolarHBondContact O-N 3.37Å; S1908-A1910 VanDerWaalsContact C-N 3.33Å; S1908-A1910 PolarHBondContact O-N 3.08Å; A1910-Y1912 HydrophobicContact CB-CE2 4.5Å; A1910-Y1912 WeakPolarHBondContact O-CD2 3.27Å; A1910-Y1912 PolarHBondContact O-N 3.32Å; A1910-Y1912 VanDerWaalsContact O-N 3.15Å; A1910-K2261 VanDerWaalsContact O-CD 3.24Å; A1910-K2261 WeakPolarHBondContact O-CD 3.39Å; A1910-K2261 WeakPolarHBondContact O-CE 3.42Å; A1910-K2261 PolarHBondContact O-NZ 2.61Å; A1910-G2307 WeakPolarHBondContact CA-O 3.35Å; A1910-G2307 WeakPolarHBondContact CB-O 3.31Å
1911	F	47	Very low	50.1	Low	106.8 Å²	106.8	105.6 Å²	105.6	47%	0.468	53%	0.529	S	S	.	.			trans	-73.8	97.9	-176.1	-87.3	-76.4	0	0	0	113.1	S1907 S1908 S1909 N1913 K2261 F2262 D2263 P2265 L2308 G2309	S1907-F1911 WeakPolarHBondContact O-CD2 3.4Å; S1908-F1911 VanDerWaalsContact O-CD2 3.28Å; S1908-F1911 WeakPolarHBondContact O-CD2 3.28Å; S1908-F1911 PolarHBondContact O-N 3.26Å; S1909-F1911 VanDerWaalsContact C-N 3.3Å; S1909-F1911 PolarHBondContact O-N 2.85Å; F1911-N1913 PolarHBondContact O-N 3.09Å; F1911-N1913 VanDerWaalsContact O-N 3.12Å; F1911-K2261 PolarHBondContact O-NZ 3.09Å; F1911-F2262 HydrophobicContact CE1-CB 3.99Å; F1911-F2262 WeakPolarHBondContact CE2-O 3.37Å; F1911-F2262 HydrophobicContact CZ-CB 4.07Å; F1911-D2263 WeakPolarHBondContact CE1-O 3.33Å; F1911-P2265 HydrophobicContact CD1-CG 4.35Å; F1911-P2265 HydrophobicContact CE1-CG 3.79Å; F1911-P2265 HydrophobicContact CE2-CG 4.31Å; F1911-P2265 HydrophobicContact CZ-CG 3.79Å; F1911-L2308 VanDerWaalsContact CZ-O 3.31Å; F1911-L2308 WeakPolarHBondContact CZ-O 3.49Å; F1911-G2309 VanDerWaalsContact CE2-CA 3.43Å
1912	Y	42.8	Very low	48.2	Very low	176.4 Å²	176.4	107.8 Å²	107.8	69%	0.692	54%	0.544	S	S	*	.			trans	-82.5	78.2	167.7	-91.3	-80.2	0	0	0	111.2	A1910 D1914 K2261	A1910-Y1912 HydrophobicContact CB-CE2 4.5Å; A1910-Y1912 WeakPolarHBondContact O-CD2 3.27Å; A1910-Y1912 PolarHBondContact O-N 3.32Å; A1910-Y1912 VanDerWaalsContact O-N 3.15Å; Y1912-D1914 PolarHBondContact O-N 3.18Å; Y1912-K2261 HydrophobicContact CD2-CD 3.81Å; Y1912-K2261 HydrophobicContact CE1-CD 4.42Å; Y1912-K2261 HydrophobicContact CE2-CD 3.66Å; Y1912-K2261 HydrophobicContact CG-CD 4.27Å
1913	N	37.1	Very low	46.4	Very low	119.6 Å²	119.6	111.4 Å²	111.4	64%	0.64	56%	0.561	S	S	*	*			trans	-95.8	72.4	172.9	-115.1	-3.8	0	0	0	111.6	F1911 N1915	F1911-N1913 PolarHBondContact O-N 3.09Å; F1911-N1913 VanDerWaalsContact O-N 3.12Å; N1913-N1915 PolarHBondContact O-N 3.26Å
1914	D	35.5	Very low	44.8	Very low	121.8 Å²	121.8	115.7 Å²	115.7	65%	0.651	58%	0.581	S	S	*	*			trans	-98.6	65.2	-177.9	-141.1	4	0	0	0	112.9	Y1912 M1916 R1918	Y1912-D1914 PolarHBondContact O-N 3.18Å; D1914-M1916 PolarHBondContact O-N 3.26Å; D1914-R1918 IonicContact OD1-CZ 3.31Å; D1914-R1918 IonicContact OD1-NE 2.69Å; D1914-R1918 PolarHBondContact OD1-NE 2.89Å; D1914-R1918 IonicContact OD1-NH2 3.55Å; D1914-R1918 PolarHBondContact OD1-NH2 3.12Å; D1914-R1918 IonicContact OD2-CZ 3.32Å; D1914-R1918 IonicContact OD2-NE 2.73Å; D1914-R1918 PolarHBondContact OD2-NE 3.48Å; D1914-R1918 IonicContact OD2-NH2 3.83Å; D1914-R1918 PolarHBondContact OD2-NH2 3.17Å
1915	N	34.1	Very low	43	Very low	137.6 Å²	137.6	119.1 Å²	119.1	74%	0.736	59%	0.592	S	S	*	*			trans	-112.5	60.9	175	-86.5	-54.5	0	0	0	112.3	N1913 R1917 R1918	N1913-N1915 PolarHBondContact O-N 3.26Å; N1915-R1917 PolarHBondContact O-N 2.98Å; N1915-R1918 PolarHBondContact O-N 3.46Å; N1915-R1918 VanDerWaalsContact OD1-CZ 3.24Å; N1915-R1918 PolarHBondContact OD1-NE 3.34Å; N1915-R1918 PolarHBondContact OD1-NH2 2.71Å
1916	M	33.2	Very low	41.5	Very low	174.2 Å²	174.2	120 Å²	120	86%	0.858	60%	0.603	S	S	*	*	S	Bend	trans	-160.3	0.5	167.9	-95.7	-102.5	-175.1	0	0	118.3	D1914	D1914-M1916 PolarHBondContact O-N 3.26Å
1917	R	32.8	Very low	40.1	Very low	225 Å²	225	123.3 Å²	123.3	85%	0.849	62%	0.62	S	S	*	*	S	Bend	trans	-120.5	17.6	176.1	-83.2	-172.7	179.7	-173.9	1.2	117.8	N1915 R1919 S1920	N1915-R1917 PolarHBondContact O-N 2.98Å; R1917-R1919 PolarHBondContact O-N 2.85Å; R1917-R1919 VanDerWaalsContact O-N 3.13Å; R1917-S1920 PolarHBondContact O-N 3.22Å
1918	R	33.1	Very low	39.2	Very low	190.4 Å²	190.4	125.4 Å²	125.4	72%	0.718	62%	0.621	S	S	*	*			trans	-109.6	38.5	165.7	-82.3	-171.8	-143.9	-162.9	3.4	113.8	D1914 N1915 S1920 V1921	D1914-R1918 IonicContact OD1-CZ 3.31Å; D1914-R1918 IonicContact OD1-NE 2.69Å; D1914-R1918 PolarHBondContact OD1-NE 2.89Å; D1914-R1918 IonicContact OD1-NH2 3.55Å; D1914-R1918 PolarHBondContact OD1-NH2 3.12Å; D1914-R1918 IonicContact OD2-CZ 3.32Å; D1914-R1918 IonicContact OD2-NE 2.73Å; D1914-R1918 PolarHBondContact OD2-NE 3.48Å; D1914-R1918 IonicContact OD2-NH2 3.83Å; D1914-R1918 PolarHBondContact OD2-NH2 3.17Å; N1915-R1918 PolarHBondContact O-N 3.46Å; N1915-R1918 VanDerWaalsContact OD1-CZ 3.24Å; N1915-R1918 PolarHBondContact OD1-NE 3.34Å; N1915-R1918 PolarHBondContact OD1-NH2 2.71Å; R1918-S1920 VanDerWaalsContact C-N 3.29Å; R1918-S1920 PolarHBondContact O-N 3Å; R1918-V1921 PolarHBondContact O-N 3.49Å
1919	R	32.3	Very low	38.2	Very low	235.6 Å²	235.6	126.4 Å²	126.4	89%	0.889	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	27.8	174.2	-84	179.2	175.9	165.3	-1	114	R1917	R1917-R1919 PolarHBondContact O-N 2.85Å; R1917-R1919 VanDerWaalsContact O-N 3.13Å
1920	S	33.5	Very low	37.5	Very low	82.6 Å²	82.6	130.8 Å²	130.8	58%	0.578	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123	-14.8	176.6	64.9	0	0	0	0	115.5	R1917 R1918 C1922 Q1923 N1924	R1917-S1920 PolarHBondContact O-N 3.22Å; R1918-S1920 VanDerWaalsContact C-N 3.29Å; R1918-S1920 PolarHBondContact O-N 3Å; S1920-C1922 PolarHBondContact O-N 3.03Å; S1920-Q1923 PolarHBondContact O-N 2.9Å; S1920-N1924 PolarHBondContact O-OD1 2.94Å
1921	V	33.5	Very low	37	Very low	93.6 Å²	93.6	133.1 Å²	133.1	57%	0.567	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-16	-172.8	-171.5	0	0	0	0	113.9	R1918 Q1923 N1924 H1925	R1918-V1921 PolarHBondContact O-N 3.49Å; V1921-Q1923 VanDerWaalsContact C-N 3.32Å; V1921-Q1923 PolarHBondContact O-N 3.15Å; V1921-Q1923 VanDerWaalsContact O-N 3.11Å; V1921-N1924 PolarHBondContact O-N 3.15Å; V1921-N1924 VanDerWaalsContact O-N 3.13Å; V1921-H1925 PolarHBondContact O-N 2.82Å
1922	C	31.5	Very low	36.7	Very low	108.8 Å²	108.8	133.3 Å²	133.3	74%	0.735	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	10.3	174.8	-68.3	0	0	0	0	114.5	S1920 N1924 S1926	S1920-C1922 PolarHBondContact O-N 3.03Å; C1922-N1924 VanDerWaalsContact C-N 3.35Å; C1922-S1926 PolarHBondContact O-OG 3.45Å
1923	Q	36.6	Very low	36.5	Very low	148.2 Å²	148.2	130.7 Å²	130.7	69%	0.693	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	-16.3	176.6	-88.9	-179.3	-32	0	0	113.5	S1920 V1921 S1926	S1920-Q1923 PolarHBondContact O-N 2.9Å; V1921-Q1923 VanDerWaalsContact C-N 3.32Å; V1921-Q1923 PolarHBondContact O-N 3.15Å; V1921-Q1923 VanDerWaalsContact O-N 3.11Å; Q1923-S1926 PolarHBondContact O-OG 3.3Å; Q1923-S1926 VanDerWaalsContact O-OG 3.1Å
1924	N	35.9	Very low	36.8	Very low	105 Å²	105	130.7 Å²	130.7	56%	0.561	64%	0.642	S	S	*	*	H	α-helix	trans	-93.4	-23.5	-172.4	-68.7	9.3	0	0	0	113.9	S1920 V1921 C1922 S1926 Q1927 Q1928	S1920-N1924 PolarHBondContact O-OD1 2.94Å; V1921-N1924 PolarHBondContact O-N 3.15Å; V1921-N1924 VanDerWaalsContact O-N 3.13Å; C1922-N1924 VanDerWaalsContact C-N 3.35Å; N1924-S1926 VanDerWaalsContact C-N 3.27Å; N1924-S1926 PolarHBondContact O-N 3.31Å; N1924-Q1927 PolarHBondContact O-N 2.88Å; N1924-Q1928 WeakPolarHBondContact O-CG 3.48Å; N1924-Q1928 PolarHBondContact O-N 3.14Å; N1924-Q1928 PolarHBondContact O-OE1 3.02Å
1925	H	35.8	Very low	37.1	Very low	135.8 Å²	135.8	132.3 Å²	132.3	63%	0.629	65%	0.645	S	S	*	*	H	α-helix	trans	-89.3	-16.4	-178	-78.7	-13.7	0	0	0	114.5	V1921 Q1927 Q1928 L1929	V1921-H1925 PolarHBondContact O-N 2.82Å; H1925-Q1927 VanDerWaalsContact C-N 3.33Å; H1925-Q1928 PolarHBondContact CE1-OE1 3.17Å; H1925-Q1928 PolarHBondContact ND1-OE1 3.04Å; H1925-L1929 VanDerWaalsContact O-CB 3.31Å; H1925-L1929 WeakPolarHBondContact O-CB 3.32Å; H1925-L1929 PolarHBondContact O-N 2.97Å; H1925-L1929 VanDerWaalsContact O-N 3.13Å
1926	S	37.8	Very low	37.2	Very low	78.2 Å²	78.2	129.3 Å²	129.3	55%	0.547	64%	0.639	S	S	.	*	H	α-helix	trans	-78.7	-30.2	174.3	64.1	0	0	0	0	112.4	C1922 Q1923 N1924 L1929 E1930	C1922-S1926 PolarHBondContact O-OG 3.45Å; Q1923-S1926 PolarHBondContact O-OG 3.3Å; Q1923-S1926 VanDerWaalsContact O-OG 3.1Å; N1924-S1926 VanDerWaalsContact C-N 3.27Å; N1924-S1926 PolarHBondContact O-N 3.31Å; S1926-L1929 PolarHBondContact O-N 3.41Å; S1926-E1930 VanDerWaalsContact O-CB 3.31Å; S1926-E1930 WeakPolarHBondContact O-CB 3.43Å; S1926-E1930 PolarHBondContact O-N 2.95Å
1927	Q	40.9	Very low	37.1	Very low	122 Å²	122	123.7 Å²	123.7	57%	0.57	63%	0.626	S	S	*	*	H	α-helix	trans	-79.8	-39.4	177.2	-72.7	175.8	-32.8	0	0	112	N1924 H1925 L1929 E1930 D1931	N1924-Q1927 PolarHBondContact O-N 2.88Å; H1925-Q1927 VanDerWaalsContact C-N 3.33Å; Q1927-L1929 VanDerWaalsContact C-N 3.32Å; Q1927-L1929 PolarHBondContact O-N 3.15Å; Q1927-E1930 WeakPolarHBondContact O-CB 3.08Å; Q1927-E1930 PolarHBondContact O-N 3.19Å; Q1927-E1930 VanDerWaalsContact O-N 3.13Å; Q1927-D1931 WeakPolarHBondContact O-CB 3.31Å; Q1927-D1931 VanDerWaalsContact O-CG 3.23Å; Q1927-D1931 PolarHBondContact O-N 3.12Å
1928	Q	40.9	Very low	37.1	Very low	119.6 Å²	119.6	118.3 Å²	118.3	56%	0.559	62%	0.617	S	S	*	*	H	α-helix	trans	-63.1	-29.5	176.3	-76.8	-177.8	-38.4	0	0	113.8	N1924 H1925 L1932	N1924-Q1928 WeakPolarHBondContact O-CG 3.48Å; N1924-Q1928 PolarHBondContact O-N 3.14Å; N1924-Q1928 PolarHBondContact O-OE1 3.02Å; H1925-Q1928 PolarHBondContact CE1-OE1 3.17Å; H1925-Q1928 PolarHBondContact ND1-OE1 3.04Å; Q1928-L1932 VanDerWaalsContact O-CB 3.24Å; Q1928-L1932 WeakPolarHBondContact O-CB 3.24Å; Q1928-L1932 VanDerWaalsContact O-CD1 3.32Å; Q1928-L1932 WeakPolarHBondContact O-CD1 3.5Å; Q1928-L1932 VanDerWaalsContact O-CG 3.25Å; Q1928-L1932 WeakPolarHBondContact O-CG 3.34Å; Q1928-L1932 PolarHBondContact O-N 3.2Å; Q1928-L1932 VanDerWaalsContact O-N 3.15Å
1929	L	37.4	Very low	36.9	Very low	113.8 Å²	113.8	117.2 Å²	117.2	60%	0.596	62%	0.621	S	S	*	*	H	α-helix	trans	-77.5	-36.9	175.7	-143.6	96.7	0	0	0	112.2	H1925 S1926 Q1927 D1931 L1932 L1933	H1925-L1929 VanDerWaalsContact O-CB 3.31Å; H1925-L1929 WeakPolarHBondContact O-CB 3.32Å; H1925-L1929 PolarHBondContact O-N 2.97Å; H1925-L1929 VanDerWaalsContact O-N 3.13Å; S1926-L1929 PolarHBondContact O-N 3.41Å; Q1927-L1929 VanDerWaalsContact C-N 3.32Å; Q1927-L1929 PolarHBondContact O-N 3.15Å; L1929-D1931 VanDerWaalsContact C-N 3.32Å; L1929-D1931 PolarHBondContact O-N 3.04Å; L1929-L1932 PolarHBondContact O-N 3.13Å; L1929-L1933 HydrophobicContact CD2-CD1 4.43Å; L1929-L1933 HydrophobicContact CG-CD1 4.25Å; L1929-L1933 VanDerWaalsContact O-CB 3.28Å; L1929-L1933 WeakPolarHBondContact O-CB 3.33Å; L1929-L1933 WeakPolarHBondContact O-CD1 3.3Å; L1929-L1933 VanDerWaalsContact O-CG 3.28Å; L1929-L1933 WeakPolarHBondContact O-CG 3.39Å; L1929-L1933 PolarHBondContact O-N 3.28Å; L1929-L1933 VanDerWaalsContact O-N 3.12Å
1930	E	40.6	Very low	36.8	Very low	111.8 Å²	111.8	114.3 Å²	114.3	52%	0.522	62%	0.617	S	S	.	*	H	α-helix	trans	-68	-36	175.7	-119.1	-172.2	147	0	0	112.2	S1926 Q1927 L1933 K1934	S1926-E1930 VanDerWaalsContact O-CB 3.31Å; S1926-E1930 WeakPolarHBondContact O-CB 3.43Å; S1926-E1930 PolarHBondContact O-N 2.95Å; Q1927-E1930 WeakPolarHBondContact O-CB 3.08Å; Q1927-E1930 PolarHBondContact O-N 3.19Å; Q1927-E1930 VanDerWaalsContact O-N 3.13Å; E1930-L1933 PolarHBondContact O-N 3.26Å; E1930-K1934 WeakPolarHBondContact O-CB 3.45Å; E1930-K1934 VanDerWaalsContact O-CD 3.25Å; E1930-K1934 WeakPolarHBondContact O-CD 3.28Å; E1930-K1934 WeakPolarHBondContact O-CE 3.36Å; E1930-K1934 VanDerWaalsContact O-CG 3.29Å; E1930-K1934 WeakPolarHBondContact O-CG 3.3Å; E1930-K1934 PolarHBondContact O-N 3.03Å; E1930-K1934 VanDerWaalsContact O-N 3.14Å; E1930-K1934 WeakPolarHBondContact OE1-CE 3.49Å; E1930-K1934 IonicContact OE1-NZ 2.9Å; E1930-K1934 PolarHBondContact OE1-NZ 3.08Å; E1930-K1934 IonicContact OE2-NZ 3.6Å
1931	D	44.8	Very low	36.5	Very low	89 Å²	89	115.9 Å²	115.9	48%	0.476	62%	0.623	S	S	.	*	H	α-helix	trans	-74.6	-40.8	177	-68.3	-25.5	0	0	0	111.6	Q1927 L1929 L1933 K1934 E1935	Q1927-D1931 WeakPolarHBondContact O-CB 3.31Å; Q1927-D1931 VanDerWaalsContact O-CG 3.23Å; Q1927-D1931 PolarHBondContact O-N 3.12Å; L1929-D1931 VanDerWaalsContact C-N 3.32Å; L1929-D1931 PolarHBondContact O-N 3.04Å; D1931-L1933 VanDerWaalsContact C-N 3.29Å; D1931-L1933 PolarHBondContact O-N 3.02Å; D1931-K1934 WeakPolarHBondContact O-CA 3.41Å; D1931-K1934 WeakPolarHBondContact O-CB 3.34Å; D1931-K1934 PolarHBondContact O-N 3.14Å; D1931-K1934 IonicContact OD1-NZ 3.02Å; D1931-K1934 PolarHBondContact OD1-NZ 3.12Å; D1931-E1935 WeakPolarHBondContact O-CG 3.44Å; D1931-E1935 PolarHBondContact O-N 3.26Å
1932	L	40.7	Very low	36.3	Very low	111 Å²	111	121.5 Å²	121.5	58%	0.581	63%	0.634	S	S	*	*	H	α-helix	trans	-62.4	-34.9	172.3	-87.9	166.1	0	0	0	112.8	Q1928 L1929 K1934 E1935 A1936	Q1928-L1932 VanDerWaalsContact O-CB 3.24Å; Q1928-L1932 WeakPolarHBondContact O-CB 3.24Å; Q1928-L1932 VanDerWaalsContact O-CD1 3.32Å; Q1928-L1932 WeakPolarHBondContact O-CD1 3.5Å; Q1928-L1932 VanDerWaalsContact O-CG 3.25Å; Q1928-L1932 WeakPolarHBondContact O-CG 3.34Å; Q1928-L1932 PolarHBondContact O-N 3.2Å; Q1928-L1932 VanDerWaalsContact O-N 3.15Å; L1929-L1932 PolarHBondContact O-N 3.13Å; L1932-K1934 VanDerWaalsContact C-N 3.33Å; L1932-E1935 PolarHBondContact O-N 2.98Å; L1932-A1936 WeakPolarHBondContact O-CB 3.38Å; L1932-A1936 PolarHBondContact O-N 3.15Å
1933	L	39	Very low	36.1	Very low	120.6 Å²	120.6	122.7 Å²	122.7	63%	0.631	63%	0.633	S	S	*	*	H	α-helix	trans	-74.5	-22.6	174.7	-74.2	167.5	0	0	0	112.8	L1929 E1930 D1931 G1937	L1929-L1933 HydrophobicContact CD2-CD1 4.43Å; L1929-L1933 HydrophobicContact CG-CD1 4.25Å; L1929-L1933 VanDerWaalsContact O-CB 3.28Å; L1929-L1933 WeakPolarHBondContact O-CB 3.33Å; L1929-L1933 WeakPolarHBondContact O-CD1 3.3Å; L1929-L1933 VanDerWaalsContact O-CG 3.28Å; L1929-L1933 WeakPolarHBondContact O-CG 3.39Å; L1929-L1933 PolarHBondContact O-N 3.28Å; L1929-L1933 VanDerWaalsContact O-N 3.12Å; E1930-L1933 PolarHBondContact O-N 3.26Å; D1931-L1933 VanDerWaalsContact C-N 3.29Å; D1931-L1933 PolarHBondContact O-N 3.02Å; L1933-G1937 PolarHBondContact O-N 3.33Å
1934	K	43.5	Very low	35.7	Very low	120.8 Å²	120.8	125.1 Å²	125.1	53%	0.525	64%	0.642	S	S	.	*	H	α-helix	trans	-81	-37.4	172	-74.4	166.7	-167.6	159	0	112.1	E1930 D1931 L1932 A1936 G1937 V1938	E1930-K1934 WeakPolarHBondContact O-CB 3.45Å; E1930-K1934 VanDerWaalsContact O-CD 3.25Å; E1930-K1934 WeakPolarHBondContact O-CD 3.28Å; E1930-K1934 WeakPolarHBondContact O-CE 3.36Å; E1930-K1934 VanDerWaalsContact O-CG 3.29Å; E1930-K1934 WeakPolarHBondContact O-CG 3.3Å; E1930-K1934 PolarHBondContact O-N 3.03Å; E1930-K1934 VanDerWaalsContact O-N 3.14Å; E1930-K1934 WeakPolarHBondContact OE1-CE 3.49Å; E1930-K1934 IonicContact OE1-NZ 2.9Å; E1930-K1934 PolarHBondContact OE1-NZ 3.08Å; E1930-K1934 IonicContact OE2-NZ 3.6Å; D1931-K1934 WeakPolarHBondContact O-CA 3.41Å; D1931-K1934 WeakPolarHBondContact O-CB 3.34Å; D1931-K1934 PolarHBondContact O-N 3.14Å; D1931-K1934 IonicContact OD1-NZ 3.02Å; D1931-K1934 PolarHBondContact OD1-NZ 3.12Å; L1932-K1934 VanDerWaalsContact C-N 3.33Å; K1934-A1936 VanDerWaalsContact C-N 3.28Å; K1934-A1936 PolarHBondContact O-N 3.18Å; K1934-G1937 PolarHBondContact O-N 3.22Å; K1934-G1937 VanDerWaalsContact O-N 3.14Å; K1934-V1938 WeakPolarHBondContact O-CG2 3.47Å; K1934-V1938 PolarHBondContact O-N 2.9Å
1935	E	41.4	Very low	35.2	Very low	155.6 Å²	155.6	124.8 Å²	124.8	73%	0.727	65%	0.648	S	S	*	*	H	α-helix	trans	-70.8	-33.3	175.5	-76.1	-169.7	140	0	0	112.7	D1931 L1932 G1937 V1938 Q1939	D1931-E1935 WeakPolarHBondContact O-CG 3.44Å; D1931-E1935 PolarHBondContact O-N 3.26Å; L1932-E1935 PolarHBondContact O-N 2.98Å; E1935-G1937 PolarHBondContact O-N 3.08Å; E1935-V1938 PolarHBondContact O-N 2.94Å; E1935-Q1939 PolarHBondContact O-N 2.84Å
1936	A	36.3	Very low	34.9	Very low	74.6 Å²	74.6	126 Å²	126	62%	0.617	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-1.9	176.1	0	0	0	0	0	113.8	L1932 K1934 V1938 H1940	L1932-A1936 WeakPolarHBondContact O-CB 3.38Å; L1932-A1936 PolarHBondContact O-N 3.15Å; K1934-A1936 VanDerWaalsContact C-N 3.28Å; K1934-A1936 PolarHBondContact O-N 3.18Å; A1936-V1938 VanDerWaalsContact C-N 3.29Å; A1936-V1938 PolarHBondContact O-N 3.17Å; A1936-H1940 PolarHBondContact O-N 2.83Å
1937	G	30.5	Very low	34.4	Very low	54.8 Å²	54.8	128.9 Å²	128.9	57%	0.565	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	10.1	179.1	0	0	0	0	0	116.9	L1933 K1934 E1935 Q1939 T1941	L1933-G1937 PolarHBondContact O-N 3.33Å; K1934-G1937 PolarHBondContact O-N 3.22Å; K1934-G1937 VanDerWaalsContact O-N 3.14Å; E1935-G1937 PolarHBondContact O-N 3.08Å; G1937-Q1939 PolarHBondContact O-N 3.36Å; G1937-T1941 WeakPolarHBondContact O-CG2 3.4Å; G1937-T1941 PolarHBondContact O-OG1 3.14Å
1938	V	32.7	Very low	34	Very low	111.8 Å²	111.8	128.4 Å²	128.4	68%	0.678	67%	0.674	S	S	*	*			trans	-108	44.6	-179.5	-176.3	0	0	0	0	112.4	K1934 E1935 A1936 H1940 T1941	K1934-V1938 WeakPolarHBondContact O-CG2 3.47Å; K1934-V1938 PolarHBondContact O-N 2.9Å; E1935-V1938 PolarHBondContact O-N 2.94Å; A1936-V1938 VanDerWaalsContact C-N 3.29Å; A1936-V1938 PolarHBondContact O-N 3.17Å; V1938-H1940 PolarHBondContact O-N 2.96Å; V1938-T1941 PolarHBondContact O-OG1 3.12Å
1939	Q	29.9	Very low	33.4	Very low	168 Å²	168	131.4 Å²	131.4	79%	0.785	69%	0.688	S	S	*	*			trans	-131.1	84.3	164.7	-85	172.4	24.5	0	0	112.2	E1935 G1937 T1941	E1935-Q1939 PolarHBondContact O-N 2.84Å; G1937-Q1939 PolarHBondContact O-N 3.36Å; Q1939-T1941 PolarHBondContact O-N 2.98Å
1940	H	29.3	Very low	33.1	Very low	174 Å²	174	131.5 Å²	131.5	81%	0.806	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-179.8	60.4	172.9	-79.5	-69.1	0	0	0	115	A1936 V1938	A1936-H1940 PolarHBondContact O-N 2.83Å; V1938-H1940 PolarHBondContact O-N 2.96Å
1941	T	27.8	Very low	32.6	Very low	116.6 Å²	116.6	132.3 Å²	132.3	72%	0.715	71%	0.71	S	S	*	*			trans	-144.6	83.4	154.1	48.5	0	0	0	0	112.7	G1937 V1938 Q1939	G1937-T1941 WeakPolarHBondContact O-CG2 3.4Å; G1937-T1941 PolarHBondContact O-OG1 3.14Å; V1938-T1941 PolarHBondContact O-OG1 3.12Å; Q1939-T1941 PolarHBondContact O-N 2.98Å
1942	R	28.1	Very low	31.9	Very low	212.4 Å²	212.4	134.4 Å²	134.4	80%	0.802	72%	0.721	S	S	*	*			trans	-114.9	116.7	170.4	-79.9	-179.5	178.1	144.2	0.2	112.7	F1944	R1942-F1944 VanDerWaalsContact C-N 3.32Å; R1942-F1944 PolarHBondContact O-N 3.14Å
1943	D	27.5	Very low	31.3	Very low	134 Å²	134	137 Å²	137	72%	0.717	73%	0.728	S	S	*	*			trans	-131.1	86.4	134.9	-77.5	-26.2	0	0	0	112.7
1944	F	28.5	Very low	30.9	Very low	198.6 Å²	198.6	138.2 Å²	138.2	87%	0.871	74%	0.735	S	S	*	*			trans	-137.2	90.1	157.9	-78.4	-73.3	0	0	0	112.9	R1942 I1946	R1942-F1944 VanDerWaalsContact C-N 3.32Å; R1942-F1944 PolarHBondContact O-N 3.14Å; F1944-I1946 PolarHBondContact O-N 2.83Å
1945	S	25.1	Very low	30.1	Very low	98.6 Å²	98.6	137.5 Å²	137.5	69%	0.69	75%	0.746	S	S	*	*			trans	-105.4	116.3	163.1	134.1	0	0	0	0	111.8	N1947	S1945-N1947 PolarHBondContact O-N 2.93Å
1946	I	29.5	Very low	29.4	Very low	159.2 Å²	159.2	136.1 Å²	136.1	82%	0.816	75%	0.747	S	S	*	*			trans	-134	124	156.6	-68.1	169.8	0	0	0	109.1	F1944 P1948	F1944-I1946 PolarHBondContact O-N 2.83Å; I1946-P1948 WeakPolarHBondContact O-CD 3.49Å
1947	N	27.6	Very low	28.9	Very low	140.4 Å²	140.4	140.3 Å²	140.3	75%	0.751	75%	0.754	S	S	*	*			trans	-87	151.1	-175.4	-100.9	-11.6	0	0	0	110.7	S1945 E1949	S1945-N1947 PolarHBondContact O-N 2.93Å; N1947-E1949 VanDerWaalsContact C-N 3.27Å; N1947-E1949 PolarHBondContact O-N 3.12Å; N1947-E1949 VanDerWaalsContact O-N 3.09Å
1948	P	31.9	Very low	28.7	Very low	111.4 Å²	111.4	148.4 Å²	148.4	72%	0.723	77%	0.77	S	S	*	*			trans	-98.9	152.1	174.6	25.1	-13.4	0	0	0	113.9	I1946	I1946-P1948 WeakPolarHBondContact O-CD 3.49Å
1949	E	29.3	Very low	28.4	Very low	181.6 Å²	181.6	151.1 Å²	151.1	85%	0.849	77%	0.774	S	S	*	*			trans	178.8	90.3	168.2	-78.8	-172.1	172	0	0	116.2	N1947	N1947-E1949 VanDerWaalsContact C-N 3.27Å; N1947-E1949 PolarHBondContact O-N 3.12Å; N1947-E1949 VanDerWaalsContact O-N 3.09Å
1950	S	31.1	Very low	28.2	Very low	117.4 Å²	117.4	150.9 Å²	150.9	82%	0.821	78%	0.778	S	S	*	*			trans	153.6	124.1	146.9	59.1	0	0	0	0	113.3	D1952	S1950-D1952 PolarHBondContact O-N 2.92Å
1951	V	30	Very low	28.2	Very low	127.6 Å²	127.6	148.4 Å²	148.4	77%	0.773	78%	0.777	S	S	*	*			trans	-114	122.2	145.5	174.9	0	0	0	0	107.5
1952	D	29.9	Very low	28.1	Very low	132.4 Å²	132.4	154 Å²	154	71%	0.708	79%	0.785	S	S	*	*			trans	-134.2	144.4	131	-108.9	-21	0	0	0	114.6	S1950 N1954	S1950-D1952 PolarHBondContact O-N 2.92Å; D1952-N1954 PolarHBondContact O-N 2.79Å
1953	K	29.4	Very low	28.2	Very low	165.6 Å²	165.6	150.8 Å²	150.8	72%	0.72	78%	0.784	S	S	*	*			trans	-46.2	134.5	156.9	-76.1	162.2	-171.3	138.1	0	113.9
1954	N	29.2	Very low	28.2	Very low	146.8 Å²	146.8	151.6 Å²	151.6	79%	0.785	79%	0.788	S	S	*	*				172	133.4	116.3	-94.5	-10.9	0	0	0	112.6	D1952	D1952-N1954 PolarHBondContact O-N 2.79Å
1955	S	26.4	Very low	28.3	Very low	106 Å²	106	148.4 Å²	148.4	74%	0.741	79%	0.785	S	S	*	*			trans	54.3	124.6	146.5	61.1	0	0	0	0	115.9
1956	V	27.6	Very low	28.4	Very low	125.6 Å²	125.6	151.2 Å²	151.2	76%	0.761	79%	0.792	S	S	*	*			trans	-129.3	120.8	138.5	180	0	0	0	0	110.8	Y1958	V1956-Y1958 HydrophobicContact CG1-CD2 4.35Å; V1956-Y1958 HydrophobicContact CG1-CE2 4.33Å
1957	Q	24.6	Very low	28.3	Very low	162.6 Å²	162.6	152.2 Å²	152.2	76%	0.76	80%	0.795	S	S	*	*			trans	-99.8	142.9	157.3	-88.4	164.9	-60.4	0	0	110.5	E1959	Q1957-E1959 HydrophobicContact CB-CG 4.39Å; Q1957-E1959 PolarHBondContact NE2-OE1 3.07Å; Q1957-E1959 PolarHBondContact O-N 2.69Å; Q1957-E1959 VanDerWaalsContact O-N 3.1Å
1958	Y	26.9	Very low	28.3	Very low	226.6 Å²	226.6	152.7 Å²	152.7	89%	0.889	80%	0.798	S	S	*	*			trans	-105.2	116.8	161.1	-82.7	-84.6	0	0	0	109.8	V1956 L1960	V1956-Y1958 HydrophobicContact CG1-CD2 4.35Å; V1956-Y1958 HydrophobicContact CG1-CE2 4.33Å; Y1958-L1960 PolarHBondContact O-N 2.83Å
1959	E	25.9	Very low	28.1	Very low	167.4 Å²	167.4	152.8 Å²	152.8	78%	0.782	80%	0.801	S	S	*	*			trans	-103.8	130.8	172.7	-69.8	-173.4	153.2	0	0	110.5	Q1957 P1961	Q1957-E1959 HydrophobicContact CB-CG 4.39Å; Q1957-E1959 PolarHBondContact NE2-OE1 3.07Å; Q1957-E1959 PolarHBondContact O-N 2.69Å; Q1957-E1959 VanDerWaalsContact O-N 3.1Å; E1959-P1961 VanDerWaalsContact O-CD 3.3Å; E1959-P1961 WeakPolarHBondContact O-CD 3.38Å
1960	L	25.6	Very low	28	Very low	164.8 Å²	164.8	149.8 Å²	149.8	86%	0.863	80%	0.795	S	S	*	*			trans	-83.4	125.5	170.9	-83.1	153.3	0	0	0	109.8	Y1958 R1962	Y1958-L1960 PolarHBondContact O-N 2.83Å; L1960-R1962 PolarHBondContact O-N 3.24Å
1961	P	29.8	Very low	27.8	Very low	121.8 Å²	121.8	152.8 Å²	152.8	79%	0.791	80%	0.799	S	S	*	*			trans	-78.4	126.8	172.3	-0.5	14.2	0	0	0	110.8	E1959 D1963	E1959-P1961 VanDerWaalsContact O-CD 3.3Å; E1959-P1961 WeakPolarHBondContact O-CD 3.38Å; P1961-D1963 PolarHBondContact O-N 3.01Å
1962	R	26.9	Very low	27.7	Very low	232.2 Å²	232.2	153.7 Å²	153.7	88%	0.876	80%	0.799	S	S	*	*			trans	-83.7	126.1	159.5	-72.6	178.3	176.2	167.4	-0.8	108.2	L1960 N1964	L1960-R1962 PolarHBondContact O-N 3.24Å; R1962-N1964 VanDerWaalsContact C-N 3.31Å; R1962-N1964 PolarHBondContact O-N 2.59Å
1963	D	28.7	Very low	27.6	Very low	147 Å²	147	156.3 Å²	156.3	79%	0.786	81%	0.807	S	S	*	*			trans	-146.8	133.4	140.2	-106.3	-26.9	0	0	0	111.4	P1961 T1965	P1961-D1963 PolarHBondContact O-N 3.01Å; D1963-T1965 PolarHBondContact O-N 3.38Å
1964	N	28.2	Very low	27.5	Very low	149.6 Å²	149.6	153.4 Å²	153.4	80%	0.8	81%	0.808	S	S	*	*			trans	-100.4	99.9	170.1	-77.9	-41.5	0	0	0	112.7	R1962 L1966	R1962-N1964 VanDerWaalsContact C-N 3.31Å; R1962-N1964 PolarHBondContact O-N 2.59Å; N1964-L1966 VanDerWaalsContact C-N 3.33Å; N1964-L1966 PolarHBondContact O-N 2.9Å; N1964-L1966 VanDerWaalsContact O-N 3.16Å
1965	T	30.9	Very low	27.5	Very low	132 Å²	132	152.7 Å²	152.7	81%	0.81	81%	0.809	S	S	*	*			trans	-122.9	108.7	157.9	30.7	0	0	0	0	110.6	D1963 M1967	D1963-T1965 PolarHBondContact O-N 3.38Å; T1965-M1967 VanDerWaalsContact C-N 3.26Å; T1965-M1967 PolarHBondContact O-N 3.34Å; T1965-M1967 VanDerWaalsContact O-N 3.13Å
1966	L	26.9	Very low	27.6	Very low	156.4 Å²	156.4	154.8 Å²	154.8	82%	0.819	81%	0.811	S	S	*	*			trans	-74.2	118.5	167.5	-102.5	78.1	0	0	0	110.5	N1964 N1968	N1964-L1966 VanDerWaalsContact C-N 3.33Å; N1964-L1966 PolarHBondContact O-N 2.9Å; N1964-L1966 VanDerWaalsContact O-N 3.16Å; L1966-N1968 PolarHBondContact O-N 3.33Å; L1966-N1968 VanDerWaalsContact O-N 3.13Å
1967	M	27.3	Very low	27.5	Very low	181.6 Å²	181.6	154 Å²	154	90%	0.895	81%	0.812	S	S	*	*			trans	-117.5	122	148.5	-131.1	166.2	151.1	0	0	111.3	T1965 S1969	T1965-M1967 VanDerWaalsContact C-N 3.26Å; T1965-M1967 PolarHBondContact O-N 3.34Å; T1965-M1967 VanDerWaalsContact O-N 3.13Å; M1967-S1969 PolarHBondContact O-N 3.23Å
1968	N	27.6	Very low	27.8	Very low	150.4 Å²	150.4	151.4 Å²	151.4	80%	0.804	81%	0.811	S	S	*	*			trans	-107.3	127.8	165.9	-78.8	-28.6	0	0	0	110.2	L1966 T1970	L1966-N1968 PolarHBondContact O-N 3.33Å; L1966-N1968 VanDerWaalsContact O-N 3.13Å; N1968-T1970 PolarHBondContact O-N 3.13Å
1969	S	27.7	Very low	27.8	Very low	112.6 Å²	112.6	149.6 Å²	149.6	79%	0.787	81%	0.811	S	S	*	*			trans	-126.5	115	164.7	57.6	0	0	0	0	110.8	M1967	M1967-S1969 PolarHBondContact O-N 3.23Å
1970	T	27.2	Very low	27.9	Very low	119.6 Å²	119.6	147.4 Å²	147.4	73%	0.734	81%	0.809	S	S	*	*			trans	-74.1	127.1	164.6	43.7	0	0	0	0	112.3	N1968 N1972	N1968-T1970 PolarHBondContact O-N 3.13Å; T1970-N1972 PolarHBondContact O-N 3.09Å; T1970-N1972 VanDerWaalsContact O-N 3.12Å
1971	M	26.6	Very low	28	Very low	181.2 Å²	181.2	147 Å²	147	89%	0.893	81%	0.806	S	S	*	*			trans	-103.1	136.8	147.9	-76.9	-67.6	136.8	0	0	110.4
1972	N	28.3	Very low	27.8	Very low	144.8 Å²	144.8	147.9 Å²	147.9	77%	0.774	80%	0.804	S	S	*	*			trans	-120.8	138.9	174.4	-80.8	-12.7	0	0	0	111.1	T1970 S1974	T1970-N1972 PolarHBondContact O-N 3.09Å; T1970-N1972 VanDerWaalsContact O-N 3.12Å; N1972-S1974 PolarHBondContact O-N 3.29Å
1973	E	27.5	Very low	27.8	Very low	187 Å²	187	142 Å²	142	87%	0.874	80%	0.796	S	S	*	*			trans	-61.3	132.9	160.1	-71.5	174.7	156.2	0	0	112.9
1974	S	28.3	Very low	27.7	Very low	105.6 Å²	105.6	140.6 Å²	140.6	74%	0.738	79%	0.792	S	S	*	*			trans	159.5	123.7	147.9	67.4	0	0	0	0	110.9	N1972 D1976	N1972-S1974 PolarHBondContact O-N 3.29Å; S1974-D1976 PolarHBondContact O-N 3.1Å
1975	V	27.8	Very low	27.6	Very low	132.8 Å²	132.8	139 Å²	139	81%	0.805	79%	0.789	S	S	*	*			trans	-18.5	119.1	131.9	-175.7	0	0	0	0	111.4
1976	D	28.4	Very low	27.3	Very low	148.4 Å²	148.4	137.6 Å²	137.6	79%	0.794	78%	0.776	S	S	*	*			trans	-169.1	146.8	133.5	-115.9	-30	0	0	0	113.2	S1974 S1978	S1974-D1976 PolarHBondContact O-N 3.1Å; D1976-S1978 PolarHBondContact O-N 2.82Å
1977	S	26.3	Very low	27.2	Very low	110.4 Å²	110.4	134.1 Å²	134.1	77%	0.772	76%	0.761	S	S	*	*			trans	-97.9	110.2	-169.2	51.8	0	0	0	0	113
1978	S	30.5	Very low	27.2	Very low	106.6 Å²	106.6	132.9 Å²	132.9	75%	0.745	75%	0.746	S	S	*	*			trans	-156.5	127.5	158.7	50.8	0	0	0	0	109.7	D1976 T1980	D1976-S1978 PolarHBondContact O-N 2.82Å; S1978-T1980 VanDerWaalsContact C-N 3.35Å; S1978-T1980 PolarHBondContact O-N 3.08Å
1979	E	26.6	Very low	27.3	Very low	189 Å²	189	132 Å²	132	88%	0.883	74%	0.735	S	S	*	*			trans	-15.1	106.4	144.9	-66.2	-171.5	148.5	0	0	113	I1981	E1979-I1981 PolarHBondContact O-N 2.88Å; E1979-I1981 VanDerWaalsContact O-N 3.1Å
1980	T	28.6	Very low	27.3	Very low	121.2 Å²	121.2	132.6 Å²	132.6	74%	0.744	73%	0.725	S	S	*	*			trans	-90.7	119.7	166.6	43.3	0	0	0	0	109.5	S1978 N1982	S1978-T1980 VanDerWaalsContact C-N 3.35Å; S1978-T1980 PolarHBondContact O-N 3.08Å; T1980-N1982 VanDerWaalsContact C-N 3.34Å; T1980-N1982 PolarHBondContact O-N 3.06Å; T1980-N1982 PolarHBondContact O-OD1 3.45Å; T1980-N1982 PolarHBondContact OG1-OD1 2.78Å
1981	I	27.6	Very low	27.4	Very low	157.6 Å²	157.6	132.1 Å²	132.1	81%	0.808	72%	0.715	S	S	*	*				-57.9	97.3	127.7	-59.7	168.2	0	0	0	108.9	E1979 P1983	E1979-I1981 PolarHBondContact O-N 2.88Å; E1979-I1981 VanDerWaalsContact O-N 3.1Å; I1981-P1983 WeakPolarHBondContact O-CD 3.3Å; I1981-P1983 VanDerWaalsContact O-N 3.14Å
1982	N	25.9	Very low	27.6	Very low	140 Å²	140	128.4 Å²	128.4	75%	0.749	70%	0.699	S	S	*	*			trans	-81.2	121.5	169.3	-81.4	-25.8	0	0	0	108.3	T1980 V1984	T1980-N1982 VanDerWaalsContact C-N 3.34Å; T1980-N1982 PolarHBondContact O-N 3.06Å; T1980-N1982 PolarHBondContact O-OD1 3.45Å; T1980-N1982 PolarHBondContact OG1-OD1 2.78Å; N1982-V1984 PolarHBondContact O-N 3.09Å; N1982-V1984 VanDerWaalsContact O-N 3.16Å
1983	P	26.6	Very low	27.7	Very low	108 Å²	108	125.3 Å²	125.3	70%	0.701	69%	0.689	S	S	*	*			trans	-69.2	121	171.6	28.7	-31.9	0	0	0	108.8	I1981 T1985	I1981-P1983 WeakPolarHBondContact O-CD 3.3Å; I1981-P1983 VanDerWaalsContact O-N 3.14Å; P1983-T1985 VanDerWaalsContact C-N 3.33Å; P1983-T1985 PolarHBondContact O-N 3.19Å; P1983-T1985 PolarHBondContact O-OG1 2.88Å
1984	V	27.1	Very low	28	Very low	116.8 Å²	116.8	121.8 Å²	121.8	71%	0.708	68%	0.675	S	S	*	*			trans	-38.1	109.6	172.5	178.6	0	0	0	0	110.4	N1982 L1986	N1982-V1984 PolarHBondContact O-N 3.09Å; N1982-V1984 VanDerWaalsContact O-N 3.16Å; V1984-L1986 VanDerWaalsContact C-N 3.28Å; V1984-L1986 HydrophobicContact CG1-CD2 4.12Å; V1984-L1986 HydrophobicContact CG1-CG 4.42Å; V1984-L1986 PolarHBondContact O-N 2.97Å
1985	T	25.9	Very low	28.2	Very low	117.8 Å²	117.8	124.1 Å²	124.1	72%	0.723	67%	0.669	S	S	*	*			trans	-79.6	119	170.2	-45.8	0	0	0	0	107.5	P1983 T1987	P1983-T1985 VanDerWaalsContact C-N 3.33Å; P1983-T1985 PolarHBondContact O-N 3.19Å; P1983-T1985 PolarHBondContact O-OG1 2.88Å; T1985-T1987 VanDerWaalsContact C-N 3.27Å; T1985-T1987 HydrophobicContact CG2-CG2 4.07Å; T1985-T1987 WeakPolarHBondContact O-CG2 3.49Å; T1985-T1987 PolarHBondContact O-N 2.93Å
1986	L	25	Very low	28.3	Very low	102.4 Å²	102.4	123.2 Å²	123.2	54%	0.536	67%	0.666	S	S	.	*			trans	-79.5	102.9	180	-75.7	160.9	0	0	0	110	N1835 V1984 W1988 Q2049 R2050 A2053	N1835-L1986 PolarHBondContact ND2-O 3.48Å; V1984-L1986 VanDerWaalsContact C-N 3.28Å; V1984-L1986 HydrophobicContact CG1-CD2 4.12Å; V1984-L1986 HydrophobicContact CG1-CG 4.42Å; V1984-L1986 PolarHBondContact O-N 2.97Å; L1986-W1988 VanDerWaalsContact C-CD1 3.5Å; L1986-W1988 VanDerWaalsContact C-N 3.3Å; L1986-W1988 HydrophobicContact CB-CD2 4.47Å; L1986-W1988 VanDerWaalsContact CB-CE2 3.46Å; L1986-W1988 HydrophobicContact CB-CZ2 3.63Å; L1986-W1988 HydrophobicContact CD1-CZ2 3.91Å; L1986-W1988 HydrophobicContact CD2-CH2 4.15Å; L1986-W1988 HydrophobicContact CD2-CZ2 3.72Å; L1986-W1988 HydrophobicContact CG-CZ2 3.95Å; L1986-W1988 PolarHBondContact O-N 2.84Å; L1986-W1988 PolarHBondContact O-NE1 2.72Å; L1986-W1988 VanDerWaalsContact O-NE1 3.16Å; L1986-Q2049 HydrophobicContact CD1-CB 3.96Å; L1986-Q2049 HydrophobicContact CD2-CG 4.02Å; L1986-R2050 HydrophobicContact CD1-CG 3.55Å; L1986-R2050 HydrophobicContact CD2-CG 4.14Å; L1986-A2053 HydrophobicContact CD2-CB 4.04Å
1987	T	25.1	Very low	28.4	Very low	82.4 Å²	82.4	118.6 Å²	118.6	51%	0.506	65%	0.654	S	S	.	*			trans	-71.6	118.7	168.5	49.9	0	0	0	0	110.5	N1835 N1839 H1902 T1985 F1989	N1835-T1987 HydrophobicContact CB-CG2 3.71Å; N1835-T1987 WeakPolarHBondContact OD1-CB 3.35Å; N1835-T1987 PolarHBondContact OD1-OG1 2.84Å; N1839-T1987 WeakPolarHBondContact ND2-CB 3.31Å; N1839-T1987 PolarHBondContact ND2-OG1 3.26Å; N1839-T1987 VanDerWaalsContact ND2-OG1 3.13Å; H1902-T1987 PolarHBondContact CE1-O 2.73Å; H1902-T1987 PolarHBondContact NE2-O 3.13Å; T1985-T1987 VanDerWaalsContact C-N 3.27Å; T1985-T1987 HydrophobicContact CG2-CG2 4.07Å; T1985-T1987 WeakPolarHBondContact O-CG2 3.49Å; T1985-T1987 PolarHBondContact O-N 2.93Å; T1987-F1989 VanDerWaalsContact O-CD2 3.27Å; T1987-F1989 WeakPolarHBondContact O-CD2 3.32Å; T1987-F1989 WeakPolarHBondContact O-CE2 3.38Å; T1987-F1989 PolarHBondContact O-N 2.82Å
1988	W	26.6	Very low	28.7	Very low	156.4 Å²	156.4	122.4 Å²	122.4	59%	0.592	65%	0.651	S	S	*	*			trans	-96	123.6	172.6	-67.3	86.4	0	0	0	111.2	Q1832 Y1836 L1986 Q1990 L2052 I2058 Y2059	Q1832-W1988 WeakPolarHBondContact CA-O 3.34Å; Q1832-W1988 HydrophobicContact CB-CB 3.68Å; Q1832-W1988 HydrophobicContact CB-CG 3.84Å; Q1832-W1988 VanDerWaalsContact CD-CG 3.49Å; Q1832-W1988 HydrophobicContact CG-CB 3.81Å; Q1832-W1988 HydrophobicContact CG-CD2 4.19Å; Q1832-W1988 HydrophobicContact CG-CG 3.54Å; Q1832-W1988 WeakPolarHBondContact CG-O 3.39Å; Y1836-W1988 VanDerWaalsContact CB-O 3.31Å; Y1836-W1988 WeakPolarHBondContact CB-O 3.47Å; L1986-W1988 VanDerWaalsContact C-CD1 3.5Å; L1986-W1988 VanDerWaalsContact C-N 3.3Å; L1986-W1988 HydrophobicContact CB-CD2 4.47Å; L1986-W1988 VanDerWaalsContact CB-CE2 3.46Å; L1986-W1988 HydrophobicContact CB-CZ2 3.63Å; L1986-W1988 HydrophobicContact CD1-CZ2 3.91Å; L1986-W1988 HydrophobicContact CD2-CH2 4.15Å; L1986-W1988 HydrophobicContact CD2-CZ2 3.72Å; L1986-W1988 HydrophobicContact CG-CZ2 3.95Å; L1986-W1988 PolarHBondContact O-N 2.84Å; L1986-W1988 PolarHBondContact O-NE1 2.72Å; L1986-W1988 VanDerWaalsContact O-NE1 3.16Å; W1988-Q1990 PolarHBondContact O-N 3Å; W1988-L2052 HydrophobicContact CE3-CB 4.22Å; W1988-L2052 HydrophobicContact CH2-CB 4.24Å; W1988-L2052 HydrophobicContact CH2-CD1 3.61Å; W1988-L2052 VanDerWaalsContact CH2-O 3.26Å; W1988-L2052 WeakPolarHBondContact CH2-O 3.43Å; W1988-L2052 HydrophobicContact CZ3-CB 3.55Å; W1988-L2052 HydrophobicContact CZ3-CD1 3.66Å; W1988-L2052 HydrophobicContact CZ3-CG 4.17Å; W1988-L2052 WeakPolarHBondContact CZ3-O 3.49Å; W1988-I2058 HydrophobicContact CH2-CD1 3.75Å; W1988-I2058 HydrophobicContact CZ3-CD1 3.93Å; W1988-Y2059 HydrophobicContact CE3-CE2 4.49Å
1989	F	29.6	Very low	28.8	Very low	131.4 Å²	131.4	124.6 Å²	124.6	58%	0.576	65%	0.653	S	S	*	*			trans	-120.2	121.7	175	-73.6	-78	0	0	0	110.4	Q1832 N1835 N1839 R1883 P1901 H1902 T1987 E1991 A2053 E2056	Q1832-F1989 PolarHBondContact NE2-O 3.11Å; N1835-F1989 VanDerWaalsContact C-CE1 3.43Å; N1835-F1989 HydrophobicContact CB-CE1 3.88Å; N1835-F1989 HydrophobicContact CB-CE2 3.86Å; N1835-F1989 HydrophobicContact CB-CZ 3.46Å; N1835-F1989 VanDerWaalsContact CB-CZ 3.46Å; N1835-F1989 WeakPolarHBondContact O-CE1 3.45Å; N1839-F1989 HydrophobicContact CB-CE1 4.36Å; N1839-F1989 WeakPolarHBondContact ND2-CE1 3.41Å; N1839-F1989 WeakPolarHBondContact ND2-CZ 3.25Å; R1883-F1989 VanDerWaalsContact NH2-CG 3.27Å; P1901-F1989 HydrophobicContact CG-CD1 4.45Å; P1901-F1989 HydrophobicContact CG-CE1 4.39Å; P1901-F1989 HydrophobicContact CG-CZ 4.49Å; H1902-F1989 AromaticContact CE1-CD2 3.21Å; H1902-F1989 WeakPolarHBondContact CE1-CD2 3.46Å; H1902-F1989 AromaticContact CE1-CE2 3.41Å; H1902-F1989 VanDerWaalsContact CE1-CE2 3.41Å; H1902-F1989 WeakPolarHBondContact CE1-CE2 3.35Å; H1902-F1989 AromaticContact NE2-CD2 3.06Å; H1902-F1989 WeakPolarHBondContact NE2-CD2 3.32Å; H1902-F1989 AromaticContact NE2-CE2 3.69Å; H1902-F1989 AromaticContact NE2-CG 3.65Å; T1987-F1989 VanDerWaalsContact O-CD2 3.27Å; T1987-F1989 WeakPolarHBondContact O-CD2 3.32Å; T1987-F1989 WeakPolarHBondContact O-CE2 3.38Å; T1987-F1989 PolarHBondContact O-N 2.82Å; F1989-E1991 PolarHBondContact O-N 3.1Å; F1989-A2053 WeakPolarHBondContact CE2-O 3.47Å; F1989-E2056 HydrophobicContact CB-CG 4.32Å; F1989-E2056 HydrophobicContact CD2-CG 4.21Å; F1989-E2056 HydrophobicContact CG-CG 4.5Å
1990	Q	28	Very low	29	Very low	124.2 Å²	124.2	120.8 Å²	120.8	58%	0.58	65%	0.647	S	S	*	*			trans	-130.1	109.8	169	-179.1	169.6	-24.5	0	0	108.9	Q1832 Y1836 W1988 D1992 E2056 S2060	Q1832-Q1990 HydrophobicContact CB-CB 4.43Å; Q1832-Q1990 HydrophobicContact CG-CB 4.35Å; Y1836-Q1990 WeakPolarHBondContact CE1-O 3.21Å; Y1836-Q1990 WeakPolarHBondContact CE2-O 3.37Å; Y1836-Q1990 VanDerWaalsContact CZ-C 3.46Å; Y1836-Q1990 PolarHBondContact OH-O 2.8Å; W1988-Q1990 PolarHBondContact O-N 3Å; Q1990-D1992 HydrophobicContact CG-CB 4.02Å; Q1990-D1992 WeakPolarHBondContact CG-OD2 3.4Å; Q1990-D1992 PolarHBondContact NE2-OD2 3.32Å; Q1990-D1992 PolarHBondContact O-N 3.39Å; Q1990-D1992 VanDerWaalsContact O-N 3.07Å; Q1990-E2056 WeakPolarHBondContact CG-O 3.34Å; Q1990-E2056 PolarHBondContact NE2-O 2.8Å; Q1990-E2056 VanDerWaalsContact NE2-O 3.16Å; Q1990-E2056 PolarHBondContact OE1-O 2.83Å; Q1990-S2060 PolarHBondContact NE2-OG 3.42Å
1991	E	28.4	Very low	29.4	Very low	110.6 Å²	110.6	119.5 Å²	119.5	52%	0.517	63%	0.634	S	S	.	*			trans	-98.8	122.6	167.6	-77.9	176.3	-175.2	0	0	110.5	Y1836 K1840 R1843 R1883 I1898 F1989 S1993 L1994 Y1995	Y1836-E1991 HydrophobicContact CE2-CG 4.04Å; Y1836-E1991 WeakPolarHBondContact OH-CA 3.33Å; Y1836-E1991 WeakPolarHBondContact OH-CG 3.49Å; K1840-E1991 IonicContact NZ-OE1 2.9Å; R1843-E1991 IonicContact NH1-OE1 2.88Å; R1883-E1991 IonicContact CZ-OE1 2.69Å; R1883-E1991 VanDerWaalsContact NH2-CD 3.35Å; R1883-E1991 IonicContact NH2-OE1 3.82Å; R1883-E1991 PolarHBondContact NH2-OE1 3.34Å; I1898-E1991 WeakPolarHBondContact CD1-OE1 3.35Å; F1989-E1991 PolarHBondContact O-N 3.1Å; E1991-S1993 PolarHBondContact O-N 3.2Å; E1991-L1994 PolarHBondContact O-N 2.85Å; E1991-Y1995 HydrophobicContact CB-CE2 4.24Å
1992	D	31.5	Very low	29.7	Very low	103.8 Å²	103.8	116.7 Å²	116.7	56%	0.555	62%	0.621	S	S	*	*			trans	-91.6	121	170.5	-94.3	-21.9	0	0	0	115.9	Q1990 L1994 R1998 H2057 S2060 W2062	Q1990-D1992 HydrophobicContact CG-CB 4.02Å; Q1990-D1992 WeakPolarHBondContact CG-OD2 3.4Å; Q1990-D1992 PolarHBondContact NE2-OD2 3.32Å; Q1990-D1992 PolarHBondContact O-N 3.39Å; Q1990-D1992 VanDerWaalsContact O-N 3.07Å; D1992-L1994 PolarHBondContact O-N 3.05Å; D1992-R1998 WeakPolarHBondContact OD1-CD 3.42Å; D1992-R1998 IonicContact OD1-CZ 3.63Å; D1992-R1998 IonicContact OD1-NH1 2.73Å; D1992-R1998 PolarHBondContact OD1-NH1 2.78Å; D1992-H2057 IonicContact OD2-CE1 2.71Å; D1992-H2057 IonicContact OD2-ND1 3.54Å; D1992-H2057 PolarHBondContact OD2-ND1 3.25Å; D1992-S2060 WeakPolarHBondContact OD2-CB 3.49Å; D1992-S2060 PolarHBondContact OD2-OG 3.49Å; D1992-W2062 PolarHBondContact OD1-NE1 2.92Å; D1992-W2062 PolarHBondContact OD2-NE1 3.01Å
1993	S	31.3	Very low	30.5	Very low	79.6 Å²	79.6	117.3 Å²	117.3	56%	0.557	62%	0.617	S	S	*	*			trans	-82.4	56.8	170.1	-15.7	0	0	0	0	117.5	E1991 Y1995 E2066	E1991-S1993 PolarHBondContact O-N 3.2Å; S1993-Y1995 PolarHBondContact O-N 3.4Å; S1993-E2066 PolarHBondContact OG-OE2 2.82Å
1994	L	32.6	Very low	31.4	Very low	112.4 Å²	112.4	120.4 Å²	120.4	59%	0.588	62%	0.62	S	S	*	*			trans	-132.5	106.1	156.8	-100.4	132.1	0	0	0	113.2	L1833 E1991 D1992 P1996 L2687 F2688	L1833-L1994 HydrophobicContact CD1-CD1 4.49Å; L1833-L1994 HydrophobicContact CD2-CD1 4.37Å; E1991-L1994 PolarHBondContact O-N 2.85Å; D1992-L1994 PolarHBondContact O-N 3.05Å; L1994-P1996 WeakPolarHBondContact O-CD 3.34Å; L1994-L2687 HydrophobicContact CD1-CD2 3.81Å; L1994-L2687 HydrophobicContact CD2-CB 4.43Å; L1994-L2687 HydrophobicContact CD2-CD2 4.24Å; L1994-F2688 HydrophobicContact CB-CZ 4.33Å; L1994-F2688 HydrophobicContact CD2-CE2 3.75Å; L1994-F2688 HydrophobicContact CD2-CZ 3.7Å
1995	Y	32.9	Very low	32.5	Very low	153.4 Å²	153.4	117.2 Å²	117.2	60%	0.602	60%	0.599	S	S	*	*			trans	-39.7	117.7	167.6	-71.6	-86.9	0	0	0	113.2	L1833 Y1836 L1837 E1991 S1993 G1997 R1998	L1833-Y1995 HydrophobicContact CD1-CD1 3.28Å; L1833-Y1995 HydrophobicContact CD1-CD2 3.88Å; L1833-Y1995 HydrophobicContact CD1-CE1 3.69Å; L1833-Y1995 HydrophobicContact CD1-CE2 4.22Å; L1833-Y1995 HydrophobicContact CD1-CG 3.39Å; L1833-Y1995 HydrophobicContact CD2-CG 4.26Å; L1833-Y1995 HydrophobicContact CG-CG 4.48Å; Y1836-Y1995 AromaticContact CD1-CE1 3.78Å; Y1836-Y1995 HydrophobicContact CD1-CE1 3.78Å; Y1836-Y1995 AromaticContact CE1-CE1 3.43Å; Y1836-Y1995 HydrophobicContact CE1-CE1 3.43Å; Y1836-Y1995 VanDerWaalsContact CE1-CE1 3.43Å; Y1836-Y1995 AromaticContact CE1-CZ 3.78Å; Y1836-Y1995 WeakPolarHBondContact CE1-OH 3.15Å; L1837-Y1995 HydrophobicContact CD2-CE2 3.95Å; L1837-Y1995 VanDerWaalsContact CD2-OH 3.25Å; L1837-Y1995 WeakPolarHBondContact CD2-OH 3.25Å; E1991-Y1995 HydrophobicContact CB-CE2 4.24Å; S1993-Y1995 PolarHBondContact O-N 3.4Å; Y1995-G1997 VanDerWaalsContact C-N 3.3Å; Y1995-G1997 PolarHBondContact O-N 2.91Å; Y1995-R1998 PolarHBondContact O-N 3.45Å
1996	P	30.3	Very low	34	Very low	115.4 Å²	115.4	117.1 Å²	117.1	75%	0.749	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	75.1	170	30.7	-30.5	0	0	0	111	L1994	L1994-P1996 WeakPolarHBondContact O-CD 3.34Å
1997	G	30.8	Very low	35.7	Very low	52.2 Å²	52.2	113.9 Å²	113.9	54%	0.538	59%	0.586	S	S	.	*			trans	-154.1	5.2	-175.5	0	0	0	0	0	117.3	Y1995	Y1995-G1997 VanDerWaalsContact C-N 3.3Å; Y1995-G1997 PolarHBondContact O-N 2.91Å
1998	R	32.4	Very low	38.1	Very low	190.2 Å²	190.2	117.7 Å²	117.7	72%	0.718	59%	0.592	S	S	*	*			trans	-137.6	85.6	176	-96.9	-173.1	-179.8	-166.7	-0.2	112	D1992 Y1995 C2000	D1992-R1998 WeakPolarHBondContact OD1-CD 3.42Å; D1992-R1998 IonicContact OD1-CZ 3.63Å; D1992-R1998 IonicContact OD1-NH1 2.73Å; D1992-R1998 PolarHBondContact OD1-NH1 2.78Å; Y1995-R1998 PolarHBondContact O-N 3.45Å; R1998-C2000 VanDerWaalsContact C-N 3.27Å; R1998-C2000 PolarHBondContact O-N 3.03Å; R1998-C2000 PolarHBondContact O-SG 3.41Å
1999	L	31.5	Very low	40.9	Very low	151.4 Å²	151.4	111.8 Å²	111.8	79%	0.793	57%	0.572	S	S	*	*			trans	-86.5	47.7	166.8	-82.1	156.4	0	0	0	111.1	L1833 I2001	L1833-L1999 HydrophobicContact CD2-CD1 3.68Å; L1833-L1999 HydrophobicContact CD2-CD2 3.44Å; L1833-L1999 VanDerWaalsContact CD2-CD2 3.44Å; L1833-L1999 HydrophobicContact CD2-CG 4.22Å; L1999-I2001 PolarHBondContact O-N 3.13Å
2000	C	32.2	Very low	43.7	Very low	109.8 Å²	109.8	108.1 Å²	108.1	74%	0.742	56%	0.563	S	S	*	*			trans	-87.7	113.9	172.6	-58.3	0	0	0	0	109.5	R1998 D2002	R1998-C2000 VanDerWaalsContact C-N 3.27Å; R1998-C2000 PolarHBondContact O-N 3.03Å; R1998-C2000 PolarHBondContact O-SG 3.41Å; C2000-D2002 VanDerWaalsContact C-N 3.31Å; C2000-D2002 PolarHBondContact O-N 3.16Å; C2000-D2002 VanDerWaalsContact O-N 3.13Å
2001	I	35.3	Very low	46.7	Very low	94.25 Å²	94.25	103 Å²	103	48%	0.483	54%	0.54	S	S	.	.			trans	-70.2	92.9	165.6	-55.4	171.3	0	0	0	106.4	L1999 F2003	L1999-I2001 PolarHBondContact O-N 3.13Å; I2001-F2003 VanDerWaalsContact C-N 3.3Å; I2001-F2003 HydrophobicContact CB-CD2 4.27Å; I2001-F2003 HydrophobicContact CB-CE2 4.16Å; I2001-F2003 HydrophobicContact CB-CZ 4.47Å; I2001-F2003 HydrophobicContact CD1-CE2 4.47Å; I2001-F2003 HydrophobicContact CG2-CD1 4.16Å; I2001-F2003 HydrophobicContact CG2-CD2 3.88Å; I2001-F2003 HydrophobicContact CG2-CE1 3.96Å; I2001-F2003 HydrophobicContact CG2-CE2 3.62Å; I2001-F2003 VanDerWaalsContact CG2-CE2 3.45Å; I2001-F2003 HydrophobicContact CG2-CG 4.08Å; I2001-F2003 HydrophobicContact CG2-CZ 3.82Å; I2001-F2003 VanDerWaalsContact CG2-CZ 3.41Å; I2001-F2003 VanDerWaalsContact O-CD2 3.3Å; I2001-F2003 WeakPolarHBondContact O-CD2 3.42Å; I2001-F2003 PolarHBondContact O-N 3.28Å
2002	D	35.1	Very low	49.8	Very low	99 Å²	99	101.8 Å²	101.8	53%	0.529	54%	0.542	S	S	.	.			trans	-81.1	89.6	176.8	-157.8	-1.2	0	0	0	108.3	C2000 K2004 N2005	C2000-D2002 VanDerWaalsContact C-N 3.31Å; C2000-D2002 PolarHBondContact O-N 3.16Å; C2000-D2002 VanDerWaalsContact O-N 3.13Å; D2002-K2004 PolarHBondContact O-N 3.21Å; D2002-K2004 VanDerWaalsContact OD1-CB 3.31Å; D2002-K2004 WeakPolarHBondContact OD1-CB 3.37Å; D2002-K2004 VanDerWaalsContact OD1-CD 3.3Å; D2002-K2004 WeakPolarHBondContact OD1-CD 3.47Å; D2002-K2004 VanDerWaalsContact OD1-CG 3.25Å; D2002-K2004 WeakPolarHBondContact OD1-CG 3.43Å; D2002-K2004 PolarHBondContact OD1-N 3.21Å; D2002-N2005 WeakPolarHBondContact O-CB 3.38Å; D2002-N2005 PolarHBondContact O-N 3.04Å
2003	F	42.8	Very low	52.7	Low	152 Å²	152	97.2 Å²	97.2	67%	0.667	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-3.6	175.3	-74.1	-83	0	0	0	113.4	I1822 I2001 N2005	I1822-F2003 HydrophobicContact CG2-CE1 4.08Å; I2001-F2003 VanDerWaalsContact C-N 3.3Å; I2001-F2003 HydrophobicContact CB-CD2 4.27Å; I2001-F2003 HydrophobicContact CB-CE2 4.16Å; I2001-F2003 HydrophobicContact CB-CZ 4.47Å; I2001-F2003 HydrophobicContact CD1-CE2 4.47Å; I2001-F2003 HydrophobicContact CG2-CD1 4.16Å; I2001-F2003 HydrophobicContact CG2-CD2 3.88Å; I2001-F2003 HydrophobicContact CG2-CE1 3.96Å; I2001-F2003 HydrophobicContact CG2-CE2 3.62Å; I2001-F2003 VanDerWaalsContact CG2-CE2 3.45Å; I2001-F2003 HydrophobicContact CG2-CG 4.08Å; I2001-F2003 HydrophobicContact CG2-CZ 3.82Å; I2001-F2003 VanDerWaalsContact CG2-CZ 3.41Å; I2001-F2003 VanDerWaalsContact O-CD2 3.3Å; I2001-F2003 WeakPolarHBondContact O-CD2 3.42Å; I2001-F2003 PolarHBondContact O-N 3.28Å; F2003-N2005 VanDerWaalsContact C-N 3.31Å; F2003-N2005 PolarHBondContact O-N 3.11Å
2004	K	44.7	Very low	55.7	Low	173.25 Å²	173.25	95.1 Å²	95.1	75%	0.753	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-13.8	175.2	-67.7	-179.8	-179.3	174.6	0	114.4	D2002 T2006	D2002-K2004 PolarHBondContact O-N 3.21Å; D2002-K2004 VanDerWaalsContact OD1-CB 3.31Å; D2002-K2004 WeakPolarHBondContact OD1-CB 3.37Å; D2002-K2004 VanDerWaalsContact OD1-CD 3.3Å; D2002-K2004 WeakPolarHBondContact OD1-CD 3.47Å; D2002-K2004 VanDerWaalsContact OD1-CG 3.25Å; D2002-K2004 WeakPolarHBondContact OD1-CG 3.43Å; D2002-K2004 PolarHBondContact OD1-N 3.21Å; K2004-T2006 VanDerWaalsContact C-N 3.33Å; K2004-T2006 PolarHBondContact O-N 3.06Å; K2004-T2006 VanDerWaalsContact O-N 3.12Å; K2004-T2006 PolarHBondContact O-OG1 3.24Å
2005	N	49.9	Very low	58.7	Low	49.75 Å²	49.75	89.8 Å²	89.8	27%	0.266	47%	0.472	S	S	.	.			trans	-82.1	75.3	173.5	-99.8	-7.8	0	0	0	110.2	D2002 F2003 A2007 S2029 E2032	D2002-N2005 WeakPolarHBondContact O-CB 3.38Å; D2002-N2005 PolarHBondContact O-N 3.04Å; F2003-N2005 VanDerWaalsContact C-N 3.31Å; F2003-N2005 PolarHBondContact O-N 3.11Å; N2005-A2007 PolarHBondContact O-N 3.09Å; N2005-A2007 VanDerWaalsContact O-N 3.16Å; N2005-S2029 PolarHBondContact ND2-OG 2.99Å; N2005-S2029 PolarHBondContact OD1-OG 2.86Å; N2005-E2032 PolarHBondContact ND2-OE1 3.12Å
2006	T	57.8	Low	61.6	Low	115.75 Å²	115.75	82.7 Å²	82.7	71%	0.71	45%	0.445	S	S	*	.			trans	-52.9	123.6	169.2	-23.3	0	0	0	0	108.8	K2004 Y2008	K2004-T2006 VanDerWaalsContact C-N 3.33Å; K2004-T2006 PolarHBondContact O-N 3.06Å; K2004-T2006 VanDerWaalsContact O-N 3.12Å; K2004-T2006 PolarHBondContact O-OG1 3.24Å; T2006-Y2008 PolarHBondContact O-N 2.94Å
2007	A	60.7	Low	64.5	Low	34.5 Å²	34.5	77.7 Å²	77.7	29%	0.285	41%	0.412	S	S	.	.			trans	-61.9	127	171.9	0	0	0	0	0	108.4	N2005 L2009 I2028	N2005-A2007 PolarHBondContact O-N 3.09Å; N2005-A2007 VanDerWaalsContact O-N 3.16Å; A2007-L2009 PolarHBondContact O-N 3.32Å; A2007-I2028 CarbonylContact C-O 3.53Å; A2007-I2028 VanDerWaalsContact CA-O 3.32Å; A2007-I2028 WeakPolarHBondContact CA-O 3.4Å
2008	Y	75.7	Confident	67.1	Low	162.75 Å²	162.75	76.3 Å²	76.3	64%	0.638	39%	0.392	S	S	*	.	S	Bend	trans	-83.9	-17.3	176.8	123.7	-98.4	0	0	0	111.6	T2006 I2028 S2029 A2108	T2006-Y2008 PolarHBondContact O-N 2.94Å; Y2008-I2028 HydrophobicContact CE1-CG2 4.38Å; Y2008-I2028 HydrophobicContact CE2-CG2 4.42Å; Y2008-I2028 PolarHBondContact N-O 3.02Å; Y2008-I2028 WeakPolarHBondContact OH-CG2 3.46Å; Y2008-S2029 VanDerWaalsContact CE1-O 3.24Å; Y2008-S2029 WeakPolarHBondContact CE1-O 3.33Å; Y2008-A2108 HydrophobicContact CE2-CB 3.76Å; Y2008-A2108 PolarHBondContact OH-O 3.37Å
2009	L	85.8	Confident	69.3	Low	32.75 Å²	32.75	69 Å²	69	17%	0.171	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	130.7	172.3	179.6	63.1	0	0	0	108.6	A2007 V2011 S2027 I2028 L2104 V2105 A2108	A2007-L2009 PolarHBondContact O-N 3.32Å; L2009-V2011 HydrophobicContact CD1-CG2 3.64Å; L2009-V2011 HydrophobicContact CD2-CG2 4.28Å; L2009-V2011 HydrophobicContact CG-CG2 3.8Å; L2009-S2027 CarbonylContact O-C 3.55Å; L2009-S2027 WeakPolarHBondContact O-CA 3.34Å; L2009-I2028 HydrophobicContact CB-CB 4.43Å; L2009-I2028 HydrophobicContact CD2-CD1 4.25Å; L2009-I2028 HydrophobicContact CD2-CG1 4.43Å; L2009-I2028 PolarHBondContact N-O 3.23Å; L2009-I2028 PolarHBondContact O-N 3.19Å; L2009-L2104 HydrophobicContact CD1-CD1 4.5Å; L2009-L2104 HydrophobicContact CD1-CD2 3.32Å; L2009-L2104 HydrophobicContact CD2-CB 4.31Å; L2009-L2104 HydrophobicContact CD2-CD2 3.29Å; L2009-L2104 HydrophobicContact CG-CD2 3.89Å; L2009-V2105 HydrophobicContact CD2-CG2 4.1Å; L2009-A2108 HydrophobicContact CB-CB 4.41Å; L2009-A2108 HydrophobicContact CD2-CB 3.8Å
2010	S	88.7	Confident	72	Confident	54 Å²	54	62.8 Å²	62.8	38%	0.378	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	129.9	171.4	-168.4	0	0	0	0	108.4	T2025 L2026 S2027	S2010-T2025 WeakPolarHBondContact OG-CG2 3.31Å; S2010-L2026 WeakPolarHBondContact CA-O 3.37Å; S2010-S2027 PolarHBondContact OG-OG 3.13Å
2011	V	91.1	Very high	74.8	Confident	15.25 Å²	15.25	59.7 Å²	59.7	9%	0.092	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	132.5	-168.7	179.9	0	0	0	0	110.5	L2009 C2013 L2026 F2096 T2101 V2105	L2009-V2011 HydrophobicContact CD1-CG2 3.64Å; L2009-V2011 HydrophobicContact CD2-CG2 4.28Å; L2009-V2011 HydrophobicContact CG-CG2 3.8Å; V2011-C2013 PolarHBondContact O-N 3.08Å; V2011-L2026 PolarHBondContact N-O 3.15Å; V2011-L2026 PolarHBondContact O-N 3.24Å; V2011-F2096 HydrophobicContact CG1-CD1 3.94Å; V2011-F2096 HydrophobicContact CG1-CE1 4.29Å; V2011-T2101 HydrophobicContact CB-CG2 4.44Å; V2011-T2101 HydrophobicContact CG1-CG2 3.36Å; V2011-T2101 HydrophobicContact CG2-CG2 4.44Å; V2011-V2105 HydrophobicContact CG2-CG2 4.4Å
2012	P	92	Very high	77.4	Confident	87.25 Å²	87.25	55.2 Å²	55.2	57%	0.567	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.3	134.1	171.6	2	0.3	0	0	0	111.6	G2024	P2012-G2024 WeakPolarHBondContact CA-O 3.42Å
2013	C	93.8	Very high	80.1	Confident	7.25 Å²	7.25	52.3 Å²	52.3	5%	0.049	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	175.5	178.5	79	0	0	0	0	112.3	V2011 G2024 L2026 F2035 A2095 F2096	V2011-C2013 PolarHBondContact O-N 3.08Å; C2013-G2024 PolarHBondContact N-O 3.19Å; C2013-G2024 PolarHBondContact O-N 3.04Å; C2013-L2026 HydrophobicContact CB-CB 4.46Å; C2013-L2026 VanDerWaalsContact SG-CB 3.57Å; C2013-F2035 VanDerWaalsContact SG-CE2 3.54Å; C2013-F2035 WeakPolarHBondContact SG-CE2 3.15Å; C2013-A2095 CarbonylContact C-O 3.49Å; C2013-A2095 WeakPolarHBondContact CA-O 3.39Å; C2013-A2095 WeakPolarHBondContact CB-O 3.3Å; C2013-F2096 HydrophobicContact CB-CD1 3.68Å; C2013-F2096 HydrophobicContact CB-CE1 3.66Å; C2013-F2096 HydrophobicContact CB-CG 4.5Å; C2013-F2096 HydrophobicContact CB-CZ 4.49Å
2014	I	94.3	Very high	82.4	Confident	35.25 Å²	35.25	45.4 Å²	45.4	18%	0.181	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	120.1	174.6	-59.1	173.3	0	0	0	107.7	V2016 T2021 V2022 F2075 F2094 A2095	I2014-V2016 HydrophobicContact CG2-CG2 4.25Å; I2014-T2021 HydrophobicContact CG2-CG2 3.97Å; I2014-V2022 CarbonylContact C-O 3.41Å; I2014-V2022 WeakPolarHBondContact CA-O 3.43Å; I2014-F2075 HydrophobicContact CD1-CE1 4.46Å; I2014-F2094 CarbonylContact O-C 3.53Å; I2014-F2094 VanDerWaalsContact O-CA 3.31Å; I2014-F2094 WeakPolarHBondContact O-CA 3.4Å; I2014-A2095 HydrophobicContact CB-CB 4.35Å; I2014-A2095 PolarHBondContact N-O 3.11Å; I2014-A2095 PolarHBondContact O-N 2.88Å
2015	L	94.6	Very high	84.6	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	123	164.8	170.4	65.7	0	0	0	108.5	T2021 V2022 F2035 I2055 H2057 I2058 V2092 F2094	L2015-T2021 WeakPolarHBondContact O-CA 3.04Å; L2015-V2022 HydrophobicContact CB-CB 4.27Å; L2015-V2022 PolarHBondContact N-O 3.39Å; L2015-V2022 PolarHBondContact O-N 3.26Å; L2015-F2035 HydrophobicContact CB-CD1 4.26Å; L2015-F2035 HydrophobicContact CB-CE1 3.68Å; L2015-F2035 HydrophobicContact CB-CE2 4.25Å; L2015-F2035 HydrophobicContact CB-CZ 3.67Å; L2015-F2035 HydrophobicContact CD2-CD1 4.03Å; L2015-F2035 HydrophobicContact CD2-CE1 3.82Å; L2015-F2035 HydrophobicContact CG-CE1 4.4Å; L2015-I2055 HydrophobicContact CD2-CG2 4.13Å; L2015-H2057 HydrophobicContact CD1-CB 4.17Å; L2015-H2057 VanDerWaalsContact CD2-C 3.47Å; L2015-H2057 HydrophobicContact CD2-CB 4.07Å; L2015-I2058 HydrophobicContact CD2-CB 4.49Å; L2015-I2058 HydrophobicContact CD2-CG1 4.3Å; L2015-V2092 HydrophobicContact CD1-CG2 3.49Å; L2015-V2092 VanDerWaalsContact CD1-CG2 3.46Å; L2015-F2094 HydrophobicContact CB-CD1 4.29Å; L2015-F2094 HydrophobicContact CB-CE1 4.15Å; L2015-F2094 HydrophobicContact CD1-CD1 4.31Å; L2015-F2094 HydrophobicContact CD1-CE1 3.9Å; L2015-F2094 HydrophobicContact CD1-CZ 4.45Å
2016	V	93.4	Very high	86.6	Confident	3.25 Å²	3.25	36.3 Å²	36.3	2%	0.02	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122	177	-175.8	0	0	0	0	108.4	I2014 V2020 T2021 F2075 L2093 A2095 D2168	I2014-V2016 HydrophobicContact CG2-CG2 4.25Å; V2016-V2020 WeakPolarHBondContact CA-O 3.29Å; V2016-T2021 HydrophobicContact CG2-CG2 4.46Å; V2016-F2075 HydrophobicContact CG1-CE2 4.36Å; V2016-F2075 HydrophobicContact CG2-CD2 3.9Å; V2016-F2075 HydrophobicContact CG2-CE2 3.74Å; V2016-F2075 HydrophobicContact CG2-CZ 4.42Å; V2016-L2093 HydrophobicContact CB-CB 4.36Å; V2016-L2093 HydrophobicContact CB-CD2 3.89Å; V2016-L2093 HydrophobicContact CB-CG 3.98Å; V2016-L2093 HydrophobicContact CG1-CD2 3.97Å; V2016-L2093 HydrophobicContact CG2-CD2 4.48Å; V2016-L2093 HydrophobicContact CG2-CG 4.42Å; V2016-L2093 PolarHBondContact N-O 2.88Å; V2016-A2095 HydrophobicContact CG2-CB 4.2Å; V2016-D2168 HydrophobicContact CG1-CB 4.19Å
2017	S	91	Very high	88.1	Confident	10.25 Å²	10.25	30.9 Å²	30.9	7%	0.072	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	134.5	179	-171.1	0	0	0	0	111.3	G2019 V2020 N2167	S2017-G2019 VanDerWaalsContact C-N 3.27Å; S2017-G2019 PolarHBondContact O-N 3.21Å; S2017-G2019 VanDerWaalsContact O-N 3.09Å; S2017-V2020 PolarHBondContact N-O 3.07Å; S2017-V2020 VanDerWaalsContact N-O 3.08Å; S2017-V2020 WeakPolarHBondContact O-CA 3.44Å; S2017-V2020 WeakPolarHBondContact O-CB 3.37Å; S2017-V2020 WeakPolarHBondContact O-CG2 3.3Å; S2017-V2020 PolarHBondContact O-N 2.97Å; S2017-V2020 VanDerWaalsContact O-O 3.05Å; S2017-N2167 CarbonylContact C-O 3.44Å; S2017-N2167 WeakPolarHBondContact CA-O 3.38Å; S2017-N2167 PolarHBondContact OG-OD1 3.12Å; S2017-N2167 VanDerWaalsContact OG-OD1 3.09Å
2018	L	85.4	Confident	89.6	Confident	23.5 Å²	23.5	29.3 Å²	29.3	12%	0.123	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	32.1	177.9	-61	169.8	0	0	0	114.2	V2020 N2167 L2169 P2249 F2250 V2253	L2018-V2020 VanDerWaalsContact C-N 3.34Å; L2018-V2020 PolarHBondContact O-N 3.12Å; L2018-N2167 PolarHBondContact N-O 3.06Å; L2018-N2167 VanDerWaalsContact N-O 3.16Å; L2018-L2169 VanDerWaalsContact O-CD1 3.28Å; L2018-L2169 WeakPolarHBondContact O-CD1 3.38Å; L2018-P2249 HydrophobicContact CD1-CB 3.99Å; L2018-P2249 HydrophobicContact CD1-CG 3.48Å; L2018-P2249 VanDerWaalsContact CD1-CG 3.47Å; L2018-P2249 HydrophobicContact CD2-CG 3.96Å; L2018-P2249 HydrophobicContact CG-CG 4.26Å; L2018-F2250 HydrophobicContact CD2-CD1 4.41Å; L2018-F2250 HydrophobicContact CD2-CE1 4.05Å; L2018-F2250 HydrophobicContact CD2-CZ 4.24Å; L2018-V2253 HydrophobicContact CB-CG2 4.27Å; L2018-V2253 HydrophobicContact CD1-CG2 4.33Å; L2018-V2253 VanDerWaalsContact O-CG1 3.26Å; L2018-V2253 WeakPolarHBondContact O-CG1 3.38Å
2019	G	80.3	Confident	90.1	Very high	37.75 Å²	37.75	21.7 Å²	21.7	39%	0.389	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	0.5	-176.9	0	0	0	0	0	115.2	S2017 N2167	S2017-G2019 VanDerWaalsContact C-N 3.27Å; S2017-G2019 PolarHBondContact O-N 3.21Å; S2017-G2019 VanDerWaalsContact O-N 3.09Å; G2019-N2167 PolarHBondContact N-O 3.31Å
2020	V	87.2	Confident	90	Very high	19.5 Å²	19.5	27.1 Å²	27.1	12%	0.118	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	147.5	174.2	-157.7	0	0	0	0	110.6	V2016 S2017 L2018 V2022 I2047 V2051 I2055	V2016-V2020 WeakPolarHBondContact CA-O 3.29Å; S2017-V2020 PolarHBondContact N-O 3.07Å; S2017-V2020 VanDerWaalsContact N-O 3.08Å; S2017-V2020 WeakPolarHBondContact O-CA 3.44Å; S2017-V2020 WeakPolarHBondContact O-CB 3.37Å; S2017-V2020 WeakPolarHBondContact O-CG2 3.3Å; S2017-V2020 PolarHBondContact O-N 2.97Å; S2017-V2020 VanDerWaalsContact O-O 3.05Å; L2018-V2020 VanDerWaalsContact C-N 3.34Å; L2018-V2020 PolarHBondContact O-N 3.12Å; V2020-V2022 HydrophobicContact CG1-CG2 4.31Å; V2020-I2047 HydrophobicContact CG1-CB 4.49Å; V2020-I2047 HydrophobicContact CG1-CD1 3.78Å; V2020-I2047 HydrophobicContact CG1-CG1 4.26Å; V2020-I2047 HydrophobicContact CG1-CG2 4.01Å; V2020-I2047 HydrophobicContact CG2-CG2 4.41Å; V2020-V2051 HydrophobicContact CG1-CG1 3.76Å; V2020-V2051 HydrophobicContact CG2-CG1 3.8Å; V2020-I2055 HydrophobicContact CB-CD1 3.95Å; V2020-I2055 HydrophobicContact CG1-CD1 3.95Å; V2020-I2055 HydrophobicContact CG2-CD1 4.08Å; V2020-I2055 HydrophobicContact CG2-CG1 4.34Å
2021	T	90.6	Very high	89.8	Confident	45.25 Å²	45.25	30.8 Å²	30.8	28%	0.278	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	115.5	178.2	51.3	0	0	0	0	110	I2014 L2015 V2016 F2075	I2014-T2021 HydrophobicContact CG2-CG2 3.97Å; L2015-T2021 WeakPolarHBondContact O-CA 3.04Å; V2016-T2021 HydrophobicContact CG2-CG2 4.46Å; T2021-F2075 HydrophobicContact CG2-CE2 4.11Å; T2021-F2075 HydrophobicContact CG2-CZ 3.79Å
2022	V	91.2	Very high	89.7	Confident	0.5 Å²	0.5	31.6 Å²	31.6	0%	0.003	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	116.8	179.6	179.8	0	0	0	0	109	I2014 L2015 V2020 F2035 H2037 I2047 L2052 I2055 I2058	I2014-V2022 CarbonylContact C-O 3.41Å; I2014-V2022 WeakPolarHBondContact CA-O 3.43Å; L2015-V2022 HydrophobicContact CB-CB 4.27Å; L2015-V2022 PolarHBondContact N-O 3.39Å; L2015-V2022 PolarHBondContact O-N 3.26Å; V2020-V2022 HydrophobicContact CG1-CG2 4.31Å; V2022-F2035 HydrophobicContact CG1-CE1 4.25Å; V2022-F2035 HydrophobicContact CG1-CZ 4.41Å; V2022-H2037 WeakPolarHBondContact CG1-ND1 3.36Å; V2022-I2047 HydrophobicContact CG2-CD1 4.06Å; V2022-L2052 HydrophobicContact CG2-CD2 4.32Å; V2022-I2055 HydrophobicContact CG2-CD1 4Å; V2022-I2058 HydrophobicContact CG1-CG1 4.44Å; V2022-I2058 HydrophobicContact CG1-CG2 4.46Å; V2022-I2058 HydrophobicContact CG2-CD1 4.44Å; V2022-I2058 HydrophobicContact CG2-CG1 4.36Å
2023	H	92.1	Very high	89.6	Confident	36.75 Å²	36.75	27.5 Å²	27.5	17%	0.17	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	144.8	177.9	-71.6	-109.6	0	0	0	111.3	D2038 H2041 N2043 N2044	H2023-D2038 PolarHBondContact O-N 3.4Å; H2023-H2041 HydrophobicContact CB-CB 4.27Å; H2023-H2041 AromaticContact CD2-CE1 3.64Å; H2023-H2041 AromaticContact CD2-ND1 3.74Å; H2023-H2041 AromaticContact CE1-CE1 3.61Å; H2023-H2041 PolarHBondContact CE1-CE1 2.89Å; H2023-H2041 VanDerWaalsContact CE1-CE1 3.47Å; H2023-H2041 AromaticContact CE1-NE2 3.97Å; H2023-H2041 AromaticContact CG-CE1 3.41Å; H2023-H2041 VanDerWaalsContact CG-CE1 3.48Å; H2023-H2041 AromaticContact CG-ND1 3.55Å; H2023-H2041 AromaticContact CG-NE2 3.82Å; H2023-H2041 AromaticContact ND1-CE1 3.4Å; H2023-H2041 PolarHBondContact ND1-CE1 3.35Å; H2023-H2041 VanDerWaalsContact ND1-CE1 3.3Å; H2023-H2041 AromaticContact ND1-ND1 3.88Å; H2023-H2041 AromaticContact ND1-NE2 3.52Å; H2023-H2041 PolarHBondContact ND1-NE2 3.15Å; H2023-H2041 AromaticContact NE2-CE1 3.75Å; H2023-N2043 PolarHBondContact NE2-ND2 3.02Å; H2023-N2043 VanDerWaalsContact NE2-ND2 3.15Å; H2023-N2044 PolarHBondContact N-ND2 2.88Å; H2023-N2044 PolarHBondContact N-OD1 3.22Å; H2023-N2044 PolarHBondContact O-ND2 3.14Å
2024	G	90.5	Very high	89.3	Confident	8 Å²	8	28.4 Å²	28.4	8%	0.082	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.9	-161.8	178.8	0	0	0	0	0	112.9	P2012 C2013 E2036	P2012-G2024 WeakPolarHBondContact CA-O 3.42Å; C2013-G2024 PolarHBondContact N-O 3.19Å; C2013-G2024 PolarHBondContact O-N 3.04Å; G2024-E2036 CarbonylContact C-O 3.43Å; G2024-E2036 WeakPolarHBondContact CA-O 3.42Å
2025	T	90	Very high	89.1	Confident	29.5 Å²	29.5	26.8 Å²	26.8	18%	0.181	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	131.5	-179	-53.5	0	0	0	0	110	L1818 S2010 F2035 E2036	L1818-T2025 HydrophobicContact CD1-CG2 4.34Å; S2010-T2025 WeakPolarHBondContact OG-CG2 3.31Å; T2025-F2035 WeakPolarHBondContact O-CA 3.17Å; T2025-F2035 VanDerWaalsContact O-CD2 3.29Å; T2025-F2035 WeakPolarHBondContact O-CD2 3.41Å; T2025-E2036 PolarHBondContact N-O 3.15Å; T2025-E2036 PolarHBondContact O-N 2.94Å
2026	L	91.9	Very high	88.5	Confident	2 Å²	2	26.9 Å²	26.9	1%	0.01	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	118.7	172	-168.2	69.6	0	0	0	109.5	S2010 V2011 C2013 L2033 F2035 F2094 F2096 V2105	S2010-L2026 WeakPolarHBondContact CA-O 3.37Å; V2011-L2026 PolarHBondContact N-O 3.15Å; V2011-L2026 PolarHBondContact O-N 3.24Å; C2013-L2026 HydrophobicContact CB-CB 4.46Å; C2013-L2026 VanDerWaalsContact SG-CB 3.57Å; L2026-L2033 HydrophobicContact CD1-CD1 3.63Å; L2026-L2033 HydrophobicContact CD1-CD2 4.39Å; L2026-L2033 HydrophobicContact CD1-CG 4.14Å; L2026-L2033 HydrophobicContact CD2-CD1 4.04Å; L2026-L2033 HydrophobicContact CG-CD1 3.75Å; L2026-F2035 HydrophobicContact CD1-CB 4.31Å; L2026-F2094 HydrophobicContact CD1-CD1 4.28Å; L2026-F2094 HydrophobicContact CD1-CD2 4.19Å; L2026-F2094 HydrophobicContact CD1-CE1 3.96Å; L2026-F2094 HydrophobicContact CD1-CE2 3.78Å; L2026-F2094 HydrophobicContact CD1-CG 4.39Å; L2026-F2094 HydrophobicContact CD1-CZ 3.65Å; L2026-F2094 HydrophobicContact CD2-CD2 4.28Å; L2026-F2094 HydrophobicContact CD2-CE2 4.47Å; L2026-F2094 HydrophobicContact CD2-CG 4.39Å; L2026-F2096 HydrophobicContact CB-CE1 4.49Å; L2026-F2096 HydrophobicContact CD2-CE1 3.8Å; L2026-F2096 HydrophobicContact CD2-CZ 3.66Å; L2026-V2105 HydrophobicContact CD2-CG1 4.29Å
2027	S	90.4	Very high	88	Confident	2 Å²	2	27.3 Å²	27.3	1%	0.014	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.6	-179	-68.3	0	0	0	0	110.6	L2009 S2010 Y2034 E2036	L2009-S2027 CarbonylContact O-C 3.55Å; L2009-S2027 WeakPolarHBondContact O-CA 3.34Å; S2010-S2027 PolarHBondContact OG-OG 3.13Å; S2027-Y2034 VanDerWaalsContact CB-CE1 3.44Å; S2027-Y2034 VanDerWaalsContact CB-CE2 3.46Å; S2027-Y2034 WeakPolarHBondContact CB-OH 3.3Å; S2027-Y2034 PolarHBondContact N-O 3.31Å; S2027-Y2034 WeakPolarHBondContact O-CD1 3.4Å; S2027-Y2034 PolarHBondContact O-N 3.35Å; S2027-E2036 VanDerWaalsContact CB-OE1 3.27Å; S2027-E2036 WeakPolarHBondContact CB-OE1 3.4Å; S2027-E2036 PolarHBondContact OG-OE1 3.27Å
2028	I	90.9	Very high	87.7	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.01	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	118.2	-177.2	-49.5	-172.7	0	0	0	108.7	A2007 Y2008 L2009 L2033 L2064 V2105 A2108 L2109	A2007-I2028 CarbonylContact C-O 3.53Å; A2007-I2028 VanDerWaalsContact CA-O 3.32Å; A2007-I2028 WeakPolarHBondContact CA-O 3.4Å; Y2008-I2028 HydrophobicContact CE1-CG2 4.38Å; Y2008-I2028 HydrophobicContact CE2-CG2 4.42Å; Y2008-I2028 PolarHBondContact N-O 3.02Å; Y2008-I2028 WeakPolarHBondContact OH-CG2 3.46Å; L2009-I2028 HydrophobicContact CB-CB 4.43Å; L2009-I2028 HydrophobicContact CD2-CD1 4.25Å; L2009-I2028 HydrophobicContact CD2-CG1 4.43Å; L2009-I2028 PolarHBondContact N-O 3.23Å; L2009-I2028 PolarHBondContact O-N 3.19Å; I2028-L2033 HydrophobicContact CB-CD1 4.39Å; I2028-L2033 HydrophobicContact CD1-CD1 3.99Å; I2028-L2033 HydrophobicContact CG1-CD1 3.6Å; I2028-L2033 VanDerWaalsContact CG1-CD1 3.45Å; I2028-L2033 HydrophobicContact CG2-CD1 4.49Å; I2028-L2064 HydrophobicContact CG2-CD2 4.44Å; I2028-V2105 HydrophobicContact CD1-CG1 4.1Å; I2028-A2108 HydrophobicContact CD1-CB 3.93Å; I2028-A2108 HydrophobicContact CG2-CB 4.32Å; I2028-L2109 HydrophobicContact CD1-CD2 4.13Å; I2028-L2109 HydrophobicContact CD1-CG 4.23Å
2029	S	87.3	Confident	87.4	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.014	15%	0.152	C	C	.	.			trans	-101.3	-177	171.4	86	0	0	0	0	110.8	N2005 Y2008 Y2031 E2032	N2005-S2029 PolarHBondContact ND2-OG 2.99Å; N2005-S2029 PolarHBondContact OD1-OG 2.86Å; Y2008-S2029 VanDerWaalsContact CE1-O 3.24Å; Y2008-S2029 WeakPolarHBondContact CE1-O 3.33Å; S2029-Y2031 PolarHBondContact O-N 3.25Å; S2029-Y2031 VanDerWaalsContact O-N 3.07Å; S2029-Y2031 PolarHBondContact OG-N 3.03Å; S2029-Y2031 VanDerWaalsContact OG-N 3.14Å; S2029-E2032 PolarHBondContact N-O 3.13Å; S2029-E2032 WeakPolarHBondContact OG-CG 3.23Å; S2029-E2032 PolarHBondContact OG-N 3.21Å; S2029-E2032 VanDerWaalsContact OG-N 3.12Å; S2029-E2032 PolarHBondContact OG-O 3.17Å
2030	K	84	Confident	87.4	Confident	147.5 Å²	147.5	30.6 Å²	30.6	64%	0.641	15%	0.15	S	C	*	.	S	Bend	trans	-61.5	-24.3	178.6	-171.8	175.6	177.1	-170.9	0	114
2031	Y	84.5	Confident	87.3	Confident	130 Å²	130	31.9 Å²	31.9	51%	0.51	16%	0.155	S	C	.	.	S	Bend	trans	-129.5	-17.3	-171.8	-56.2	-66.6	0	0	0	114.4	S2029 S2063 L2064	S2029-Y2031 PolarHBondContact O-N 3.25Å; S2029-Y2031 VanDerWaalsContact O-N 3.07Å; S2029-Y2031 PolarHBondContact OG-N 3.03Å; S2029-Y2031 VanDerWaalsContact OG-N 3.14Å; Y2031-S2063 PolarHBondContact O-OG 2.73Å; Y2031-L2064 PolarHBondContact O-N 3.26Å
2032	E	88.3	Confident	87	Confident	33.75 Å²	33.75	34.1 Å²	34.1	16%	0.158	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	150.4	-173.1	53.4	-179.7	179.1	0	0	112.4	N2005 S2029 Y2034 R2061 W2062	N2005-E2032 PolarHBondContact ND2-OE1 3.12Å; S2029-E2032 PolarHBondContact N-O 3.13Å; S2029-E2032 WeakPolarHBondContact OG-CG 3.23Å; S2029-E2032 PolarHBondContact OG-N 3.21Å; S2029-E2032 VanDerWaalsContact OG-N 3.12Å; S2029-E2032 PolarHBondContact OG-O 3.17Å; E2032-Y2034 HydrophobicContact CG-CD1 4.27Å; E2032-R2061 VanDerWaalsContact CD-CZ 3.46Å; E2032-R2061 VanDerWaalsContact CD-NH1 3.25Å; E2032-R2061 IonicContact OE1-CZ 3.42Å; E2032-R2061 IonicContact OE1-NH1 2.64Å; E2032-R2061 PolarHBondContact OE1-NH1 3.09Å; E2032-R2061 VanDerWaalsContact OE1-NH1 3.11Å; E2032-R2061 IonicContact OE1-NH2 2.92Å; E2032-R2061 PolarHBondContact OE1-NH2 2.91Å; E2032-R2061 WeakPolarHBondContact OE2-CD 3.48Å; E2032-R2061 IonicContact OE2-CZ 2.97Å; E2032-R2061 IonicContact OE2-NE 2.96Å; E2032-R2061 PolarHBondContact OE2-NE 3.34Å; E2032-R2061 IonicContact OE2-NH1 2.68Å; E2032-R2061 PolarHBondContact OE2-NH1 2.92Å; E2032-R2061 IonicContact OE2-NH2 2.68Å; E2032-R2061 PolarHBondContact OE2-NH2 3.27Å; E2032-W2062 CarbonylContact C-O 3.57Å; E2032-W2062 VanDerWaalsContact CA-O 3.31Å; E2032-W2062 WeakPolarHBondContact CA-O 3.37Å; E2032-W2062 WeakPolarHBondContact CB-O 3.42Å
2033	L	90	Very high	86.6	Confident	0.25 Å²	0.25	37.7 Å²	37.7	0%	0.001	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	133.3	169.8	174.7	70.7	0	0	0	107.3	L2026 I2028 R2061 W2062 L2064 I2067 I2084 F2094 L2109	L2026-L2033 HydrophobicContact CD1-CD1 3.63Å; L2026-L2033 HydrophobicContact CD1-CD2 4.39Å; L2026-L2033 HydrophobicContact CD1-CG 4.14Å; L2026-L2033 HydrophobicContact CD2-CD1 4.04Å; L2026-L2033 HydrophobicContact CG-CD1 3.75Å; I2028-L2033 HydrophobicContact CB-CD1 4.39Å; I2028-L2033 HydrophobicContact CD1-CD1 3.99Å; I2028-L2033 HydrophobicContact CG1-CD1 3.6Å; I2028-L2033 VanDerWaalsContact CG1-CD1 3.45Å; I2028-L2033 HydrophobicContact CG2-CD1 4.49Å; L2033-R2061 CarbonylContact O-C 3.56Å; L2033-R2061 WeakPolarHBondContact O-CA 3.35Å; L2033-W2062 HydrophobicContact CB-CB 4.46Å; L2033-W2062 HydrophobicContact CB-CE3 4.38Å; L2033-W2062 HydrophobicContact CD2-CE3 4Å; L2033-W2062 HydrophobicContact CD2-CZ3 4.3Å; L2033-W2062 HydrophobicContact CG-CE3 4.04Å; L2033-W2062 HydrophobicContact CG-CZ3 4.33Å; L2033-W2062 PolarHBondContact N-O 3.31Å; L2033-W2062 PolarHBondContact O-N 3.28Å; L2033-L2064 HydrophobicContact CB-CD2 4.04Å; L2033-I2067 HydrophobicContact CD2-CD1 4.42Å; L2033-I2084 HydrophobicContact CD2-CD1 3.64Å; L2033-F2094 HydrophobicContact CD2-CE2 4.45Å; L2033-L2109 HydrophobicContact CD1-CD2 4.38Å; L2033-L2109 HydrophobicContact CD2-CD2 4.38Å
2034	Y	87.6	Confident	86.3	Confident	27.25 Å²	27.25	36.2 Å²	36.2	11%	0.107	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	149	174.9	61	-82.6	0	0	0	112.2	S2027 E2032 E2036 S2060	S2027-Y2034 VanDerWaalsContact CB-CE1 3.44Å; S2027-Y2034 VanDerWaalsContact CB-CE2 3.46Å; S2027-Y2034 WeakPolarHBondContact CB-OH 3.3Å; S2027-Y2034 PolarHBondContact N-O 3.31Å; S2027-Y2034 WeakPolarHBondContact O-CD1 3.4Å; S2027-Y2034 PolarHBondContact O-N 3.35Å; E2032-Y2034 HydrophobicContact CG-CD1 4.27Å; Y2034-E2036 HydrophobicContact CD2-CG 3.96Å; Y2034-E2036 HydrophobicContact CE2-CG 4.04Å; Y2034-E2036 WeakPolarHBondContact CE2-OE1 3.35Å; Y2034-S2060 WeakPolarHBondContact CA-O 3.15Å; Y2034-S2060 WeakPolarHBondContact CB-O 3.33Å
2035	F	89	Confident	86	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	139.6	176.4	178.1	-110.8	0	0	0	109.7	C2013 L2015 V2022 T2025 L2026 I2058 S2060 W2062 F2094	C2013-F2035 VanDerWaalsContact SG-CE2 3.54Å; C2013-F2035 WeakPolarHBondContact SG-CE2 3.15Å; L2015-F2035 HydrophobicContact CB-CD1 4.26Å; L2015-F2035 HydrophobicContact CB-CE1 3.68Å; L2015-F2035 HydrophobicContact CB-CE2 4.25Å; L2015-F2035 HydrophobicContact CB-CZ 3.67Å; L2015-F2035 HydrophobicContact CD2-CD1 4.03Å; L2015-F2035 HydrophobicContact CD2-CE1 3.82Å; L2015-F2035 HydrophobicContact CG-CE1 4.4Å; V2022-F2035 HydrophobicContact CG1-CE1 4.25Å; V2022-F2035 HydrophobicContact CG1-CZ 4.41Å; T2025-F2035 WeakPolarHBondContact O-CA 3.17Å; T2025-F2035 VanDerWaalsContact O-CD2 3.29Å; T2025-F2035 WeakPolarHBondContact O-CD2 3.41Å; L2026-F2035 HydrophobicContact CD1-CB 4.31Å; F2035-I2058 VanDerWaalsContact CD1-O 3.27Å; F2035-I2058 WeakPolarHBondContact CD1-O 3.39Å; F2035-S2060 PolarHBondContact N-O 3.14Å; F2035-W2062 HydrophobicContact CB-CZ3 4.29Å; F2035-F2094 HydrophobicContact CB-CE1 3.97Å; F2035-F2094 HydrophobicContact CB-CZ 4.08Å; F2035-F2094 HydrophobicContact CD1-CE1 4.46Å; F2035-F2094 HydrophobicContact CD2-CD1 4.36Å; F2035-F2094 AromaticContact CD2-CE1 3.74Å; F2035-F2094 HydrophobicContact CD2-CE1 3.74Å; F2035-F2094 HydrophobicContact CE2-CE1 4.32Å; F2035-F2094 AromaticContact CG-CE1 3.82Å; F2035-F2094 HydrophobicContact CG-CE1 3.82Å; F2035-F2094 HydrophobicContact CG-CZ 4.38Å
2036	E	82.7	Confident	85.6	Confident	4.25 Å²	4.25	47 Å²	47	2%	0.02	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	119.8	-178.7	-62.7	172.6	-161.1	0	0	109	L1818 I1822 R1829 G2024 T2025 S2027 Y2034	L1818-E2036 VanDerWaalsContact CD1-OE2 3.27Å; L1818-E2036 WeakPolarHBondContact CD1-OE2 3.32Å; I1822-E2036 VanDerWaalsContact CG1-CD 3.44Å; I1822-E2036 HydrophobicContact CG1-CG 4.25Å; I1822-E2036 WeakPolarHBondContact CG1-OE1 3.32Å; I1822-E2036 VanDerWaalsContact CG1-OE2 3.25Å; I1822-E2036 WeakPolarHBondContact CG1-OE2 3.29Å; R1829-E2036 IonicContact NH1-OE1 3.13Å; G2024-E2036 CarbonylContact C-O 3.43Å; G2024-E2036 WeakPolarHBondContact CA-O 3.42Å; T2025-E2036 PolarHBondContact N-O 3.15Å; T2025-E2036 PolarHBondContact O-N 2.94Å; S2027-E2036 VanDerWaalsContact CB-OE1 3.27Å; S2027-E2036 WeakPolarHBondContact CB-OE1 3.4Å; S2027-E2036 PolarHBondContact OG-OE1 3.27Å; Y2034-E2036 HydrophobicContact CD2-CG 3.96Å; Y2034-E2036 HydrophobicContact CE2-CG 4.04Å; Y2034-E2036 WeakPolarHBondContact CE2-OE1 3.35Å
2037	H	83.9	Confident	85.2	Confident	11.5 Å²	11.5	48.1 Å²	48.1	5%	0.053	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	124.8	-178.4	174.8	56.2	0	0	0	111.3	S1825 V2022 T2039 N2044 I2058 Y2059	S1825-H2037 PolarHBondContact OG-N 3.13Å; V2022-H2037 WeakPolarHBondContact CG1-ND1 3.36Å; H2037-T2039 VanDerWaalsContact CD2-CG2 3.44Å; H2037-T2039 WeakPolarHBondContact CD2-CG2 3.35Å; H2037-T2039 PolarHBondContact O-N 2.91Å; H2037-T2039 VanDerWaalsContact O-N 3.12Å; H2037-N2044 VanDerWaalsContact CE1-CG 3.44Å; H2037-N2044 PolarHBondContact CE1-ND2 3.18Å; H2037-N2044 VanDerWaalsContact CE1-ND2 3.28Å; H2037-N2044 PolarHBondContact ND1-ND2 3.13Å; H2037-I2058 HydrophobicContact CB-CG2 3.54Å; H2037-I2058 VanDerWaalsContact CB-CG2 3.45Å; H2037-Y2059 HydrophobicContact CB-CD1 4.21Å; H2037-Y2059 HydrophobicContact CB-CE1 3.8Å; H2037-Y2059 AromaticContact CD2-CE1 3.95Å; H2037-Y2059 AromaticContact CD2-CZ 3.99Å; H2037-Y2059 PolarHBondContact CD2-OH 3.35Å; H2037-Y2059 VanDerWaalsContact CD2-OH 3.22Å
2038	D	83.9	Confident	84.9	Confident	27 Å²	27	50.3 Å²	50.3	14%	0.144	25%	0.25	C	C	.	.			trans	-83.7	89.6	173.6	-172.5	10.6	0	0	0	110.2	K1817 N1821 H2023 D2040 H2041 N2044	K1817-D2038 WeakPolarHBondContact CE-OD1 3.44Å; K1817-D2038 IonicContact NZ-OD1 2.9Å; K1817-D2038 PolarHBondContact NZ-OD1 3.14Å; K1817-D2038 IonicContact NZ-OD2 3.46Å; K1817-D2038 PolarHBondContact NZ-OD2 3.09Å; N1821-D2038 PolarHBondContact ND2-OD1 2.97Å; H2023-D2038 PolarHBondContact O-N 3.4Å; D2038-D2040 PolarHBondContact O-N 3.19Å; D2038-D2040 VanDerWaalsContact O-N 3.13Å; D2038-D2040 PolarHBondContact OD1-N 3.18Å; D2038-H2041 HydrophobicContact CB-CB 4.1Å; D2038-H2041 VanDerWaalsContact O-CB 3.3Å; D2038-H2041 WeakPolarHBondContact O-CB 3.41Å; D2038-H2041 PolarHBondContact O-N 3.08Å; D2038-H2041 VanDerWaalsContact O-N 3.12Å; D2038-H2041 PolarHBondContact OD1-N 3.12Å; D2038-N2044 PolarHBondContact O-ND2 3.21Å
2039	T	79.4	Confident	84.5	Confident	47.75 Å²	47.75	56.3 Å²	56.3	29%	0.293	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-23.9	179.4	52.8	0	0	0	0	113.2	L1828 H2037 H2041 R2045	L1828-T2039 HydrophobicContact CD1-CG2 4.42Å; H2037-T2039 VanDerWaalsContact CD2-CG2 3.44Å; H2037-T2039 WeakPolarHBondContact CD2-CG2 3.35Å; H2037-T2039 PolarHBondContact O-N 2.91Å; H2037-T2039 VanDerWaalsContact O-N 3.12Å; T2039-H2041 VanDerWaalsContact C-N 3.33Å; T2039-R2045 WeakPolarHBondContact O-CG 3.42Å; T2039-R2045 PolarHBondContact O-NE 3.39Å
2040	D	80.9	Confident	84.2	Confident	65.5 Å²	65.5	61.5 Å²	61.5	35%	0.35	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-11.1	-179.1	-73.4	-37.6	0	0	0	113.4	K1820 D2038 R2045	K1820-D2040 IonicContact NZ-OD1 3.22Å; K1820-D2040 IonicContact NZ-OD2 3.27Å; K1820-D2040 PolarHBondContact NZ-OD2 3.47Å; D2038-D2040 PolarHBondContact O-N 3.19Å; D2038-D2040 VanDerWaalsContact O-N 3.13Å; D2038-D2040 PolarHBondContact OD1-N 3.18Å; D2040-R2045 VanDerWaalsContact O-CZ 3.29Å; D2040-R2045 PolarHBondContact O-NE 3.25Å; D2040-R2045 PolarHBondContact O-NH2 3.19Å; D2040-R2045 IonicContact OD1-CZ 3Å; D2040-R2045 IonicContact OD1-NH2 3.07Å; D2040-R2045 PolarHBondContact OD1-NH2 3.2Å
2041	H	84	Confident	84.2	Confident	46.75 Å²	46.75	54.6 Å²	54.6	22%	0.216	27%	0.267	C	S	.	.			trans	-66.5	132.1	-179.3	-166.3	-88.1	0	0	0	111.8	H2023 D2038 T2039 N2043 N2044 R2045	H2023-H2041 HydrophobicContact CB-CB 4.27Å; H2023-H2041 AromaticContact CD2-CE1 3.64Å; H2023-H2041 AromaticContact CD2-ND1 3.74Å; H2023-H2041 AromaticContact CE1-CE1 3.61Å; H2023-H2041 PolarHBondContact CE1-CE1 2.89Å; H2023-H2041 VanDerWaalsContact CE1-CE1 3.47Å; H2023-H2041 AromaticContact CE1-NE2 3.97Å; H2023-H2041 AromaticContact CG-CE1 3.41Å; H2023-H2041 VanDerWaalsContact CG-CE1 3.48Å; H2023-H2041 AromaticContact CG-ND1 3.55Å; H2023-H2041 AromaticContact CG-NE2 3.82Å; H2023-H2041 AromaticContact ND1-CE1 3.4Å; H2023-H2041 PolarHBondContact ND1-CE1 3.35Å; H2023-H2041 VanDerWaalsContact ND1-CE1 3.3Å; H2023-H2041 AromaticContact ND1-ND1 3.88Å; H2023-H2041 AromaticContact ND1-NE2 3.52Å; H2023-H2041 PolarHBondContact ND1-NE2 3.15Å; H2023-H2041 AromaticContact NE2-CE1 3.75Å; D2038-H2041 HydrophobicContact CB-CB 4.1Å; D2038-H2041 VanDerWaalsContact O-CB 3.3Å; D2038-H2041 WeakPolarHBondContact O-CB 3.41Å; D2038-H2041 PolarHBondContact O-N 3.08Å; D2038-H2041 VanDerWaalsContact O-N 3.12Å; D2038-H2041 PolarHBondContact OD1-N 3.12Å; T2039-H2041 VanDerWaalsContact C-N 3.33Å; H2041-N2043 VanDerWaalsContact C-N 3.31Å; H2041-N2043 PolarHBondContact ND1-N 3.2Å; H2041-N2043 PolarHBondContact O-N 2.93Å; H2041-N2044 HydrophobicContact CB-CB 4.25Å; H2041-N2044 WeakPolarHBondContact O-CB 3.28Å; H2041-N2044 PolarHBondContact O-N 3.04Å; H2041-R2045 PolarHBondContact O-N 3.13Å
2042	P	84.7	Confident	84.2	Confident	91.75 Å²	91.75	49.4 Å²	49.4	60%	0.596	25%	0.248	S	C	*	.	H	α-helix	trans	-59.1	-40.9	-173.2	21.6	-33.7	0	0	0	113.4	N2044 R2045 S2046	P2042-N2044 VanDerWaalsContact C-N 3.31Å; P2042-N2044 PolarHBondContact O-N 3.07Å; P2042-R2045 PolarHBondContact O-N 3Å; P2042-S2046 PolarHBondContact O-N 3.14Å; P2042-S2046 PolarHBondContact O-OG 2.91Å
2043	N	83.5	Confident	83.8	Confident	75.75 Å²	75.75	48.9 Å²	48.9	41%	0.405	25%	0.249	S	C	.	.	H	α-helix	trans	-62.9	-35	177.1	-64.3	-10.5	0	0	0	112.1	H2023 H2041 R2045 S2046 I2047	H2023-N2043 PolarHBondContact NE2-ND2 3.02Å; H2023-N2043 VanDerWaalsContact NE2-ND2 3.15Å; H2041-N2043 VanDerWaalsContact C-N 3.31Å; H2041-N2043 PolarHBondContact ND1-N 3.2Å; H2041-N2043 PolarHBondContact O-N 2.93Å; N2043-R2045 PolarHBondContact O-N 2.85Å; N2043-S2046 WeakPolarHBondContact CA-OG 3.14Å; N2043-S2046 PolarHBondContact O-N 3.06Å; N2043-S2046 VanDerWaalsContact O-N 3.09Å; N2043-S2046 PolarHBondContact O-OG 3.09Å; N2043-I2047 WeakPolarHBondContact O-CG1 3.18Å
2044	N	85.8	Confident	83.5	Confident	5.25 Å²	5.25	49.4 Å²	49.4	3%	0.028	25%	0.251	C	S	.	.	H	α-helix	trans	-71.6	-38	-178	-71.3	-5.3	0	0	0	111.6	H2023 H2037 D2038 H2041 P2042 S2046 I2047	H2023-N2044 PolarHBondContact N-ND2 2.88Å; H2023-N2044 PolarHBondContact N-OD1 3.22Å; H2023-N2044 PolarHBondContact O-ND2 3.14Å; H2037-N2044 VanDerWaalsContact CE1-CG 3.44Å; H2037-N2044 PolarHBondContact CE1-ND2 3.18Å; H2037-N2044 VanDerWaalsContact CE1-ND2 3.28Å; H2037-N2044 PolarHBondContact ND1-ND2 3.13Å; D2038-N2044 PolarHBondContact O-ND2 3.21Å; H2041-N2044 HydrophobicContact CB-CB 4.25Å; H2041-N2044 WeakPolarHBondContact O-CB 3.28Å; H2041-N2044 PolarHBondContact O-N 3.04Å; P2042-N2044 VanDerWaalsContact C-N 3.31Å; P2042-N2044 PolarHBondContact O-N 3.07Å; N2044-S2046 PolarHBondContact O-N 3.19Å; N2044-S2046 VanDerWaalsContact O-N 3.16Å; N2044-I2047 PolarHBondContact O-N 3.29Å
2045	R	82.8	Confident	83.3	Confident	169 Å²	169	48.2 Å²	48.2	64%	0.638	25%	0.247	S	C	*	.	H	α-helix	trans	-65.5	-19.3	176.1	-64.7	179.9	-177.8	-176	-0.4	113.7	T2039 D2040 H2041 P2042 N2043	T2039-R2045 WeakPolarHBondContact O-CG 3.42Å; T2039-R2045 PolarHBondContact O-NE 3.39Å; D2040-R2045 VanDerWaalsContact O-CZ 3.29Å; D2040-R2045 PolarHBondContact O-NE 3.25Å; D2040-R2045 PolarHBondContact O-NH2 3.19Å; D2040-R2045 IonicContact OD1-CZ 3Å; D2040-R2045 IonicContact OD1-NH2 3.07Å; D2040-R2045 PolarHBondContact OD1-NH2 3.2Å; H2041-R2045 PolarHBondContact O-N 3.13Å; P2042-R2045 PolarHBondContact O-N 3Å; N2043-R2045 PolarHBondContact O-N 2.85Å
2046	S	83.1	Confident	82.5	Confident	96.5 Å²	96.5	50 Å²	50	68%	0.675	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-8.1	178.5	66.8	0	0	0	0	114.5	P2042 N2043 N2044	P2042-S2046 PolarHBondContact O-N 3.14Å; P2042-S2046 PolarHBondContact O-OG 2.91Å; N2043-S2046 WeakPolarHBondContact CA-OG 3.14Å; N2043-S2046 PolarHBondContact O-N 3.06Å; N2043-S2046 VanDerWaalsContact O-N 3.09Å; N2043-S2046 PolarHBondContact O-OG 3.09Å; N2044-S2046 PolarHBondContact O-N 3.19Å; N2044-S2046 VanDerWaalsContact O-N 3.16Å
2047	I	83.5	Confident	82.3	Confident	25 Å²	25	50.9 Å²	50.9	13%	0.128	26%	0.259	C	S	.	.	S	Bend	trans	-81.4	132.6	-177.2	-51.4	170.3	0	0	0	109.7	V2020 V2022 N2043 N2044 Q2049 V2051 L2052	V2020-I2047 HydrophobicContact CG1-CB 4.49Å; V2020-I2047 HydrophobicContact CG1-CD1 3.78Å; V2020-I2047 HydrophobicContact CG1-CG1 4.26Å; V2020-I2047 HydrophobicContact CG1-CG2 4.01Å; V2020-I2047 HydrophobicContact CG2-CG2 4.41Å; V2022-I2047 HydrophobicContact CG2-CD1 4.06Å; N2043-I2047 WeakPolarHBondContact O-CG1 3.18Å; N2044-I2047 PolarHBondContact O-N 3.29Å; I2047-Q2049 PolarHBondContact O-N 3.41Å; I2047-V2051 HydrophobicContact CG2-CB 4.4Å; I2047-V2051 HydrophobicContact CG2-CG1 4.28Å; I2047-L2052 HydrophobicContact CB-CD1 4.11Å; I2047-L2052 HydrophobicContact CB-CD2 3.99Å; I2047-L2052 HydrophobicContact CB-CG 4.07Å; I2047-L2052 HydrophobicContact CD1-CD2 4.01Å; I2047-L2052 HydrophobicContact CG2-CD1 4.24Å; I2047-L2052 HydrophobicContact CG2-CD2 3.86Å; I2047-L2052 HydrophobicContact CG2-CG 3.68Å
2048	D	83.6	Confident	82	Confident	47.25 Å²	47.25	50.4 Å²	50.4	25%	0.253	26%	0.257	S	S	.	.			trans	-59.7	127.2	174.3	-173.5	-25.1	0	0	0	110.6	R2050 V2051 L2052 N2256	D2048-R2050 PolarHBondContact O-N 3.09Å; D2048-R2050 VanDerWaalsContact O-N 3.15Å; D2048-R2050 WeakPolarHBondContact OD1-CB 3.39Å; D2048-R2050 WeakPolarHBondContact OD1-CG 3.31Å; D2048-R2050 PolarHBondContact OD1-N 3.31Å; D2048-R2050 IonicContact OD1-NE 3.13Å; D2048-R2050 PolarHBondContact OD1-NE 2.95Å; D2048-R2050 IonicContact OD2-CZ 2.95Å; D2048-R2050 VanDerWaalsContact OD2-CZ 3.28Å; D2048-R2050 IonicContact OD2-NE 3.52Å; D2048-R2050 PolarHBondContact OD2-NE 3.1Å; D2048-R2050 IonicContact OD2-NH2 2.81Å; D2048-R2050 PolarHBondContact OD2-NH2 3.2Å; D2048-V2051 HydrophobicContact CB-CG2 4.3Å; D2048-V2051 WeakPolarHBondContact O-CB 3.4Å; D2048-V2051 PolarHBondContact O-N 3.03Å; D2048-L2052 PolarHBondContact O-N 3.21Å; D2048-N2256 VanDerWaalsContact CB-ND2 3.34Å; D2048-N2256 WeakPolarHBondContact CB-ND2 3.36Å
2049	Q	81.6	Confident	81.5	Confident	127.75 Å²	127.75	50 Å²	50	60%	0.597	25%	0.254	S	S	*	.	H	α-helix	trans	-56	-30.1	178.9	-117.3	157.3	6	0	0	112.8	L1986 I2047 V2051 L2052 A2053	L1986-Q2049 HydrophobicContact CD1-CB 3.96Å; L1986-Q2049 HydrophobicContact CD2-CG 4.02Å; I2047-Q2049 PolarHBondContact O-N 3.41Å; Q2049-V2051 VanDerWaalsContact C-N 3.33Å; Q2049-L2052 PolarHBondContact O-N 2.88Å; Q2049-A2053 WeakPolarHBondContact O-CB 3.33Å; Q2049-A2053 PolarHBondContact O-N 3.13Å; Q2049-A2053 VanDerWaalsContact O-N 3.12Å
2050	R	81.8	Confident	81.3	Confident	112.75 Å²	112.75	48.7 Å²	48.7	43%	0.425	25%	0.247	S	C	.	.	H	α-helix	trans	-66.6	-36.4	175.1	-64.8	179.4	-88.2	177.6	0.9	112.2	L1986 D2048 A2053 Y2054 T2252	L1986-R2050 HydrophobicContact CD1-CG 3.55Å; L1986-R2050 HydrophobicContact CD2-CG 4.14Å; D2048-R2050 PolarHBondContact O-N 3.09Å; D2048-R2050 VanDerWaalsContact O-N 3.15Å; D2048-R2050 WeakPolarHBondContact OD1-CB 3.39Å; D2048-R2050 WeakPolarHBondContact OD1-CG 3.31Å; D2048-R2050 PolarHBondContact OD1-N 3.31Å; D2048-R2050 IonicContact OD1-NE 3.13Å; D2048-R2050 PolarHBondContact OD1-NE 2.95Å; D2048-R2050 IonicContact OD2-CZ 2.95Å; D2048-R2050 VanDerWaalsContact OD2-CZ 3.28Å; D2048-R2050 IonicContact OD2-NE 3.52Å; D2048-R2050 PolarHBondContact OD2-NE 3.1Å; D2048-R2050 IonicContact OD2-NH2 2.81Å; D2048-R2050 PolarHBondContact OD2-NH2 3.2Å; R2050-A2053 WeakPolarHBondContact O-CB 3.23Å; R2050-Y2054 VanDerWaalsContact O-CD2 3.27Å; R2050-Y2054 WeakPolarHBondContact O-CD2 3.34Å; R2050-T2252 HydrophobicContact CB-CG2 3.9Å
2051	V	84.7	Confident	81.3	Confident	1.25 Å²	1.25	49.7 Å²	49.7	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-74.2	-42.9	175.5	178.5	0	0	0	0	110.2	V2020 I2047 D2048 Q2049 A2053 Y2054 T2252 V2253 N2256	V2020-V2051 HydrophobicContact CG1-CG1 3.76Å; V2020-V2051 HydrophobicContact CG2-CG1 3.8Å; I2047-V2051 HydrophobicContact CG2-CB 4.4Å; I2047-V2051 HydrophobicContact CG2-CG1 4.28Å; D2048-V2051 HydrophobicContact CB-CG2 4.3Å; D2048-V2051 WeakPolarHBondContact O-CB 3.4Å; D2048-V2051 PolarHBondContact O-N 3.03Å; Q2049-V2051 VanDerWaalsContact C-N 3.33Å; V2051-A2053 VanDerWaalsContact C-N 3.25Å; V2051-A2053 PolarHBondContact O-N 2.97Å; V2051-A2053 VanDerWaalsContact O-N 3.17Å; V2051-Y2054 PolarHBondContact O-N 2.93Å; V2051-T2252 HydrophobicContact CG2-CG2 3.89Å; V2051-V2253 HydrophobicContact CG1-CG2 4.22Å; V2051-V2253 HydrophobicContact CG2-CG2 4.45Å; V2051-N2256 HydrophobicContact CG2-CB 3.76Å; V2051-N2256 WeakPolarHBondContact CG2-ND2 3.39Å
2052	L	83.1	Confident	81.4	Confident	21.75 Å²	21.75	48 Å²	48	11%	0.114	24%	0.237	C	C	.	.	H	α-helix	trans	-56.1	-35.1	175.6	-72.5	169	0	0	0	112.4	W1988 V2022 I2047 D2048 Q2049 Y2054 I2055 I2058	W1988-L2052 HydrophobicContact CE3-CB 4.22Å; W1988-L2052 HydrophobicContact CH2-CB 4.24Å; W1988-L2052 HydrophobicContact CH2-CD1 3.61Å; W1988-L2052 VanDerWaalsContact CH2-O 3.26Å; W1988-L2052 WeakPolarHBondContact CH2-O 3.43Å; W1988-L2052 HydrophobicContact CZ3-CB 3.55Å; W1988-L2052 HydrophobicContact CZ3-CD1 3.66Å; W1988-L2052 HydrophobicContact CZ3-CG 4.17Å; W1988-L2052 WeakPolarHBondContact CZ3-O 3.49Å; V2022-L2052 HydrophobicContact CG2-CD2 4.32Å; I2047-L2052 HydrophobicContact CB-CD1 4.11Å; I2047-L2052 HydrophobicContact CB-CD2 3.99Å; I2047-L2052 HydrophobicContact CB-CG 4.07Å; I2047-L2052 HydrophobicContact CD1-CD2 4.01Å; I2047-L2052 HydrophobicContact CG2-CD1 4.24Å; I2047-L2052 HydrophobicContact CG2-CD2 3.86Å; I2047-L2052 HydrophobicContact CG2-CG 3.68Å; D2048-L2052 PolarHBondContact O-N 3.21Å; Q2049-L2052 PolarHBondContact O-N 2.88Å; L2052-Y2054 PolarHBondContact O-N 3.3Å; L2052-Y2054 VanDerWaalsContact O-N 3.13Å; L2052-I2055 HydrophobicContact CD2-CD1 4.23Å; L2052-I2055 PolarHBondContact O-N 3.22Å; L2052-I2055 VanDerWaalsContact O-N 3.09Å; L2052-I2058 HydrophobicContact CB-CD1 4.19Å; L2052-I2058 HydrophobicContact CD2-CD1 3.74Å
2053	A	80.3	Confident	81.6	Confident	22.5 Å²	22.5	45.5 Å²	45.5	19%	0.186	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.8	177.3	0	0	0	0	0	114.3	L1986 F1989 Q2049 R2050 V2051	L1986-A2053 HydrophobicContact CD2-CB 4.04Å; F1989-A2053 WeakPolarHBondContact CE2-O 3.47Å; Q2049-A2053 WeakPolarHBondContact O-CB 3.33Å; Q2049-A2053 PolarHBondContact O-N 3.13Å; Q2049-A2053 VanDerWaalsContact O-N 3.12Å; R2050-A2053 WeakPolarHBondContact O-CB 3.23Å; V2051-A2053 VanDerWaalsContact C-N 3.25Å; V2051-A2053 PolarHBondContact O-N 2.97Å; V2051-A2053 VanDerWaalsContact O-N 3.17Å
2054	Y	84.2	Confident	81.8	Confident	10.75 Å²	10.75	43.2 Å²	43.2	4%	0.042	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-7.6	177.5	-70.6	-68.4	0	0	0	114.4	R1883 N1900 R2050 V2051 L2052 E2056 E2248 P2249 T2252	R1883-Y2054 HydrophobicContact CB-CE1 4.46Å; N1900-Y2054 VanDerWaalsContact CG-OH 3.22Å; N1900-Y2054 PolarHBondContact ND2-OH 3.38Å; N1900-Y2054 PolarHBondContact OD1-OH 3.22Å; R2050-Y2054 VanDerWaalsContact O-CD2 3.27Å; R2050-Y2054 WeakPolarHBondContact O-CD2 3.34Å; V2051-Y2054 PolarHBondContact O-N 2.93Å; L2052-Y2054 PolarHBondContact O-N 3.3Å; L2052-Y2054 VanDerWaalsContact O-N 3.13Å; Y2054-E2056 PolarHBondContact O-N 2.97Å; Y2054-E2056 VanDerWaalsContact O-N 3.16Å; Y2054-E2248 HydrophobicContact CE1-CB 4.41Å; Y2054-E2248 PolarHBondContact OH-OE1 2.93Å; Y2054-P2249 HydrophobicContact CD1-CB 3.8Å; Y2054-P2249 HydrophobicContact CD2-CB 3.91Å; Y2054-P2249 HydrophobicContact CE1-CB 4.34Å; Y2054-P2249 HydrophobicContact CE2-CB 4.44Å; Y2054-P2249 HydrophobicContact CG-CB 3.51Å; Y2054-P2249 VanDerWaalsContact CG-CB 3.48Å; Y2054-T2252 HydrophobicContact CD2-CG2 4.24Å; Y2054-T2252 HydrophobicContact CE2-CG2 4.06Å; Y2054-T2252 VanDerWaalsContact CE2-OG1 3.28Å; Y2054-T2252 WeakPolarHBondContact CE2-OG1 3.39Å
2055	I	83.8	Confident	81.8	Confident	1.5 Å²	1.5	47.3 Å²	47.3	1%	0.008	24%	0.239	C	C	.	.			trans	-87.4	97.1	179.6	-53.5	174.8	0	0	0	109.1	L2015 V2020 V2022 L2052 H2057 I2058	L2015-I2055 HydrophobicContact CD2-CG2 4.13Å; V2020-I2055 HydrophobicContact CB-CD1 3.95Å; V2020-I2055 HydrophobicContact CG1-CD1 3.95Å; V2020-I2055 HydrophobicContact CG2-CD1 4.08Å; V2020-I2055 HydrophobicContact CG2-CG1 4.34Å; V2022-I2055 HydrophobicContact CG2-CD1 4Å; L2052-I2055 HydrophobicContact CD2-CD1 4.23Å; L2052-I2055 PolarHBondContact O-N 3.22Å; L2052-I2055 VanDerWaalsContact O-N 3.09Å; I2055-H2057 VanDerWaalsContact C-N 3.29Å; I2055-H2057 PolarHBondContact O-N 3Å; I2055-I2058 HydrophobicContact CB-CD1 3.82Å; I2055-I2058 HydrophobicContact CB-CG1 3.81Å; I2055-I2058 HydrophobicContact CD1-CD1 4.32Å; I2055-I2058 HydrophobicContact CG1-CD1 4.47Å; I2055-I2058 HydrophobicContact CG2-CD1 4.14Å; I2055-I2058 HydrophobicContact CG2-CG1 3.57Å; I2055-I2058 VanDerWaalsContact CG2-CG1 3.46Å; I2055-I2058 WeakPolarHBondContact O-CG1 3.25Å; I2055-I2058 PolarHBondContact O-N 3.27Å
2056	E	72	Confident	82	Confident	39.5 Å²	39.5	42.3 Å²	42.3	19%	0.185	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-22.4	-173.8	-57.5	-173	155.6	0	0	113.9	R1883 T1886 F1989 Q1990 Y2054 S2060	R1883-E2056 IonicContact CZ-OE1 3.19Å; R1883-E2056 IonicContact NH1-OE1 2.87Å; R1883-E2056 PolarHBondContact NH1-OE1 3.03Å; R1883-E2056 IonicContact NH2-OE1 2.99Å; R1883-E2056 PolarHBondContact NH2-OE1 2.95Å; T1886-E2056 WeakPolarHBondContact CB-OE2 3.4Å; T1886-E2056 WeakPolarHBondContact CG2-OE2 3.37Å; T1886-E2056 PolarHBondContact OG1-OE2 3.18Å; F1989-E2056 HydrophobicContact CB-CG 4.32Å; F1989-E2056 HydrophobicContact CD2-CG 4.21Å; F1989-E2056 HydrophobicContact CG-CG 4.5Å; Q1990-E2056 WeakPolarHBondContact CG-O 3.34Å; Q1990-E2056 PolarHBondContact NE2-O 2.8Å; Q1990-E2056 VanDerWaalsContact NE2-O 3.16Å; Q1990-E2056 PolarHBondContact OE1-O 2.83Å; Y2054-E2056 PolarHBondContact O-N 2.97Å; Y2054-E2056 VanDerWaalsContact O-N 3.16Å; E2056-S2060 PolarHBondContact O-OG 2.91Å
2057	H	77.9	Confident	82.4	Confident	22.25 Å²	22.25	37.9 Å²	37.9	10%	0.103	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	2	-168.3	-60.3	-34.9	0	0	0	115.7	D1992 L2015 I2055 Y2059 S2060 W2062 V2092	D1992-H2057 IonicContact OD2-CE1 2.71Å; D1992-H2057 IonicContact OD2-ND1 3.54Å; D1992-H2057 PolarHBondContact OD2-ND1 3.25Å; L2015-H2057 HydrophobicContact CD1-CB 4.17Å; L2015-H2057 VanDerWaalsContact CD2-C 3.47Å; L2015-H2057 HydrophobicContact CD2-CB 4.07Å; I2055-H2057 VanDerWaalsContact C-N 3.29Å; I2055-H2057 PolarHBondContact O-N 3Å; H2057-Y2059 PolarHBondContact O-N 3.03Å; H2057-Y2059 VanDerWaalsContact O-N 3.14Å; H2057-S2060 WeakPolarHBondContact CA-OG 3.31Å; H2057-S2060 PolarHBondContact ND1-OG 3.07Å; H2057-S2060 PolarHBondContact O-N 2.98Å; H2057-W2062 HydrophobicContact CB-CH2 4.23Å; H2057-W2062 HydrophobicContact CB-CZ2 3.99Å; H2057-W2062 AromaticContact CG-CZ2 3.9Å; H2057-W2062 AromaticContact ND1-CZ2 3.83Å; H2057-V2092 HydrophobicContact CB-CG2 4.08Å
2058	I	77	Confident	82.6	Confident	1.5 Å²	1.5	43.1 Å²	43.1	1%	0.008	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-34.5	-176.9	-59.8	176.4	0	0	0	112.3	W1988 L2015 V2022 F2035 H2037 L2052 I2055	W1988-I2058 HydrophobicContact CH2-CD1 3.75Å; W1988-I2058 HydrophobicContact CZ3-CD1 3.93Å; L2015-I2058 HydrophobicContact CD2-CB 4.49Å; L2015-I2058 HydrophobicContact CD2-CG1 4.3Å; V2022-I2058 HydrophobicContact CG1-CG1 4.44Å; V2022-I2058 HydrophobicContact CG1-CG2 4.46Å; V2022-I2058 HydrophobicContact CG2-CD1 4.44Å; V2022-I2058 HydrophobicContact CG2-CG1 4.36Å; F2035-I2058 VanDerWaalsContact CD1-O 3.27Å; F2035-I2058 WeakPolarHBondContact CD1-O 3.39Å; H2037-I2058 HydrophobicContact CB-CG2 3.54Å; H2037-I2058 VanDerWaalsContact CB-CG2 3.45Å; L2052-I2058 HydrophobicContact CB-CD1 4.19Å; L2052-I2058 HydrophobicContact CD2-CD1 3.74Å; I2055-I2058 HydrophobicContact CB-CD1 3.82Å; I2055-I2058 HydrophobicContact CB-CG1 3.81Å; I2055-I2058 HydrophobicContact CD1-CD1 4.32Å; I2055-I2058 HydrophobicContact CG1-CD1 4.47Å; I2055-I2058 HydrophobicContact CG2-CD1 4.14Å; I2055-I2058 HydrophobicContact CG2-CG1 3.57Å; I2055-I2058 VanDerWaalsContact CG2-CG1 3.46Å; I2055-I2058 WeakPolarHBondContact O-CG1 3.25Å; I2055-I2058 PolarHBondContact O-N 3.27Å
2059	Y	73.3	Confident	83.1	Confident	18.25 Å²	18.25	41.3 Å²	41.3	7%	0.072	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125	18.5	-177.3	-47.7	-82.2	0	0	0	112.6	L1828 R1829 Q1832 W1988 H2037 H2057	L1828-Y2059 HydrophobicContact CB-CD1 4.06Å; L1828-Y2059 HydrophobicContact CB-CD2 4.2Å; L1828-Y2059 HydrophobicContact CB-CE1 3.75Å; L1828-Y2059 VanDerWaalsContact CB-CE1 3.43Å; L1828-Y2059 HydrophobicContact CB-CE2 4.25Å; L1828-Y2059 HydrophobicContact CB-CG 4.27Å; L1828-Y2059 HydrophobicContact CD1-CD1 4.28Å; L1828-Y2059 HydrophobicContact CD1-CE1 3.63Å; L1828-Y2059 VanDerWaalsContact CD1-CE1 3.41Å; L1828-Y2059 WeakPolarHBondContact CD1-OH 3.37Å; L1828-Y2059 HydrophobicContact CG-CE1 4.22Å; R1829-Y2059 VanDerWaalsContact CD-O 3.25Å; R1829-Y2059 WeakPolarHBondContact CD-O 3.34Å; R1829-Y2059 VanDerWaalsContact CG-CB 3.5Å; R1829-Y2059 HydrophobicContact CG-CG 4.18Å; R1829-Y2059 WeakPolarHBondContact CG-O 3.37Å; R1829-Y2059 PolarHBondContact NH1-O 2.84Å; Q1832-Y2059 VanDerWaalsContact CD-CD2 3.45Å; Q1832-Y2059 HydrophobicContact CG-CD2 4.46Å; Q1832-Y2059 VanDerWaalsContact NE2-CD2 3.34Å; Q1832-Y2059 VanDerWaalsContact OE1-CD2 3.29Å; W1988-Y2059 HydrophobicContact CE3-CE2 4.49Å; H2037-Y2059 HydrophobicContact CB-CD1 4.21Å; H2037-Y2059 HydrophobicContact CB-CE1 3.8Å; H2037-Y2059 AromaticContact CD2-CE1 3.95Å; H2037-Y2059 AromaticContact CD2-CZ 3.99Å; H2037-Y2059 PolarHBondContact CD2-OH 3.35Å; H2037-Y2059 VanDerWaalsContact CD2-OH 3.22Å; H2057-Y2059 PolarHBondContact O-N 3.03Å; H2057-Y2059 VanDerWaalsContact O-N 3.14Å
2060	S	75.2	Confident	83.7	Confident	21 Å²	21	35.3 Å²	35.3	15%	0.147	17%	0.173	C	C	.	.			trans	-69.8	151.5	-174.1	-78.7	0	0	0	0	113.7	Q1990 D1992 Y2034 F2035 E2056 H2057 W2062	Q1990-S2060 PolarHBondContact NE2-OG 3.42Å; D1992-S2060 WeakPolarHBondContact OD2-CB 3.49Å; D1992-S2060 PolarHBondContact OD2-OG 3.49Å; Y2034-S2060 WeakPolarHBondContact CA-O 3.15Å; Y2034-S2060 WeakPolarHBondContact CB-O 3.33Å; F2035-S2060 PolarHBondContact N-O 3.14Å; E2056-S2060 PolarHBondContact O-OG 2.91Å; H2057-S2060 WeakPolarHBondContact CA-OG 3.31Å; H2057-S2060 PolarHBondContact ND1-OG 3.07Å; H2057-S2060 PolarHBondContact O-N 2.98Å; S2060-W2062 VanDerWaalsContact CB-CE2 3.42Å; S2060-W2062 VanDerWaalsContact CB-CH2 3.48Å; S2060-W2062 WeakPolarHBondContact O-CZ3 3.31Å; S2060-W2062 VanDerWaalsContact OG-CZ2 3.3Å; S2060-W2062 WeakPolarHBondContact OG-CZ2 3.18Å
2061	R	81.9	Confident	84.3	Confident	85.5 Å²	85.5	30.3 Å²	30.3	32%	0.323	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138	167.3	-54.2	-174.8	102.2	174.4	-3.4	108.1	E2032 L2033	E2032-R2061 VanDerWaalsContact CD-CZ 3.46Å; E2032-R2061 VanDerWaalsContact CD-NH1 3.25Å; E2032-R2061 IonicContact OE1-CZ 3.42Å; E2032-R2061 IonicContact OE1-NH1 2.64Å; E2032-R2061 PolarHBondContact OE1-NH1 3.09Å; E2032-R2061 VanDerWaalsContact OE1-NH1 3.11Å; E2032-R2061 IonicContact OE1-NH2 2.92Å; E2032-R2061 PolarHBondContact OE1-NH2 2.91Å; E2032-R2061 WeakPolarHBondContact OE2-CD 3.48Å; E2032-R2061 IonicContact OE2-CZ 2.97Å; E2032-R2061 IonicContact OE2-NE 2.96Å; E2032-R2061 PolarHBondContact OE2-NE 3.34Å; E2032-R2061 IonicContact OE2-NH1 2.68Å; E2032-R2061 PolarHBondContact OE2-NH1 2.92Å; E2032-R2061 IonicContact OE2-NH2 2.68Å; E2032-R2061 PolarHBondContact OE2-NH2 3.27Å; L2033-R2061 CarbonylContact O-C 3.56Å; L2033-R2061 WeakPolarHBondContact O-CA 3.35Å
2062	W	86.7	Confident	84.8	Confident	12 Å²	12	31.6 Å²	31.6	5%	0.045	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.9	179.1	-56.5	-82.4	0	0	0	109.4	D1992 E2032 L2033 F2035 H2057 S2060 V2086 V2092 F2094	D1992-W2062 PolarHBondContact OD1-NE1 2.92Å; D1992-W2062 PolarHBondContact OD2-NE1 3.01Å; E2032-W2062 CarbonylContact C-O 3.57Å; E2032-W2062 VanDerWaalsContact CA-O 3.31Å; E2032-W2062 WeakPolarHBondContact CA-O 3.37Å; E2032-W2062 WeakPolarHBondContact CB-O 3.42Å; L2033-W2062 HydrophobicContact CB-CB 4.46Å; L2033-W2062 HydrophobicContact CB-CE3 4.38Å; L2033-W2062 HydrophobicContact CD2-CE3 4Å; L2033-W2062 HydrophobicContact CD2-CZ3 4.3Å; L2033-W2062 HydrophobicContact CG-CE3 4.04Å; L2033-W2062 HydrophobicContact CG-CZ3 4.33Å; L2033-W2062 PolarHBondContact N-O 3.31Å; L2033-W2062 PolarHBondContact O-N 3.28Å; F2035-W2062 HydrophobicContact CB-CZ3 4.29Å; H2057-W2062 HydrophobicContact CB-CH2 4.23Å; H2057-W2062 HydrophobicContact CB-CZ2 3.99Å; H2057-W2062 AromaticContact CG-CZ2 3.9Å; H2057-W2062 AromaticContact ND1-CZ2 3.83Å; S2060-W2062 VanDerWaalsContact CB-CE2 3.42Å; S2060-W2062 VanDerWaalsContact CB-CH2 3.48Å; S2060-W2062 WeakPolarHBondContact O-CZ3 3.31Å; S2060-W2062 VanDerWaalsContact OG-CZ2 3.3Å; S2060-W2062 WeakPolarHBondContact OG-CZ2 3.18Å; W2062-V2086 HydrophobicContact CG-CG1 4.36Å; W2062-V2092 HydrophobicContact CH2-CB 4.3Å; W2062-V2092 HydrophobicContact CH2-CG1 4.24Å; W2062-V2092 HydrophobicContact CH2-CG2 3.95Å; W2062-V2092 HydrophobicContact CZ2-CB 4.02Å; W2062-V2092 HydrophobicContact CZ2-CG1 3.93Å; W2062-V2092 HydrophobicContact CZ2-CG2 3.96Å; W2062-V2092 HydrophobicContact CZ3-CG1 4.46Å; W2062-F2094 HydrophobicContact CH2-CE2 4.35Å; W2062-F2094 AromaticContact CH2-CZ 3.76Å; W2062-F2094 HydrophobicContact CH2-CZ 3.76Å; W2062-F2094 HydrophobicContact CZ3-CE2 4.25Å; W2062-F2094 AromaticContact CZ3-CZ 3.79Å; W2062-F2094 HydrophobicContact CZ3-CZ 3.79Å
2063	S	87.1	Confident	85.4	Confident	38.75 Å²	38.75	30.9 Å²	30.9	27%	0.271	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	139.4	170.6	176.1	0	0	0	0	109.5	Y2031 S2065 E2066	Y2031-S2063 PolarHBondContact O-OG 2.73Å; S2063-S2065 PolarHBondContact O-N 2.96Å; S2063-S2065 VanDerWaalsContact O-N 3.11Å; S2063-S2065 PolarHBondContact OG-N 3.01Å; S2063-S2065 PolarHBondContact OG-OG 3.3Å; S2063-E2066 WeakPolarHBondContact CB-OE2 3.28Å; S2063-E2066 PolarHBondContact N-OE2 2.94Å; S2063-E2066 VanDerWaalsContact N-OE2 3.08Å; S2063-E2066 WeakPolarHBondContact O-CB 3.25Å; S2063-E2066 PolarHBondContact O-N 3.06Å
2064	L	88.8	Confident	85.9	Confident	26.5 Å²	26.5	30.8 Å²	30.8	14%	0.139	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-61.3	-21.5	174.6	-63	-176.6	0	0	0	112	I2028 Y2031 L2033 E2066 I2067 L2109 P2110	I2028-L2064 HydrophobicContact CG2-CD2 4.44Å; Y2031-L2064 PolarHBondContact O-N 3.26Å; L2033-L2064 HydrophobicContact CB-CD2 4.04Å; L2064-E2066 VanDerWaalsContact C-N 3.3Å; L2064-E2066 PolarHBondContact O-N 2.92Å; L2064-I2067 HydrophobicContact CD2-CD1 3.8Å; L2064-I2067 PolarHBondContact O-N 2.75Å; L2064-L2109 HydrophobicContact CD2-CD2 3.91Å; L2064-P2110 HydrophobicContact CB-CG 4.1Å; L2064-P2110 HydrophobicContact CD2-CG 4.39Å; L2064-P2110 HydrophobicContact CG-CG 4.45Å; L2064-P2110 WeakPolarHBondContact O-CG 3.41Å
2065	S	86.1	Confident	86.2	Confident	92.5 Å²	92.5	31.7 Å²	31.7	65%	0.647	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-17.1	172.9	67.3	0	0	0	0	114.4	S2063 R2068	S2063-S2065 PolarHBondContact O-N 2.96Å; S2063-S2065 VanDerWaalsContact O-N 3.11Å; S2063-S2065 PolarHBondContact OG-N 3.01Å; S2063-S2065 PolarHBondContact OG-OG 3.3Å; S2065-R2068 PolarHBondContact O-NH1 2.71Å; S2065-R2068 PolarHBondContact O-NH2 3.15Å
2066	E	86	Confident	86.4	Confident	63.25 Å²	63.25	32.5 Å²	32.5	30%	0.296	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-19.2	-179	-68.6	173.5	148.2	0	0	112.4	S1993 S2063 L2064 R2068 V2086 T2087	S1993-E2066 PolarHBondContact OG-OE2 2.82Å; S2063-E2066 WeakPolarHBondContact CB-OE2 3.28Å; S2063-E2066 PolarHBondContact N-OE2 2.94Å; S2063-E2066 VanDerWaalsContact N-OE2 3.08Å; S2063-E2066 WeakPolarHBondContact O-CB 3.25Å; S2063-E2066 PolarHBondContact O-N 3.06Å; L2064-E2066 VanDerWaalsContact C-N 3.3Å; L2064-E2066 PolarHBondContact O-N 2.92Å; E2066-R2068 PolarHBondContact O-N 2.9Å; E2066-V2086 CarbonylContact O-C 3.48Å; E2066-V2086 VanDerWaalsContact O-CA 3.25Å; E2066-V2086 WeakPolarHBondContact O-CA 3.26Å; E2066-T2087 WeakPolarHBondContact CA-OG1 3.36Å; E2066-T2087 WeakPolarHBondContact CB-OG1 3.29Å; E2066-T2087 VanDerWaalsContact CG-OG1 3.29Å; E2066-T2087 WeakPolarHBondContact CG-OG1 3.45Å; E2066-T2087 WeakPolarHBondContact O-CB 3.3Å; E2066-T2087 PolarHBondContact O-N 3.24Å; E2066-T2087 PolarHBondContact O-OG1 3.2Å
2067	I	91.3	Very high	87.1	Confident	4.75 Å²	4.75	31.6 Å²	31.6	2%	0.024	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	131.7	178.7	-59.7	178	0	0	0	109.7	L2033 L2064 I2070 I2084 V2086 L2109 P2110 V2112	L2033-I2067 HydrophobicContact CD2-CD1 4.42Å; L2064-I2067 HydrophobicContact CD2-CD1 3.8Å; L2064-I2067 PolarHBondContact O-N 2.75Å; I2067-I2070 HydrophobicContact CG2-CD1 4.1Å; I2067-I2070 HydrophobicContact CG2-CG1 3.83Å; I2067-I2084 HydrophobicContact CB-CG2 4.43Å; I2067-I2084 HydrophobicContact CD1-CG2 4.12Å; I2067-I2084 HydrophobicContact CG1-CG2 3.97Å; I2067-I2084 HydrophobicContact CG2-CG2 3.81Å; I2067-V2086 HydrophobicContact CG1-CG1 4.42Å; I2067-L2109 HydrophobicContact CD1-CD2 3.94Å; I2067-P2110 HydrophobicContact CB-CG 4.29Å; I2067-P2110 HydrophobicContact CD1-CG 4.23Å; I2067-P2110 HydrophobicContact CG2-CG 4.44Å; I2067-V2112 HydrophobicContact CG2-CG1 4.4Å; I2067-V2112 HydrophobicContact CG2-CG2 3.84Å; I2067-V2112 WeakPolarHBondContact O-CG1 3.36Å
2068	R	89	Confident	87.6	Confident	133.5 Å²	133.5	34.1 Å²	34.1	50%	0.504	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	-29	-176.4	-66.2	-78.2	177.3	-179.6	-2.6	114.6	S2065 E2066 F2085 T2087	S2065-R2068 PolarHBondContact O-NH1 2.71Å; S2065-R2068 PolarHBondContact O-NH2 3.15Å; E2066-R2068 PolarHBondContact O-N 2.9Å; R2068-F2085 PolarHBondContact N-O 3.03Å; R2068-T2087 HydrophobicContact CG-CG2 4.05Å; R2068-T2087 VanDerWaalsContact NE-CG2 3.3Å; R2068-T2087 PolarHBondContact NE-OG1 3.42Å; R2068-T2087 VanDerWaalsContact NH2-CG2 3.29Å; R2068-T2087 PolarHBondContact NH2-OG1 3.42Å
2069	A	92.8	Very high	88.2	Confident	8.75 Å²	8.75	38.4 Å²	38.4	7%	0.072	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	148.7	173.2	0	0	0	0	0	110	F2071 F2085 G2113 I2114	A2069-F2071 HydrophobicContact CB-CD2 4.35Å; A2069-F2071 HydrophobicContact CB-CE2 3.78Å; A2069-F2071 HydrophobicContact CB-CZ 4.48Å; A2069-F2085 HydrophobicContact CB-CB 4.18Å; A2069-F2085 HydrophobicContact CB-CD2 4.37Å; A2069-F2085 HydrophobicContact CB-CG 4.48Å; A2069-F2085 PolarHBondContact N-O 3.13Å; A2069-F2085 PolarHBondContact O-N 2.9Å; A2069-G2113 CarbonylContact C-O 3.57Å; A2069-G2113 WeakPolarHBondContact CA-O 3.27Å; A2069-I2114 VanDerWaalsContact CB-C 3.48Å
2070	I	95.4	Very high	89.2	Confident	2.5 Å²	2.5	38.1 Å²	38.1	1%	0.013	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	124.2	174.3	-55.9	161.3	0	0	0	107.2	I2067 L2082 E2083 I2084 L2109 V2112 G2113 I2114 T2127	I2067-I2070 HydrophobicContact CG2-CD1 4.1Å; I2067-I2070 HydrophobicContact CG2-CG1 3.83Å; I2070-L2082 HydrophobicContact CG2-CB 4.49Å; I2070-L2082 HydrophobicContact CG2-CD2 4.12Å; I2070-E2083 WeakPolarHBondContact CA-O 3.33Å; I2070-I2084 HydrophobicContact CG1-CG1 4.46Å; I2070-I2084 HydrophobicContact CG1-CG2 4.47Å; I2070-I2084 HydrophobicContact CG2-CG1 4.39Å; I2070-L2109 HydrophobicContact CD1-CB 3.75Å; I2070-L2109 HydrophobicContact CD1-CD1 3.81Å; I2070-L2109 HydrophobicContact CD1-CG 4.36Å; I2070-V2112 HydrophobicContact CB-CG2 4.43Å; I2070-V2112 HydrophobicContact CD1-CG2 3.67Å; I2070-V2112 HydrophobicContact CG1-CG2 3.7Å; I2070-G2113 PolarHBondContact N-O 3.04Å; I2070-I2114 WeakPolarHBondContact O-CG2 3.39Å; I2070-T2127 HydrophobicContact CB-CG2 3.95Å; I2070-T2127 HydrophobicContact CG2-CG2 3.64Å; I2070-T2127 WeakPolarHBondContact O-CB 3.4Å; I2070-T2127 VanDerWaalsContact O-CG2 3.29Å; I2070-T2127 WeakPolarHBondContact O-CG2 3.26Å; I2070-T2127 PolarHBondContact O-OG1 3.09Å; I2070-T2127 VanDerWaalsContact O-OG1 3.05Å
2071	F	94.5	Very high	90.2	Very high	7 Å²	7	37.1 Å²	37.1	3%	0.031	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135.6	177.6	-67.3	-101.9	0	0	0	111	A2069 R2073 L2082 E2083 F2085 I2114 Y2118 T2160	A2069-F2071 HydrophobicContact CB-CD2 4.35Å; A2069-F2071 HydrophobicContact CB-CE2 3.78Å; A2069-F2071 HydrophobicContact CB-CZ 4.48Å; F2071-R2073 VanDerWaalsContact CB-NH1 3.31Å; F2071-R2073 VanDerWaalsContact CG-NH2 3.29Å; F2071-L2082 WeakPolarHBondContact O-CA 3.31Å; F2071-E2083 HydrophobicContact CB-CB 4.43Å; F2071-E2083 PolarHBondContact N-O 3.13Å; F2071-E2083 PolarHBondContact O-N 2.99Å; F2071-F2085 AromaticContact CD2-CD2 3.67Å; F2071-F2085 HydrophobicContact CD2-CD2 3.67Å; F2071-F2085 AromaticContact CD2-CE2 3.45Å; F2071-F2085 HydrophobicContact CD2-CE2 3.45Å; F2071-F2085 VanDerWaalsContact CD2-CE2 3.42Å; F2071-F2085 AromaticContact CE2-CD2 3.69Å; F2071-F2085 HydrophobicContact CE2-CD2 3.69Å; F2071-F2085 AromaticContact CE2-CE2 3.56Å; F2071-F2085 HydrophobicContact CE2-CE2 3.56Å; F2071-F2085 HydrophobicContact CE2-CZ 4.4Å; F2071-F2085 HydrophobicContact CG-CE2 4.47Å; F2071-I2114 HydrophobicContact CD1-CB 4.02Å; F2071-I2114 HydrophobicContact CD1-CG2 3.69Å; F2071-I2114 HydrophobicContact CE1-CB 3.65Å; F2071-I2114 HydrophobicContact CE1-CD1 4.2Å; F2071-I2114 HydrophobicContact CE1-CG1 4.45Å; F2071-I2114 HydrophobicContact CE1-CG2 3.86Å; F2071-I2114 HydrophobicContact CE2-CB 4.35Å; F2071-I2114 HydrophobicContact CG-CB 4.46Å; F2071-I2114 HydrophobicContact CG-CG2 4.16Å; F2071-I2114 HydrophobicContact CZ-CB 3.87Å; F2071-I2114 HydrophobicContact CZ-CG2 4.39Å; F2071-Y2118 AromaticContact CE1-CE2 3.96Å; F2071-Y2118 HydrophobicContact CE1-CE2 4.04Å; F2071-Y2118 HydrophobicContact CZ-CD2 4.48Å; F2071-Y2118 AromaticContact CZ-CE2 3.77Å; F2071-Y2118 HydrophobicContact CZ-CE2 3.77Å; F2071-T2160 HydrophobicContact CE1-CG2 4Å; F2071-T2160 HydrophobicContact CZ-CG2 3.93Å
2072	N	94.9	Very high	90.8	Very high	29.25 Å²	29.25	33 Å²	33	16%	0.156	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	134.7	162.2	-169.6	8.2	0	0	0	110.3	A2081 T2127	N2072-A2081 PolarHBondContact OD1-O 3.07Å; N2072-A2081 VanDerWaalsContact OD1-O 3.09Å; N2072-T2127 VanDerWaalsContact CB-O 3.27Å; N2072-T2127 WeakPolarHBondContact CB-O 3.41Å; N2072-T2127 PolarHBondContact N-O 3.14Å; N2072-T2127 VanDerWaalsContact N-O 3.13Å
2073	R	94.5	Very high	91.3	Very high	7 Å²	7	32.5 Å²	32.5	3%	0.026	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	157.9	-176.2	-65.1	-62.4	-179.7	-136	9.6	111	F2071 K2079 A2081 E2083 L2093 T2160 G2163	F2071-R2073 VanDerWaalsContact CB-NH1 3.31Å; F2071-R2073 VanDerWaalsContact CG-NH2 3.29Å; R2073-K2079 CarbonylContact O-C 3.38Å; R2073-A2081 HydrophobicContact CB-CB 3.9Å; R2073-A2081 PolarHBondContact N-O 3.15Å; R2073-A2081 PolarHBondContact O-N 3.04Å; R2073-A2081 VanDerWaalsContact O-N 3.14Å; R2073-E2083 HydrophobicContact CG-CB 3.73Å; R2073-E2083 IonicContact CZ-OE2 3.37Å; R2073-E2083 VanDerWaalsContact CZ-OE2 3.23Å; R2073-E2083 IonicContact NE-OE2 3.27Å; R2073-E2083 PolarHBondContact NE-OE2 3.04Å; R2073-E2083 IonicContact NH2-OE2 3.42Å; R2073-E2083 PolarHBondContact NH2-OE2 3.07Å; R2073-L2093 HydrophobicContact CB-CD1 4.02Å; R2073-L2093 HydrophobicContact CG-CD1 3.95Å; R2073-T2160 VanDerWaalsContact CZ-O 3.3Å; R2073-T2160 PolarHBondContact NH1-O 3.09Å; R2073-T2160 PolarHBondContact NH2-O 2.88Å; R2073-T2160 VanDerWaalsContact NH2-O 3.13Å; R2073-G2163 WeakPolarHBondContact CD-O 3.41Å
2074	S	91.6	Very high	91.7	Very high	20.75 Å²	20.75	30.7 Å²	30.7	15%	0.145	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	140.7	169	-58.7	0	0	0	0	109.6	R2078 Q2171	S2074-R2078 CarbonylContact C-O 3.53Å; S2074-R2078 VanDerWaalsContact CA-O 3.24Å; S2074-R2078 WeakPolarHBondContact CA-O 3.4Å; S2074-Q2171 PolarHBondContact O-NE2 3.28Å; S2074-Q2171 PolarHBondContact O-OE1 3.01Å
2075	F	91.1	Very high	91.9	Very high	29.75 Å²	29.75	30.5 Å²	30.5	13%	0.13	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	122	166.9	177.7	-108.4	0	0	0	107.4	I2014 V2016 T2021 H2077 R2078 V2080 A2081 A2095	I2014-F2075 HydrophobicContact CD1-CE1 4.46Å; V2016-F2075 HydrophobicContact CG1-CE2 4.36Å; V2016-F2075 HydrophobicContact CG2-CD2 3.9Å; V2016-F2075 HydrophobicContact CG2-CE2 3.74Å; V2016-F2075 HydrophobicContact CG2-CZ 4.42Å; T2021-F2075 HydrophobicContact CG2-CE2 4.11Å; T2021-F2075 HydrophobicContact CG2-CZ 3.79Å; F2075-H2077 VanDerWaalsContact C-N 3.31Å; F2075-H2077 PolarHBondContact O-N 3.07Å; F2075-R2078 PolarHBondContact N-O 3.3Å; F2075-R2078 WeakPolarHBondContact O-CB 3.44Å; F2075-R2078 PolarHBondContact O-N 3.05Å; F2075-V2080 HydrophobicContact CB-CG2 4.43Å; F2075-A2081 HydrophobicContact CB-CB 4Å; F2075-A2095 HydrophobicContact CB-CB 3.9Å; F2075-A2095 HydrophobicContact CD1-CB 3.68Å; F2075-A2095 HydrophobicContact CD2-CB 4.32Å; F2075-A2095 HydrophobicContact CE1-CB 4.28Å; F2075-A2095 HydrophobicContact CG-CB 3.7Å
2076	L	88	Confident	92.1	Very high	17.5 Å²	17.5	26.5 Å²	26.5	9%	0.092	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	49.8	-174	-54.1	176.4	0	0	0	112.4	R2078 W2384 Q2397 I2400 Q2401	L2076-R2078 PolarHBondContact O-N 3.18Å; L2076-W2384 WeakPolarHBondContact O-CZ2 3.35Å; L2076-Q2397 HydrophobicContact CD1-CB 4.06Å; L2076-Q2397 HydrophobicContact CD1-CG 3.88Å; L2076-I2400 HydrophobicContact CB-CG2 4.48Å; L2076-I2400 HydrophobicContact CD2-CG2 4.22Å; L2076-Q2401 HydrophobicContact CD2-CB 4.43Å; L2076-Q2401 HydrophobicContact CD2-CG 3.52Å
2077	H	86.2	Confident	91.9	Very high	21.25 Å²	21.25	26 Å²	26	10%	0.098	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	9.7	-174.7	-61.6	-50.4	0	0	0	116.7	F2075 L2376 T2377	F2075-H2077 VanDerWaalsContact C-N 3.31Å; F2075-H2077 PolarHBondContact O-N 3.07Å; H2077-L2376 PolarHBondContact CD2-O 3.09Å; H2077-L2376 PolarHBondContact NE2-O 3.12Å; H2077-L2376 VanDerWaalsContact NE2-O 3.09Å; H2077-T2377 PolarHBondContact CE1-O 3.26Å; H2077-T2377 PolarHBondContact NE2-O 3Å
2078	R	87.9	Confident	91.4	Very high	75.5 Å²	75.5	28.2 Å²	28.2	29%	0.285	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	130.4	172.5	-59.2	-179.6	169.4	-169.8	1.1	110	S2074 F2075 L2076 V2080 T2097 W2384	S2074-R2078 CarbonylContact C-O 3.53Å; S2074-R2078 VanDerWaalsContact CA-O 3.24Å; S2074-R2078 WeakPolarHBondContact CA-O 3.4Å; F2075-R2078 PolarHBondContact N-O 3.3Å; F2075-R2078 WeakPolarHBondContact O-CB 3.44Å; F2075-R2078 PolarHBondContact O-N 3.05Å; L2076-R2078 PolarHBondContact O-N 3.18Å; R2078-V2080 HydrophobicContact CB-CB 4.49Å; R2078-V2080 HydrophobicContact CB-CG1 4.06Å; R2078-V2080 HydrophobicContact CB-CG2 3.79Å; R2078-V2080 PolarHBondContact O-N 3.23Å; R2078-T2097 PolarHBondContact NH2-O 3.46Å; R2078-W2384 HydrophobicContact CG-CG 4.32Å; R2078-W2384 VanDerWaalsContact NE-CD1 3.32Å; R2078-W2384 VanDerWaalsContact NE-CD2 3.32Å; R2078-W2384 VanDerWaalsContact NE-CE2 3.28Å; R2078-W2384 VanDerWaalsContact NE-CG 3.25Å; R2078-W2384 VanDerWaalsContact NH2-CD2 3.3Å
2079	K	90.3	Very high	91.2	Very high	90.5 Å²	90.5	25.1 Å²	25.1	39%	0.393	13%	0.125	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	61	178.9	-65.5	176.3	-177.7	119.6	0	111.4	R2073 M2099 D2379	R2073-K2079 CarbonylContact O-C 3.38Å; K2079-M2099 HydrophobicContact CB-CE 3.53Å; K2079-M2099 WeakPolarHBondContact O-CE 3.35Å; K2079-M2099 VanDerWaalsContact O-SD 3.38Å; K2079-D2379 WeakPolarHBondContact CE-OD2 3.24Å; K2079-D2379 IonicContact NZ-OD1 3.18Å; K2079-D2379 PolarHBondContact NZ-OD1 2.98Å; K2079-D2379 IonicContact NZ-OD2 3.87Å; K2079-D2379 PolarHBondContact NZ-OD2 3.28Å
2080	V	93.5	Very high	90.9	Very high	12.5 Å²	12.5	25 Å²	25	8%	0.076	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	17.5	-171.5	-60.5	0	0	0	0	112.4	F2075 R2078 F2096	F2075-V2080 HydrophobicContact CB-CG2 4.43Å; R2078-V2080 HydrophobicContact CB-CB 4.49Å; R2078-V2080 HydrophobicContact CB-CG1 4.06Å; R2078-V2080 HydrophobicContact CB-CG2 3.79Å; R2078-V2080 PolarHBondContact O-N 3.23Å; V2080-F2096 WeakPolarHBondContact CB-O 3.39Å; V2080-F2096 VanDerWaalsContact CG2-O 3.29Å; V2080-F2096 WeakPolarHBondContact CG2-O 3.44Å; V2080-F2096 WeakPolarHBondContact O-CD2 3.38Å; V2080-F2096 PolarHBondContact O-N 3.03Å
2081	A	95.8	Very high	90.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	154.9	-176.5	0	0	0	0	0	113.1	N2072 R2073 F2075 L2093 F2094 A2095	N2072-A2081 PolarHBondContact OD1-O 3.07Å; N2072-A2081 VanDerWaalsContact OD1-O 3.09Å; R2073-A2081 HydrophobicContact CB-CB 3.9Å; R2073-A2081 PolarHBondContact N-O 3.15Å; R2073-A2081 PolarHBondContact O-N 3.04Å; R2073-A2081 VanDerWaalsContact O-N 3.14Å; F2075-A2081 HydrophobicContact CB-CB 4Å; A2081-L2093 HydrophobicContact CB-CD1 4.05Å; A2081-F2094 CarbonylContact C-O 3.34Å; A2081-F2094 WeakPolarHBondContact CA-O 3.27Å; A2081-F2094 VanDerWaalsContact CB-O 3.32Å; A2081-F2094 WeakPolarHBondContact CB-O 3.3Å; A2081-A2095 HydrophobicContact CB-CB 4.11Å
2082	L	96.3	Very high	90.7	Very high	0.5 Å²	0.5	25.1 Å²	25.1	0%	0.003	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	127.2	176.8	-66.4	174.9	0	0	0	110.2	I2070 F2071 L2093 F2094 F2096 V2102 V2105 V2106 T2127	I2070-L2082 HydrophobicContact CG2-CB 4.49Å; I2070-L2082 HydrophobicContact CG2-CD2 4.12Å; F2071-L2082 WeakPolarHBondContact O-CA 3.31Å; L2082-L2093 WeakPolarHBondContact O-CA 3.38Å; L2082-F2094 PolarHBondContact N-O 3.2Å; L2082-F2094 PolarHBondContact O-N 3.32Å; L2082-F2096 HydrophobicContact CB-CE2 4.1Å; L2082-F2096 HydrophobicContact CD1-CE2 3.79Å; L2082-F2096 HydrophobicContact CD1-CZ 4.32Å; L2082-F2096 HydrophobicContact CG-CE2 3.93Å; L2082-V2102 HydrophobicContact CD1-CG1 4.26Å; L2082-V2102 HydrophobicContact CD2-CG1 3.8Å; L2082-V2102 HydrophobicContact CG-CG1 4.03Å; L2082-V2105 HydrophobicContact CD1-CB 4.18Å; L2082-V2105 HydrophobicContact CD1-CG1 3.67Å; L2082-V2106 HydrophobicContact CD1-CG2 3.75Å; L2082-V2106 HydrophobicContact CD2-CG2 3.74Å; L2082-V2106 HydrophobicContact CG-CG2 4.41Å; L2082-T2127 HydrophobicContact CD2-CG2 4.45Å
2083	E	96	Very high	90.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	121.2	169.3	-168.9	176.5	-144.2	0	0	109.6	I2070 F2071 R2073 F2085 V2092 L2093 S2165	I2070-E2083 WeakPolarHBondContact CA-O 3.33Å; F2071-E2083 HydrophobicContact CB-CB 4.43Å; F2071-E2083 PolarHBondContact N-O 3.13Å; F2071-E2083 PolarHBondContact O-N 2.99Å; R2073-E2083 HydrophobicContact CG-CB 3.73Å; R2073-E2083 IonicContact CZ-OE2 3.37Å; R2073-E2083 VanDerWaalsContact CZ-OE2 3.23Å; R2073-E2083 IonicContact NE-OE2 3.27Å; R2073-E2083 PolarHBondContact NE-OE2 3.04Å; R2073-E2083 IonicContact NH2-OE2 3.42Å; R2073-E2083 PolarHBondContact NH2-OE2 3.07Å; E2083-F2085 HydrophobicContact CB-CE2 4.27Å; E2083-F2085 HydrophobicContact CG-CD2 4.3Å; E2083-F2085 HydrophobicContact CG-CE2 3.6Å; E2083-F2085 HydrophobicContact CG-CZ 4.04Å; E2083-F2085 WeakPolarHBondContact OE2-CE2 3.37Å; E2083-F2085 WeakPolarHBondContact OE2-CZ 3.24Å; E2083-V2092 CarbonylContact C-O 3.57Å; E2083-V2092 WeakPolarHBondContact CA-O 3.36Å; E2083-L2093 HydrophobicContact CB-CD1 4.08Å; E2083-S2165 VanDerWaalsContact OE1-CB 3.27Å; E2083-S2165 WeakPolarHBondContact OE1-CB 3.36Å; E2083-S2165 PolarHBondContact OE1-OG 2.96Å
2084	I	95	Very high	90.8	Very high	1.5 Å²	1.5	23.6 Å²	23.6	1%	0.008	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	120.9	-175.8	-55.4	177.7	0	0	0	108.4	L2033 I2067 I2070 V2086 S2091 V2092 F2094 L2109	L2033-I2084 HydrophobicContact CD2-CD1 3.64Å; I2067-I2084 HydrophobicContact CB-CG2 4.43Å; I2067-I2084 HydrophobicContact CD1-CG2 4.12Å; I2067-I2084 HydrophobicContact CG1-CG2 3.97Å; I2067-I2084 HydrophobicContact CG2-CG2 3.81Å; I2070-I2084 HydrophobicContact CG1-CG1 4.46Å; I2070-I2084 HydrophobicContact CG1-CG2 4.47Å; I2070-I2084 HydrophobicContact CG2-CG1 4.39Å; I2084-V2086 HydrophobicContact CG2-CG1 4.35Å; I2084-S2091 CarbonylContact O-C 3.57Å; I2084-S2091 VanDerWaalsContact O-CA 3.26Å; I2084-S2091 WeakPolarHBondContact O-CA 3.39Å; I2084-V2092 HydrophobicContact CB-CG1 3.95Å; I2084-V2092 PolarHBondContact N-O 3.2Å; I2084-V2092 PolarHBondContact O-N 3.23Å; I2084-F2094 HydrophobicContact CD1-CD2 4.26Å; I2084-F2094 HydrophobicContact CD1-CE2 4.4Å; I2084-L2109 HydrophobicContact CD1-CD1 4.01Å
2085	F	92.9	Very high	91	Very high	21.25 Å²	21.25	22.7 Å²	22.7	9%	0.093	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	133.8	177.1	-70.1	-99.5	0	0	0	110.2	R2068 A2069 F2071 E2083	R2068-F2085 PolarHBondContact N-O 3.03Å; A2069-F2085 HydrophobicContact CB-CB 4.18Å; A2069-F2085 HydrophobicContact CB-CD2 4.37Å; A2069-F2085 HydrophobicContact CB-CG 4.48Å; A2069-F2085 PolarHBondContact N-O 3.13Å; A2069-F2085 PolarHBondContact O-N 2.9Å; F2071-F2085 AromaticContact CD2-CD2 3.67Å; F2071-F2085 HydrophobicContact CD2-CD2 3.67Å; F2071-F2085 AromaticContact CD2-CE2 3.45Å; F2071-F2085 HydrophobicContact CD2-CE2 3.45Å; F2071-F2085 VanDerWaalsContact CD2-CE2 3.42Å; F2071-F2085 AromaticContact CE2-CD2 3.69Å; F2071-F2085 HydrophobicContact CE2-CD2 3.69Å; F2071-F2085 AromaticContact CE2-CE2 3.56Å; F2071-F2085 HydrophobicContact CE2-CE2 3.56Å; F2071-F2085 HydrophobicContact CE2-CZ 4.4Å; F2071-F2085 HydrophobicContact CG-CE2 4.47Å; E2083-F2085 HydrophobicContact CB-CE2 4.27Å; E2083-F2085 HydrophobicContact CG-CD2 4.3Å; E2083-F2085 HydrophobicContact CG-CE2 3.6Å; E2083-F2085 HydrophobicContact CG-CZ 4.04Å; E2083-F2085 WeakPolarHBondContact OE2-CE2 3.37Å; E2083-F2085 WeakPolarHBondContact OE2-CZ 3.24Å
2086	V	90.2	Very high	91.2	Very high	8.75 Å²	8.75	21.9 Å²	21.9	5%	0.053	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	165.8	-172.2	-70.3	0	0	0	0	112.8	W2062 E2066 I2067 I2084 S2088 R2089 G2090	W2062-V2086 HydrophobicContact CG-CG1 4.36Å; E2066-V2086 CarbonylContact O-C 3.48Å; E2066-V2086 VanDerWaalsContact O-CA 3.25Å; E2066-V2086 WeakPolarHBondContact O-CA 3.26Å; I2067-V2086 HydrophobicContact CG1-CG1 4.42Å; I2084-V2086 HydrophobicContact CG2-CG1 4.35Å; V2086-S2088 VanDerWaalsContact CG2-OG 3.27Å; V2086-S2088 WeakPolarHBondContact CG2-OG 3.33Å; V2086-S2088 PolarHBondContact O-N 3.08Å; V2086-R2089 WeakPolarHBondContact O-CA 3.29Å; V2086-R2089 PolarHBondContact O-N 3.03Å; V2086-R2089 VanDerWaalsContact O-N 3.1Å; V2086-G2090 WeakPolarHBondContact CG2-O 3.37Å; V2086-G2090 PolarHBondContact N-O 3.27Å; V2086-G2090 VanDerWaalsContact N-O 3.13Å
2087	T	83.7	Confident	91.3	Very high	54 Å²	54	25.5 Å²	25.5	33%	0.331	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-26.3	-178.4	-15.5	0	0	0	0	113.9	E2066 R2068 R2089	E2066-T2087 WeakPolarHBondContact CA-OG1 3.36Å; E2066-T2087 WeakPolarHBondContact CB-OG1 3.29Å; E2066-T2087 VanDerWaalsContact CG-OG1 3.29Å; E2066-T2087 WeakPolarHBondContact CG-OG1 3.45Å; E2066-T2087 WeakPolarHBondContact O-CB 3.3Å; E2066-T2087 PolarHBondContact O-N 3.24Å; E2066-T2087 PolarHBondContact O-OG1 3.2Å; R2068-T2087 HydrophobicContact CG-CG2 4.05Å; R2068-T2087 VanDerWaalsContact NE-CG2 3.3Å; R2068-T2087 PolarHBondContact NE-OG1 3.42Å; R2068-T2087 VanDerWaalsContact NH2-CG2 3.29Å; R2068-T2087 PolarHBondContact NH2-OG1 3.42Å; T2087-R2089 PolarHBondContact O-N 3.13Å; T2087-R2089 VanDerWaalsContact O-N 3.12Å
2088	S	79.1	Confident	91.5	Very high	51.25 Å²	51.25	26.9 Å²	26.9	36%	0.358	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	4.8	173.3	55.6	0	0	0	0	113.9	W1887 V2086 G2090 R2724	W1887-S2088 VanDerWaalsContact CE3-O 3.24Å; W1887-S2088 WeakPolarHBondContact CZ3-O 3.36Å; V2086-S2088 VanDerWaalsContact CG2-OG 3.27Å; V2086-S2088 WeakPolarHBondContact CG2-OG 3.33Å; V2086-S2088 PolarHBondContact O-N 3.08Å; S2088-G2090 VanDerWaalsContact C-N 3.29Å; S2088-G2090 PolarHBondContact O-N 3.14Å; S2088-G2090 VanDerWaalsContact O-N 3.16Å; S2088-R2724 PolarHBondContact O-NH2 3.45Å
2089	R	84.9	Confident	91.7	Very high	68 Å²	68	26.2 Å²	26.2	26%	0.257	14%	0.14	S	C	.	.	S	Bend	trans	63.1	18.7	-179	-52.7	-80.4	-163.2	140.1	-1.7	115.2	W1887 E1888 D1890 V2086 T2087 H2649 A2704	W1887-R2089 HydrophobicContact CD2-CB 4.16Å; W1887-R2089 HydrophobicContact CD2-CG 3.94Å; W1887-R2089 HydrophobicContact CE3-CB 4.11Å; W1887-R2089 HydrophobicContact CE3-CG 4.47Å; W1887-R2089 HydrophobicContact CG-CB 4.13Å; W1887-R2089 HydrophobicContact CG-CG 4.43Å; W1887-R2089 HydrophobicContact CH2-CG 4.05Å; W1887-R2089 HydrophobicContact CZ2-CB 4.13Å; W1887-R2089 HydrophobicContact CZ2-CG 3.98Å; W1887-R2089 VanDerWaalsContact CZ2-CG 3.45Å; E1888-R2089 WeakPolarHBondContact CA-O 3.4Å; E1888-R2089 VanDerWaalsContact CB-O 3.31Å; E1888-R2089 WeakPolarHBondContact CB-O 3.34Å; E1888-R2089 PolarHBondContact N-O 3.15Å; E1888-R2089 VanDerWaalsContact O-CB 3.25Å; E1888-R2089 WeakPolarHBondContact O-CB 3.32Å; E1888-R2089 VanDerWaalsContact O-CD 3.24Å; E1888-R2089 WeakPolarHBondContact O-CD 3.44Å; D1890-R2089 IonicContact OD1-CZ 3.23Å; D1890-R2089 VanDerWaalsContact OD1-CZ 3.27Å; D1890-R2089 IonicContact OD1-NH1 3Å; D1890-R2089 PolarHBondContact OD1-NH1 2.85Å; D1890-R2089 IonicContact OD1-NH2 3.28Å; D1890-R2089 PolarHBondContact OD1-NH2 3.21Å; D1890-R2089 IonicContact OD2-NH2 3.1Å; V2086-R2089 WeakPolarHBondContact O-CA 3.29Å; V2086-R2089 PolarHBondContact O-N 3.03Å; V2086-R2089 VanDerWaalsContact O-N 3.1Å; T2087-R2089 PolarHBondContact O-N 3.13Å; T2087-R2089 VanDerWaalsContact O-N 3.12Å; R2089-H2649 PolarHBondContact NH2-CD2 2.88Å; R2089-H2649 PolarHBondContact NH2-NE2 2.82Å; R2089-H2649 VanDerWaalsContact NH2-NE2 3.17Å; R2089-A2704 PolarHBondContact NE-O 3.03Å
2090	G	86.7	Confident	91.9	Very high	6.25 Å²	6.25	26.8 Å²	26.8	6%	0.064	15%	0.148	C	C	.	.			trans	-95.4	174.6	165.7	0	0	0	0	0	112.2	T1886 V2086 S2088	T1886-G2090 WeakPolarHBondContact O-CA 3.19Å; V2086-G2090 WeakPolarHBondContact CG2-O 3.37Å; V2086-G2090 PolarHBondContact N-O 3.27Å; V2086-G2090 VanDerWaalsContact N-O 3.13Å; S2088-G2090 VanDerWaalsContact C-N 3.29Å; S2088-G2090 PolarHBondContact O-N 3.14Å; S2088-G2090 VanDerWaalsContact O-N 3.16Å
2091	S	92.1	Very high	91.9	Very high	10.25 Å²	10.25	27.2 Å²	27.2	7%	0.072	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	143.7	171.9	61.5	0	0	0	0	111.2	E1888 I2084 N2167	E1888-S2091 PolarHBondContact OE1-OG 3.27Å; I2084-S2091 CarbonylContact O-C 3.57Å; I2084-S2091 VanDerWaalsContact O-CA 3.26Å; I2084-S2091 WeakPolarHBondContact O-CA 3.39Å; S2091-N2167 PolarHBondContact O-ND2 3.1Å; S2091-N2167 PolarHBondContact OG-ND2 3.3Å; S2091-N2167 VanDerWaalsContact OG-ND2 3.11Å
2092	V	93.4	Very high	91.8	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.012	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	138.7	176.9	63	0	0	0	0	110.3	L2015 H2057 W2062 E2083 I2084 F2094	L2015-V2092 HydrophobicContact CD1-CG2 3.49Å; L2015-V2092 VanDerWaalsContact CD1-CG2 3.46Å; H2057-V2092 HydrophobicContact CB-CG2 4.08Å; W2062-V2092 HydrophobicContact CH2-CB 4.3Å; W2062-V2092 HydrophobicContact CH2-CG1 4.24Å; W2062-V2092 HydrophobicContact CH2-CG2 3.95Å; W2062-V2092 HydrophobicContact CZ2-CB 4.02Å; W2062-V2092 HydrophobicContact CZ2-CG1 3.93Å; W2062-V2092 HydrophobicContact CZ2-CG2 3.96Å; W2062-V2092 HydrophobicContact CZ3-CG1 4.46Å; E2083-V2092 CarbonylContact C-O 3.57Å; E2083-V2092 WeakPolarHBondContact CA-O 3.36Å; I2084-V2092 HydrophobicContact CB-CG1 3.95Å; I2084-V2092 PolarHBondContact N-O 3.2Å; I2084-V2092 PolarHBondContact O-N 3.23Å; V2092-F2094 HydrophobicContact CB-CE2 4.38Å; V2092-F2094 HydrophobicContact CG1-CD2 4.43Å; V2092-F2094 HydrophobicContact CG1-CE2 3.74Å; V2092-F2094 HydrophobicContact CG1-CZ 4.38Å; V2092-F2094 HydrophobicContact CG2-CD2 4.36Å; V2092-F2094 HydrophobicContact CG2-CE1 4.22Å; V2092-F2094 HydrophobicContact CG2-CE2 3.7Å; V2092-F2094 HydrophobicContact CG2-CZ 3.62Å
2093	L	95.5	Very high	91.7	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	119.6	-176.8	178.3	61.4	0	0	0	110.8	V2016 R2073 A2081 L2082 E2083 N2167 D2168	V2016-L2093 HydrophobicContact CB-CB 4.36Å; V2016-L2093 HydrophobicContact CB-CD2 3.89Å; V2016-L2093 HydrophobicContact CB-CG 3.98Å; V2016-L2093 HydrophobicContact CG1-CD2 3.97Å; V2016-L2093 HydrophobicContact CG2-CD2 4.48Å; V2016-L2093 HydrophobicContact CG2-CG 4.42Å; V2016-L2093 PolarHBondContact N-O 2.88Å; R2073-L2093 HydrophobicContact CB-CD1 4.02Å; R2073-L2093 HydrophobicContact CG-CD1 3.95Å; A2081-L2093 HydrophobicContact CB-CD1 4.05Å; L2082-L2093 WeakPolarHBondContact O-CA 3.38Å; E2083-L2093 HydrophobicContact CB-CD1 4.08Å; L2093-N2167 HydrophobicContact CB-CB 3.8Å; L2093-N2167 HydrophobicContact CD2-CB 4.04Å; L2093-D2168 HydrophobicContact CD2-CB 4.13Å
2094	F	96.3	Very high	91.6	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	130.5	174.9	-64	-69.6	0	0	0	110.7	I2014 L2015 L2026 L2033 F2035 W2062 A2081 L2082 I2084 V2092 F2096	I2014-F2094 CarbonylContact O-C 3.53Å; I2014-F2094 VanDerWaalsContact O-CA 3.31Å; I2014-F2094 WeakPolarHBondContact O-CA 3.4Å; L2015-F2094 HydrophobicContact CB-CD1 4.29Å; L2015-F2094 HydrophobicContact CB-CE1 4.15Å; L2015-F2094 HydrophobicContact CD1-CD1 4.31Å; L2015-F2094 HydrophobicContact CD1-CE1 3.9Å; L2015-F2094 HydrophobicContact CD1-CZ 4.45Å; L2026-F2094 HydrophobicContact CD1-CD1 4.28Å; L2026-F2094 HydrophobicContact CD1-CD2 4.19Å; L2026-F2094 HydrophobicContact CD1-CE1 3.96Å; L2026-F2094 HydrophobicContact CD1-CE2 3.78Å; L2026-F2094 HydrophobicContact CD1-CG 4.39Å; L2026-F2094 HydrophobicContact CD1-CZ 3.65Å; L2026-F2094 HydrophobicContact CD2-CD2 4.28Å; L2026-F2094 HydrophobicContact CD2-CE2 4.47Å; L2026-F2094 HydrophobicContact CD2-CG 4.39Å; L2033-F2094 HydrophobicContact CD2-CE2 4.45Å; F2035-F2094 HydrophobicContact CB-CE1 3.97Å; F2035-F2094 HydrophobicContact CB-CZ 4.08Å; F2035-F2094 HydrophobicContact CD1-CE1 4.46Å; F2035-F2094 HydrophobicContact CD2-CD1 4.36Å; F2035-F2094 AromaticContact CD2-CE1 3.74Å; F2035-F2094 HydrophobicContact CD2-CE1 3.74Å; F2035-F2094 HydrophobicContact CE2-CE1 4.32Å; F2035-F2094 AromaticContact CG-CE1 3.82Å; F2035-F2094 HydrophobicContact CG-CE1 3.82Å; F2035-F2094 HydrophobicContact CG-CZ 4.38Å; W2062-F2094 HydrophobicContact CH2-CE2 4.35Å; W2062-F2094 AromaticContact CH2-CZ 3.76Å; W2062-F2094 HydrophobicContact CH2-CZ 3.76Å; W2062-F2094 HydrophobicContact CZ3-CE2 4.25Å; W2062-F2094 AromaticContact CZ3-CZ 3.79Å; W2062-F2094 HydrophobicContact CZ3-CZ 3.79Å; A2081-F2094 CarbonylContact C-O 3.34Å; A2081-F2094 WeakPolarHBondContact CA-O 3.27Å; A2081-F2094 VanDerWaalsContact CB-O 3.32Å; A2081-F2094 WeakPolarHBondContact CB-O 3.3Å; L2082-F2094 PolarHBondContact N-O 3.2Å; L2082-F2094 PolarHBondContact O-N 3.32Å; I2084-F2094 HydrophobicContact CD1-CD2 4.26Å; I2084-F2094 HydrophobicContact CD1-CE2 4.4Å; V2092-F2094 HydrophobicContact CB-CE2 4.38Å; V2092-F2094 HydrophobicContact CG1-CD2 4.43Å; V2092-F2094 HydrophobicContact CG1-CE2 3.74Å; V2092-F2094 HydrophobicContact CG1-CZ 4.38Å; V2092-F2094 HydrophobicContact CG2-CD2 4.36Å; V2092-F2094 HydrophobicContact CG2-CE1 4.22Å; V2092-F2094 HydrophobicContact CG2-CE2 3.7Å; V2092-F2094 HydrophobicContact CG2-CZ 3.62Å; F2094-F2096 HydrophobicContact CB-CE1 4.5Å; F2094-F2096 HydrophobicContact CB-CE2 3.86Å; F2094-F2096 HydrophobicContact CB-CZ 3.76Å; F2094-F2096 WeakPolarHBondContact O-CE2 3.41Å
2095	A	95.7	Very high	91.5	Very high	1.75 Å²	1.75	36 Å²	36	1%	0.014	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	139.9	169.3	0	0	0	0	0	110.6	C2013 I2014 V2016 F2075 A2081	C2013-A2095 CarbonylContact C-O 3.49Å; C2013-A2095 WeakPolarHBondContact CA-O 3.39Å; C2013-A2095 WeakPolarHBondContact CB-O 3.3Å; I2014-A2095 HydrophobicContact CB-CB 4.35Å; I2014-A2095 PolarHBondContact N-O 3.11Å; I2014-A2095 PolarHBondContact O-N 2.88Å; V2016-A2095 HydrophobicContact CG2-CB 4.2Å; F2075-A2095 HydrophobicContact CB-CB 3.9Å; F2075-A2095 HydrophobicContact CD1-CB 3.68Å; F2075-A2095 HydrophobicContact CD2-CB 4.32Å; F2075-A2095 HydrophobicContact CE1-CB 4.28Å; F2075-A2095 HydrophobicContact CG-CB 3.7Å; A2081-A2095 HydrophobicContact CB-CB 4.11Å
2096	F	95.8	Very high	91.6	Very high	13.5 Å²	13.5	35.1 Å²	35.1	6%	0.059	19%	0.189	C	C	.	.			trans	-117.6	172.1	-176.7	-57.3	-85.4	0	0	0	110.6	V2011 C2013 L2026 V2080 L2082 F2094 T2101 V2102 V2105	V2011-F2096 HydrophobicContact CG1-CD1 3.94Å; V2011-F2096 HydrophobicContact CG1-CE1 4.29Å; C2013-F2096 HydrophobicContact CB-CD1 3.68Å; C2013-F2096 HydrophobicContact CB-CE1 3.66Å; C2013-F2096 HydrophobicContact CB-CG 4.5Å; C2013-F2096 HydrophobicContact CB-CZ 4.49Å; L2026-F2096 HydrophobicContact CB-CE1 4.49Å; L2026-F2096 HydrophobicContact CD2-CE1 3.8Å; L2026-F2096 HydrophobicContact CD2-CZ 3.66Å; V2080-F2096 WeakPolarHBondContact CB-O 3.39Å; V2080-F2096 VanDerWaalsContact CG2-O 3.29Å; V2080-F2096 WeakPolarHBondContact CG2-O 3.44Å; V2080-F2096 WeakPolarHBondContact O-CD2 3.38Å; V2080-F2096 PolarHBondContact O-N 3.03Å; L2082-F2096 HydrophobicContact CB-CE2 4.1Å; L2082-F2096 HydrophobicContact CD1-CE2 3.79Å; L2082-F2096 HydrophobicContact CD1-CZ 4.32Å; L2082-F2096 HydrophobicContact CG-CE2 3.93Å; F2094-F2096 HydrophobicContact CB-CE1 4.5Å; F2094-F2096 HydrophobicContact CB-CE2 3.86Å; F2094-F2096 HydrophobicContact CB-CZ 3.76Å; F2094-F2096 WeakPolarHBondContact O-CE2 3.41Å; F2096-T2101 HydrophobicContact CB-CG2 3.95Å; F2096-T2101 HydrophobicContact CD1-CG2 3.86Å; F2096-T2101 HydrophobicContact CG-CG2 4.14Å; F2096-V2102 HydrophobicContact CB-CG2 4.19Å; F2096-V2102 HydrophobicContact CD2-CG2 3.78Å; F2096-V2102 HydrophobicContact CG-CG2 4.29Å; F2096-V2105 HydrophobicContact CD1-CG2 4.41Å; F2096-V2105 HydrophobicContact CE1-CG1 4.5Å; F2096-V2105 HydrophobicContact CE1-CG2 3.85Å; F2096-V2105 HydrophobicContact CZ-CB 4.44Å; F2096-V2105 HydrophobicContact CZ-CG1 4.06Å; F2096-V2105 HydrophobicContact CZ-CG2 4.1Å
2097	T	90.6	Very high	91.7	Very high	92 Å²	92	39.3 Å²	39.3	56%	0.564	21%	0.211	S	C	*	.	S	Bend	trans	-63	-44.4	178.1	44.8	0	0	0	0	112.8	R2078 T2101	R2078-T2097 PolarHBondContact NH2-O 3.46Å; T2097-T2101 PolarHBondContact OG1-OG1 2.89Å
2098	D	90	Very high	92	Very high	50.5 Å²	50.5	37.7 Å²	37.7	27%	0.27	20%	0.204	S	C	.	.			trans	-155.4	167.1	-167.6	73.5	22.7	0	0	0	113.2	N2100 T2101 V2102	D2098-N2100 VanDerWaalsContact C-N 3.32Å; D2098-N2100 PolarHBondContact O-N 3.17Å; D2098-N2100 VanDerWaalsContact OD1-CA 3.26Å; D2098-N2100 WeakPolarHBondContact OD1-CA 3.27Å; D2098-N2100 VanDerWaalsContact OD1-CB 3.23Å; D2098-N2100 WeakPolarHBondContact OD1-CB 3.31Å; D2098-N2100 PolarHBondContact OD1-N 3.08Å; D2098-N2100 WeakPolarHBondContact OD2-CA 3.44Å; D2098-N2100 WeakPolarHBondContact OD2-CB 3.42Å; D2098-N2100 PolarHBondContact OD2-N 3.19Å; D2098-N2100 PolarHBondContact OD2-ND2 2.84Å; D2098-T2101 WeakPolarHBondContact O-CB 3.34Å; D2098-T2101 PolarHBondContact O-N 3.13Å; D2098-T2101 WeakPolarHBondContact OD1-CB 3.37Å; D2098-T2101 PolarHBondContact OD1-N 3.21Å; D2098-T2101 PolarHBondContact OD1-OG1 3.02Å; D2098-T2101 VanDerWaalsContact OD2-CB 3.27Å; D2098-T2101 WeakPolarHBondContact OD2-CB 3.32Å; D2098-T2101 PolarHBondContact OD2-N 2.93Å; D2098-T2101 PolarHBondContact OD2-OG1 3.14Å; D2098-V2102 PolarHBondContact O-N 3.02Å
2099	M	92.1	Very high	92.7	Very high	61 Å²	61	35.3 Å²	35.3	30%	0.3	19%	0.187	S	C	.	.	H	α-helix	trans	-74.1	-17.7	-176.9	-174.9	58.8	166.6	0	0	113.7	K2079 V2102 K2103 L2128	K2079-M2099 HydrophobicContact CB-CE 3.53Å; K2079-M2099 WeakPolarHBondContact O-CE 3.35Å; K2079-M2099 VanDerWaalsContact O-SD 3.38Å; M2099-V2102 HydrophobicContact CE-CG1 4.37Å; M2099-V2102 PolarHBondContact O-N 3.34Å; M2099-V2102 HydrophobicContact SD-CB 4.08Å; M2099-V2102 HydrophobicContact SD-CG1 4.08Å; M2099-V2102 HydrophobicContact SD-CG2 4.46Å; M2099-K2103 HydrophobicContact CE-CG 4.4Å; M2099-K2103 WeakPolarHBondContact O-CD 3.42Å; M2099-K2103 VanDerWaalsContact O-CE 3.28Å; M2099-K2103 WeakPolarHBondContact O-CE 3.29Å; M2099-K2103 VanDerWaalsContact O-CG 3.28Å; M2099-K2103 WeakPolarHBondContact O-CG 3.31Å; M2099-K2103 PolarHBondContact O-N 3.02Å; M2099-K2103 VanDerWaalsContact O-N 3.1Å; M2099-L2128 HydrophobicContact CE-CD2 3.95Å
2100	N	93.6	Very high	92.9	Very high	103.75 Å²	103.75	33.8 Å²	33.8	56%	0.555	19%	0.186	S	C	*	.	H	α-helix	trans	-76.8	-41.4	173.8	-57.9	-43	0	0	0	110.3	D2098 V2102 K2103 L2104	D2098-N2100 VanDerWaalsContact C-N 3.32Å; D2098-N2100 PolarHBondContact O-N 3.17Å; D2098-N2100 VanDerWaalsContact OD1-CA 3.26Å; D2098-N2100 WeakPolarHBondContact OD1-CA 3.27Å; D2098-N2100 VanDerWaalsContact OD1-CB 3.23Å; D2098-N2100 WeakPolarHBondContact OD1-CB 3.31Å; D2098-N2100 PolarHBondContact OD1-N 3.08Å; D2098-N2100 WeakPolarHBondContact OD2-CA 3.44Å; D2098-N2100 WeakPolarHBondContact OD2-CB 3.42Å; D2098-N2100 PolarHBondContact OD2-N 3.19Å; D2098-N2100 PolarHBondContact OD2-ND2 2.84Å; N2100-V2102 VanDerWaalsContact C-N 3.32Å; N2100-V2102 PolarHBondContact O-N 3.31Å; N2100-K2103 WeakPolarHBondContact O-CA 3.18Å; N2100-K2103 WeakPolarHBondContact O-CB 3.32Å; N2100-K2103 PolarHBondContact O-N 3.33Å; N2100-K2103 VanDerWaalsContact O-N 3.1Å; N2100-K2103 PolarHBondContact OD1-NZ 3.02Å; N2100-L2104 WeakPolarHBondContact O-CB 3.31Å; N2100-L2104 WeakPolarHBondContact O-CG 3.46Å; N2100-L2104 PolarHBondContact O-N 3.21Å
2101	T	93.8	Very high	93.1	Very high	21.75 Å²	21.75	38.8 Å²	38.8	13%	0.133	21%	0.208	C	C	.	.	H	α-helix	trans	-56.4	-44.7	169.9	-64.1	0	0	0	0	111.7	V2011 F2096 T2097 D2098 K2103 L2104 V2105	V2011-T2101 HydrophobicContact CB-CG2 4.44Å; V2011-T2101 HydrophobicContact CG1-CG2 3.36Å; V2011-T2101 HydrophobicContact CG2-CG2 4.44Å; F2096-T2101 HydrophobicContact CB-CG2 3.95Å; F2096-T2101 HydrophobicContact CD1-CG2 3.86Å; F2096-T2101 HydrophobicContact CG-CG2 4.14Å; T2097-T2101 PolarHBondContact OG1-OG1 2.89Å; D2098-T2101 WeakPolarHBondContact O-CB 3.34Å; D2098-T2101 PolarHBondContact O-N 3.13Å; D2098-T2101 WeakPolarHBondContact OD1-CB 3.37Å; D2098-T2101 PolarHBondContact OD1-N 3.21Å; D2098-T2101 PolarHBondContact OD1-OG1 3.02Å; D2098-T2101 VanDerWaalsContact OD2-CB 3.27Å; D2098-T2101 WeakPolarHBondContact OD2-CB 3.32Å; D2098-T2101 PolarHBondContact OD2-N 2.93Å; D2098-T2101 PolarHBondContact OD2-OG1 3.14Å; T2101-K2103 VanDerWaalsContact C-N 3.33Å; T2101-K2103 PolarHBondContact O-N 3.15Å; T2101-L2104 WeakPolarHBondContact O-CB 3.38Å; T2101-L2104 PolarHBondContact O-N 3.02Å; T2101-L2104 VanDerWaalsContact O-N 3.15Å; T2101-V2105 HydrophobicContact CG2-CG2 4.47Å; T2101-V2105 WeakPolarHBondContact O-CG2 3.33Å; T2101-V2105 PolarHBondContact O-N 3.15Å
2102	V	94.4	Very high	92.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-56.2	-44.3	173.2	171.7	0	0	0	0	112.2	L2082 F2096 D2098 M2099 N2100 L2104 V2105 V2106 L2128	L2082-V2102 HydrophobicContact CD1-CG1 4.26Å; L2082-V2102 HydrophobicContact CD2-CG1 3.8Å; L2082-V2102 HydrophobicContact CG-CG1 4.03Å; F2096-V2102 HydrophobicContact CB-CG2 4.19Å; F2096-V2102 HydrophobicContact CD2-CG2 3.78Å; F2096-V2102 HydrophobicContact CG-CG2 4.29Å; D2098-V2102 PolarHBondContact O-N 3.02Å; M2099-V2102 HydrophobicContact CE-CG1 4.37Å; M2099-V2102 PolarHBondContact O-N 3.34Å; M2099-V2102 HydrophobicContact SD-CB 4.08Å; M2099-V2102 HydrophobicContact SD-CG1 4.08Å; M2099-V2102 HydrophobicContact SD-CG2 4.46Å; N2100-V2102 VanDerWaalsContact C-N 3.32Å; N2100-V2102 PolarHBondContact O-N 3.31Å; V2102-L2104 VanDerWaalsContact C-N 3.32Å; V2102-L2104 PolarHBondContact O-N 3.49Å; V2102-V2105 PolarHBondContact O-N 3Å; V2102-V2106 HydrophobicContact CG1-CG2 4.38Å; V2102-V2106 WeakPolarHBondContact O-CB 3.33Å; V2102-V2106 VanDerWaalsContact O-CG2 3.3Å; V2102-V2106 WeakPolarHBondContact O-CG2 3.3Å; V2102-V2106 PolarHBondContact O-N 3.23Å; V2102-L2128 HydrophobicContact CG1-CD2 4.09Å
2103	K	94.2	Very high	92.8	Very high	89.25 Å²	89.25	39.5 Å²	39.5	39%	0.388	21%	0.212	S	C	.	.	H	α-helix	trans	-65	-40.7	177.7	-68.4	165.9	-167.9	166.3	0	111.9	M2099 N2100 T2101 V2106 N2107 L2128	M2099-K2103 HydrophobicContact CE-CG 4.4Å; M2099-K2103 WeakPolarHBondContact O-CD 3.42Å; M2099-K2103 VanDerWaalsContact O-CE 3.28Å; M2099-K2103 WeakPolarHBondContact O-CE 3.29Å; M2099-K2103 VanDerWaalsContact O-CG 3.28Å; M2099-K2103 WeakPolarHBondContact O-CG 3.31Å; M2099-K2103 PolarHBondContact O-N 3.02Å; M2099-K2103 VanDerWaalsContact O-N 3.1Å; N2100-K2103 WeakPolarHBondContact O-CA 3.18Å; N2100-K2103 WeakPolarHBondContact O-CB 3.32Å; N2100-K2103 PolarHBondContact O-N 3.33Å; N2100-K2103 VanDerWaalsContact O-N 3.1Å; N2100-K2103 PolarHBondContact OD1-NZ 3.02Å; T2101-K2103 VanDerWaalsContact C-N 3.33Å; T2101-K2103 PolarHBondContact O-N 3.15Å; K2103-V2106 PolarHBondContact O-N 3.05Å; K2103-N2107 WeakPolarHBondContact O-CB 3.3Å; K2103-N2107 PolarHBondContact O-N 3.17Å; K2103-N2107 PolarHBondContact O-ND2 3.23Å; K2103-L2128 HydrophobicContact CG-CD1 4.23Å
2104	L	93.5	Very high	92.6	Very high	95.5 Å²	95.5	39.5 Å²	39.5	50%	0.5	21%	0.212	S	C	.	.	H	α-helix	trans	-60.4	-47.6	176.8	-87.8	172.4	0	0	0	110.7	L2009 N2100 T2101 V2102 N2107 A2108	L2009-L2104 HydrophobicContact CD1-CD1 4.5Å; L2009-L2104 HydrophobicContact CD1-CD2 3.32Å; L2009-L2104 HydrophobicContact CD2-CB 4.31Å; L2009-L2104 HydrophobicContact CD2-CD2 3.29Å; L2009-L2104 HydrophobicContact CG-CD2 3.89Å; N2100-L2104 WeakPolarHBondContact O-CB 3.31Å; N2100-L2104 WeakPolarHBondContact O-CG 3.46Å; N2100-L2104 PolarHBondContact O-N 3.21Å; T2101-L2104 WeakPolarHBondContact O-CB 3.38Å; T2101-L2104 PolarHBondContact O-N 3.02Å; T2101-L2104 VanDerWaalsContact O-N 3.15Å; V2102-L2104 VanDerWaalsContact C-N 3.32Å; V2102-L2104 PolarHBondContact O-N 3.49Å; L2104-N2107 PolarHBondContact O-N 3.16Å; L2104-A2108 PolarHBondContact O-N 3.18Å; L2104-A2108 VanDerWaalsContact O-N 3.11Å
2105	V	94	Very high	92	Very high	1.5 Å²	1.5	40.2 Å²	40.2	1%	0.009	22%	0.218	C	C	.	.	H	α-helix	trans	-62	-46.6	176.4	172.5	0	0	0	0	111.6	L2009 V2011 L2026 I2028 L2082 F2096 T2101 V2102 N2107 A2108 L2109	L2009-V2105 HydrophobicContact CD2-CG2 4.1Å; V2011-V2105 HydrophobicContact CG2-CG2 4.4Å; L2026-V2105 HydrophobicContact CD2-CG1 4.29Å; I2028-V2105 HydrophobicContact CD1-CG1 4.1Å; L2082-V2105 HydrophobicContact CD1-CB 4.18Å; L2082-V2105 HydrophobicContact CD1-CG1 3.67Å; F2096-V2105 HydrophobicContact CD1-CG2 4.41Å; F2096-V2105 HydrophobicContact CE1-CG1 4.5Å; F2096-V2105 HydrophobicContact CE1-CG2 3.85Å; F2096-V2105 HydrophobicContact CZ-CB 4.44Å; F2096-V2105 HydrophobicContact CZ-CG1 4.06Å; F2096-V2105 HydrophobicContact CZ-CG2 4.1Å; T2101-V2105 HydrophobicContact CG2-CG2 4.47Å; T2101-V2105 WeakPolarHBondContact O-CG2 3.33Å; T2101-V2105 PolarHBondContact O-N 3.15Å; V2102-V2105 PolarHBondContact O-N 3Å; V2105-N2107 VanDerWaalsContact C-N 3.26Å; V2105-N2107 PolarHBondContact O-N 3.34Å; V2105-A2108 PolarHBondContact O-N 3.13Å; V2105-A2108 VanDerWaalsContact O-N 3.1Å; V2105-L2109 HydrophobicContact CG1-CD1 3.88Å; V2105-L2109 HydrophobicContact CG1-CG 4.36Å; V2105-L2109 WeakPolarHBondContact O-CB 3.24Å; V2105-L2109 VanDerWaalsContact O-CG 3.29Å; V2105-L2109 WeakPolarHBondContact O-CG 3.4Å; V2105-L2109 PolarHBondContact O-N 2.97Å
2106	V	93.6	Very high	91.4	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.012	25%	0.25	C	C	.	.	H	α-helix	trans	-62.4	-32.5	177.1	170.2	0	0	0	0	112.3	L2082 V2102 K2103 A2108 L2109 R2124 T2127 L2128	L2082-V2106 HydrophobicContact CD1-CG2 3.75Å; L2082-V2106 HydrophobicContact CD2-CG2 3.74Å; L2082-V2106 HydrophobicContact CG-CG2 4.41Å; V2102-V2106 HydrophobicContact CG1-CG2 4.38Å; V2102-V2106 WeakPolarHBondContact O-CB 3.33Å; V2102-V2106 VanDerWaalsContact O-CG2 3.3Å; V2102-V2106 WeakPolarHBondContact O-CG2 3.3Å; V2102-V2106 PolarHBondContact O-N 3.23Å; K2103-V2106 PolarHBondContact O-N 3.05Å; V2106-A2108 VanDerWaalsContact C-N 3.35Å; V2106-L2109 PolarHBondContact O-N 2.95Å; V2106-R2124 HydrophobicContact CG1-CB 3.98Å; V2106-R2124 HydrophobicContact CG1-CG 3.99Å; V2106-R2124 VanDerWaalsContact O-CD 3.27Å; V2106-R2124 WeakPolarHBondContact O-CD 3.35Å; V2106-R2124 PolarHBondContact O-NE 3.11Å; V2106-T2127 HydrophobicContact CG1-CG2 4.08Å; V2106-T2127 HydrophobicContact CG2-CG2 3.95Å; V2106-L2128 HydrophobicContact CB-CD2 4.41Å; V2106-L2128 HydrophobicContact CG1-CD1 4.3Å; V2106-L2128 HydrophobicContact CG1-CD2 4.45Å; V2106-L2128 HydrophobicContact CG1-CG 4.22Å; V2106-L2128 HydrophobicContact CG2-CD2 4.02Å
2107	N	92.1	Very high	90.7	Very high	96.75 Å²	96.75	49.9 Å²	49.9	52%	0.517	27%	0.267	S	S	.	.	H	α-helix	trans	-72	-32.9	175.8	-73.1	-19.3	0	0	0	112.8	K2103 L2104 V2105 R2124	K2103-N2107 WeakPolarHBondContact O-CB 3.3Å; K2103-N2107 PolarHBondContact O-N 3.17Å; K2103-N2107 PolarHBondContact O-ND2 3.23Å; L2104-N2107 PolarHBondContact O-N 3.16Å; V2105-N2107 VanDerWaalsContact C-N 3.26Å; V2105-N2107 PolarHBondContact O-N 3.34Å; N2107-R2124 PolarHBondContact O-NE 3.15Å; N2107-R2124 PolarHBondContact O-NH2 3.1Å
2108	A	91	Very high	90.5	Very high	20.75 Å²	20.75	46.2 Å²	46.2	17%	0.171	24%	0.242	C	C	.	.	H	α-helix	trans	-74.1	-28.6	173	0	0	0	0	0	112.9	Y2008 L2009 I2028 L2104 V2105 V2106	Y2008-A2108 HydrophobicContact CE2-CB 3.76Å; Y2008-A2108 PolarHBondContact OH-O 3.37Å; L2009-A2108 HydrophobicContact CB-CB 4.41Å; L2009-A2108 HydrophobicContact CD2-CB 3.8Å; I2028-A2108 HydrophobicContact CD1-CB 3.93Å; I2028-A2108 HydrophobicContact CG2-CB 4.32Å; L2104-A2108 PolarHBondContact O-N 3.18Å; L2104-A2108 VanDerWaalsContact O-N 3.11Å; V2105-A2108 PolarHBondContact O-N 3.13Å; V2105-A2108 VanDerWaalsContact O-N 3.1Å; V2106-A2108 VanDerWaalsContact C-N 3.35Å
2109	L	92.8	Very high	90	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	25%	0.253	C	S	.	.	S	Bend	trans	-78.1	157.8	179.7	-71.1	175	0	0	0	113.3	I2028 L2033 L2064 I2067 I2070 I2084 V2105 V2106 R2124	I2028-L2109 HydrophobicContact CD1-CD2 4.13Å; I2028-L2109 HydrophobicContact CD1-CG 4.23Å; L2033-L2109 HydrophobicContact CD1-CD2 4.38Å; L2033-L2109 HydrophobicContact CD2-CD2 4.38Å; L2064-L2109 HydrophobicContact CD2-CD2 3.91Å; I2067-L2109 HydrophobicContact CD1-CD2 3.94Å; I2070-L2109 HydrophobicContact CD1-CB 3.75Å; I2070-L2109 HydrophobicContact CD1-CD1 3.81Å; I2070-L2109 HydrophobicContact CD1-CG 4.36Å; I2084-L2109 HydrophobicContact CD1-CD1 4.01Å; V2105-L2109 HydrophobicContact CG1-CD1 3.88Å; V2105-L2109 HydrophobicContact CG1-CG 4.36Å; V2105-L2109 WeakPolarHBondContact O-CB 3.24Å; V2105-L2109 VanDerWaalsContact O-CG 3.29Å; V2105-L2109 WeakPolarHBondContact O-CG 3.4Å; V2105-L2109 PolarHBondContact O-N 2.97Å; V2106-L2109 PolarHBondContact O-N 2.95Å; L2109-R2124 PolarHBondContact O-NE 3.14Å; L2109-R2124 PolarHBondContact O-NH2 3.08Å
2110	P	90.6	Very high	89.6	Confident	37 Å²	37	44 Å²	44	24%	0.24	24%	0.243	C	C	.	.			trans	-62.4	149.7	177.5	1	-0.5	0	0	0	113.2	L2064 I2067 V2112	L2064-P2110 HydrophobicContact CB-CG 4.1Å; L2064-P2110 HydrophobicContact CD2-CG 4.39Å; L2064-P2110 HydrophobicContact CG-CG 4.45Å; L2064-P2110 WeakPolarHBondContact O-CG 3.41Å; I2067-P2110 HydrophobicContact CB-CG 4.29Å; I2067-P2110 HydrophobicContact CD1-CG 4.23Å; I2067-P2110 HydrophobicContact CG2-CG 4.44Å; P2110-V2112 VanDerWaalsContact C-N 3.27Å; P2110-V2112 HydrophobicContact CB-CG1 4.28Å; P2110-V2112 HydrophobicContact CG-CG1 4.18Å; P2110-V2112 PolarHBondContact O-N 3.12Å
2111	E	89.6	Confident	89.2	Confident	111.25 Å²	111.25	43.5 Å²	43.5	52%	0.52	25%	0.245	S	C	.	.	S	Bend	trans	-75.9	68.5	178.2	-58.7	-161.1	-176.6	0	0	112.1	V2122 R2124	E2111-V2122 WeakPolarHBondContact O-CG1 3.38Å; E2111-R2124 VanDerWaalsContact CD-NH1 3.3Å; E2111-R2124 HydrophobicContact CG-CG 4.1Å; E2111-R2124 VanDerWaalsContact CG-CZ 3.45Å; E2111-R2124 VanDerWaalsContact CG-NH1 3.29Å; E2111-R2124 WeakPolarHBondContact OE1-CD 3.48Å; E2111-R2124 WeakPolarHBondContact OE1-CG 3.46Å; E2111-R2124 IonicContact OE1-CZ 3.66Å; E2111-R2124 IonicContact OE1-NE 2.72Å; E2111-R2124 IonicContact OE1-NH1 3.16Å; E2111-R2124 PolarHBondContact OE1-NH1 3Å; E2111-R2124 IonicContact OE1-NH2 3.13Å
2112	V	89.3	Confident	88.8	Confident	26 Å²	26	45.9 Å²	45.9	16%	0.158	26%	0.26	C	S	.	.			trans	-93	-16.1	176.5	-64.4	0	0	0	0	113.4	I2067 I2070 P2110 G2115 V2122	I2067-V2112 HydrophobicContact CG2-CG1 4.4Å; I2067-V2112 HydrophobicContact CG2-CG2 3.84Å; I2067-V2112 WeakPolarHBondContact O-CG1 3.36Å; I2070-V2112 HydrophobicContact CB-CG2 4.43Å; I2070-V2112 HydrophobicContact CD1-CG2 3.67Å; I2070-V2112 HydrophobicContact CG1-CG2 3.7Å; P2110-V2112 VanDerWaalsContact C-N 3.27Å; P2110-V2112 HydrophobicContact CB-CG1 4.28Å; P2110-V2112 HydrophobicContact CG-CG1 4.18Å; P2110-V2112 PolarHBondContact O-N 3.12Å; V2112-G2115 PolarHBondContact O-N 3.07Å; V2112-V2122 WeakPolarHBondContact O-CG1 3.43Å
2113	G	90.8	Very high	88.6	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.01	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	-148.9	-172.5	0	0	0	0	0	112.2	A2069 I2070 G2115 S2123 S2126 T2127	A2069-G2113 CarbonylContact C-O 3.57Å; A2069-G2113 WeakPolarHBondContact CA-O 3.27Å; I2070-G2113 PolarHBondContact N-O 3.04Å; G2113-G2115 VanDerWaalsContact C-N 3.31Å; G2113-G2115 PolarHBondContact O-N 3.32Å; G2113-S2123 VanDerWaalsContact CA-O 3.27Å; G2113-S2123 WeakPolarHBondContact CA-O 3.39Å; G2113-S2126 WeakPolarHBondContact CA-OG 3.44Å; G2113-T2127 VanDerWaalsContact C-OG1 3.31Å; G2113-T2127 VanDerWaalsContact CA-OG1 3.26Å; G2113-T2127 WeakPolarHBondContact CA-OG1 3.27Å; G2113-T2127 PolarHBondContact O-OG1 3.26Å
2114	I	90	Very high	88.5	Confident	4.25 Å²	4.25	46.3 Å²	46.3	2%	0.022	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	21.6	173.1	64.9	170.3	0	0	0	113.4	A2069 I2070 F2071 Y2118 L2120 S2126 I2134	A2069-I2114 VanDerWaalsContact CB-C 3.48Å; I2070-I2114 WeakPolarHBondContact O-CG2 3.39Å; F2071-I2114 HydrophobicContact CD1-CB 4.02Å; F2071-I2114 HydrophobicContact CD1-CG2 3.69Å; F2071-I2114 HydrophobicContact CE1-CB 3.65Å; F2071-I2114 HydrophobicContact CE1-CD1 4.2Å; F2071-I2114 HydrophobicContact CE1-CG1 4.45Å; F2071-I2114 HydrophobicContact CE1-CG2 3.86Å; F2071-I2114 HydrophobicContact CE2-CB 4.35Å; F2071-I2114 HydrophobicContact CG-CB 4.46Å; F2071-I2114 HydrophobicContact CG-CG2 4.16Å; F2071-I2114 HydrophobicContact CZ-CB 3.87Å; F2071-I2114 HydrophobicContact CZ-CG2 4.39Å; I2114-Y2118 HydrophobicContact CD1-CD2 3.95Å; I2114-Y2118 HydrophobicContact CD1-CE2 4.38Å; I2114-Y2118 HydrophobicContact CG1-CD2 4.21Å; I2114-Y2118 WeakPolarHBondContact O-CE2 3.15Å; I2114-L2120 HydrophobicContact CD1-CB 4.42Å; I2114-L2120 HydrophobicContact CD1-CD1 3.66Å; I2114-L2120 VanDerWaalsContact CD1-CD1 3.48Å; I2114-L2120 HydrophobicContact CD1-CD2 3.92Å; I2114-L2120 HydrophobicContact CD1-CG 4.42Å; I2114-L2120 HydrophobicContact CG1-CD1 4.23Å; I2114-S2126 WeakPolarHBondContact CG2-O 3.42Å; I2114-S2126 PolarHBondContact N-OG 2.95Å; I2114-I2134 HydrophobicContact CD1-CD1 4.2Å; I2114-I2134 HydrophobicContact CD1-CG1 4.29Å; I2114-I2134 HydrophobicContact CD1-CG2 3.57Å; I2114-I2134 HydrophobicContact CG2-CD1 4.37Å
2115	G	85	Confident	88.3	Confident	12.75 Å²	12.75	45.4 Å²	45.4	13%	0.131	27%	0.27	C	S	.	.			trans	77.8	169.4	-175.6	0	0	0	0	0	114.1	V2112 G2113 R2117	V2112-G2115 PolarHBondContact O-N 3.07Å; G2113-G2115 VanDerWaalsContact C-N 3.31Å; G2113-G2115 PolarHBondContact O-N 3.32Å; G2115-R2117 VanDerWaalsContact C-N 3.34Å; G2115-R2117 PolarHBondContact O-N 3.06Å
2116	T	82.5	Confident	88.1	Confident	110.5 Å²	110.5	45.9 Å²	45.9	68%	0.678	27%	0.274	S	S	*	.	S	Bend	trans	-82.6	-14.2	-172.9	52.7	0	0	0	0	114.5	Y2118 G2119 V2122	T2116-Y2118 VanDerWaalsContact C-N 3.32Å; T2116-Y2118 PolarHBondContact O-N 3.13Å; T2116-G2119 PolarHBondContact O-N 3.14Å; T2116-V2122 HydrophobicContact CG2-CG2 3.91Å
2117	R	81.8	Confident	88	Confident	109.25 Å²	109.25	45.9 Å²	45.9	41%	0.412	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-33.8	-170.6	-126.7	-174.4	-105.8	-146.4	-1.9	114.3	D1890 G2115 G2119 M2140 D2153	D1890-R2117 PolarHBondContact O-NH1 3.07Å; D1890-R2117 PolarHBondContact O-NH2 2.92Å; D1890-R2117 IonicContact OD1-NH2 3.35Å; D1890-R2117 PolarHBondContact OD1-NH2 3.22Å; D1890-R2117 IonicContact OD2-NH2 2.68Å; G2115-R2117 VanDerWaalsContact C-N 3.34Å; G2115-R2117 PolarHBondContact O-N 3.06Å; R2117-G2119 VanDerWaalsContact C-N 3.34Å; R2117-G2119 PolarHBondContact O-N 3.23Å; R2117-M2140 WeakPolarHBondContact O-CE 3.41Å; R2117-D2153 IonicContact NH2-OD1 3.61Å; R2117-D2153 PolarHBondContact NH2-OD1 3.11Å
2118	Y	85.6	Confident	88	Confident	14.5 Å²	14.5	43.7 Å²	43.7	6%	0.057	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	7.8	-172.1	-51.8	-47.1	0	0	0	114.5	F2071 I2114 T2116 L2120 S2138 M2140 Y2157 T2160 I2161	F2071-Y2118 AromaticContact CE1-CE2 3.96Å; F2071-Y2118 HydrophobicContact CE1-CE2 4.04Å; F2071-Y2118 HydrophobicContact CZ-CD2 4.48Å; F2071-Y2118 AromaticContact CZ-CE2 3.77Å; F2071-Y2118 HydrophobicContact CZ-CE2 3.77Å; I2114-Y2118 HydrophobicContact CD1-CD2 3.95Å; I2114-Y2118 HydrophobicContact CD1-CE2 4.38Å; I2114-Y2118 HydrophobicContact CG1-CD2 4.21Å; I2114-Y2118 WeakPolarHBondContact O-CE2 3.15Å; T2116-Y2118 VanDerWaalsContact C-N 3.32Å; T2116-Y2118 PolarHBondContact O-N 3.13Å; Y2118-L2120 VanDerWaalsContact C-N 3.29Å; Y2118-L2120 WeakPolarHBondContact O-CD1 3.34Å; Y2118-L2120 PolarHBondContact O-N 3.18Å; Y2118-S2138 PolarHBondContact O-OG 3.23Å; Y2118-S2138 VanDerWaalsContact O-OG 3.06Å; Y2118-M2140 HydrophobicContact CD1-CE 3.91Å; Y2118-M2140 HydrophobicContact CD1-CG 3.96Å; Y2118-M2140 HydrophobicContact CD1-SD 4.02Å; Y2118-M2140 HydrophobicContact CE1-CE 4.16Å; Y2118-M2140 HydrophobicContact CG-CG 4.39Å; Y2118-Y2157 AromaticContact CD1-CD2 3.56Å; Y2118-Y2157 HydrophobicContact CD1-CD2 3.56Å; Y2118-Y2157 VanDerWaalsContact CD1-CD2 3.49Å; Y2118-Y2157 AromaticContact CD1-CE2 3.65Å; Y2118-Y2157 HydrophobicContact CD1-CE2 3.89Å; Y2118-Y2157 HydrophobicContact CD2-CD2 4.29Å; Y2118-Y2157 HydrophobicContact CD2-CE2 4.4Å; Y2118-Y2157 AromaticContact CE1-CD2 3.56Å; Y2118-Y2157 HydrophobicContact CE1-CD2 3.56Å; Y2118-Y2157 VanDerWaalsContact CE1-CD2 3.45Å; Y2118-Y2157 AromaticContact CE1-CE2 3.95Å; Y2118-Y2157 HydrophobicContact CE1-CE2 4.16Å; Y2118-Y2157 HydrophobicContact CE1-CG 4.46Å; Y2118-Y2157 HydrophobicContact CE2-CD2 4.32Å; Y2118-Y2157 AromaticContact CG-CD2 3.96Å; Y2118-Y2157 HydrophobicContact CG-CD2 4.21Å; Y2118-Y2157 HydrophobicContact CG-CE2 4.15Å; Y2118-Y2157 AromaticContact CZ-CD2 3.96Å; Y2118-T2160 HydrophobicContact CE2-CG2 4.38Å; Y2118-T2160 WeakPolarHBondContact OH-CG2 3.41Å; Y2118-I2161 HydrophobicContact CD2-CG2 4.34Å; Y2118-I2161 HydrophobicContact CE2-CG2 4.22Å
2119	G	79.1	Confident	88	Confident	48.5 Å²	48.5	43.7 Å²	43.7	50%	0.5	26%	0.261	S	S	.	.	S	Bend	trans	72.5	17.8	178.6	0	0	0	0	0	114.8	T2116 R2117	T2116-G2119 PolarHBondContact O-N 3.14Å; R2117-G2119 VanDerWaalsContact C-N 3.34Å; R2117-G2119 PolarHBondContact O-N 3.23Å
2120	L	85.4	Confident	87.8	Confident	16 Å²	16	46.5 Å²	46.5	8%	0.084	28%	0.281	C	S	.	.			trans	-96.8	151.6	-178.9	-75	147.6	0	0	0	111.7	I2114 Y2118 V2122 I2134 L2137	I2114-L2120 HydrophobicContact CD1-CB 4.42Å; I2114-L2120 HydrophobicContact CD1-CD1 3.66Å; I2114-L2120 VanDerWaalsContact CD1-CD1 3.48Å; I2114-L2120 HydrophobicContact CD1-CD2 3.92Å; I2114-L2120 HydrophobicContact CD1-CG 4.42Å; I2114-L2120 HydrophobicContact CG1-CD1 4.23Å; Y2118-L2120 VanDerWaalsContact C-N 3.29Å; Y2118-L2120 WeakPolarHBondContact O-CD1 3.34Å; Y2118-L2120 PolarHBondContact O-N 3.18Å; L2120-V2122 PolarHBondContact O-N 3.08Å; L2120-I2134 HydrophobicContact CD1-CG2 3.98Å; L2120-I2134 HydrophobicContact CD2-CG2 4.23Å; L2120-L2137 HydrophobicContact CD1-CB 4.46Å; L2120-L2137 VanDerWaalsContact CD2-C 3.46Å; L2120-L2137 HydrophobicContact CD2-CB 3.51Å; L2120-L2137 HydrophobicContact CD2-CD1 4.33Å; L2120-L2137 HydrophobicContact CD2-CG 4.47Å; L2120-L2137 WeakPolarHBondContact CD2-O 3.17Å; L2120-L2137 HydrophobicContact CG-CB 4.02Å
2121	P	83.2	Confident	87.8	Confident	93.25 Å²	93.25	46.4 Å²	46.4	61%	0.606	28%	0.281	S	S	*	.			trans	-63.9	130	174.7	2.3	0.4	0	0	0	111.6	S2123 S2126	P2121-S2123 PolarHBondContact O-N 3.15Å; P2121-S2123 VanDerWaalsContact O-N 3.1Å; P2121-S2123 PolarHBondContact O-OG 3.36Å; P2121-S2126 WeakPolarHBondContact O-CB 3.31Å; P2121-S2126 PolarHBondContact O-OG 3Å
2122	V	86.8	Confident	87.9	Confident	73.5 Å²	73.5	43.4 Å²	43.4	45%	0.445	27%	0.272	S	S	.	.			trans	-64.3	106	172.7	173.6	0	0	0	0	108.5	E2111 V2112 T2116 L2120	E2111-V2122 WeakPolarHBondContact O-CG1 3.38Å; V2112-V2122 WeakPolarHBondContact O-CG1 3.43Å; T2116-V2122 HydrophobicContact CG2-CG2 3.91Å; L2120-V2122 PolarHBondContact O-N 3.08Å
2123	S	89.8	Confident	88	Confident	30.25 Å²	30.25	46.9 Å²	46.9	21%	0.212	29%	0.285	C	S	.	.	S	Bend	trans	-164.8	152.9	-176.2	64	0	0	0	0	111.5	G2113 P2121 A2125 S2126 T2127	G2113-S2123 VanDerWaalsContact CA-O 3.27Å; G2113-S2123 WeakPolarHBondContact CA-O 3.39Å; P2121-S2123 PolarHBondContact O-N 3.15Å; P2121-S2123 VanDerWaalsContact O-N 3.1Å; P2121-S2123 PolarHBondContact O-OG 3.36Å; S2123-A2125 PolarHBondContact O-N 3.24Å; S2123-A2125 PolarHBondContact OG-N 3.05Å; S2123-S2126 WeakPolarHBondContact O-CB 3.37Å; S2123-S2126 PolarHBondContact O-N 3.14Å; S2123-S2126 VanDerWaalsContact O-N 3.13Å; S2123-S2126 PolarHBondContact O-OG 3.31Å; S2123-S2126 PolarHBondContact OG-N 3.26Å; S2123-S2126 VanDerWaalsContact OG-N 3.15Å; S2123-S2126 PolarHBondContact OG-OG 2.93Å; S2123-T2127 PolarHBondContact O-N 3.28Å
2124	R	91.4	Very high	88	Confident	67.25 Å²	67.25	47.3 Å²	47.3	25%	0.254	29%	0.287	S	S	.	.	H	α-helix	trans	-60.5	-30.6	172	-67.2	-175.7	-179.4	101.3	2.3	112.9	V2106 N2107 L2109 E2111 S2126 T2127 L2128	V2106-R2124 HydrophobicContact CG1-CB 3.98Å; V2106-R2124 HydrophobicContact CG1-CG 3.99Å; V2106-R2124 VanDerWaalsContact O-CD 3.27Å; V2106-R2124 WeakPolarHBondContact O-CD 3.35Å; V2106-R2124 PolarHBondContact O-NE 3.11Å; N2107-R2124 PolarHBondContact O-NE 3.15Å; N2107-R2124 PolarHBondContact O-NH2 3.1Å; L2109-R2124 PolarHBondContact O-NE 3.14Å; L2109-R2124 PolarHBondContact O-NH2 3.08Å; E2111-R2124 VanDerWaalsContact CD-NH1 3.3Å; E2111-R2124 HydrophobicContact CG-CG 4.1Å; E2111-R2124 VanDerWaalsContact CG-CZ 3.45Å; E2111-R2124 VanDerWaalsContact CG-NH1 3.29Å; E2111-R2124 WeakPolarHBondContact OE1-CD 3.48Å; E2111-R2124 WeakPolarHBondContact OE1-CG 3.46Å; E2111-R2124 IonicContact OE1-CZ 3.66Å; E2111-R2124 IonicContact OE1-NE 2.72Å; E2111-R2124 IonicContact OE1-NH1 3.16Å; E2111-R2124 PolarHBondContact OE1-NH1 3Å; E2111-R2124 IonicContact OE1-NH2 3.13Å; R2124-S2126 VanDerWaalsContact C-N 3.29Å; R2124-S2126 PolarHBondContact O-N 3.19Å; R2124-T2127 WeakPolarHBondContact O-CB 3.41Å; R2124-T2127 PolarHBondContact O-N 3.23Å; R2124-T2127 VanDerWaalsContact O-N 3.17Å; R2124-L2128 PolarHBondContact O-N 3.24Å; R2124-L2128 VanDerWaalsContact O-N 3.13Å
2125	A	89.6	Confident	88.2	Confident	76 Å²	76	48.8 Å²	48.8	63%	0.628	29%	0.293	S	S	*	.	H	α-helix	trans	-62.2	-34	175	0	0	0	0	0	112.5	S2123 A2129	S2123-A2125 PolarHBondContact O-N 3.24Å; S2123-A2125 PolarHBondContact OG-N 3.05Å; A2125-A2129 WeakPolarHBondContact O-CB 3.1Å; A2125-A2129 PolarHBondContact O-N 3.3Å; A2125-A2129 VanDerWaalsContact O-N 3.11Å
2126	S	89.6	Confident	88.5	Confident	12 Å²	12	54.6 Å²	54.6	8%	0.084	32%	0.317	C	S	.	.	H	α-helix	trans	-72.1	-34.9	174.5	49.7	0	0	0	0	112.7	G2113 I2114 P2121 S2123 R2124 A2129	G2113-S2126 WeakPolarHBondContact CA-OG 3.44Å; I2114-S2126 WeakPolarHBondContact CG2-O 3.42Å; I2114-S2126 PolarHBondContact N-OG 2.95Å; P2121-S2126 WeakPolarHBondContact O-CB 3.31Å; P2121-S2126 PolarHBondContact O-OG 3Å; S2123-S2126 WeakPolarHBondContact O-CB 3.37Å; S2123-S2126 PolarHBondContact O-N 3.14Å; S2123-S2126 VanDerWaalsContact O-N 3.13Å; S2123-S2126 PolarHBondContact O-OG 3.31Å; S2123-S2126 PolarHBondContact OG-N 3.26Å; S2123-S2126 VanDerWaalsContact OG-N 3.15Å; S2123-S2126 PolarHBondContact OG-OG 2.93Å; R2124-S2126 VanDerWaalsContact C-N 3.29Å; R2124-S2126 PolarHBondContact O-N 3.19Å; S2126-A2129 WeakPolarHBondContact O-CB 3.37Å; S2126-A2129 PolarHBondContact O-N 2.92Å
2127	T	92.1	Very high	88.8	Confident	3 Å²	3	54.2 Å²	54.2	2%	0.018	31%	0.31	C	S	.	.	H	α-helix	trans	-62.3	-42.5	173.8	-71.5	0	0	0	0	112.4	I2070 N2072 L2082 V2106 G2113 S2123 R2124 A2129	I2070-T2127 HydrophobicContact CB-CG2 3.95Å; I2070-T2127 HydrophobicContact CG2-CG2 3.64Å; I2070-T2127 WeakPolarHBondContact O-CB 3.4Å; I2070-T2127 VanDerWaalsContact O-CG2 3.29Å; I2070-T2127 WeakPolarHBondContact O-CG2 3.26Å; I2070-T2127 PolarHBondContact O-OG1 3.09Å; I2070-T2127 VanDerWaalsContact O-OG1 3.05Å; N2072-T2127 VanDerWaalsContact CB-O 3.27Å; N2072-T2127 WeakPolarHBondContact CB-O 3.41Å; N2072-T2127 PolarHBondContact N-O 3.14Å; N2072-T2127 VanDerWaalsContact N-O 3.13Å; L2082-T2127 HydrophobicContact CD2-CG2 4.45Å; V2106-T2127 HydrophobicContact CG1-CG2 4.08Å; V2106-T2127 HydrophobicContact CG2-CG2 3.95Å; G2113-T2127 VanDerWaalsContact C-OG1 3.31Å; G2113-T2127 VanDerWaalsContact CA-OG1 3.26Å; G2113-T2127 WeakPolarHBondContact CA-OG1 3.27Å; G2113-T2127 PolarHBondContact O-OG1 3.26Å; S2123-T2127 PolarHBondContact O-N 3.28Å; R2124-T2127 WeakPolarHBondContact O-CB 3.41Å; R2124-T2127 PolarHBondContact O-N 3.23Å; R2124-T2127 VanDerWaalsContact O-N 3.17Å; T2127-A2129 VanDerWaalsContact C-N 3.35Å
2128	L	91.8	Very high	89.3	Confident	50.25 Å²	50.25	49.2 Å²	49.2	26%	0.263	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-1.8	-178.3	-64.5	174.5	0	0	0	113.9	M2099 V2102 K2103 V2106 R2124	M2099-L2128 HydrophobicContact CE-CD2 3.95Å; V2102-L2128 HydrophobicContact CG1-CD2 4.09Å; K2103-L2128 HydrophobicContact CG-CD1 4.23Å; V2106-L2128 HydrophobicContact CB-CD2 4.41Å; V2106-L2128 HydrophobicContact CG1-CD1 4.3Å; V2106-L2128 HydrophobicContact CG1-CD2 4.45Å; V2106-L2128 HydrophobicContact CG1-CG 4.22Å; V2106-L2128 HydrophobicContact CG2-CD2 4.02Å; R2124-L2128 PolarHBondContact O-N 3.24Å; R2124-L2128 VanDerWaalsContact O-N 3.13Å
2129	A	90.7	Very high	89.5	Confident	19.75 Å²	19.75	51.7 Å²	51.7	16%	0.163	31%	0.306	C	S	.	.	S	Bend	trans	-67.1	147.6	-178.5	0	0	0	0	0	112	A2125 S2126 T2127 K2133 I2134	A2125-A2129 WeakPolarHBondContact O-CB 3.1Å; A2125-A2129 PolarHBondContact O-N 3.3Å; A2125-A2129 VanDerWaalsContact O-N 3.11Å; S2126-A2129 WeakPolarHBondContact O-CB 3.37Å; S2126-A2129 PolarHBondContact O-N 2.92Å; T2127-A2129 VanDerWaalsContact C-N 3.35Å; A2129-K2133 HydrophobicContact CB-CB 4.47Å; A2129-K2133 HydrophobicContact CB-CD 4.39Å; A2129-I2134 HydrophobicContact CB-CD1 4.24Å; A2129-I2134 HydrophobicContact CB-CG1 3.74Å
2130	S	90.2	Very high	90.1	Very high	59.5 Å²	59.5	49.7 Å²	49.7	42%	0.416	28%	0.284	S	S	.	.			trans	-69.6	151.4	175.1	64.6	0	0	0	0	111.6	S2132 K2133 I2134	S2130-S2132 VanDerWaalsContact C-N 3.29Å; S2130-S2132 PolarHBondContact O-N 2.99Å; S2130-K2133 WeakPolarHBondContact O-CA 3.32Å; S2130-K2133 WeakPolarHBondContact O-CB 3.37Å; S2130-K2133 PolarHBondContact O-N 3.02Å; S2130-K2133 WeakPolarHBondContact OG-CB 3.4Å; S2130-K2133 PolarHBondContact OG-N 3.29Å; S2130-I2134 PolarHBondContact O-N 3.08Å
2131	P	90.4	Very high	90.5	Very high	36 Å²	36	49.6 Å²	49.6	23%	0.234	28%	0.284	C	S	.	.	H	α-helix	trans	-47.6	-46.4	176.7	-33.9	38.4	0	0	0	114.1	K2133 I2134 F2135 I2161 L2410	P2131-K2133 VanDerWaalsContact C-N 3.32Å; P2131-K2133 PolarHBondContact O-N 3.14Å; P2131-I2134 PolarHBondContact O-N 3.12Å; P2131-F2135 WeakPolarHBondContact O-CB 3.5Å; P2131-F2135 PolarHBondContact O-N 3.12Å; P2131-I2161 VanDerWaalsContact CB-O 3.24Å; P2131-I2161 WeakPolarHBondContact CB-O 3.38Å; P2131-I2161 VanDerWaalsContact CG-O 3.24Å; P2131-I2161 WeakPolarHBondContact CG-O 3.46Å; P2131-L2410 HydrophobicContact CB-CD2 3.61Å
2132	S	91.2	Very high	91	Very high	48.25 Å²	48.25	49.3 Å²	49.3	34%	0.337	28%	0.275	S	S	.	.	H	α-helix	trans	-65.3	-33.9	178.4	-47.2	0	0	0	0	112.6	S2130 F2135 Q2136 Q2409 L2410	S2130-S2132 VanDerWaalsContact C-N 3.29Å; S2130-S2132 PolarHBondContact O-N 2.99Å; S2132-F2135 PolarHBondContact O-N 2.83Å; S2132-Q2136 WeakPolarHBondContact O-CB 3.35Å; S2132-Q2136 VanDerWaalsContact O-CG 3.24Å; S2132-Q2136 WeakPolarHBondContact O-CG 3.35Å; S2132-Q2136 PolarHBondContact O-N 3.17Å; S2132-Q2136 VanDerWaalsContact O-N 3.09Å; S2132-Q2136 PolarHBondContact OG-NE2 3.2Å; S2132-Q2409 PolarHBondContact OG-O 3.18Å; S2132-L2410 WeakPolarHBondContact CA-O 3.4Å; S2132-L2410 WeakPolarHBondContact CB-O 3.29Å; S2132-L2410 PolarHBondContact OG-O 2.93Å
2133	K	91.2	Very high	91.2	Very high	99 Å²	99	49.1 Å²	49.1	43%	0.43	27%	0.266	S	S	.	.	H	α-helix	trans	-73.5	-38.4	176.8	-171.1	76.2	174.9	177	0	111.8	A2129 S2130 P2131 F2135 Q2136 L2137	A2129-K2133 HydrophobicContact CB-CB 4.47Å; A2129-K2133 HydrophobicContact CB-CD 4.39Å; S2130-K2133 WeakPolarHBondContact O-CA 3.32Å; S2130-K2133 WeakPolarHBondContact O-CB 3.37Å; S2130-K2133 PolarHBondContact O-N 3.02Å; S2130-K2133 WeakPolarHBondContact OG-CB 3.4Å; S2130-K2133 PolarHBondContact OG-N 3.29Å; P2131-K2133 VanDerWaalsContact C-N 3.32Å; P2131-K2133 PolarHBondContact O-N 3.14Å; K2133-F2135 VanDerWaalsContact C-N 3.33Å; K2133-Q2136 PolarHBondContact O-N 3.24Å; K2133-L2137 HydrophobicContact CD-CD1 4.25Å; K2133-L2137 HydrophobicContact CD-CG 4.35Å; K2133-L2137 HydrophobicContact CG-CD1 4.14Å; K2133-L2137 WeakPolarHBondContact O-CB 3.42Å; K2133-L2137 VanDerWaalsContact O-CG 3.31Å; K2133-L2137 WeakPolarHBondContact O-CG 3.42Å; K2133-L2137 PolarHBondContact O-N 2.96Å; K2133-L2137 VanDerWaalsContact O-N 3.13Å
2134	I	91.3	Very high	91.4	Very high	10 Å²	10	47.9 Å²	47.9	5%	0.051	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-46.4	172.6	-66	170.7	0	0	0	109.9	I2114 L2120 A2129 S2130 P2131 Q2136 L2137 S2138 I2161	I2114-I2134 HydrophobicContact CD1-CD1 4.2Å; I2114-I2134 HydrophobicContact CD1-CG1 4.29Å; I2114-I2134 HydrophobicContact CD1-CG2 3.57Å; I2114-I2134 HydrophobicContact CG2-CD1 4.37Å; L2120-I2134 HydrophobicContact CD1-CG2 3.98Å; L2120-I2134 HydrophobicContact CD2-CG2 4.23Å; A2129-I2134 HydrophobicContact CB-CD1 4.24Å; A2129-I2134 HydrophobicContact CB-CG1 3.74Å; S2130-I2134 PolarHBondContact O-N 3.08Å; P2131-I2134 PolarHBondContact O-N 3.12Å; I2134-Q2136 PolarHBondContact O-N 2.97Å; I2134-L2137 PolarHBondContact O-N 3.16Å; I2134-S2138 VanDerWaalsContact O-CB 3.28Å; I2134-S2138 WeakPolarHBondContact O-CB 3.39Å; I2134-S2138 PolarHBondContact O-N 2.95Å; I2134-S2138 VanDerWaalsContact O-N 3.1Å; I2134-I2161 HydrophobicContact CG2-CB 4.23Å; I2134-I2161 HydrophobicContact CG2-CD1 4.27Å; I2134-I2161 HydrophobicContact CG2-CG2 3.75Å
2135	F	93.1	Very high	91.5	Very high	36 Å²	36	47.8 Å²	47.8	16%	0.158	26%	0.259	C	S	.	.	H	α-helix	trans	-58	-47.3	176.5	-176.9	-99.5	0	0	0	112.4	P2131 S2132 K2133 L2137 S2138 T2141 Y2157 L2158 I2161 L2410 L2411 H2415	P2131-F2135 WeakPolarHBondContact O-CB 3.5Å; P2131-F2135 PolarHBondContact O-N 3.12Å; S2132-F2135 PolarHBondContact O-N 2.83Å; K2133-F2135 VanDerWaalsContact C-N 3.33Å; F2135-L2137 VanDerWaalsContact C-N 3.32Å; F2135-L2137 PolarHBondContact O-N 2.9Å; F2135-S2138 PolarHBondContact O-N 3.18Å; F2135-T2141 VanDerWaalsContact CE2-OG1 3.27Å; F2135-T2141 WeakPolarHBondContact CE2-OG1 3.42Å; F2135-T2141 HydrophobicContact CZ-CG2 4.27Å; F2135-T2141 WeakPolarHBondContact CZ-OG1 3.43Å; F2135-Y2157 HydrophobicContact CD2-CE1 4.33Å; F2135-Y2157 HydrophobicContact CE2-CE1 4.41Å; F2135-L2158 HydrophobicContact CD2-CD2 4.12Å; F2135-L2158 HydrophobicContact CE2-CD2 3.79Å; F2135-I2161 HydrophobicContact CB-CD1 3.87Å; F2135-I2161 HydrophobicContact CD2-CD1 3.84Å; F2135-I2161 HydrophobicContact CG-CD1 4.35Å; F2135-L2410 HydrophobicContact CB-CB 4.32Å; F2135-L2410 HydrophobicContact CB-CD2 4.48Å; F2135-L2410 HydrophobicContact CD2-CB 4.32Å; F2135-L2410 HydrophobicContact CD2-CD1 4.21Å; F2135-L2410 HydrophobicContact CG-CB 4.18Å; F2135-L2411 HydrophobicContact CD1-CB 4.26Å; F2135-L2411 HydrophobicContact CD1-CD2 3.91Å; F2135-L2411 HydrophobicContact CD1-CG 4.07Å; F2135-L2411 HydrophobicContact CE1-CB 3.91Å; F2135-L2411 HydrophobicContact CE1-CD1 3.86Å; F2135-L2411 HydrophobicContact CE1-CD2 3.85Å; F2135-L2411 VanDerWaalsContact CE1-CD2 3.5Å; F2135-L2411 HydrophobicContact CE1-CG 3.97Å; F2135-L2411 HydrophobicContact CZ-CD1 3.91Å; F2135-L2411 HydrophobicContact CZ-CD2 4.26Å; F2135-L2411 HydrophobicContact CZ-CG 4.08Å; F2135-H2415 AromaticContact CZ-CD2 3.99Å; F2135-H2415 AromaticContact CZ-NE2 3.88Å
2136	Q	90.9	Very high	91.6	Very high	134.25 Å²	134.25	50.3 Å²	50.3	63%	0.627	25%	0.252	S	S	*	.	H	α-helix	trans	-63.8	-33.1	180	-75.2	170.3	15.9	0	0	114.1	S2132 K2133 I2134	S2132-Q2136 WeakPolarHBondContact O-CB 3.35Å; S2132-Q2136 VanDerWaalsContact O-CG 3.24Å; S2132-Q2136 WeakPolarHBondContact O-CG 3.35Å; S2132-Q2136 PolarHBondContact O-N 3.17Å; S2132-Q2136 VanDerWaalsContact O-N 3.09Å; S2132-Q2136 PolarHBondContact OG-NE2 3.2Å; K2133-Q2136 PolarHBondContact O-N 3.24Å; I2134-Q2136 PolarHBondContact O-N 2.97Å
2137	L	89.4	Confident	91.6	Very high	101 Å²	101	53.4 Å²	53.4	53%	0.529	26%	0.262	S	S	.	.	H	α-helix	trans	-90.5	-16.7	-177.1	-68.2	176.4	0	0	0	113.2	L2120 K2133 I2134 F2135	L2120-L2137 HydrophobicContact CD1-CB 4.46Å; L2120-L2137 VanDerWaalsContact CD2-C 3.46Å; L2120-L2137 HydrophobicContact CD2-CB 3.51Å; L2120-L2137 HydrophobicContact CD2-CD1 4.33Å; L2120-L2137 HydrophobicContact CD2-CG 4.47Å; L2120-L2137 WeakPolarHBondContact CD2-O 3.17Å; L2120-L2137 HydrophobicContact CG-CB 4.02Å; K2133-L2137 HydrophobicContact CD-CD1 4.25Å; K2133-L2137 HydrophobicContact CD-CG 4.35Å; K2133-L2137 HydrophobicContact CG-CD1 4.14Å; K2133-L2137 WeakPolarHBondContact O-CB 3.42Å; K2133-L2137 VanDerWaalsContact O-CG 3.31Å; K2133-L2137 WeakPolarHBondContact O-CG 3.42Å; K2133-L2137 PolarHBondContact O-N 2.96Å; K2133-L2137 VanDerWaalsContact O-N 3.13Å; I2134-L2137 PolarHBondContact O-N 3.16Å; F2135-L2137 VanDerWaalsContact C-N 3.32Å; F2135-L2137 PolarHBondContact O-N 2.9Å
2138	S	91.5	Very high	91.4	Very high	4.5 Å²	4.5	57 Å²	57	3%	0.031	28%	0.279	C	S	.	.			trans	-79.7	150.2	-178.2	166.5	0	0	0	0	112.1	Y2118 I2134 F2135 M2140 Q2142 Y2157	Y2118-S2138 PolarHBondContact O-OG 3.23Å; Y2118-S2138 VanDerWaalsContact O-OG 3.06Å; I2134-S2138 VanDerWaalsContact O-CB 3.28Å; I2134-S2138 WeakPolarHBondContact O-CB 3.39Å; I2134-S2138 PolarHBondContact O-N 2.95Å; I2134-S2138 VanDerWaalsContact O-N 3.1Å; F2135-S2138 PolarHBondContact O-N 3.18Å; S2138-M2140 VanDerWaalsContact C-N 3.34Å; S2138-M2140 WeakPolarHBondContact OG-CB 3.46Å; S2138-M2140 WeakPolarHBondContact OG-CG 3.34Å; S2138-M2140 PolarHBondContact OG-N 3.13Å; S2138-M2140 VanDerWaalsContact OG-N 3.15Å; S2138-Q2142 PolarHBondContact O-OE1 3.2Å; S2138-Y2157 VanDerWaalsContact CB-OH 3.23Å; S2138-Y2157 WeakPolarHBondContact CB-OH 3.32Å; S2138-Y2157 PolarHBondContact OG-OH 3.17Å
2139	N	90.6	Very high	91.3	Very high	67.5 Å²	67.5	55.7 Å²	55.7	36%	0.361	27%	0.272	S	S	.	.	S	Bend	trans	-90.7	2.5	173.3	68.2	1.8	0	0	0	113.8	T2141 Q2142 R2143	N2139-T2141 VanDerWaalsContact C-N 3.34Å; N2139-T2141 PolarHBondContact O-N 3Å; N2139-Q2142 VanDerWaalsContact CA-OE1 3.25Å; N2139-Q2142 PolarHBondContact O-N 3.02Å; N2139-Q2142 PolarHBondContact O-OE1 3.25Å; N2139-Q2142 VanDerWaalsContact O-OE1 3.06Å; N2139-R2143 VanDerWaalsContact O-CG 3.3Å; N2139-R2143 WeakPolarHBondContact O-CG 3.44Å; N2139-R2143 PolarHBondContact O-N 3.06Å; N2139-R2143 VanDerWaalsContact O-N 3.12Å; N2139-R2143 WeakPolarHBondContact OD1-CD 3.43Å
2140	M	92.5	Very high	91.5	Very high	6.25 Å²	6.25	55.9 Å²	55.9	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-37.7	-170	-68.8	-69	-72.9	0	0	112.9	R2117 Y2118 S2138 Q2142 R2143 W2144 L2149 Y2154 Y2157	R2117-M2140 WeakPolarHBondContact O-CE 3.41Å; Y2118-M2140 HydrophobicContact CD1-CE 3.91Å; Y2118-M2140 HydrophobicContact CD1-CG 3.96Å; Y2118-M2140 HydrophobicContact CD1-SD 4.02Å; Y2118-M2140 HydrophobicContact CE1-CE 4.16Å; Y2118-M2140 HydrophobicContact CG-CG 4.39Å; S2138-M2140 VanDerWaalsContact C-N 3.34Å; S2138-M2140 WeakPolarHBondContact OG-CB 3.46Å; S2138-M2140 WeakPolarHBondContact OG-CG 3.34Å; S2138-M2140 PolarHBondContact OG-N 3.13Å; S2138-M2140 VanDerWaalsContact OG-N 3.15Å; M2140-Q2142 VanDerWaalsContact C-N 3.35Å; M2140-Q2142 PolarHBondContact O-N 3.43Å; M2140-R2143 PolarHBondContact O-N 3.02Å; M2140-W2144 WeakPolarHBondContact O-CB 3.25Å; M2140-W2144 PolarHBondContact O-N 2.99Å; M2140-L2149 HydrophobicContact CB-CD1 4.34Å; M2140-L2149 HydrophobicContact CE-CD1 3.45Å; M2140-L2149 VanDerWaalsContact CE-CD1 3.48Å; M2140-L2149 HydrophobicContact CE-CD2 4.14Å; M2140-L2149 HydrophobicContact CE-CG 4.46Å; M2140-L2149 WeakPolarHBondContact O-CD1 3.25Å; M2140-L2149 HydrophobicContact SD-CD1 3.73Å; M2140-L2149 VanDerWaalsContact SD-CD1 3.6Å; M2140-L2149 HydrophobicContact SD-CD2 4.46Å; M2140-Y2154 HydrophobicContact CB-CE2 4.47Å; M2140-Y2157 HydrophobicContact CB-CD1 3.81Å; M2140-Y2157 HydrophobicContact CB-CD2 4.18Å; M2140-Y2157 HydrophobicContact CB-CE1 3.55Å; M2140-Y2157 VanDerWaalsContact CB-CE1 3.49Å; M2140-Y2157 HydrophobicContact CB-CE2 3.93Å; M2140-Y2157 HydrophobicContact CB-CG 4.11Å; M2140-Y2157 VanDerWaalsContact CB-CZ 3.5Å; M2140-Y2157 HydrophobicContact CE-CD2 4.06Å; M2140-Y2157 HydrophobicContact CE-CG 3.91Å; M2140-Y2157 HydrophobicContact CG-CD1 4.37Å; M2140-Y2157 HydrophobicContact CG-CD2 3.85Å; M2140-Y2157 HydrophobicContact CG-CE1 4.24Å; M2140-Y2157 HydrophobicContact CG-CE2 3.68Å; M2140-Y2157 HydrophobicContact CG-CG 4.17Å
2141	T	94	Very high	91.8	Very high	13.75 Å²	13.75	53.1 Å²	53.1	8%	0.084	25%	0.252	C	S	.	.	H	α-helix	trans	-63.7	-43.4	177.3	-56.4	0	0	0	0	111.7	F2135 N2139 R2143 W2144 Q2145 Y2154 P2416	F2135-T2141 VanDerWaalsContact CE2-OG1 3.27Å; F2135-T2141 WeakPolarHBondContact CE2-OG1 3.42Å; F2135-T2141 HydrophobicContact CZ-CG2 4.27Å; F2135-T2141 WeakPolarHBondContact CZ-OG1 3.43Å; N2139-T2141 VanDerWaalsContact C-N 3.34Å; N2139-T2141 PolarHBondContact O-N 3Å; T2141-R2143 VanDerWaalsContact C-N 3.34Å; T2141-R2143 PolarHBondContact O-N 3.07Å; T2141-W2144 PolarHBondContact O-N 3.16Å; T2141-Q2145 VanDerWaalsContact O-CG 3.3Å; T2141-Q2145 WeakPolarHBondContact O-CG 3.37Å; T2141-Q2145 PolarHBondContact O-N 3.09Å; T2141-Y2154 WeakPolarHBondContact CB-OH 3.42Å; T2141-Y2154 WeakPolarHBondContact CG2-OH 3.42Å; T2141-Y2154 PolarHBondContact OG1-OH 3.04Å; T2141-P2416 HydrophobicContact CG2-CG 3.93Å
2142	Q	92.2	Very high	92.2	Very high	88 Å²	88	51.3 Å²	51.3	41%	0.411	24%	0.241	S	C	.	.	H	α-helix	trans	-66.8	-37.5	176.7	-58.4	87.1	-5.3	0	0	111.1	S2138 N2139 M2140 Q2145 R2146	S2138-Q2142 PolarHBondContact O-OE1 3.2Å; N2139-Q2142 VanDerWaalsContact CA-OE1 3.25Å; N2139-Q2142 PolarHBondContact O-N 3.02Å; N2139-Q2142 PolarHBondContact O-OE1 3.25Å; N2139-Q2142 VanDerWaalsContact O-OE1 3.06Å; M2140-Q2142 VanDerWaalsContact C-N 3.35Å; M2140-Q2142 PolarHBondContact O-N 3.43Å; Q2142-Q2145 PolarHBondContact O-N 3.17Å; Q2142-R2146 WeakPolarHBondContact O-CB 3.38Å; Q2142-R2146 WeakPolarHBondContact O-CD 3.42Å; Q2142-R2146 VanDerWaalsContact O-CG 3.26Å; Q2142-R2146 WeakPolarHBondContact O-CG 3.37Å; Q2142-R2146 PolarHBondContact O-N 3.18Å; Q2142-R2146 PolarHBondContact O-NE 2.75Å
2143	R	91.9	Very high	92.4	Very high	68.75 Å²	68.75	50.7 Å²	50.7	26%	0.259	23%	0.234	S	C	.	.	H	α-helix	trans	-64.6	-40.7	175.2	-69	-175.2	71.2	-152.8	-6.7	112.1	N2139 M2140 T2141 R2146 R2147 E2148 L2149	N2139-R2143 VanDerWaalsContact O-CG 3.3Å; N2139-R2143 WeakPolarHBondContact O-CG 3.44Å; N2139-R2143 PolarHBondContact O-N 3.06Å; N2139-R2143 VanDerWaalsContact O-N 3.12Å; N2139-R2143 WeakPolarHBondContact OD1-CD 3.43Å; M2140-R2143 PolarHBondContact O-N 3.02Å; T2141-R2143 VanDerWaalsContact C-N 3.34Å; T2141-R2143 PolarHBondContact O-N 3.07Å; R2143-R2146 CarbonylContact O-C 3.55Å; R2143-R2146 PolarHBondContact O-N 3.33Å; R2143-R2147 PolarHBondContact O-N 3.02Å; R2143-R2147 VanDerWaalsContact O-N 3.1Å; R2143-E2148 HydrophobicContact CB-CB 4.12Å; R2143-E2148 VanDerWaalsContact CG-OE2 3.26Å; R2143-E2148 WeakPolarHBondContact CG-OE2 3.42Å; R2143-E2148 IonicContact CZ-OE2 3.26Å; R2143-E2148 IonicContact NE-OE2 3.18Å; R2143-E2148 PolarHBondContact NE-OE2 3.08Å; R2143-E2148 IonicContact NH2-OE2 2.73Å; R2143-E2148 WeakPolarHBondContact O-CB 3.43Å; R2143-E2148 PolarHBondContact O-N 2.95Å; R2143-L2149 HydrophobicContact CB-CD1 3.75Å; R2143-L2149 HydrophobicContact CB-CG 4.07Å
2144	W	94.5	Very high	92.6	Very high	5.75 Å²	5.75	46 Å²	46	2%	0.022	21%	0.213	C	C	.	.	H	α-helix	trans	-65.8	-43.5	173.3	171.5	71.2	0	0	0	112.5	M2140 T2141 R2146 R2147 L2149 N2151 Y2154 L2349 H2350 H2415 P2416 R2418	M2140-W2144 WeakPolarHBondContact O-CB 3.25Å; M2140-W2144 PolarHBondContact O-N 2.99Å; T2141-W2144 PolarHBondContact O-N 3.16Å; W2144-R2146 VanDerWaalsContact C-N 3.28Å; W2144-R2146 PolarHBondContact O-N 2.93Å; W2144-R2147 WeakPolarHBondContact O-CA 3.48Å; W2144-R2147 PolarHBondContact O-N 3.11Å; W2144-L2149 HydrophobicContact CB-CB 4.37Å; W2144-L2149 HydrophobicContact CB-CD1 4.45Å; W2144-N2151 PolarHBondContact NE1-OD1 3.21Å; W2144-Y2154 HydrophobicContact CB-CD1 4.29Å; W2144-Y2154 HydrophobicContact CB-CD2 3.5Å; W2144-Y2154 VanDerWaalsContact CB-CD2 3.48Å; W2144-Y2154 HydrophobicContact CB-CE2 3.95Å; W2144-Y2154 HydrophobicContact CB-CG 3.7Å; W2144-Y2154 VanDerWaalsContact CD1-CB 3.43Å; W2144-Y2154 AromaticContact CD1-CD1 3.85Å; W2144-Y2154 AromaticContact CD1-CG 3.64Å; W2144-Y2154 AromaticContact CD2-CD1 3.49Å; W2144-Y2154 HydrophobicContact CD2-CD1 3.49Å; W2144-Y2154 VanDerWaalsContact CD2-CD1 3.45Å; W2144-Y2154 HydrophobicContact CD2-CD2 4.32Å; W2144-Y2154 AromaticContact CD2-CE1 3.7Å; W2144-Y2154 HydrophobicContact CD2-CE1 3.7Å; W2144-Y2154 HydrophobicContact CD2-CE2 4.42Å; W2144-Y2154 AromaticContact CD2-CG 3.83Å; W2144-Y2154 HydrophobicContact CD2-CG 3.83Å; W2144-Y2154 AromaticContact CE2-CD1 3.7Å; W2144-Y2154 AromaticContact CE3-CD1 3.87Å; W2144-Y2154 HydrophobicContact CE3-CD1 3.95Å; W2144-Y2154 AromaticContact CE3-CE1 3.63Å; W2144-Y2154 HydrophobicContact CE3-CE1 3.63Å; W2144-Y2154 HydrophobicContact CE3-CE2 4.25Å; W2144-Y2154 HydrophobicContact CE3-CG 4.29Å; W2144-Y2154 AromaticContact CE3-CZ 3.81Å; W2144-Y2154 AromaticContact CG-CD1 3.64Å; W2144-Y2154 HydrophobicContact CG-CD1 3.64Å; W2144-Y2154 AromaticContact CG-CD2 3.78Å; W2144-Y2154 HydrophobicContact CG-CD2 3.78Å; W2144-Y2154 HydrophobicContact CG-CE1 4.17Å; W2144-Y2154 HydrophobicContact CG-CE2 4.31Å; W2144-Y2154 AromaticContact CG-CG 3.42Å; W2144-Y2154 HydrophobicContact CG-CG 3.42Å; W2144-Y2154 VanDerWaalsContact CG-CG 3.44Å; W2144-Y2154 HydrophobicContact CH2-CD1 4.45Å; W2144-Y2154 HydrophobicContact CH2-CE1 4.36Å; W2144-Y2154 HydrophobicContact CZ2-CD1 4.3Å; W2144-Y2154 HydrophobicContact CZ2-CE1 4.47Å; W2144-Y2154 HydrophobicContact CZ3-CD1 4.23Å; W2144-Y2154 AromaticContact CZ3-CE1 3.71Å; W2144-Y2154 HydrophobicContact CZ3-CE1 4.03Å; W2144-Y2154 AromaticContact NE1-CD1 3.9Å; W2144-L2349 HydrophobicContact CZ2-CB 4.42Å; W2144-L2349 HydrophobicContact CZ2-CD2 4.29Å; W2144-H2350 HydrophobicContact CH2-CB 4.4Å; W2144-H2415 AromaticContact CZ3-CE1 3.69Å; W2144-P2416 WeakPolarHBondContact CZ3-O 3.44Å; W2144-R2418 HydrophobicContact CD2-CG 4.02Å; W2144-R2418 HydrophobicContact CE3-CB 4.48Å; W2144-R2418 HydrophobicContact CE3-CG 4.35Å; W2144-R2418 HydrophobicContact CG-CG 4.48Å; W2144-R2418 HydrophobicContact CH2-CB 3.73Å; W2144-R2418 HydrophobicContact CH2-CG 4.25Å; W2144-R2418 HydrophobicContact CZ2-CB 3.72Å; W2144-R2418 HydrophobicContact CZ2-CG 3.88Å; W2144-R2418 HydrophobicContact CZ3-CB 4.13Å; W2144-R2418 HydrophobicContact CZ3-CG 4.45Å; W2144-R2418 WeakPolarHBondContact O-CG 3.37Å; W2144-R2418 PolarHBondContact O-NE 2.93Å; W2144-R2418 VanDerWaalsContact O-NE 3.17Å
2145	Q	93.2	Very high	93	Very high	63.75 Å²	63.75	45.6 Å²	45.6	30%	0.298	21%	0.211	S	C	.	.	H	α-helix	trans	-58.7	-37	173	-72.4	-177.1	-58.9	0	0	112.2	T2141 Q2142 R2147 R2417 N2419	T2141-Q2145 VanDerWaalsContact O-CG 3.3Å; T2141-Q2145 WeakPolarHBondContact O-CG 3.37Å; T2141-Q2145 PolarHBondContact O-N 3.09Å; Q2142-Q2145 PolarHBondContact O-N 3.17Å; Q2145-R2147 VanDerWaalsContact C-N 3.26Å; Q2145-R2147 PolarHBondContact O-N 3Å; Q2145-R2417 WeakPolarHBondContact CG-O 3.24Å; Q2145-R2417 PolarHBondContact NE2-O 3.13Å; Q2145-N2419 VanDerWaalsContact O-CB 3.24Å; Q2145-N2419 WeakPolarHBondContact O-CB 3.32Å; Q2145-N2419 PolarHBondContact O-N 3.15Å; Q2145-N2419 PolarHBondContact O-ND2 3.4Å
2146	R	90.6	Very high	93.1	Very high	128.5 Å²	128.5	44 Å²	44	49%	0.485	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	0.7	174.5	-69.8	173.2	-155	175	0.9	114.6	Q2142 R2143 W2144 E2148 H2424	Q2142-R2146 WeakPolarHBondContact O-CB 3.38Å; Q2142-R2146 WeakPolarHBondContact O-CD 3.42Å; Q2142-R2146 VanDerWaalsContact O-CG 3.26Å; Q2142-R2146 WeakPolarHBondContact O-CG 3.37Å; Q2142-R2146 PolarHBondContact O-N 3.18Å; Q2142-R2146 PolarHBondContact O-NE 2.75Å; R2143-R2146 CarbonylContact O-C 3.55Å; R2143-R2146 PolarHBondContact O-N 3.33Å; W2144-R2146 VanDerWaalsContact C-N 3.28Å; W2144-R2146 PolarHBondContact O-N 2.93Å; R2146-E2148 HydrophobicContact CB-CG 4.09Å; R2146-E2148 WeakPolarHBondContact CD-OE1 3.4Å; R2146-E2148 IonicContact CZ-OE1 3.89Å; R2146-E2148 IonicContact NE-OE1 3.44Å; R2146-E2148 IonicContact NH1-OE1 2.83Å; R2146-E2148 PolarHBondContact NH1-OE1 2.86Å; R2146-E2148 PolarHBondContact O-N 3.11Å; R2146-E2148 VanDerWaalsContact O-N 3.17Å; R2146-H2424 WeakPolarHBondContact CB-NE2 3.13Å; R2146-H2424 WeakPolarHBondContact CG-NE2 3.24Å; R2146-H2424 PolarHBondContact O-CD2 3.18Å; R2146-H2424 PolarHBondContact O-NE2 2.85Å; R2146-H2424 VanDerWaalsContact O-NE2 3.1Å
2147	R	89.6	Confident	93.4	Very high	78.5 Å²	78.5	37.8 Å²	37.8	30%	0.296	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	22.5	-176.9	-50.9	-155.4	179	-141.5	-3.6	114.7	R2143 W2144 Q2145 L2149 E2343 N2419 A2421	R2143-R2147 PolarHBondContact O-N 3.02Å; R2143-R2147 VanDerWaalsContact O-N 3.1Å; W2144-R2147 WeakPolarHBondContact O-CA 3.48Å; W2144-R2147 PolarHBondContact O-N 3.11Å; Q2145-R2147 VanDerWaalsContact C-N 3.26Å; Q2145-R2147 PolarHBondContact O-N 3Å; R2147-L2149 VanDerWaalsContact C-N 3.33Å; R2147-L2149 PolarHBondContact O-N 3.13Å; R2147-E2343 IonicContact CZ-OE1 3.58Å; R2147-E2343 IonicContact CZ-OE2 3.4Å; R2147-E2343 IonicContact NH1-OE2 2.81Å; R2147-E2343 PolarHBondContact NH1-OE2 2.87Å; R2147-E2343 IonicContact NH2-OE1 3.06Å; R2147-E2343 PolarHBondContact NH2-OE1 3.27Å; R2147-E2343 IonicContact NH2-OE2 3.12Å; R2147-E2343 PolarHBondContact NH2-OE2 3.08Å; R2147-N2419 VanDerWaalsContact CZ-O 3.29Å; R2147-N2419 PolarHBondContact NE-O 3.3Å; R2147-N2419 PolarHBondContact NH2-O 2.89Å; R2147-A2421 VanDerWaalsContact CZ-N 3.34Å
2148	E	88.6	Confident	93.7	Very high	77.75 Å²	77.75	33.1 Å²	33.1	36%	0.363	15%	0.15	S	C	.	.	S	Bend	trans	-74.7	-15	169.2	-59.8	176.5	-150.9	0	0	112.4	R2143 R2146	R2143-E2148 HydrophobicContact CB-CB 4.12Å; R2143-E2148 VanDerWaalsContact CG-OE2 3.26Å; R2143-E2148 WeakPolarHBondContact CG-OE2 3.42Å; R2143-E2148 IonicContact CZ-OE2 3.26Å; R2143-E2148 IonicContact NE-OE2 3.18Å; R2143-E2148 PolarHBondContact NE-OE2 3.08Å; R2143-E2148 IonicContact NH2-OE2 2.73Å; R2143-E2148 WeakPolarHBondContact O-CB 3.43Å; R2143-E2148 PolarHBondContact O-N 2.95Å; R2146-E2148 HydrophobicContact CB-CG 4.09Å; R2146-E2148 WeakPolarHBondContact CD-OE1 3.4Å; R2146-E2148 IonicContact CZ-OE1 3.89Å; R2146-E2148 IonicContact NE-OE1 3.44Å; R2146-E2148 IonicContact NH1-OE1 2.83Å; R2146-E2148 PolarHBondContact NH1-OE1 2.86Å; R2146-E2148 PolarHBondContact O-N 3.11Å; R2146-E2148 VanDerWaalsContact O-N 3.17Å
2149	L	90.3	Very high	94	Very high	22.5 Å²	22.5	32.8 Å²	32.8	12%	0.118	15%	0.149	C	C	.	.	S	Bend	trans	-127	141.8	178	-64.5	170.1	0	0	0	109.4	M2140 R2143 W2144 R2147 D2153 R2418	M2140-L2149 HydrophobicContact CB-CD1 4.34Å; M2140-L2149 HydrophobicContact CE-CD1 3.45Å; M2140-L2149 VanDerWaalsContact CE-CD1 3.48Å; M2140-L2149 HydrophobicContact CE-CD2 4.14Å; M2140-L2149 HydrophobicContact CE-CG 4.46Å; M2140-L2149 WeakPolarHBondContact O-CD1 3.25Å; M2140-L2149 HydrophobicContact SD-CD1 3.73Å; M2140-L2149 VanDerWaalsContact SD-CD1 3.6Å; M2140-L2149 HydrophobicContact SD-CD2 4.46Å; R2143-L2149 HydrophobicContact CB-CD1 3.75Å; R2143-L2149 HydrophobicContact CB-CG 4.07Å; W2144-L2149 HydrophobicContact CB-CB 4.37Å; W2144-L2149 HydrophobicContact CB-CD1 4.45Å; R2147-L2149 VanDerWaalsContact C-N 3.33Å; R2147-L2149 PolarHBondContact O-N 3.13Å; L2149-D2153 HydrophobicContact CB-CB 4.36Å; L2149-D2153 HydrophobicContact CD2-CB 4.39Å; L2149-R2418 PolarHBondContact O-NH2 3.23Å
2150	S	94.1	Very high	94.2	Very high	24 Å²	24	29.7 Å²	29.7	17%	0.168	13%	0.132	C	C	.	.			trans	-69.3	162.4	172.4	75.6	0	0	0	0	111.4	F2152 D2153 Y2154 R2337 E2341	S2150-F2152 VanDerWaalsContact C-N 3.28Å; S2150-F2152 PolarHBondContact O-N 3.39Å; S2150-F2152 PolarHBondContact OG-N 3.38Å; S2150-D2153 VanDerWaalsContact CB-OD2 3.22Å; S2150-D2153 WeakPolarHBondContact CB-OD2 3.39Å; S2150-D2153 PolarHBondContact N-OD2 3.27Å; S2150-D2153 VanDerWaalsContact N-OD2 3.11Å; S2150-D2153 PolarHBondContact O-N 2.81Å; S2150-D2153 WeakPolarHBondContact OG-CB 3.33Å; S2150-D2153 VanDerWaalsContact OG-CG 3.27Å; S2150-D2153 PolarHBondContact OG-N 3.2Å; S2150-D2153 PolarHBondContact OG-OD2 3.18Å; S2150-Y2154 WeakPolarHBondContact O-CB 3.35Å; S2150-Y2154 PolarHBondContact O-N 3.13Å; S2150-Y2154 VanDerWaalsContact O-N 3.14Å; S2150-R2337 PolarHBondContact OG-NH2 2.94Å; S2150-E2341 WeakPolarHBondContact CB-OE1 3.3Å; S2150-E2341 WeakPolarHBondContact CB-OE2 3.44Å; S2150-E2341 PolarHBondContact OG-OE1 3.24Å
2151	N	97	Very high	94.3	Very high	0.25 Å²	0.25	29.6 Å²	29.6	0%	0.001	13%	0.132	C	C	.	.	H	α-helix	trans	-61.4	-40.5	173.3	-74.6	-19.8	0	0	0	110.2	W2144 Y2154 L2155 L2340 E2341 S2346 L2349 R2418	W2144-N2151 PolarHBondContact NE1-OD1 3.21Å; N2151-Y2154 PolarHBondContact O-N 2.95Å; N2151-L2155 WeakPolarHBondContact O-CB 3.45Å; N2151-L2155 VanDerWaalsContact O-CG 3.3Å; N2151-L2155 WeakPolarHBondContact O-CG 3.29Å; N2151-L2155 PolarHBondContact O-N 3.16Å; N2151-L2340 HydrophobicContact CB-CD1 4.41Å; N2151-L2340 HydrophobicContact CB-CG 4.31Å; N2151-L2340 PolarHBondContact ND2-O 3.26Å; N2151-E2341 WeakPolarHBondContact CB-OE2 3.43Å; N2151-E2341 PolarHBondContact N-OE1 3.06Å; N2151-E2341 VanDerWaalsContact N-OE1 3.17Å; N2151-E2341 PolarHBondContact N-OE2 2.87Å; N2151-S2346 PolarHBondContact ND2-OG 3.34Å; N2151-L2349 HydrophobicContact CB-CD2 3.82Å; N2151-R2418 PolarHBondContact OD1-NE 3.33Å; N2151-R2418 PolarHBondContact OD1-NH1 2.99Å
2152	F	97.4	Very high	94.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.9	-49.4	174.9	-176.9	-84.6	0	0	0	113	R1893 S2150 Y2154 L2155 M2156 F2175 P2291 F2294 Y2295 R2337 L2340 E2341	R1893-F2152 HydrophobicContact CG-CE1 3.69Å; R1893-F2152 HydrophobicContact CG-CZ 3.72Å; S2150-F2152 VanDerWaalsContact C-N 3.28Å; S2150-F2152 PolarHBondContact O-N 3.39Å; S2150-F2152 PolarHBondContact OG-N 3.38Å; F2152-Y2154 VanDerWaalsContact C-N 3.26Å; F2152-Y2154 PolarHBondContact O-N 3.24Å; F2152-L2155 PolarHBondContact O-N 2.92Å; F2152-L2155 VanDerWaalsContact O-N 3.17Å; F2152-M2156 HydrophobicContact CD1-CG 4.07Å; F2152-M2156 HydrophobicContact CE1-CE 4.42Å; F2152-M2156 HydrophobicContact CE1-CG 3.56Å; F2152-M2156 HydrophobicContact CZ-CE 4.34Å; F2152-M2156 HydrophobicContact CZ-CG 3.87Å; F2152-M2156 HydrophobicContact CZ-SD 4.31Å; F2152-M2156 WeakPolarHBondContact O-CB 3.3Å; F2152-M2156 PolarHBondContact O-N 3.21Å; F2152-F2175 HydrophobicContact CB-CE1 4.38Å; F2152-F2175 HydrophobicContact CD1-CZ 4.49Å; F2152-F2175 HydrophobicContact CD2-CD1 4.37Å; F2152-F2175 AromaticContact CD2-CE1 3.33Å; F2152-F2175 HydrophobicContact CD2-CE1 3.33Å; F2152-F2175 AromaticContact CD2-CZ 3.6Å; F2152-F2175 HydrophobicContact CD2-CZ 3.6Å; F2152-F2175 AromaticContact CE2-CE1 3.7Å; F2152-F2175 HydrophobicContact CE2-CE1 3.7Å; F2152-F2175 HydrophobicContact CE2-CE2 4.47Å; F2152-F2175 AromaticContact CE2-CZ 3.67Å; F2152-F2175 HydrophobicContact CE2-CZ 3.67Å; F2152-F2175 AromaticContact CG-CE1 3.93Å; F2152-F2175 HydrophobicContact CG-CE1 4.01Å; F2152-F2175 AromaticContact CG-CZ 3.94Å; F2152-F2175 HydrophobicContact CG-CZ 4.08Å; F2152-F2175 HydrophobicContact CZ-CZ 4.21Å; F2152-P2291 HydrophobicContact CE2-CB 4.25Å; F2152-P2291 HydrophobicContact CZ-CB 4.29Å; F2152-F2294 HydrophobicContact CD2-CB 3.98Å; F2152-F2294 HydrophobicContact CE2-CB 4.03Å; F2152-Y2295 AromaticContact CE2-CD1 3.75Å; F2152-Y2295 HydrophobicContact CE2-CD1 3.75Å; F2152-Y2295 HydrophobicContact CE2-CE1 4.34Å; F2152-Y2295 AromaticContact CZ-CD1 3.52Å; F2152-Y2295 HydrophobicContact CZ-CD1 3.52Å; F2152-Y2295 VanDerWaalsContact CZ-CD1 3.49Å; F2152-Y2295 AromaticContact CZ-CE1 3.87Å; F2152-Y2295 HydrophobicContact CZ-CE1 3.87Å; F2152-R2337 VanDerWaalsContact CG-CZ 3.48Å; F2152-L2340 HydrophobicContact CB-CD2 4Å; F2152-L2340 HydrophobicContact CD2-CD2 4.1Å; F2152-E2341 WeakPolarHBondContact CB-OE1 3.39Å; F2152-E2341 PolarHBondContact N-OE1 3.13Å; F2152-E2341 VanDerWaalsContact N-OE1 3.1Å
2153	D	95.6	Very high	94.4	Very high	34 Å²	34	25.9 Å²	25.9	18%	0.182	12%	0.118	C	C	.	.	H	α-helix	trans	-62.3	-36.9	-179.9	-65.2	-50.8	0	0	0	111.3	S1891 R2117 L2149 S2150 M2156 Y2157	S1891-D2153 VanDerWaalsContact CB-OD1 3.24Å; S1891-D2153 WeakPolarHBondContact CB-OD1 3.3Å; S1891-D2153 PolarHBondContact OG-OD1 3.04Å; R2117-D2153 IonicContact NH2-OD1 3.61Å; R2117-D2153 PolarHBondContact NH2-OD1 3.11Å; L2149-D2153 HydrophobicContact CB-CB 4.36Å; L2149-D2153 HydrophobicContact CD2-CB 4.39Å; S2150-D2153 VanDerWaalsContact CB-OD2 3.22Å; S2150-D2153 WeakPolarHBondContact CB-OD2 3.39Å; S2150-D2153 PolarHBondContact N-OD2 3.27Å; S2150-D2153 VanDerWaalsContact N-OD2 3.11Å; S2150-D2153 PolarHBondContact O-N 2.81Å; S2150-D2153 WeakPolarHBondContact OG-CB 3.33Å; S2150-D2153 VanDerWaalsContact OG-CG 3.27Å; S2150-D2153 PolarHBondContact OG-N 3.2Å; S2150-D2153 PolarHBondContact OG-OD2 3.18Å; D2153-M2156 PolarHBondContact O-N 3.08Å; D2153-Y2157 WeakPolarHBondContact O-CB 3.43Å; D2153-Y2157 PolarHBondContact O-N 2.99Å
2154	Y	97.1	Very high	94.5	Very high	1.75 Å²	1.75	22.9 Å²	22.9	1%	0.007	11%	0.107	C	C	.	.	H	α-helix	trans	-68.8	-42.8	177.4	-171.2	-115.5	0	0	0	112.1	M2140 T2141 W2144 S2150 N2151 F2152 M2156 Y2157 L2158 H2415	M2140-Y2154 HydrophobicContact CB-CE2 4.47Å; T2141-Y2154 WeakPolarHBondContact CB-OH 3.42Å; T2141-Y2154 WeakPolarHBondContact CG2-OH 3.42Å; T2141-Y2154 PolarHBondContact OG1-OH 3.04Å; W2144-Y2154 HydrophobicContact CB-CD1 4.29Å; W2144-Y2154 HydrophobicContact CB-CD2 3.5Å; W2144-Y2154 VanDerWaalsContact CB-CD2 3.48Å; W2144-Y2154 HydrophobicContact CB-CE2 3.95Å; W2144-Y2154 HydrophobicContact CB-CG 3.7Å; W2144-Y2154 VanDerWaalsContact CD1-CB 3.43Å; W2144-Y2154 AromaticContact CD1-CD1 3.85Å; W2144-Y2154 AromaticContact CD1-CG 3.64Å; W2144-Y2154 AromaticContact CD2-CD1 3.49Å; W2144-Y2154 HydrophobicContact CD2-CD1 3.49Å; W2144-Y2154 VanDerWaalsContact CD2-CD1 3.45Å; W2144-Y2154 HydrophobicContact CD2-CD2 4.32Å; W2144-Y2154 AromaticContact CD2-CE1 3.7Å; W2144-Y2154 HydrophobicContact CD2-CE1 3.7Å; W2144-Y2154 HydrophobicContact CD2-CE2 4.42Å; W2144-Y2154 AromaticContact CD2-CG 3.83Å; W2144-Y2154 HydrophobicContact CD2-CG 3.83Å; W2144-Y2154 AromaticContact CE2-CD1 3.7Å; W2144-Y2154 AromaticContact CE3-CD1 3.87Å; W2144-Y2154 HydrophobicContact CE3-CD1 3.95Å; W2144-Y2154 AromaticContact CE3-CE1 3.63Å; W2144-Y2154 HydrophobicContact CE3-CE1 3.63Å; W2144-Y2154 HydrophobicContact CE3-CE2 4.25Å; W2144-Y2154 HydrophobicContact CE3-CG 4.29Å; W2144-Y2154 AromaticContact CE3-CZ 3.81Å; W2144-Y2154 AromaticContact CG-CD1 3.64Å; W2144-Y2154 HydrophobicContact CG-CD1 3.64Å; W2144-Y2154 AromaticContact CG-CD2 3.78Å; W2144-Y2154 HydrophobicContact CG-CD2 3.78Å; W2144-Y2154 HydrophobicContact CG-CE1 4.17Å; W2144-Y2154 HydrophobicContact CG-CE2 4.31Å; W2144-Y2154 AromaticContact CG-CG 3.42Å; W2144-Y2154 HydrophobicContact CG-CG 3.42Å; W2144-Y2154 VanDerWaalsContact CG-CG 3.44Å; W2144-Y2154 HydrophobicContact CH2-CD1 4.45Å; W2144-Y2154 HydrophobicContact CH2-CE1 4.36Å; W2144-Y2154 HydrophobicContact CZ2-CD1 4.3Å; W2144-Y2154 HydrophobicContact CZ2-CE1 4.47Å; W2144-Y2154 HydrophobicContact CZ3-CD1 4.23Å; W2144-Y2154 AromaticContact CZ3-CE1 3.71Å; W2144-Y2154 HydrophobicContact CZ3-CE1 4.03Å; W2144-Y2154 AromaticContact NE1-CD1 3.9Å; S2150-Y2154 WeakPolarHBondContact O-CB 3.35Å; S2150-Y2154 PolarHBondContact O-N 3.13Å; S2150-Y2154 VanDerWaalsContact O-N 3.14Å; N2151-Y2154 PolarHBondContact O-N 2.95Å; F2152-Y2154 VanDerWaalsContact C-N 3.26Å; F2152-Y2154 PolarHBondContact O-N 3.24Å; Y2154-M2156 VanDerWaalsContact C-N 3.33Å; Y2154-M2156 PolarHBondContact O-N 3.37Å; Y2154-Y2157 AromaticContact CD2-CD1 3.81Å; Y2154-Y2157 HydrophobicContact CD2-CD1 3.87Å; Y2154-Y2157 HydrophobicContact CD2-CE1 4.36Å; Y2154-Y2157 AromaticContact CE2-CD1 3.77Å; Y2154-Y2157 HydrophobicContact CE2-CD1 3.77Å; Y2154-Y2157 AromaticContact CE2-CE1 3.78Å; Y2154-Y2157 HydrophobicContact CE2-CE1 3.96Å; Y2154-Y2157 WeakPolarHBondContact O-CB 3.36Å; Y2154-Y2157 PolarHBondContact O-N 3.15Å; Y2154-L2158 HydrophobicContact CD1-CD1 4.02Å; Y2154-L2158 HydrophobicContact CD1-CG 4.42Å; Y2154-L2158 HydrophobicContact CE1-CD1 3.68Å; Y2154-L2158 HydrophobicContact CE1-CD2 4.34Å; Y2154-L2158 HydrophobicContact CE1-CG 4.14Å; Y2154-L2158 HydrophobicContact CE2-CD2 4.41Å; Y2154-L2158 VanDerWaalsContact O-CG 3.31Å; Y2154-L2158 WeakPolarHBondContact O-CG 3.37Å; Y2154-L2158 PolarHBondContact O-N 3.24Å; Y2154-H2415 AromaticContact CE1-CE1 3.81Å; Y2154-H2415 AromaticContact CE1-NE2 3.78Å; Y2154-H2415 AromaticContact CZ-CE1 3.93Å; Y2154-H2415 AromaticContact CZ-NE2 3.81Å; Y2154-H2415 PolarHBondContact OH-CE1 3.25Å; Y2154-H2415 VanDerWaalsContact OH-CE1 3.28Å; Y2154-H2415 PolarHBondContact OH-NE2 2.92Å
2155	L	98	Very high	94.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62.4	-41.9	173.1	-72.8	177.3	0	0	0	111.8	N2151 F2152 Y2157 L2158 N2159 F2175 P2176 L2340 L2349 W2352 V2353	N2151-L2155 WeakPolarHBondContact O-CB 3.45Å; N2151-L2155 VanDerWaalsContact O-CG 3.3Å; N2151-L2155 WeakPolarHBondContact O-CG 3.29Å; N2151-L2155 PolarHBondContact O-N 3.16Å; F2152-L2155 PolarHBondContact O-N 2.92Å; F2152-L2155 VanDerWaalsContact O-N 3.17Å; L2155-Y2157 VanDerWaalsContact C-N 3.32Å; L2155-Y2157 PolarHBondContact O-N 3.14Å; L2155-L2158 HydrophobicContact CD2-CD1 4.36Å; L2155-L2158 PolarHBondContact O-N 3.28Å; L2155-N2159 WeakPolarHBondContact O-CB 3.38Å; L2155-N2159 PolarHBondContact O-N 3.12Å; L2155-N2159 PolarHBondContact O-ND2 3.15Å; L2155-F2175 HydrophobicContact CB-CD1 4.42Å; L2155-F2175 HydrophobicContact CB-CE1 3.83Å; L2155-F2175 HydrophobicContact CB-CE2 3.95Å; L2155-F2175 HydrophobicContact CB-CZ 3.52Å; L2155-F2175 VanDerWaalsContact CB-CZ 3.46Å; L2155-F2175 HydrophobicContact CD1-CD1 3.65Å; L2155-F2175 HydrophobicContact CD1-CE1 3.59Å; L2155-F2175 HydrophobicContact CD1-CG 4.3Å; L2155-F2175 HydrophobicContact CD1-CZ 4.18Å; L2155-F2175 HydrophobicContact CG-CE1 4.37Å; L2155-F2175 HydrophobicContact CG-CZ 4.44Å; L2155-P2176 HydrophobicContact CD1-CG 4.41Å; L2155-L2340 HydrophobicContact CD1-CD1 4Å; L2155-L2349 HydrophobicContact CD1-CD1 4.33Å; L2155-L2349 HydrophobicContact CD1-CD2 4.3Å; L2155-L2349 HydrophobicContact CD2-CD1 4.28Å; L2155-L2349 HydrophobicContact CD2-CD2 4.39Å; L2155-L2349 HydrophobicContact CD2-CG 4.49Å; L2155-L2349 HydrophobicContact CG-CD2 4.27Å; L2155-W2352 HydrophobicContact CD2-CE3 4.07Å; L2155-W2352 HydrophobicContact CD2-CZ3 3.62Å; L2155-V2353 HydrophobicContact CD2-CG2 4.41Å
2156	M	96.7	Very high	94.5	Very high	3.25 Å²	3.25	20.3 Å²	20.3	2%	0.016	9%	0.094	C	C	.	.	H	α-helix	trans	-63.9	-39.7	175.2	-123.4	1.3	2.5	0	0	111.8	R1892 F2152 D2153 Y2154 N2159 T2160 Y2166 P2173 F2175 P2291	R1892-M2156 HydrophobicContact CB-CE 3.96Å; R1892-M2156 VanDerWaalsContact CB-CE 3.48Å; R1892-M2156 HydrophobicContact CB-CG 3.82Å; R1892-M2156 HydrophobicContact CB-SD 3.97Å; R1892-M2156 HydrophobicContact CG-CG 4.03Å; R1892-M2156 HydrophobicContact CG-SD 4.49Å; F2152-M2156 HydrophobicContact CD1-CG 4.07Å; F2152-M2156 HydrophobicContact CE1-CE 4.42Å; F2152-M2156 HydrophobicContact CE1-CG 3.56Å; F2152-M2156 HydrophobicContact CZ-CE 4.34Å; F2152-M2156 HydrophobicContact CZ-CG 3.87Å; F2152-M2156 HydrophobicContact CZ-SD 4.31Å; F2152-M2156 WeakPolarHBondContact O-CB 3.3Å; F2152-M2156 PolarHBondContact O-N 3.21Å; D2153-M2156 PolarHBondContact O-N 3.08Å; Y2154-M2156 VanDerWaalsContact C-N 3.33Å; Y2154-M2156 PolarHBondContact O-N 3.37Å; M2156-N2159 PolarHBondContact O-N 3.01Å; M2156-T2160 VanDerWaalsContact O-CB 3.31Å; M2156-T2160 WeakPolarHBondContact O-CB 3.39Å; M2156-T2160 PolarHBondContact O-N 3.16Å; M2156-T2160 PolarHBondContact O-OG1 3.45Å; M2156-T2160 VanDerWaalsContact O-OG1 3.06Å; M2156-Y2166 HydrophobicContact CE-CE2 4.27Å; M2156-Y2166 VanDerWaalsContact CE-OH 3.24Å; M2156-Y2166 WeakPolarHBondContact CE-OH 3.37Å; M2156-P2173 HydrophobicContact CE-CB 4.45Å; M2156-P2173 HydrophobicContact CE-CG 4.36Å; M2156-P2173 HydrophobicContact SD-CB 4.44Å; M2156-P2173 HydrophobicContact SD-CG 4.47Å; M2156-F2175 HydrophobicContact CE-CE2 4.26Å; M2156-F2175 HydrophobicContact CG-CE2 4.21Å; M2156-F2175 HydrophobicContact CG-CZ 4.01Å; M2156-F2175 HydrophobicContact SD-CE2 3.56Å; M2156-F2175 VanDerWaalsContact SD-CE2 3.56Å; M2156-F2175 HydrophobicContact SD-CZ 3.94Å; M2156-P2291 HydrophobicContact CE-CB 3.9Å; M2156-P2291 HydrophobicContact CE-CG 3.74Å; M2156-P2291 HydrophobicContact SD-CB 4.06Å; M2156-P2291 HydrophobicContact SD-CG 3.78Å
2157	Y	95.6	Very high	94.7	Very high	4 Å²	4	14.9 Å²	14.9	2%	0.016	8%	0.075	C	C	.	.	H	α-helix	trans	-58.3	-51.5	171.5	158.4	-105.6	0	0	0	112	Y2118 F2135 S2138 M2140 D2153 Y2154 L2155 N2159 T2160 I2161	Y2118-Y2157 AromaticContact CD1-CD2 3.56Å; Y2118-Y2157 HydrophobicContact CD1-CD2 3.56Å; Y2118-Y2157 VanDerWaalsContact CD1-CD2 3.49Å; Y2118-Y2157 AromaticContact CD1-CE2 3.65Å; Y2118-Y2157 HydrophobicContact CD1-CE2 3.89Å; Y2118-Y2157 HydrophobicContact CD2-CD2 4.29Å; Y2118-Y2157 HydrophobicContact CD2-CE2 4.4Å; Y2118-Y2157 AromaticContact CE1-CD2 3.56Å; Y2118-Y2157 HydrophobicContact CE1-CD2 3.56Å; Y2118-Y2157 VanDerWaalsContact CE1-CD2 3.45Å; Y2118-Y2157 AromaticContact CE1-CE2 3.95Å; Y2118-Y2157 HydrophobicContact CE1-CE2 4.16Å; Y2118-Y2157 HydrophobicContact CE1-CG 4.46Å; Y2118-Y2157 HydrophobicContact CE2-CD2 4.32Å; Y2118-Y2157 AromaticContact CG-CD2 3.96Å; Y2118-Y2157 HydrophobicContact CG-CD2 4.21Å; Y2118-Y2157 HydrophobicContact CG-CE2 4.15Å; Y2118-Y2157 AromaticContact CZ-CD2 3.96Å; F2135-Y2157 HydrophobicContact CD2-CE1 4.33Å; F2135-Y2157 HydrophobicContact CE2-CE1 4.41Å; S2138-Y2157 VanDerWaalsContact CB-OH 3.23Å; S2138-Y2157 WeakPolarHBondContact CB-OH 3.32Å; S2138-Y2157 PolarHBondContact OG-OH 3.17Å; M2140-Y2157 HydrophobicContact CB-CD1 3.81Å; M2140-Y2157 HydrophobicContact CB-CD2 4.18Å; M2140-Y2157 HydrophobicContact CB-CE1 3.55Å; M2140-Y2157 VanDerWaalsContact CB-CE1 3.49Å; M2140-Y2157 HydrophobicContact CB-CE2 3.93Å; M2140-Y2157 HydrophobicContact CB-CG 4.11Å; M2140-Y2157 VanDerWaalsContact CB-CZ 3.5Å; M2140-Y2157 HydrophobicContact CE-CD2 4.06Å; M2140-Y2157 HydrophobicContact CE-CG 3.91Å; M2140-Y2157 HydrophobicContact CG-CD1 4.37Å; M2140-Y2157 HydrophobicContact CG-CD2 3.85Å; M2140-Y2157 HydrophobicContact CG-CE1 4.24Å; M2140-Y2157 HydrophobicContact CG-CE2 3.68Å; M2140-Y2157 HydrophobicContact CG-CG 4.17Å; D2153-Y2157 WeakPolarHBondContact O-CB 3.43Å; D2153-Y2157 PolarHBondContact O-N 2.99Å; Y2154-Y2157 AromaticContact CD2-CD1 3.81Å; Y2154-Y2157 HydrophobicContact CD2-CD1 3.87Å; Y2154-Y2157 HydrophobicContact CD2-CE1 4.36Å; Y2154-Y2157 AromaticContact CE2-CD1 3.77Å; Y2154-Y2157 HydrophobicContact CE2-CD1 3.77Å; Y2154-Y2157 AromaticContact CE2-CE1 3.78Å; Y2154-Y2157 HydrophobicContact CE2-CE1 3.96Å; Y2154-Y2157 WeakPolarHBondContact O-CB 3.36Å; Y2154-Y2157 PolarHBondContact O-N 3.15Å; L2155-Y2157 VanDerWaalsContact C-N 3.32Å; L2155-Y2157 PolarHBondContact O-N 3.14Å; Y2157-N2159 VanDerWaalsContact C-N 3.34Å; Y2157-N2159 PolarHBondContact O-N 2.9Å; Y2157-T2160 WeakPolarHBondContact O-CB 3.28Å; Y2157-T2160 PolarHBondContact O-N 3.21Å; Y2157-T2160 VanDerWaalsContact O-N 3.13Å; Y2157-I2161 HydrophobicContact CD1-CD1 4.43Å; Y2157-I2161 HydrophobicContact CD2-CG2 3.94Å; Y2157-I2161 HydrophobicContact CE1-CD1 3.99Å; Y2157-I2161 HydrophobicContact CE2-CD1 4.02Å; Y2157-I2161 HydrophobicContact CE2-CG1 4.32Å; Y2157-I2161 HydrophobicContact CE2-CG2 3.56Å; Y2157-I2161 VanDerWaalsContact CE2-CG2 3.48Å; Y2157-I2161 VanDerWaalsContact CZ-CD1 3.49Å; Y2157-I2161 WeakPolarHBondContact O-CG1 3.33Å; Y2157-I2161 PolarHBondContact O-N 3.11Å; Y2157-I2161 WeakPolarHBondContact OH-CD1 3.34Å
2158	L	97.1	Very high	94.8	Very high	1.5 Å²	1.5	11.7 Å²	11.7	1%	0.008	6%	0.064	C	C	.	.	H	α-helix	trans	-58.3	-46.6	179.6	-68.9	175.7	0	0	0	111.6	F2135 Y2154 L2155 T2160 I2161 A2162 V2353 F2357 L2410	F2135-L2158 HydrophobicContact CD2-CD2 4.12Å; F2135-L2158 HydrophobicContact CE2-CD2 3.79Å; Y2154-L2158 HydrophobicContact CD1-CD1 4.02Å; Y2154-L2158 HydrophobicContact CD1-CG 4.42Å; Y2154-L2158 HydrophobicContact CE1-CD1 3.68Å; Y2154-L2158 HydrophobicContact CE1-CD2 4.34Å; Y2154-L2158 HydrophobicContact CE1-CG 4.14Å; Y2154-L2158 HydrophobicContact CE2-CD2 4.41Å; Y2154-L2158 VanDerWaalsContact O-CG 3.31Å; Y2154-L2158 WeakPolarHBondContact O-CG 3.37Å; Y2154-L2158 PolarHBondContact O-N 3.24Å; L2155-L2158 HydrophobicContact CD2-CD1 4.36Å; L2155-L2158 PolarHBondContact O-N 3.28Å; L2158-T2160 VanDerWaalsContact C-N 3.32Å; L2158-T2160 PolarHBondContact O-N 2.88Å; L2158-I2161 HydrophobicContact CD2-CD1 4.25Å; L2158-I2161 VanDerWaalsContact O-CG1 3.27Å; L2158-I2161 WeakPolarHBondContact O-CG1 3.28Å; L2158-I2161 PolarHBondContact O-N 3.12Å; L2158-A2162 WeakPolarHBondContact O-CB 3.25Å; L2158-A2162 PolarHBondContact O-N 3.2Å; L2158-V2353 HydrophobicContact CD1-CB 4.34Å; L2158-V2353 HydrophobicContact CD1-CG1 3.7Å; L2158-V2353 HydrophobicContact CD1-CG2 3.6Å; L2158-F2357 HydrophobicContact CB-CD2 4.29Å; L2158-F2357 HydrophobicContact CB-CE2 4.13Å; L2158-F2357 HydrophobicContact CB-CZ 4.34Å; L2158-F2357 HydrophobicContact CD1-CD2 4.33Å; L2158-F2357 HydrophobicContact CD1-CE2 4.43Å; L2158-L2410 HydrophobicContact CB-CD1 4.2Å; L2158-L2410 HydrophobicContact CD2-CD1 3.69Å; L2158-L2410 HydrophobicContact CG-CD1 4.49Å
2159	N	97	Very high	95	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-55.4	-51.2	173.6	-82.3	-71.1	0	0	0	111.4	L2155 M2156 Y2157 I2161 A2162 G2163 R2164 P2173 I2174	L2155-N2159 WeakPolarHBondContact O-CB 3.38Å; L2155-N2159 PolarHBondContact O-N 3.12Å; L2155-N2159 PolarHBondContact O-ND2 3.15Å; M2156-N2159 PolarHBondContact O-N 3.01Å; Y2157-N2159 VanDerWaalsContact C-N 3.34Å; Y2157-N2159 PolarHBondContact O-N 2.9Å; N2159-I2161 VanDerWaalsContact C-N 3.32Å; N2159-I2161 PolarHBondContact O-N 3.12Å; N2159-A2162 PolarHBondContact O-N 3.2Å; N2159-A2162 VanDerWaalsContact O-N 3.14Å; N2159-G2163 PolarHBondContact O-N 3.28Å; N2159-R2164 HydrophobicContact CB-CB 4.1Å; N2159-R2164 HydrophobicContact CB-CG 4.12Å; N2159-R2164 VanDerWaalsContact O-CB 3.27Å; N2159-R2164 WeakPolarHBondContact O-CB 3.38Å; N2159-R2164 WeakPolarHBondContact O-CG 3.44Å; N2159-R2164 PolarHBondContact O-N 3.25Å; N2159-R2164 VanDerWaalsContact OD1-CD 3.22Å; N2159-R2164 WeakPolarHBondContact OD1-CD 3.42Å; N2159-R2164 WeakPolarHBondContact OD1-CG 3.4Å; N2159-P2173 HydrophobicContact CB-CB 4.09Å; N2159-P2173 WeakPolarHBondContact OD1-CA 3.38Å; N2159-I2174 PolarHBondContact ND2-O 2.97Å; N2159-I2174 VanDerWaalsContact OD1-CG2 3.26Å; N2159-I2174 WeakPolarHBondContact OD1-CG2 3.07Å; N2159-I2174 PolarHBondContact OD1-N 2.96Å; N2159-I2174 PolarHBondContact OD1-O 3.24Å
2160	T	94.7	Very high	95	Very high	1.25 Å²	1.25	8.5 Å²	8.5	1%	0.008	5%	0.049	C	C	.	.	H	α-helix	trans	-60.6	-41.6	-177.8	-55.9	0	0	0	0	112.6	R1892 F2071 R2073 Y2118 M2156 Y2157 L2158 G2163	R1892-T2160 WeakPolarHBondContact CD-OG1 3.37Å; R1892-T2160 PolarHBondContact NH1-OG1 2.81Å; F2071-T2160 HydrophobicContact CE1-CG2 4Å; F2071-T2160 HydrophobicContact CZ-CG2 3.93Å; R2073-T2160 VanDerWaalsContact CZ-O 3.3Å; R2073-T2160 PolarHBondContact NH1-O 3.09Å; R2073-T2160 PolarHBondContact NH2-O 2.88Å; R2073-T2160 VanDerWaalsContact NH2-O 3.13Å; Y2118-T2160 HydrophobicContact CE2-CG2 4.38Å; Y2118-T2160 WeakPolarHBondContact OH-CG2 3.41Å; M2156-T2160 VanDerWaalsContact O-CB 3.31Å; M2156-T2160 WeakPolarHBondContact O-CB 3.39Å; M2156-T2160 PolarHBondContact O-N 3.16Å; M2156-T2160 PolarHBondContact O-OG1 3.45Å; M2156-T2160 VanDerWaalsContact O-OG1 3.06Å; Y2157-T2160 WeakPolarHBondContact O-CB 3.28Å; Y2157-T2160 PolarHBondContact O-N 3.21Å; Y2157-T2160 VanDerWaalsContact O-N 3.13Å; L2158-T2160 VanDerWaalsContact C-N 3.32Å; L2158-T2160 PolarHBondContact O-N 2.88Å; T2160-G2163 PolarHBondContact O-N 3.11Å
2161	I	94.1	Very high	95	Very high	4.25 Å²	4.25	8.2 Å²	8.2	2%	0.022	5%	0.046	C	C	.	.	H	α-helix	trans	-79.4	-26.9	179.4	65.1	165.4	0	0	0	112.9	Y2118 P2131 I2134 F2135 Y2157 L2158 N2159 G2163 L2410	Y2118-I2161 HydrophobicContact CD2-CG2 4.34Å; Y2118-I2161 HydrophobicContact CE2-CG2 4.22Å; P2131-I2161 VanDerWaalsContact CB-O 3.24Å; P2131-I2161 WeakPolarHBondContact CB-O 3.38Å; P2131-I2161 VanDerWaalsContact CG-O 3.24Å; P2131-I2161 WeakPolarHBondContact CG-O 3.46Å; I2134-I2161 HydrophobicContact CG2-CB 4.23Å; I2134-I2161 HydrophobicContact CG2-CD1 4.27Å; I2134-I2161 HydrophobicContact CG2-CG2 3.75Å; F2135-I2161 HydrophobicContact CB-CD1 3.87Å; F2135-I2161 HydrophobicContact CD2-CD1 3.84Å; F2135-I2161 HydrophobicContact CG-CD1 4.35Å; Y2157-I2161 HydrophobicContact CD1-CD1 4.43Å; Y2157-I2161 HydrophobicContact CD2-CG2 3.94Å; Y2157-I2161 HydrophobicContact CE1-CD1 3.99Å; Y2157-I2161 HydrophobicContact CE2-CD1 4.02Å; Y2157-I2161 HydrophobicContact CE2-CG1 4.32Å; Y2157-I2161 HydrophobicContact CE2-CG2 3.56Å; Y2157-I2161 VanDerWaalsContact CE2-CG2 3.48Å; Y2157-I2161 VanDerWaalsContact CZ-CD1 3.49Å; Y2157-I2161 WeakPolarHBondContact O-CG1 3.33Å; Y2157-I2161 PolarHBondContact O-N 3.11Å; Y2157-I2161 WeakPolarHBondContact OH-CD1 3.34Å; L2158-I2161 HydrophobicContact CD2-CD1 4.25Å; L2158-I2161 VanDerWaalsContact O-CG1 3.27Å; L2158-I2161 WeakPolarHBondContact O-CG1 3.28Å; L2158-I2161 PolarHBondContact O-N 3.12Å; N2159-I2161 VanDerWaalsContact C-N 3.32Å; N2159-I2161 PolarHBondContact O-N 3.12Å; I2161-G2163 PolarHBondContact O-N 3.18Å; I2161-L2410 HydrophobicContact CD1-CD1 3.74Å; I2161-L2410 HydrophobicContact CD1-CD2 3.95Å; I2161-L2410 HydrophobicContact CD1-CG 4.41Å; I2161-L2410 HydrophobicContact CG1-CD1 3.88Å; I2161-L2410 HydrophobicContact CG1-CD2 3.98Å
2162	A	94.8	Very high	94.9	Very high	16 Å²	16	8.3 Å²	8.3	13%	0.132	5%	0.046	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-1.1	175	0	0	0	0	0	113.5	L2158 N2159 F2357 P2407 G2408 L2410	L2158-A2162 WeakPolarHBondContact O-CB 3.25Å; L2158-A2162 PolarHBondContact O-N 3.2Å; N2159-A2162 PolarHBondContact O-N 3.2Å; N2159-A2162 VanDerWaalsContact O-N 3.14Å; A2162-F2357 HydrophobicContact CB-CD1 3.57Å; A2162-F2357 HydrophobicContact CB-CE1 3.55Å; A2162-P2407 HydrophobicContact CB-CB 3.91Å; A2162-G2408 PolarHBondContact O-N 3.26Å; A2162-G2408 VanDerWaalsContact O-N 3.11Å; A2162-L2410 HydrophobicContact CB-CD1 4.34Å; A2162-L2410 HydrophobicContact CB-CD2 4.13Å; A2162-L2410 HydrophobicContact CB-CG 4.31Å
2163	G	93.4	Very high	94.9	Very high	7.25 Å²	7.25	8.3 Å²	8.3	8%	0.075	5%	0.046	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.9	4.1	177.1	0	0	0	0	0	114.9	R2073 N2159 T2160 I2161 Q2171	R2073-G2163 WeakPolarHBondContact CD-O 3.41Å; N2159-G2163 PolarHBondContact O-N 3.28Å; T2160-G2163 PolarHBondContact O-N 3.11Å; I2161-G2163 PolarHBondContact O-N 3.18Å; G2163-Q2171 PolarHBondContact O-OE1 3.25Å
2164	R	95.1	Very high	95	Very high	7.25 Å²	7.25	6.8 Å²	6.8	3%	0.027	4%	0.038	C	C	.	.			trans	-75.5	137.6	-177.8	-61	-115.5	166.9	173.1	-0.6	112.3	N2159 Q2171 Y2172 P2173 S2235 Q2405 P2407	N2159-R2164 HydrophobicContact CB-CB 4.1Å; N2159-R2164 HydrophobicContact CB-CG 4.12Å; N2159-R2164 VanDerWaalsContact O-CB 3.27Å; N2159-R2164 WeakPolarHBondContact O-CB 3.38Å; N2159-R2164 WeakPolarHBondContact O-CG 3.44Å; N2159-R2164 PolarHBondContact O-N 3.25Å; N2159-R2164 VanDerWaalsContact OD1-CD 3.22Å; N2159-R2164 WeakPolarHBondContact OD1-CD 3.42Å; N2159-R2164 WeakPolarHBondContact OD1-CG 3.4Å; R2164-Q2171 CarbonylContact C-O 3.52Å; R2164-Q2171 WeakPolarHBondContact CA-O 3.26Å; R2164-Q2171 WeakPolarHBondContact CB-O 3.36Å; R2164-Q2171 VanDerWaalsContact CD-C 3.5Å; R2164-Q2171 VanDerWaalsContact CD-O 3.28Å; R2164-Q2171 WeakPolarHBondContact CD-O 3.41Å; R2164-Q2171 WeakPolarHBondContact CG-O 3.43Å; R2164-Q2171 PolarHBondContact NE-O 3.39Å; R2164-Y2172 WeakPolarHBondContact CD-O 3.47Å; R2164-Y2172 PolarHBondContact NE-O 3.42Å; R2164-Y2172 PolarHBondContact NH1-O 3.1Å; R2164-Y2172 PolarHBondContact NH2-O 3.09Å; R2164-P2173 HydrophobicContact CB-CG 4.33Å; R2164-S2235 PolarHBondContact NH1-OG 2.98Å; R2164-S2235 VanDerWaalsContact NH1-OG 3.09Å; R2164-S2235 PolarHBondContact NH2-OG 2.72Å; R2164-Q2405 VanDerWaalsContact CZ-O 3.22Å; R2164-Q2405 PolarHBondContact NH1-O 2.78Å; R2164-Q2405 PolarHBondContact NH2-O 2.86Å; R2164-P2407 VanDerWaalsContact NH1-CG 3.32Å; R2164-P2407 VanDerWaalsContact NH2-CD 3.35Å
2165	S	94.3	Very high	95.1	Very high	0.75 Å²	0.75	6.8 Å²	6.8	1%	0.005	4%	0.038	C	C	.	.			trans	-139.4	151	-172.3	178.1	0	0	0	0	110.9	E2083 N2167 D2168 Q2171 Y2172	E2083-S2165 VanDerWaalsContact OE1-CB 3.27Å; E2083-S2165 WeakPolarHBondContact OE1-CB 3.36Å; E2083-S2165 PolarHBondContact OE1-OG 2.96Å; S2165-N2167 VanDerWaalsContact C-N 3.31Å; S2165-N2167 WeakPolarHBondContact OG-CB 3.39Å; S2165-N2167 PolarHBondContact OG-N 3.13Å; S2165-N2167 VanDerWaalsContact OG-N 3.1Å; S2165-D2168 VanDerWaalsContact O-O 3.12Å; S2165-Q2171 PolarHBondContact N-O 3.01Å; S2165-Y2172 WeakPolarHBondContact O-CA 3.38Å
2166	Y	94	Very high	95.1	Very high	13.25 Å²	13.25	6.8 Å²	6.8	5%	0.052	4%	0.038	C	C	.	.	S	Bend	trans	-74.5	-19	169.8	-70.6	-65.2	0	0	0	112.6	E1888 R1892 H1894 M2156 Y2172 P2173 E2292	E1888-Y2166 WeakPolarHBondContact OE1-CD2 3.38Å; R1892-Y2166 HydrophobicContact CB-CE2 4.38Å; R1892-Y2166 VanDerWaalsContact O-CE2 3.28Å; R1892-Y2166 WeakPolarHBondContact O-CE2 3.4Å; R1892-Y2166 PolarHBondContact O-OH 2.99Å; R1892-Y2166 VanDerWaalsContact O-OH 3.11Å; H1894-Y2166 AromaticContact CE1-CD1 3.88Å; H1894-Y2166 AromaticContact CE1-CD2 3.52Å; H1894-Y2166 VanDerWaalsContact CE1-CD2 3.44Å; H1894-Y2166 WeakPolarHBondContact CE1-CD2 3.33Å; H1894-Y2166 AromaticContact CE1-CE2 3.84Å; H1894-Y2166 AromaticContact CE1-CG 3.63Å; H1894-Y2166 AromaticContact ND1-CD2 3.69Å; H1894-Y2166 AromaticContact ND1-CE2 3.89Å; H1894-Y2166 AromaticContact ND1-CG 3.84Å; H1894-Y2166 AromaticContact ND1-CZ 3.97Å; H1894-Y2166 AromaticContact NE2-CD2 3.99Å; M2156-Y2166 HydrophobicContact CE-CE2 4.27Å; M2156-Y2166 VanDerWaalsContact CE-OH 3.24Å; M2156-Y2166 WeakPolarHBondContact CE-OH 3.37Å; Y2166-Y2172 HydrophobicContact CD1-CD2 4.26Å; Y2166-Y2172 AromaticContact CD1-CE1 4Å; Y2166-Y2172 HydrophobicContact CD1-CE1 4.1Å; Y2166-Y2172 AromaticContact CD1-CE2 3.55Å; Y2166-Y2172 HydrophobicContact CD1-CE2 3.55Å; Y2166-Y2172 VanDerWaalsContact CD1-CE2 3.45Å; Y2166-Y2172 AromaticContact CD1-CZ 3.44Å; Y2166-Y2172 VanDerWaalsContact CD1-CZ 3.49Å; Y2166-Y2172 VanDerWaalsContact CD1-OH 3.27Å; Y2166-Y2172 WeakPolarHBondContact CD1-OH 3.37Å; Y2166-Y2172 AromaticContact CE1-CE1 3.9Å; Y2166-Y2172 HydrophobicContact CE1-CE1 4Å; Y2166-Y2172 HydrophobicContact CE1-CE2 4.19Å; Y2166-Y2172 AromaticContact CE1-CZ 3.7Å; Y2166-Y2172 WeakPolarHBondContact CE1-OH 3.3Å; Y2166-Y2172 HydrophobicContact CG-CE2 4.46Å; Y2166-P2173 HydrophobicContact CD1-CG 4.27Å; Y2166-P2173 HydrophobicContact CE1-CG 3.99Å; Y2166-P2173 HydrophobicContact CE2-CG 4.23Å; Y2166-E2292 WeakPolarHBondContact CE1-OE1 3.42Å; Y2166-E2292 PolarHBondContact OH-OE1 3.06Å
2167	N	93.5	Very high	95.1	Very high	16.25 Å²	16.25	6.6 Å²	6.6	9%	0.087	4%	0.037	C	C	.	.	S	Bend	trans	-78.9	-28.5	-177.9	-73.6	-59.1	0	0	0	113.5	S2017 L2018 G2019 S2091 L2093 S2165	S2017-N2167 CarbonylContact C-O 3.44Å; S2017-N2167 WeakPolarHBondContact CA-O 3.38Å; S2017-N2167 PolarHBondContact OG-OD1 3.12Å; S2017-N2167 VanDerWaalsContact OG-OD1 3.09Å; L2018-N2167 PolarHBondContact N-O 3.06Å; L2018-N2167 VanDerWaalsContact N-O 3.16Å; G2019-N2167 PolarHBondContact N-O 3.31Å; S2091-N2167 PolarHBondContact O-ND2 3.1Å; S2091-N2167 PolarHBondContact OG-ND2 3.3Å; S2091-N2167 VanDerWaalsContact OG-ND2 3.11Å; L2093-N2167 HydrophobicContact CB-CB 3.8Å; L2093-N2167 HydrophobicContact CD2-CB 4.04Å; S2165-N2167 VanDerWaalsContact C-N 3.31Å; S2165-N2167 WeakPolarHBondContact OG-CB 3.39Å; S2165-N2167 PolarHBondContact OG-N 3.13Å; S2165-N2167 VanDerWaalsContact OG-N 3.1Å
2168	D	93.2	Very high	95.2	Very high	10 Å²	10	6.5 Å²	6.5	5%	0.053	4%	0.036	C	C	.	.			trans	-110.5	107.6	175	179.7	-1.9	0	0	0	110	V2016 L2093 S2165 N2170 Q2171 Y2172	V2016-D2168 HydrophobicContact CG1-CB 4.19Å; L2093-D2168 HydrophobicContact CD2-CB 4.13Å; S2165-D2168 VanDerWaalsContact O-O 3.12Å; D2168-N2170 VanDerWaalsContact C-N 3.26Å; D2168-N2170 PolarHBondContact O-N 2.94Å; D2168-N2170 WeakPolarHBondContact OD1-CA 3.4Å; D2168-N2170 WeakPolarHBondContact OD1-CB 3.39Å; D2168-N2170 PolarHBondContact OD1-N 3.11Å; D2168-N2170 PolarHBondContact OD1-ND2 2.65Å; D2168-Q2171 HydrophobicContact CB-CB 4.27Å; D2168-Q2171 CarbonylContact O-C 3.55Å; D2168-Q2171 WeakPolarHBondContact O-CA 3.38Å; D2168-Q2171 PolarHBondContact O-N 3.02Å; D2168-Q2171 PolarHBondContact OD1-N 3.23Å; D2168-Q2171 WeakPolarHBondContact OD2-CG 3.33Å; D2168-Q2171 PolarHBondContact OD2-NE2 3.48Å; D2168-Y2172 PolarHBondContact O-N 3.28Å; D2168-Y2172 VanDerWaalsContact O-N 3.13Å
2169	L	92.5	Very high	95.1	Very high	2 Å²	2	6.5 Å²	6.5	1%	0.01	4%	0.036	C	C	.	.	G	3₁₀ helix	trans	-65.2	-21.9	-178.4	-58.5	-179	0	0	0	113.4	L2018 Q2171 Y2172 A2237 V2240 L2241 F2250 V2253	L2018-L2169 VanDerWaalsContact O-CD1 3.28Å; L2018-L2169 WeakPolarHBondContact O-CD1 3.38Å; L2169-Q2171 VanDerWaalsContact C-N 3.28Å; L2169-Q2171 PolarHBondContact O-N 2.84Å; L2169-Y2172 HydrophobicContact CD2-CD2 3.86Å; L2169-Y2172 HydrophobicContact CD2-CE2 4.03Å; L2169-Y2172 PolarHBondContact O-N 3.44Å; L2169-A2237 HydrophobicContact CB-CB 3.56Å; L2169-A2237 HydrophobicContact CD1-CB 4.49Å; L2169-A2237 WeakPolarHBondContact O-CA 3.49Å; L2169-A2237 PolarHBondContact O-N 2.95Å; L2169-V2240 HydrophobicContact CD2-CG1 4.14Å; L2169-L2241 HydrophobicContact CD1-CD1 4.23Å; L2169-L2241 HydrophobicContact CD1-CD2 3.75Å; L2169-L2241 HydrophobicContact CD1-CG 3.94Å; L2169-F2250 HydrophobicContact CD2-CD1 4.47Å; L2169-F2250 HydrophobicContact CD2-CE1 4.22Å; L2169-V2253 HydrophobicContact CD1-CG1 4.28Å
2170	N	90.5	Very high	95	Very high	31.5 Å²	31.5	8 Å²	8	17%	0.168	5%	0.047	C	C	.	.	G	3₁₀ helix	trans	-79.8	-15.4	173.6	-69.9	-46.4	0	0	0	112.6	D2168 A2237 Q2401 Q2405	D2168-N2170 VanDerWaalsContact C-N 3.26Å; D2168-N2170 PolarHBondContact O-N 2.94Å; D2168-N2170 WeakPolarHBondContact OD1-CA 3.4Å; D2168-N2170 WeakPolarHBondContact OD1-CB 3.39Å; D2168-N2170 PolarHBondContact OD1-N 3.11Å; D2168-N2170 PolarHBondContact OD1-ND2 2.65Å; N2170-A2237 WeakPolarHBondContact OD1-CB 3.35Å; N2170-A2237 PolarHBondContact OD1-N 3.09Å; N2170-A2237 VanDerWaalsContact OD1-N 3.1Å; N2170-Q2401 WeakPolarHBondContact ND2-CG 3.3Å; N2170-Q2401 PolarHBondContact ND2-O 2.8Å; N2170-Q2401 PolarHBondContact OD1-O 3.02Å; N2170-Q2401 VanDerWaalsContact OD1-O 3.13Å; N2170-Q2405 PolarHBondContact O-N 2.88Å
2171	Q	93	Very high	95	Very high	18.5 Å²	18.5	9.1 Å²	9.1	9%	0.086	5%	0.053	C	C	.	.	G	3₁₀ helix	trans	-118.7	30.6	173.3	-61.5	-177.2	48.7	0	0	111.5	S2074 G2163 R2164 S2165 D2168 L2169 Q2405	S2074-Q2171 PolarHBondContact O-NE2 3.28Å; S2074-Q2171 PolarHBondContact O-OE1 3.01Å; G2163-Q2171 PolarHBondContact O-OE1 3.25Å; R2164-Q2171 CarbonylContact C-O 3.52Å; R2164-Q2171 WeakPolarHBondContact CA-O 3.26Å; R2164-Q2171 WeakPolarHBondContact CB-O 3.36Å; R2164-Q2171 VanDerWaalsContact CD-C 3.5Å; R2164-Q2171 VanDerWaalsContact CD-O 3.28Å; R2164-Q2171 WeakPolarHBondContact CD-O 3.41Å; R2164-Q2171 WeakPolarHBondContact CG-O 3.43Å; R2164-Q2171 PolarHBondContact NE-O 3.39Å; S2165-Q2171 PolarHBondContact N-O 3.01Å; D2168-Q2171 HydrophobicContact CB-CB 4.27Å; D2168-Q2171 CarbonylContact O-C 3.55Å; D2168-Q2171 WeakPolarHBondContact O-CA 3.38Å; D2168-Q2171 PolarHBondContact O-N 3.02Å; D2168-Q2171 PolarHBondContact OD1-N 3.23Å; D2168-Q2171 WeakPolarHBondContact OD2-CG 3.33Å; D2168-Q2171 PolarHBondContact OD2-NE2 3.48Å; L2169-Q2171 VanDerWaalsContact C-N 3.28Å; L2169-Q2171 PolarHBondContact O-N 2.84Å; Q2171-Q2405 HydrophobicContact CG-CB 4.13Å
2172	Y	96	Very high	95.1	Very high	2 Å²	2	9.2 Å²	9.2	1%	0.008	5%	0.053	C	C	.	.			trans	-61.7	147.3	177.5	-151.5	-100.7	0	0	0	111.6	R2164 S2165 Y2166 D2168 L2169 I2174 V2240 I2290 E2292	R2164-Y2172 WeakPolarHBondContact CD-O 3.47Å; R2164-Y2172 PolarHBondContact NE-O 3.42Å; R2164-Y2172 PolarHBondContact NH1-O 3.1Å; R2164-Y2172 PolarHBondContact NH2-O 3.09Å; S2165-Y2172 WeakPolarHBondContact O-CA 3.38Å; Y2166-Y2172 HydrophobicContact CD1-CD2 4.26Å; Y2166-Y2172 AromaticContact CD1-CE1 4Å; Y2166-Y2172 HydrophobicContact CD1-CE1 4.1Å; Y2166-Y2172 AromaticContact CD1-CE2 3.55Å; Y2166-Y2172 HydrophobicContact CD1-CE2 3.55Å; Y2166-Y2172 VanDerWaalsContact CD1-CE2 3.45Å; Y2166-Y2172 AromaticContact CD1-CZ 3.44Å; Y2166-Y2172 VanDerWaalsContact CD1-CZ 3.49Å; Y2166-Y2172 VanDerWaalsContact CD1-OH 3.27Å; Y2166-Y2172 WeakPolarHBondContact CD1-OH 3.37Å; Y2166-Y2172 AromaticContact CE1-CE1 3.9Å; Y2166-Y2172 HydrophobicContact CE1-CE1 4Å; Y2166-Y2172 HydrophobicContact CE1-CE2 4.19Å; Y2166-Y2172 AromaticContact CE1-CZ 3.7Å; Y2166-Y2172 WeakPolarHBondContact CE1-OH 3.3Å; Y2166-Y2172 HydrophobicContact CG-CE2 4.46Å; D2168-Y2172 PolarHBondContact O-N 3.28Å; D2168-Y2172 VanDerWaalsContact O-N 3.13Å; L2169-Y2172 HydrophobicContact CD2-CD2 3.86Å; L2169-Y2172 HydrophobicContact CD2-CE2 4.03Å; L2169-Y2172 PolarHBondContact O-N 3.44Å; Y2172-I2174 PolarHBondContact O-N 2.8Å; Y2172-V2240 HydrophobicContact CD1-CG1 3.9Å; Y2172-V2240 HydrophobicContact CD1-CG2 3.9Å; Y2172-V2240 HydrophobicContact CD2-CG1 3.83Å; Y2172-V2240 HydrophobicContact CD2-CG2 4.26Å; Y2172-V2240 HydrophobicContact CE1-CG1 3.95Å; Y2172-V2240 HydrophobicContact CE1-CG2 4.48Å; Y2172-V2240 HydrophobicContact CE2-CG1 3.84Å; Y2172-V2240 HydrophobicContact CG-CB 4.45Å; Y2172-V2240 HydrophobicContact CG-CG1 3.84Å; Y2172-V2240 HydrophobicContact CG-CG2 3.73Å; Y2172-I2290 HydrophobicContact CD1-CB 4.31Å; Y2172-I2290 HydrophobicContact CD1-CG2 3.96Å; Y2172-I2290 HydrophobicContact CE1-CB 4.18Å; Y2172-I2290 HydrophobicContact CE1-CG2 4.24Å; Y2172-E2292 WeakPolarHBondContact CE1-OE1 3.3Å; Y2172-E2292 PolarHBondContact OH-OE1 3.11Å
2173	P	97.4	Very high	95	Very high	0.25 Å²	0.25	13.7 Å²	13.7	0%	0.002	8%	0.079	C	C	.	.			trans	-57.5	145.4	176.4	-25.5	35.6	0	0	0	113	M2156 N2159 R2164 Y2166 P2291	M2156-P2173 HydrophobicContact CE-CB 4.45Å; M2156-P2173 HydrophobicContact CE-CG 4.36Å; M2156-P2173 HydrophobicContact SD-CB 4.44Å; M2156-P2173 HydrophobicContact SD-CG 4.47Å; N2159-P2173 HydrophobicContact CB-CB 4.09Å; N2159-P2173 WeakPolarHBondContact OD1-CA 3.38Å; R2164-P2173 HydrophobicContact CB-CG 4.33Å; Y2166-P2173 HydrophobicContact CD1-CG 4.27Å; Y2166-P2173 HydrophobicContact CE1-CG 3.99Å; Y2166-P2173 HydrophobicContact CE2-CG 4.23Å; P2173-P2291 HydrophobicContact CB-CG 3.67Å; P2173-P2291 HydrophobicContact CG-CG 4.45Å; P2173-P2291 VanDerWaalsContact O-CD 3.29Å; P2173-P2291 WeakPolarHBondContact O-CD 3.42Å
2174	I	97.4	Very high	95	Very high	2.75 Å²	2.75	16 Å²	16	1%	0.014	9%	0.092	C	C	.	.			trans	-122.5	138.6	-173.1	-111.9	143.2	0	0	0	111.2	N2159 Y2172 Y2234 E2288 W2352 I2356 F2357 P2407	N2159-I2174 PolarHBondContact ND2-O 2.97Å; N2159-I2174 VanDerWaalsContact OD1-CG2 3.26Å; N2159-I2174 WeakPolarHBondContact OD1-CG2 3.07Å; N2159-I2174 PolarHBondContact OD1-N 2.96Å; N2159-I2174 PolarHBondContact OD1-O 3.24Å; Y2172-I2174 PolarHBondContact O-N 2.8Å; I2174-Y2234 HydrophobicContact CD1-CD2 3.68Å; I2174-Y2234 HydrophobicContact CD1-CE2 3.43Å; I2174-Y2234 HydrophobicContact CD1-CG 4.14Å; I2174-Y2234 HydrophobicContact CG2-CD2 4.44Å; I2174-E2288 HydrophobicContact CD1-CB 3.79Å; I2174-E2288 HydrophobicContact CD1-CG 4.13Å; I2174-E2288 HydrophobicContact CG1-CB 3.89Å; I2174-E2288 HydrophobicContact CG2-CB 3.79Å; I2174-E2288 HydrophobicContact CG2-CG 4.44Å; I2174-W2352 HydrophobicContact CG1-CH2 4.37Å; I2174-W2352 HydrophobicContact CG1-CZ2 4.21Å; I2174-W2352 HydrophobicContact CG2-CH2 4.16Å; I2174-W2352 HydrophobicContact CG2-CZ2 4Å; I2174-I2356 HydrophobicContact CD1-CD1 4.46Å; I2174-I2356 HydrophobicContact CD1-CG2 4.42Å; I2174-I2356 HydrophobicContact CG2-CG2 4.01Å; I2174-F2357 HydrophobicContact CG2-CZ 3.95Å; I2174-P2407 HydrophobicContact CD1-CG 4.21Å
2175	F	98.2	Very high	94.9	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-130.2	151.7	177.7	-88.7	-116.5	0	0	0	111	F2152 L2155 M2156 L2289 P2291 F2294 L2340	F2152-F2175 HydrophobicContact CB-CE1 4.38Å; F2152-F2175 HydrophobicContact CD1-CZ 4.49Å; F2152-F2175 HydrophobicContact CD2-CD1 4.37Å; F2152-F2175 AromaticContact CD2-CE1 3.33Å; F2152-F2175 HydrophobicContact CD2-CE1 3.33Å; F2152-F2175 AromaticContact CD2-CZ 3.6Å; F2152-F2175 HydrophobicContact CD2-CZ 3.6Å; F2152-F2175 AromaticContact CE2-CE1 3.7Å; F2152-F2175 HydrophobicContact CE2-CE1 3.7Å; F2152-F2175 HydrophobicContact CE2-CE2 4.47Å; F2152-F2175 AromaticContact CE2-CZ 3.67Å; F2152-F2175 HydrophobicContact CE2-CZ 3.67Å; F2152-F2175 AromaticContact CG-CE1 3.93Å; F2152-F2175 HydrophobicContact CG-CE1 4.01Å; F2152-F2175 AromaticContact CG-CZ 3.94Å; F2152-F2175 HydrophobicContact CG-CZ 4.08Å; F2152-F2175 HydrophobicContact CZ-CZ 4.21Å; L2155-F2175 HydrophobicContact CB-CD1 4.42Å; L2155-F2175 HydrophobicContact CB-CE1 3.83Å; L2155-F2175 HydrophobicContact CB-CE2 3.95Å; L2155-F2175 HydrophobicContact CB-CZ 3.52Å; L2155-F2175 VanDerWaalsContact CB-CZ 3.46Å; L2155-F2175 HydrophobicContact CD1-CD1 3.65Å; L2155-F2175 HydrophobicContact CD1-CE1 3.59Å; L2155-F2175 HydrophobicContact CD1-CG 4.3Å; L2155-F2175 HydrophobicContact CD1-CZ 4.18Å; L2155-F2175 HydrophobicContact CG-CE1 4.37Å; L2155-F2175 HydrophobicContact CG-CZ 4.44Å; M2156-F2175 HydrophobicContact CE-CE2 4.26Å; M2156-F2175 HydrophobicContact CG-CE2 4.21Å; M2156-F2175 HydrophobicContact CG-CZ 4.01Å; M2156-F2175 HydrophobicContact SD-CE2 3.56Å; M2156-F2175 VanDerWaalsContact SD-CE2 3.56Å; M2156-F2175 HydrophobicContact SD-CZ 3.94Å; F2175-L2289 HydrophobicContact CB-CB 4.36Å; F2175-L2289 PolarHBondContact N-O 3.34Å; F2175-L2289 CarbonylContact O-C 3.58Å; F2175-L2289 WeakPolarHBondContact O-CA 3.38Å; F2175-L2289 WeakPolarHBondContact O-CB 3.13Å; F2175-L2289 PolarHBondContact O-N 3.08Å; F2175-L2289 VanDerWaalsContact O-O 3.11Å; F2175-P2291 HydrophobicContact CD2-CB 4.03Å; F2175-P2291 HydrophobicContact CD2-CG 3.67Å; F2175-P2291 HydrophobicContact CE2-CB 3.93Å; F2175-P2291 HydrophobicContact CE2-CG 3.7Å; F2175-P2291 HydrophobicContact CZ-CB 4.47Å; F2175-F2294 HydrophobicContact CB-CD2 4.28Å; F2175-F2294 HydrophobicContact CB-CE2 3.76Å; F2175-F2294 AromaticContact CD1-CD2 3.67Å; F2175-F2294 HydrophobicContact CD1-CD2 3.67Å; F2175-F2294 AromaticContact CD1-CE2 3.78Å; F2175-F2294 HydrophobicContact CD1-CE2 3.78Å; F2175-F2294 HydrophobicContact CD1-CG 4.43Å; F2175-F2294 HydrophobicContact CD1-CZ 4.47Å; F2175-F2294 HydrophobicContact CE1-CD2 4.35Å; F2175-F2294 HydrophobicContact CG-CD2 4.22Å; F2175-F2294 HydrophobicContact CG-CE2 4.15Å; F2175-L2340 HydrophobicContact CD1-CD2 4.13Å; F2175-L2340 HydrophobicContact CE1-CD2 3.91Å
2176	P	97.7	Very high	94.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.164	C	C	.	.			trans	-72	147	177.1	27.2	-32	0	0	0	111.9	L2155 V2178 L2198 E2288 F2294 L2340 L2349 W2352	L2155-P2176 HydrophobicContact CD1-CG 4.41Å; P2176-V2178 HydrophobicContact CG-CG2 4.14Å; P2176-V2178 PolarHBondContact O-N 3.05Å; P2176-L2198 HydrophobicContact CB-CD2 3.77Å; P2176-L2198 HydrophobicContact CG-CD2 4.3Å; P2176-E2288 WeakPolarHBondContact CA-OE2 3.41Å; P2176-F2294 WeakPolarHBondContact O-CZ 3.4Å; P2176-L2340 HydrophobicContact CG-CD1 4.41Å; P2176-L2349 HydrophobicContact CG-CD1 4.22Å; P2176-W2352 HydrophobicContact CB-CD2 3.91Å; P2176-W2352 HydrophobicContact CB-CG 4.1Å; P2176-W2352 HydrophobicContact CB-CZ2 4Å; P2176-W2352 HydrophobicContact CG-CD2 4.24Å; P2176-W2352 HydrophobicContact CG-CE3 4.37Å; P2176-W2352 HydrophobicContact CG-CZ2 4.42Å; P2176-W2352 VanDerWaalsContact N-CZ2 3.35Å
2177	W	97.4	Very high	94.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.169	C	C	.	.			trans	-58.6	123.2	148.9	-72.3	90	0	0	0	109.4	Y2182 R2196 I2202 V2272 T2275 W2276 K2287 E2288 L2289	W2177-Y2182 AromaticContact CE3-CE2 3.86Å; W2177-Y2182 HydrophobicContact CE3-CE2 3.93Å; W2177-Y2182 AromaticContact CE3-CZ 3.94Å; W2177-Y2182 AromaticContact CZ3-CE2 3.74Å; W2177-Y2182 HydrophobicContact CZ3-CE2 3.74Å; W2177-Y2182 AromaticContact CZ3-CZ 3.77Å; W2177-Y2182 WeakPolarHBondContact CZ3-OH 3.4Å; W2177-R2196 VanDerWaalsContact O-CD 3.3Å; W2177-R2196 WeakPolarHBondContact O-CD 3.29Å; W2177-R2196 PolarHBondContact O-NE 3.5Å; W2177-I2202 HydrophobicContact CB-CD1 4.35Å; W2177-I2202 HydrophobicContact CG-CD1 4.24Å; W2177-V2272 HydrophobicContact CH2-CG1 4.35Å; W2177-V2272 HydrophobicContact CZ3-CG1 4.25Å; W2177-T2275 HydrophobicContact CH2-CG2 4.19Å; W2177-T2275 HydrophobicContact CZ2-CG2 4Å; W2177-W2276 HydrophobicContact CB-CE3 4.26Å; W2177-W2276 HydrophobicContact CB-CH2 4.43Å; W2177-W2276 HydrophobicContact CB-CZ3 3.68Å; W2177-W2276 AromaticContact CD2-CE3 3.61Å; W2177-W2276 HydrophobicContact CD2-CE3 3.61Å; W2177-W2276 AromaticContact CD2-CZ3 3.95Å; W2177-W2276 HydrophobicContact CD2-CZ3 3.95Å; W2177-W2276 HydrophobicContact CE3-CD2 4.39Å; W2177-W2276 AromaticContact CE3-CE3 3.68Å; W2177-W2276 HydrophobicContact CE3-CE3 3.68Å; W2177-W2276 HydrophobicContact CE3-CZ3 4.28Å; W2177-W2276 AromaticContact CG-CE3 3.89Å; W2177-W2276 HydrophobicContact CG-CE3 3.89Å; W2177-W2276 AromaticContact CG-CZ3 3.69Å; W2177-W2276 HydrophobicContact CG-CZ3 3.69Å; W2177-W2276 HydrophobicContact CH2-CB 4.13Å; W2177-W2276 HydrophobicContact CZ3-CB 4Å; W2177-W2276 HydrophobicContact CZ3-CE3 4.26Å; W2177-K2287 PolarHBondContact NE1-O 2.83Å; W2177-K2287 VanDerWaalsContact NE1-O 3.08Å; W2177-E2288 PolarHBondContact N-OE2 3.19Å; W2177-E2288 VanDerWaalsContact N-OE2 3.09Å; W2177-L2289 HydrophobicContact CB-CD1 4.48Å; W2177-L2289 HydrophobicContact CB-CG 4.48Å; W2177-L2289 HydrophobicContact CD2-CD1 4.02Å; W2177-L2289 HydrophobicContact CD2-CD2 3.65Å; W2177-L2289 HydrophobicContact CD2-CG 3.71Å; W2177-L2289 VanDerWaalsContact CE2-CD2 3.42Å; W2177-L2289 HydrophobicContact CE3-CD1 4.07Å; W2177-L2289 HydrophobicContact CE3-CD2 4.01Å; W2177-L2289 HydrophobicContact CE3-CG 4.21Å; W2177-L2289 HydrophobicContact CG-CD1 4.22Å; W2177-L2289 HydrophobicContact CG-CD2 4.25Å; W2177-L2289 HydrophobicContact CG-CG 3.82Å; W2177-L2289 HydrophobicContact CH2-CD2 3.86Å; W2177-L2289 HydrophobicContact CZ2-CD2 3.5Å; W2177-L2289 HydrophobicContact CZ2-CG 4.4Å; W2177-L2289 HydrophobicContact CZ3-CD2 4.1Å
2178	V	97.1	Very high	94.5	Very high	1.25 Å²	1.25	35.9 Å²	35.9	1%	0.008	19%	0.186	C	C	.	.			trans	-101	-49.1	-178	172.2	0	0	0	0	111.8	P2176 Y2195 R2196 F2294 A2339 L2340 V2345	P2176-V2178 HydrophobicContact CG-CG2 4.14Å; P2176-V2178 PolarHBondContact O-N 3.05Å; V2178-Y2195 HydrophobicContact CG1-CD1 3.83Å; V2178-Y2195 HydrophobicContact CG1-CE1 3.96Å; V2178-Y2195 CarbonylContact O-C 3.48Å; V2178-Y2195 WeakPolarHBondContact O-CA 3.29Å; V2178-R2196 PolarHBondContact O-N 2.98Å; V2178-F2294 HydrophobicContact CB-CE1 4.46Å; V2178-F2294 HydrophobicContact CG2-CE1 3.99Å; V2178-F2294 HydrophobicContact CG2-CZ 3.98Å; V2178-A2339 HydrophobicContact CG1-CB 3.82Å; V2178-L2340 HydrophobicContact CG2-CB 4.33Å; V2178-L2340 HydrophobicContact CG2-CD1 3.85Å; V2178-V2345 HydrophobicContact CG1-CG2 3.53Å; V2178-V2345 VanDerWaalsContact CG1-CG2 3.48Å; V2178-V2345 HydrophobicContact CG2-CG2 4.5Å
2179	I	96.7	Very high	94.5	Very high	1.25 Å²	1.25	37.3 Å²	37.3	1%	0.006	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-87.5	141.9	-178.9	-63.5	165.6	0	0	0	109	N2181 Y2182 L2187 N2194 W2325 I2335 N2336 A2339	I2179-N2181 VanDerWaalsContact CG2-O 3.31Å; I2179-N2181 WeakPolarHBondContact CG2-O 3.3Å; I2179-Y2182 HydrophobicContact CB-CE1 4.06Å; I2179-Y2182 HydrophobicContact CG2-CD1 4.2Å; I2179-Y2182 HydrophobicContact CG2-CE1 3.88Å; I2179-Y2182 HydrophobicContact CG2-CE2 4.48Å; I2179-Y2182 VanDerWaalsContact O-CE2 3.28Å; I2179-Y2182 WeakPolarHBondContact O-CE2 3.31Å; I2179-Y2182 PolarHBondContact O-OH 3.15Å; I2179-Y2182 VanDerWaalsContact O-OH 3.09Å; I2179-L2187 HydrophobicContact CD1-CD2 3.71Å; I2179-L2187 HydrophobicContact CG1-CD2 4.25Å; I2179-L2187 HydrophobicContact CG2-CD1 4.25Å; I2179-L2187 HydrophobicContact CG2-CD2 4.22Å; I2179-N2194 WeakPolarHBondContact CA-O 3.43Å; I2179-W2325 HydrophobicContact CD1-CH2 3.9Å; I2179-W2325 HydrophobicContact CD1-CZ2 3.98Å; I2179-W2325 HydrophobicContact CG2-CZ2 4.19Å; I2179-I2335 HydrophobicContact CD1-CG2 4.44Å; I2179-N2336 HydrophobicContact CD1-CB 4.44Å; I2179-A2339 HydrophobicContact CD1-CB 3.89Å; I2179-A2339 HydrophobicContact CG1-CB 3.84Å
2180	S	94.4	Very high	94.3	Very high	32.75 Å²	32.75	41.2 Å²	41.2	23%	0.229	22%	0.221	C	C	.	.			trans	-108.7	-16.4	176	60.4	0	0	0	0	113.3	S2193 N2194 Y2195 W2276	S2180-S2193 PolarHBondContact OG-O 3.14Å; S2180-S2193 VanDerWaalsContact OG-O 3.07Å; S2180-N2194 PolarHBondContact N-O 3.04Å; S2180-N2194 VanDerWaalsContact OG-C 3.24Å; S2180-N2194 PolarHBondContact OG-O 3.23Å; S2180-Y2195 WeakPolarHBondContact CB-O 3.48Å; S2180-Y2195 VanDerWaalsContact OG-C 3.29Å; S2180-Y2195 PolarHBondContact OG-N 3.28Å; S2180-Y2195 PolarHBondContact OG-O 3.27Å; S2180-W2276 PolarHBondContact O-NE1 3.05Å
2181	N	94	Very high	94.4	Very high	24.75 Å²	24.75	41.3 Å²	41.3	13%	0.132	22%	0.223	C	C	.	.			trans	-108.8	109	-177	177.8	6.5	0	0	0	111.9	I2179 T2183 T2184 L2187 N2194 W2325	I2179-N2181 VanDerWaalsContact CG2-O 3.31Å; I2179-N2181 WeakPolarHBondContact CG2-O 3.3Å; N2181-T2183 PolarHBondContact OD1-N 3.09Å; N2181-T2183 VanDerWaalsContact OD1-N 3.13Å; N2181-T2183 PolarHBondContact OD1-OG1 3.24Å; N2181-T2184 VanDerWaalsContact ND2-CG2 3.3Å; N2181-T2184 WeakPolarHBondContact ND2-CG2 3.31Å; N2181-T2184 PolarHBondContact ND2-OG1 3.09Å; N2181-T2184 PolarHBondContact OD1-N 3.16Å; N2181-T2184 PolarHBondContact OD1-OG1 2.99Å; N2181-L2187 HydrophobicContact CB-CD1 4.23Å; N2181-N2194 HydrophobicContact CB-CB 4.49Å; N2181-N2194 WeakPolarHBondContact CB-OD1 3.34Å; N2181-N2194 PolarHBondContact ND2-OD1 3.11Å; N2181-N2194 VanDerWaalsContact ND2-OD1 3.07Å; N2181-W2325 PolarHBondContact O-NE1 3.08Å; N2181-W2325 VanDerWaalsContact O-NE1 3.11Å
2182	Y	95.7	Very high	94.4	Very high	5.5 Å²	5.5	44.6 Å²	44.6	2%	0.022	25%	0.247	C	C	.	.			trans	-116.4	15.6	178.9	-63.3	-67.7	0	0	0	113.3	W2177 I2179 V2272 W2276 P2323 P2324 W2325 F2332	W2177-Y2182 AromaticContact CE3-CE2 3.86Å; W2177-Y2182 HydrophobicContact CE3-CE2 3.93Å; W2177-Y2182 AromaticContact CE3-CZ 3.94Å; W2177-Y2182 AromaticContact CZ3-CE2 3.74Å; W2177-Y2182 HydrophobicContact CZ3-CE2 3.74Å; W2177-Y2182 AromaticContact CZ3-CZ 3.77Å; W2177-Y2182 WeakPolarHBondContact CZ3-OH 3.4Å; I2179-Y2182 HydrophobicContact CB-CE1 4.06Å; I2179-Y2182 HydrophobicContact CG2-CD1 4.2Å; I2179-Y2182 HydrophobicContact CG2-CE1 3.88Å; I2179-Y2182 HydrophobicContact CG2-CE2 4.48Å; I2179-Y2182 VanDerWaalsContact O-CE2 3.28Å; I2179-Y2182 WeakPolarHBondContact O-CE2 3.31Å; I2179-Y2182 PolarHBondContact O-OH 3.15Å; I2179-Y2182 VanDerWaalsContact O-OH 3.09Å; Y2182-V2272 HydrophobicContact CD1-CG1 4Å; Y2182-V2272 HydrophobicContact CE1-CG1 3.9Å; Y2182-V2272 HydrophobicContact CG-CG1 4.33Å; Y2182-W2276 HydrophobicContact CD2-CB 3.69Å; Y2182-W2276 AromaticContact CD2-CD1 3.67Å; Y2182-W2276 HydrophobicContact CD2-CD2 4.45Å; Y2182-W2276 AromaticContact CD2-CG 3.66Å; Y2182-W2276 HydrophobicContact CD2-CG 3.66Å; Y2182-W2276 HydrophobicContact CE2-CB 3.83Å; Y2182-W2276 AromaticContact CE2-CD1 3.99Å; Y2182-W2276 HydrophobicContact CE2-CD2 4.12Å; Y2182-W2276 AromaticContact CE2-CG 3.73Å; Y2182-W2276 HydrophobicContact CE2-CG 3.73Å; Y2182-P2323 HydrophobicContact CD1-CB 4.19Å; Y2182-P2323 HydrophobicContact CD1-CG 3.46Å; Y2182-P2323 VanDerWaalsContact CD1-CG 3.49Å; Y2182-P2323 HydrophobicContact CE1-CG 4.3Å; Y2182-P2323 HydrophobicContact CG-CG 4.23Å; Y2182-P2324 VanDerWaalsContact O-CD 3.3Å; Y2182-P2324 WeakPolarHBondContact O-CD 3.28Å; Y2182-W2325 AromaticContact CD1-CZ2 3.76Å; Y2182-W2325 HydrophobicContact CD1-CZ2 3.76Å; Y2182-W2325 HydrophobicContact CE1-CH2 4.4Å; Y2182-W2325 AromaticContact CE1-CZ2 3.81Å; Y2182-W2325 HydrophobicContact CE1-CZ2 3.91Å; Y2182-F2332 HydrophobicContact CE1-CE2 4.2Å
2183	T	93.4	Very high	94.2	Very high	110.75 Å²	110.75	48.8 Å²	48.8	68%	0.679	28%	0.276	S	S	*	.	S	Bend	trans	-118.5	-22.3	-170.7	54.2	0	0	0	0	114.3	N2181	N2181-T2183 PolarHBondContact OD1-N 3.09Å; N2181-T2183 VanDerWaalsContact OD1-N 3.13Å; N2181-T2183 PolarHBondContact OD1-OG1 3.24Å
2184	T	93.4	Very high	94.1	Very high	54.25 Å²	54.25	49.6 Å²	49.6	33%	0.333	28%	0.28	S	S	.	.	S	Bend	trans	-77.1	154.8	179.1	54.8	0	0	0	0	112.5	N2181 E2186 W2325	N2181-T2184 VanDerWaalsContact ND2-CG2 3.3Å; N2181-T2184 WeakPolarHBondContact ND2-CG2 3.31Å; N2181-T2184 PolarHBondContact ND2-OG1 3.09Å; N2181-T2184 PolarHBondContact OD1-N 3.16Å; N2181-T2184 PolarHBondContact OD1-OG1 2.99Å; T2184-E2186 VanDerWaalsContact C-N 3.32Å; T2184-E2186 VanDerWaalsContact CB-O 3.29Å; T2184-E2186 WeakPolarHBondContact CB-O 3.38Å; T2184-E2186 PolarHBondContact O-N 2.94Å; T2184-E2186 PolarHBondContact OG1-O 3.33Å; T2184-W2325 VanDerWaalsContact O-CD1 3.31Å; T2184-W2325 PolarHBondContact O-N 3.03Å
2185	K	92.6	Very high	94	Very high	179.25 Å²	179.25	50.6 Å²	50.6	78%	0.779	28%	0.284	S	S	*	.	S	Bend	trans	-72.7	-23.6	176.3	-68	-174.5	177.7	-177.4	0	114	P2324 W2325	K2185-P2324 HydrophobicContact CG-CB 4.43Å; K2185-W2325 WeakPolarHBondContact O-CA 3.39Å; K2185-W2325 WeakPolarHBondContact O-CB 3.12Å
2186	E	90.6	Very high	93.9	Very high	167.75 Å²	167.75	51 Å²	51	78%	0.784	29%	0.286	S	S	*	.	S	Bend	trans	-134.1	149.6	176.9	-65	-179.2	173	0	0	108.1	T2184	T2184-E2186 VanDerWaalsContact C-N 3.32Å; T2184-E2186 VanDerWaalsContact CB-O 3.29Å; T2184-E2186 WeakPolarHBondContact CB-O 3.38Å; T2184-E2186 PolarHBondContact O-N 2.94Å; T2184-E2186 PolarHBondContact OG1-O 3.33Å
2187	L	92.5	Very high	93.8	Very high	28 Å²	28	53.8 Å²	53.8	15%	0.147	30%	0.301	C	S	.	.			trans	-123.3	111.7	179.9	-172.1	76.5	0	0	0	109.5	I2179 N2181 L2189 N2194 W2325 I2335	I2179-L2187 HydrophobicContact CD1-CD2 3.71Å; I2179-L2187 HydrophobicContact CG1-CD2 4.25Å; I2179-L2187 HydrophobicContact CG2-CD1 4.25Å; I2179-L2187 HydrophobicContact CG2-CD2 4.22Å; N2181-L2187 HydrophobicContact CB-CD1 4.23Å; L2187-L2189 HydrophobicContact CD2-CD2 3.74Å; L2187-L2189 HydrophobicContact CG-CD2 4.27Å; L2187-L2189 PolarHBondContact O-N 3.28Å; L2187-N2194 HydrophobicContact CD1-CB 3.87Å; L2187-W2325 HydrophobicContact CB-CB 4.13Å; L2187-W2325 HydrophobicContact CB-CD2 4Å; L2187-W2325 HydrophobicContact CB-CG 3.77Å; L2187-W2325 HydrophobicContact CD2-CD2 4.22Å; L2187-W2325 HydrophobicContact CD2-CE3 4.49Å; L2187-W2325 HydrophobicContact CD2-CH2 4.3Å; L2187-W2325 HydrophobicContact CD2-CZ2 3.92Å; L2187-I2335 HydrophobicContact CD2-CG2 3.77Å
2188	D	91.7	Very high	93.8	Very high	82 Å²	82	54 Å²	54	44%	0.439	30%	0.302	S	S	.	.			trans	-85.1	109.8	172.8	174.4	19.4	0	0	0	110.2	S2190 S2191 N2194	D2188-S2190 VanDerWaalsContact CG-OG 3.25Å; D2188-S2190 PolarHBondContact O-N 3.06Å; D2188-S2190 WeakPolarHBondContact OD1-CA 3.4Å; D2188-S2190 VanDerWaalsContact OD1-CB 3.28Å; D2188-S2190 WeakPolarHBondContact OD1-CB 3.44Å; D2188-S2190 PolarHBondContact OD1-N 3.24Å; D2188-S2190 PolarHBondContact OD1-OG 3.12Å; D2188-S2190 PolarHBondContact OD2-OG 3.13Å; D2188-S2190 VanDerWaalsContact OD2-OG 3.1Å; D2188-S2191 PolarHBondContact O-N 2.97Å; D2188-S2191 WeakPolarHBondContact OD2-CB 3.17Å; D2188-S2191 PolarHBondContact OD2-N 3.12Å; D2188-S2191 VanDerWaalsContact OD2-N 3.17Å; D2188-N2194 PolarHBondContact O-ND2 3Å
2189	L	91.5	Very high	93.7	Very high	38 Å²	38	56 Å²	56	20%	0.199	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-8	177.5	-64.1	-176	0	0	0	113.5	L2187 Y2195 I2335 E2338 A2339	L2187-L2189 HydrophobicContact CD2-CD2 3.74Å; L2187-L2189 HydrophobicContact CG-CD2 4.27Å; L2187-L2189 PolarHBondContact O-N 3.28Å; L2189-Y2195 VanDerWaalsContact O-CE2 3.28Å; L2189-Y2195 WeakPolarHBondContact O-CE2 3.34Å; L2189-Y2195 PolarHBondContact O-OH 3.43Å; L2189-Y2195 VanDerWaalsContact O-OH 3.05Å; L2189-I2335 HydrophobicContact CD1-CG2 4.48Å; L2189-I2335 HydrophobicContact CD2-CG2 4.32Å; L2189-E2338 HydrophobicContact CD1-CB 3.77Å; L2189-A2339 HydrophobicContact CD2-CB 3.81Å
2190	S	89.7	Confident	93.7	Very high	85.25 Å²	85.25	59.8 Å²	59.8	60%	0.596	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-23.1	173.6	77.8	0	0	0	0	113.2	D2188 P2192	D2188-S2190 VanDerWaalsContact CG-OG 3.25Å; D2188-S2190 PolarHBondContact O-N 3.06Å; D2188-S2190 WeakPolarHBondContact OD1-CA 3.4Å; D2188-S2190 VanDerWaalsContact OD1-CB 3.28Å; D2188-S2190 WeakPolarHBondContact OD1-CB 3.44Å; D2188-S2190 PolarHBondContact OD1-N 3.24Å; D2188-S2190 PolarHBondContact OD1-OG 3.12Å; D2188-S2190 PolarHBondContact OD2-OG 3.13Å; D2188-S2190 VanDerWaalsContact OD2-OG 3.1Å; S2190-P2192 WeakPolarHBondContact O-CD 3.44Å
2191	S	92.2	Very high	93.8	Very high	32.25 Å²	32.25	58.6 Å²	58.6	23%	0.226	32%	0.324	C	S	.	.			trans	-79.5	119.9	179.7	-179.3	0	0	0	0	112.3	D2188 S2193 N2194 Y2195	D2188-S2191 PolarHBondContact O-N 2.97Å; D2188-S2191 WeakPolarHBondContact OD2-CB 3.17Å; D2188-S2191 PolarHBondContact OD2-N 3.12Å; D2188-S2191 VanDerWaalsContact OD2-N 3.17Å; S2191-S2193 PolarHBondContact O-N 3.01Å; S2191-S2193 VanDerWaalsContact O-N 3.13Å; S2191-S2193 PolarHBondContact OG-N 3.06Å; S2191-S2193 PolarHBondContact OG-OG 2.99Å; S2191-N2194 PolarHBondContact O-N 3.07Å; S2191-Y2195 WeakPolarHBondContact O-CD2 3.39Å
2192	P	92.2	Very high	93.9	Very high	89.5 Å²	89.5	57.7 Å²	57.7	58%	0.581	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-61.4	-22.1	177	-23.8	35	0	0	0	114.3	S2190 N2194 Y2195 L2344	S2190-P2192 WeakPolarHBondContact O-CD 3.44Å; P2192-N2194 VanDerWaalsContact C-N 3.25Å; P2192-N2194 PolarHBondContact O-N 3.16Å; P2192-Y2195 PolarHBondContact O-N 3.22Å; P2192-L2344 HydrophobicContact CB-CD2 4.49Å; P2192-L2344 HydrophobicContact CG-CD1 4.32Å; P2192-L2344 HydrophobicContact CG-CD2 4.15Å
2193	S	92.8	Very high	93.7	Very high	89.5 Å²	89.5	57.4 Å²	57.4	63%	0.626	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-67.2	-21.6	-179.8	66.3	0	0	0	0	113.6	S2180 S2191 Y2195	S2180-S2193 PolarHBondContact OG-O 3.14Å; S2180-S2193 VanDerWaalsContact OG-O 3.07Å; S2191-S2193 PolarHBondContact O-N 3.01Å; S2191-S2193 VanDerWaalsContact O-N 3.13Å; S2191-S2193 PolarHBondContact OG-N 3.06Å; S2191-S2193 PolarHBondContact OG-OG 2.99Å; S2193-Y2195 VanDerWaalsContact C-N 3.29Å; S2193-Y2195 PolarHBondContact O-N 3.42Å
2194	N	94.7	Very high	93.8	Very high	17 Å²	17	52.3 Å²	52.3	9%	0.091	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-83	-5.3	179.3	-72.2	-32.2	0	0	0	113.3	I2179 S2180 N2181 L2187 D2188 S2191 P2192	I2179-N2194 WeakPolarHBondContact CA-O 3.43Å; S2180-N2194 PolarHBondContact N-O 3.04Å; S2180-N2194 VanDerWaalsContact OG-C 3.24Å; S2180-N2194 PolarHBondContact OG-O 3.23Å; N2181-N2194 HydrophobicContact CB-CB 4.49Å; N2181-N2194 WeakPolarHBondContact CB-OD1 3.34Å; N2181-N2194 PolarHBondContact ND2-OD1 3.11Å; N2181-N2194 VanDerWaalsContact ND2-OD1 3.07Å; L2187-N2194 HydrophobicContact CD1-CB 3.87Å; D2188-N2194 PolarHBondContact O-ND2 3Å; S2191-N2194 PolarHBondContact O-N 3.07Å; P2192-N2194 VanDerWaalsContact C-N 3.25Å; P2192-N2194 PolarHBondContact O-N 3.16Å
2195	Y	96.1	Very high	93.8	Very high	22.75 Å²	22.75	51.6 Å²	51.6	9%	0.089	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-102.4	152.8	-180	-68.2	-92.5	0	0	0	111.8	V2178 S2180 L2189 S2191 P2192 S2193 A2339 S2342 L2344 V2345	V2178-Y2195 HydrophobicContact CG1-CD1 3.83Å; V2178-Y2195 HydrophobicContact CG1-CE1 3.96Å; V2178-Y2195 CarbonylContact O-C 3.48Å; V2178-Y2195 WeakPolarHBondContact O-CA 3.29Å; S2180-Y2195 WeakPolarHBondContact CB-O 3.48Å; S2180-Y2195 VanDerWaalsContact OG-C 3.29Å; S2180-Y2195 PolarHBondContact OG-N 3.28Å; S2180-Y2195 PolarHBondContact OG-O 3.27Å; L2189-Y2195 VanDerWaalsContact O-CE2 3.28Å; L2189-Y2195 WeakPolarHBondContact O-CE2 3.34Å; L2189-Y2195 PolarHBondContact O-OH 3.43Å; L2189-Y2195 VanDerWaalsContact O-OH 3.05Å; S2191-Y2195 WeakPolarHBondContact O-CD2 3.39Å; P2192-Y2195 PolarHBondContact O-N 3.22Å; S2193-Y2195 VanDerWaalsContact C-N 3.29Å; S2193-Y2195 PolarHBondContact O-N 3.42Å; Y2195-A2339 HydrophobicContact CE1-CB 4.03Å; Y2195-S2342 WeakPolarHBondContact OH-CB 3.36Å; Y2195-S2342 PolarHBondContact OH-OG 2.99Å; Y2195-S2342 VanDerWaalsContact OH-OG 3.08Å; Y2195-L2344 HydrophobicContact CD2-CB 4.47Å; Y2195-L2344 HydrophobicContact CD2-CD1 3.76Å; Y2195-L2344 HydrophobicContact CE2-CB 4.38Å; Y2195-L2344 HydrophobicContact CE2-CD1 3.43Å; Y2195-L2344 VanDerWaalsContact CE2-CD1 3.45Å; Y2195-L2344 HydrophobicContact CE2-CG 4.49Å; Y2195-V2345 HydrophobicContact CD1-CG2 3.77Å; Y2195-V2345 HydrophobicContact CE1-CG2 3.74Å
2196	R	95.2	Very high	93.9	Very high	9.25 Å²	9.25	45.4 Å²	45.4	4%	0.035	26%	0.256	C	S	.	.			trans	-75.4	142.5	167.7	172.3	-176	160.9	159.9	-5.9	110.2	W2177 V2178 L2198 K2200 I2205 W2276 E2288	W2177-R2196 VanDerWaalsContact O-CD 3.3Å; W2177-R2196 WeakPolarHBondContact O-CD 3.29Å; W2177-R2196 PolarHBondContact O-NE 3.5Å; V2178-R2196 PolarHBondContact O-N 2.98Å; R2196-L2198 PolarHBondContact O-N 3.14Å; R2196-K2200 PolarHBondContact NH1-O 3.09Å; R2196-K2200 PolarHBondContact NH2-O 3.15Å; R2196-I2205 HydrophobicContact CG-CD1 3.93Å; R2196-I2205 VanDerWaalsContact NE-CD1 3.33Å; R2196-W2276 HydrophobicContact CB-CH2 4.33Å; R2196-W2276 HydrophobicContact CG-CH2 4.27Å; R2196-E2288 IonicContact CZ-OE1 3.03Å; R2196-E2288 VanDerWaalsContact CZ-OE1 3.24Å; R2196-E2288 IonicContact CZ-OE2 3.02Å; R2196-E2288 IonicContact NE-OE1 2.73Å; R2196-E2288 IonicContact NE-OE2 2.69Å; R2196-E2288 IonicContact NH1-OE1 3.3Å; R2196-E2288 PolarHBondContact NH1-OE1 3.4Å; R2196-E2288 IonicContact NH1-OE2 2.73Å; R2196-E2288 PolarHBondContact NH1-OE2 2.94Å; R2196-E2288 IonicContact NH2-OE1 3.4Å; R2196-E2288 PolarHBondContact NH2-OE1 3.06Å
2197	D	95.5	Very high	94	Very high	59 Å²	59	42.2 Å²	42.2	32%	0.316	25%	0.25	S	C	.	.			trans	-67.1	99.7	165.4	-176.4	-7.2	0	0	0	110.8	S2199 K2200	D2197-S2199 PolarHBondContact O-N 3.18Å; D2197-S2199 VanDerWaalsContact OD1-CB 3.31Å; D2197-S2199 WeakPolarHBondContact OD1-CB 3.38Å; D2197-S2199 PolarHBondContact OD1-N 3.22Å; D2197-S2199 PolarHBondContact OD1-OG 3.1Å; D2197-S2199 PolarHBondContact OD2-OG 3.21Å; D2197-K2200 HydrophobicContact CB-CD 4.37Å; D2197-K2200 PolarHBondContact O-N 3.28Å; D2197-K2200 WeakPolarHBondContact OD2-CD 3.43Å; D2197-K2200 VanDerWaalsContact OD2-CE 3.25Å; D2197-K2200 WeakPolarHBondContact OD2-CE 3.17Å; D2197-K2200 IonicContact OD2-NZ 3.33Å; D2197-K2200 PolarHBondContact OD2-NZ 3.29Å
2198	L	96.9	Very high	94	Very high	4.75 Å²	4.75	49.5 Å²	49.5	3%	0.025	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-7.8	-179.9	-69.7	179	0	0	0	113.9	P2176 R2196 K2200 V2345 Q2348 L2349 N2351 W2352	P2176-L2198 HydrophobicContact CB-CD2 3.77Å; P2176-L2198 HydrophobicContact CG-CD2 4.3Å; R2196-L2198 PolarHBondContact O-N 3.14Å; L2198-K2200 VanDerWaalsContact C-N 3.29Å; L2198-K2200 PolarHBondContact O-N 3.22Å; L2198-V2345 HydrophobicContact CD1-CB 4.38Å; L2198-V2345 HydrophobicContact CD1-CG1 3.95Å; L2198-V2345 HydrophobicContact CD1-CG2 4.28Å; L2198-Q2348 HydrophobicContact CB-CB 4.34Å; L2198-Q2348 HydrophobicContact CD1-CB 4.33Å; L2198-L2349 HydrophobicContact CD1-CD1 4.36Å; L2198-N2351 CarbonylContact O-C 3.56Å; L2198-W2352 HydrophobicContact CB-CB 4.15Å; L2198-W2352 HydrophobicContact CD2-CB 4.29Å; L2198-W2352 HydrophobicContact CD2-CG 4.39Å; L2198-W2352 WeakPolarHBondContact O-CA 3.34Å; L2198-W2352 WeakPolarHBondContact O-CB 3.4Å; L2198-W2352 PolarHBondContact O-N 3.1Å
2199	S	96	Very high	94	Very high	41.5 Å²	41.5	46.1 Å²	46.1	29%	0.29	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-8.3	175.4	75.8	0	0	0	0	114.1	D2197	D2197-S2199 PolarHBondContact O-N 3.18Å; D2197-S2199 VanDerWaalsContact OD1-CB 3.31Å; D2197-S2199 WeakPolarHBondContact OD1-CB 3.38Å; D2197-S2199 PolarHBondContact OD1-N 3.22Å; D2197-S2199 PolarHBondContact OD1-OG 3.1Å; D2197-S2199 PolarHBondContact OD2-OG 3.21Å
2200	K	95.9	Very high	94.2	Very high	82.5 Å²	82.5	47.3 Å²	47.3	36%	0.359	27%	0.265	S	S	.	.	S	Bend	trans	-119.7	141.4	-176	-65.9	172.4	-175.4	139.2	0	112.2	R2196 D2197 L2198 A2204 I2205 L2355	R2196-K2200 PolarHBondContact NH1-O 3.09Å; R2196-K2200 PolarHBondContact NH2-O 3.15Å; D2197-K2200 HydrophobicContact CB-CD 4.37Å; D2197-K2200 PolarHBondContact O-N 3.28Å; D2197-K2200 WeakPolarHBondContact OD2-CD 3.43Å; D2197-K2200 VanDerWaalsContact OD2-CE 3.25Å; D2197-K2200 WeakPolarHBondContact OD2-CE 3.17Å; D2197-K2200 IonicContact OD2-NZ 3.33Å; D2197-K2200 PolarHBondContact OD2-NZ 3.29Å; L2198-K2200 VanDerWaalsContact C-N 3.29Å; L2198-K2200 PolarHBondContact O-N 3.22Å; K2200-A2204 HydrophobicContact CB-CB 4.41Å; K2200-I2205 HydrophobicContact CB-CG1 4.43Å; K2200-L2355 VanDerWaalsContact C-CD1 3.49Å; K2200-L2355 WeakPolarHBondContact O-CD1 3.43Å
2201	P	96.5	Very high	94.4	Very high	7.66667 Å²	7.66667	45.6 Å²	45.6	5%	0.05	26%	0.256	C	S	.	.			trans	-68.4	159.5	166.9	29.1	-33.2	0	0	0	110.9	G2203 A2204 I2205 A2369 T2370 N2371	P2201-G2203 VanDerWaalsContact C-N 3.28Å; P2201-G2203 PolarHBondContact O-N 3.14Å; P2201-A2204 HydrophobicContact CG-CB 3.9Å; P2201-A2204 PolarHBondContact O-N 3.32Å; P2201-I2205 PolarHBondContact O-N 2.91Å; P2201-A2369 VanDerWaalsContact CD-O 3.27Å; P2201-A2369 WeakPolarHBondContact CD-O 3.42Å; P2201-A2369 WeakPolarHBondContact CG-O 3.42Å; P2201-T2370 VanDerWaalsContact CG-O 3.24Å; P2201-T2370 WeakPolarHBondContact CG-O 3.2Å; P2201-N2371 WeakPolarHBondContact CB-OD1 3.44Å; P2201-N2371 HydrophobicContact CG-CB 4.14Å
2202	I	95.9	Very high	94.5	Very high	4.33333 Å²	4.33333	48.6 Å²	48.6	2%	0.022	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-50	-47.1	-175.7	-67.5	-71.1	0	0	0	112.2	W2177 A2204 I2205 R2209 W2276 C2279 V2286 E2288	W2177-I2202 HydrophobicContact CB-CD1 4.35Å; W2177-I2202 HydrophobicContact CG-CD1 4.24Å; I2202-A2204 PolarHBondContact O-N 3.15Å; I2202-A2204 VanDerWaalsContact O-N 3.15Å; I2202-I2205 HydrophobicContact CD1-CD1 3.98Å; I2202-I2205 PolarHBondContact O-N 3.08Å; I2202-R2209 PolarHBondContact O-NH2 3.11Å; I2202-W2276 HydrophobicContact CD1-CZ3 4.08Å; I2202-C2279 HydrophobicContact CG2-CB 4.14Å; I2202-C2279 VanDerWaalsContact CG2-O 3.23Å; I2202-C2279 WeakPolarHBondContact CG2-O 3.29Å; I2202-V2286 HydrophobicContact CB-CB 4.36Å; I2202-V2286 HydrophobicContact CG2-CB 4.3Å; I2202-V2286 HydrophobicContact CG2-CG1 4.44Å; I2202-E2288 HydrophobicContact CG1-CG 4.23Å
2203	G	93.4	Very high	94.6	Very high	0.333333 Å²	0.333333	44.4 Å²	44.4	0%	0.003	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-59.2	-27.2	-179.9	0	0	0	0	0	115.1	P2201 R2209 Y2230	P2201-G2203 VanDerWaalsContact C-N 3.28Å; P2201-G2203 PolarHBondContact O-N 3.14Å; G2203-R2209 VanDerWaalsContact CA-NH2 3.34Å; G2203-R2209 PolarHBondContact O-NE 2.85Å; G2203-Y2230 WeakPolarHBondContact CA-OH 3.15Å
2204	A	94.9	Very high	94.8	Very high	4.33333 Å²	4.33333	42.1 Å²	42.1	4%	0.036	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-97.7	-1.8	-175	0	0	0	0	0	114.8	K2200 P2201 I2202 K2210 T2370	K2200-A2204 HydrophobicContact CB-CB 4.41Å; P2201-A2204 HydrophobicContact CG-CB 3.9Å; P2201-A2204 PolarHBondContact O-N 3.32Å; I2202-A2204 PolarHBondContact O-N 3.15Å; I2202-A2204 VanDerWaalsContact O-N 3.15Å; A2204-K2210 HydrophobicContact CB-CB 4.4Å; A2204-K2210 HydrophobicContact CB-CD 4.27Å; A2204-K2210 HydrophobicContact CB-CG 3.94Å; A2204-T2370 HydrophobicContact CB-CG2 4.42Å
2205	I	94.1	Very high	94.8	Very high	39.6667 Å²	39.6667	46.8 Å²	46.8	20%	0.203	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-50.4	178.2	-64	167	0	0	0	110.4	R2196 K2200 P2201 I2202 P2207 W2276	R2196-I2205 HydrophobicContact CG-CD1 3.93Å; R2196-I2205 VanDerWaalsContact NE-CD1 3.33Å; K2200-I2205 HydrophobicContact CB-CG1 4.43Å; P2201-I2205 PolarHBondContact O-N 2.91Å; I2202-I2205 HydrophobicContact CD1-CD1 3.98Å; I2202-I2205 PolarHBondContact O-N 3.08Å; I2205-P2207 VanDerWaalsContact O-CD 3.32Å; I2205-P2207 WeakPolarHBondContact O-CD 3.4Å; I2205-W2276 HydrophobicContact CD1-CH2 3.97Å
2206	N	93.4	Very high	94.6	Very high	47.3333 Å²	47.3333	50.3 Å²	50.3	25%	0.253	25%	0.253	S	S	.	.	S	Bend	trans	-76.8	114.7	175	178.7	-13.6	0	0	0	110	K2208 R2209 K2210 Q2280	N2206-K2208 VanDerWaalsContact C-N 3.3Å; N2206-K2208 PolarHBondContact O-N 3.24Å; N2206-K2208 PolarHBondContact OD1-N 3.17Å; N2206-K2208 VanDerWaalsContact OD1-N 3.13Å; N2206-R2209 HydrophobicContact CB-CB 4.02Å; N2206-R2209 PolarHBondContact O-N 3.21Å; N2206-R2209 VanDerWaalsContact O-N 3.09Å; N2206-K2210 PolarHBondContact O-N 3.01Å; N2206-Q2280 PolarHBondContact ND2-O 3.22Å
2207	P	92.8	Very high	94.6	Very high	101.333 Å²	101.333	52.3 Å²	52.3	66%	0.658	26%	0.261	S	S	*	.	H	α-helix	trans	-61.3	-33.4	-174.7	-25.1	35.5	0	0	0	114.3	I2205 R2209 K2210 A2211	I2205-P2207 VanDerWaalsContact O-CD 3.32Å; I2205-P2207 WeakPolarHBondContact O-CD 3.4Å; P2207-R2209 VanDerWaalsContact C-N 3.34Å; P2207-K2210 PolarHBondContact O-N 3.22Å; P2207-A2211 PolarHBondContact O-N 2.93Å; P2207-A2211 VanDerWaalsContact O-N 3.12Å
2208	K	93	Very high	94.5	Very high	181.667 Å²	181.667	57.3 Å²	57.3	79%	0.79	28%	0.28	S	S	*	.	H	α-helix	trans	-65.7	-42.1	176.7	-66.8	-175.5	178.2	-178.5	0	111.1	N2206 A2211 F2212	N2206-K2208 VanDerWaalsContact C-N 3.3Å; N2206-K2208 PolarHBondContact O-N 3.24Å; N2206-K2208 PolarHBondContact OD1-N 3.17Å; N2206-K2208 VanDerWaalsContact OD1-N 3.13Å; K2208-A2211 PolarHBondContact O-N 3.19Å; K2208-F2212 PolarHBondContact O-N 2.95Å
2209	R	92.3	Very high	94.4	Very high	10.3333 Å²	10.3333	62.1 Å²	62.1	4%	0.039	31%	0.306	C	S	.	.	H	α-helix	trans	-73.3	-35.5	179.6	-160.3	179.9	86.9	-176.8	-9.5	111.6	I2202 G2203 N2206 P2207 A2211 F2212 F2213 C2279 N2282 T2283 D2285	I2202-R2209 PolarHBondContact O-NH2 3.11Å; G2203-R2209 VanDerWaalsContact CA-NH2 3.34Å; G2203-R2209 PolarHBondContact O-NE 2.85Å; N2206-R2209 HydrophobicContact CB-CB 4.02Å; N2206-R2209 PolarHBondContact O-N 3.21Å; N2206-R2209 VanDerWaalsContact O-N 3.09Å; P2207-R2209 VanDerWaalsContact C-N 3.34Å; R2209-A2211 VanDerWaalsContact C-N 3.35Å; R2209-A2211 PolarHBondContact O-N 3.08Å; R2209-F2212 WeakPolarHBondContact O-CB 3.29Å; R2209-F2212 PolarHBondContact O-N 3.11Å; R2209-F2213 HydrophobicContact CB-CE2 4.48Å; R2209-F2213 HydrophobicContact CG-CD2 4.04Å; R2209-F2213 HydrophobicContact CG-CE2 3.51Å; R2209-F2213 VanDerWaalsContact CG-CE2 3.49Å; R2209-F2213 HydrophobicContact CG-CZ 4.2Å; R2209-F2213 VanDerWaalsContact NE-CE2 3.26Å; R2209-F2213 WeakPolarHBondContact O-CD2 3.44Å; R2209-F2213 PolarHBondContact O-N 3.1Å; R2209-F2213 VanDerWaalsContact O-N 3.09Å; R2209-C2279 VanDerWaalsContact CZ-O 3.25Å; R2209-C2279 PolarHBondContact NH1-O 3.37Å; R2209-C2279 PolarHBondContact NH2-O 3.13Å; R2209-N2282 PolarHBondContact NH1-O 3.12Å; R2209-N2282 PolarHBondContact NH2-O 2.78Å; R2209-T2283 HydrophobicContact CG-CG2 4.45Å; R2209-T2283 PolarHBondContact NH2-O 3.22Å; R2209-D2285 PolarHBondContact NH1-O 2.97Å; R2209-D2285 PolarHBondContact NH2-O 3.45Å
2210	K	94.6	Very high	94.2	Very high	62.3333 Å²	62.3333	63.2 Å²	63.2	27%	0.271	30%	0.303	S	S	.	.	H	α-helix	trans	-55.7	-50	170	-167.9	-166.8	179.6	-91.6	0	111.2	A2204 N2206 P2207 F2212 F2213 D2214 T2370	A2204-K2210 HydrophobicContact CB-CB 4.4Å; A2204-K2210 HydrophobicContact CB-CD 4.27Å; A2204-K2210 HydrophobicContact CB-CG 3.94Å; N2206-K2210 PolarHBondContact O-N 3.01Å; P2207-K2210 PolarHBondContact O-N 3.22Å; K2210-F2212 VanDerWaalsContact C-N 3.31Å; K2210-F2212 PolarHBondContact O-N 3.24Å; K2210-F2213 PolarHBondContact O-N 3.13Å; K2210-F2213 VanDerWaalsContact O-N 3.14Å; K2210-D2214 WeakPolarHBondContact CE-OD2 3.41Å; K2210-D2214 IonicContact NZ-OD1 3.56Å; K2210-D2214 PolarHBondContact NZ-OD1 3.08Å; K2210-D2214 IonicContact NZ-OD2 2.76Å; K2210-D2214 PolarHBondContact NZ-OD2 2.85Å; K2210-D2214 VanDerWaalsContact O-CG 3.26Å; K2210-D2214 PolarHBondContact O-N 3.04Å; K2210-T2370 VanDerWaalsContact CE-OG1 3.3Å; K2210-T2370 WeakPolarHBondContact CE-OG1 3.29Å; K2210-T2370 HydrophobicContact CG-CG2 4.23Å; K2210-T2370 PolarHBondContact NZ-OG1 3.1Å
2211	A	94.6	Very high	93.8	Very high	51 Å²	51	68 Å²	68	42%	0.421	33%	0.327	S	S	.	.	H	α-helix	trans	-58.6	-43.2	180	0	0	0	0	0	112.3	P2207 K2208 R2209 F2213 D2214 E2215	P2207-A2211 PolarHBondContact O-N 2.93Å; P2207-A2211 VanDerWaalsContact O-N 3.12Å; K2208-A2211 PolarHBondContact O-N 3.19Å; R2209-A2211 VanDerWaalsContact C-N 3.35Å; R2209-A2211 PolarHBondContact O-N 3.08Å; A2211-F2213 PolarHBondContact O-N 3.09Å; A2211-D2214 PolarHBondContact O-N 2.93Å; A2211-E2215 VanDerWaalsContact O-CB 3.29Å; A2211-E2215 WeakPolarHBondContact O-CB 3.34Å; A2211-E2215 WeakPolarHBondContact O-CG 3.5Å; A2211-E2215 PolarHBondContact O-N 3.2Å
2212	F	93.9	Very high	93.3	Very high	93.6667 Å²	93.6667	70.9 Å²	70.9	41%	0.411	34%	0.343	S	S	.	.	H	α-helix	trans	-58.4	-43.8	173.9	168.8	-97.9	0	0	0	112.8	K2208 R2209 K2210 E2215 R2216 T2283	K2208-F2212 PolarHBondContact O-N 2.95Å; R2209-F2212 WeakPolarHBondContact O-CB 3.29Å; R2209-F2212 PolarHBondContact O-N 3.11Å; K2210-F2212 VanDerWaalsContact C-N 3.31Å; K2210-F2212 PolarHBondContact O-N 3.24Å; F2212-E2215 PolarHBondContact O-N 2.71Å; F2212-R2216 WeakPolarHBondContact O-CB 3.23Å; F2212-R2216 PolarHBondContact O-N 2.93Å; F2212-T2283 HydrophobicContact CD1-CG2 3.97Å; F2212-T2283 HydrophobicContact CE1-CG2 3.65Å; F2212-T2283 VanDerWaalsContact CE1-CG2 3.49Å; F2212-T2283 HydrophobicContact CZ-CG2 4.26Å
2213	F	95.1	Very high	92.6	Very high	1.66667 Å²	1.66667	79.8 Å²	79.8	1%	0.007	38%	0.384	C	S	.	.	H	α-helix	trans	-70.6	-39.3	177.5	-69.1	-55	0	0	0	112.9	R2209 K2210 A2211 E2215 R2216 Y2217 H2229 Y2230 T2283 V2286 T2370	R2209-F2213 HydrophobicContact CB-CE2 4.48Å; R2209-F2213 HydrophobicContact CG-CD2 4.04Å; R2209-F2213 HydrophobicContact CG-CE2 3.51Å; R2209-F2213 VanDerWaalsContact CG-CE2 3.49Å; R2209-F2213 HydrophobicContact CG-CZ 4.2Å; R2209-F2213 VanDerWaalsContact NE-CE2 3.26Å; R2209-F2213 WeakPolarHBondContact O-CD2 3.44Å; R2209-F2213 PolarHBondContact O-N 3.1Å; R2209-F2213 VanDerWaalsContact O-N 3.09Å; K2210-F2213 PolarHBondContact O-N 3.13Å; K2210-F2213 VanDerWaalsContact O-N 3.14Å; A2211-F2213 PolarHBondContact O-N 3.09Å; F2213-E2215 VanDerWaalsContact C-N 3.32Å; F2213-E2215 PolarHBondContact O-N 2.92Å; F2213-R2216 PolarHBondContact O-N 3.26Å; F2213-Y2217 WeakPolarHBondContact O-CB 3.34Å; F2213-Y2217 PolarHBondContact O-N 3.22Å; F2213-H2229 HydrophobicContact CB-CB 4.24Å; F2213-H2229 VanDerWaalsContact CD1-O 3.22Å; F2213-H2229 WeakPolarHBondContact CD1-O 3.3Å; F2213-H2229 PolarHBondContact O-CD2 2.94Å; F2213-Y2230 HydrophobicContact CD1-CD1 4.13Å; F2213-Y2230 HydrophobicContact CD1-CE1 4.16Å; F2213-Y2230 HydrophobicContact CD2-CD1 4.29Å; F2213-Y2230 AromaticContact CD2-CE1 3.57Å; F2213-Y2230 HydrophobicContact CD2-CE1 3.57Å; F2213-Y2230 AromaticContact CE1-CD1 3.88Å; F2213-Y2230 HydrophobicContact CE1-CD1 3.88Å; F2213-Y2230 HydrophobicContact CE1-CE1 4.13Å; F2213-Y2230 AromaticContact CE2-CD1 3.98Å; F2213-Y2230 HydrophobicContact CE2-CD1 4.02Å; F2213-Y2230 AromaticContact CE2-CE1 3.52Å; F2213-Y2230 HydrophobicContact CE2-CE1 3.52Å; F2213-Y2230 VanDerWaalsContact CE2-CE1 3.5Å; F2213-Y2230 HydrophobicContact CG-CD1 4.34Å; F2213-Y2230 AromaticContact CG-CE1 3.89Å; F2213-Y2230 HydrophobicContact CG-CE1 3.89Å; F2213-Y2230 AromaticContact CZ-CD1 3.81Å; F2213-Y2230 HydrophobicContact CZ-CD1 3.81Å; F2213-Y2230 AromaticContact CZ-CE1 3.82Å; F2213-Y2230 HydrophobicContact CZ-CE1 3.82Å; F2213-T2283 WeakPolarHBondContact CZ-O 3.42Å; F2213-V2286 HydrophobicContact CZ-CG1 4.44Å; F2213-T2370 HydrophobicContact CB-CG2 4.04Å
2214	D	95.1	Very high	92.2	Very high	41.6667 Å²	41.6667	86.8 Å²	86.8	22%	0.223	42%	0.421	C	S	.	.	H	α-helix	trans	-63.3	-38.5	175.2	-66.8	-22.4	0	0	0	111.1	K2210 A2211 Y2217 K2218 H2229 T2370	K2210-D2214 WeakPolarHBondContact CE-OD2 3.41Å; K2210-D2214 IonicContact NZ-OD1 3.56Å; K2210-D2214 PolarHBondContact NZ-OD1 3.08Å; K2210-D2214 IonicContact NZ-OD2 2.76Å; K2210-D2214 PolarHBondContact NZ-OD2 2.85Å; K2210-D2214 VanDerWaalsContact O-CG 3.26Å; K2210-D2214 PolarHBondContact O-N 3.04Å; A2211-D2214 PolarHBondContact O-N 2.93Å; D2214-Y2217 PolarHBondContact O-N 3.19Å; D2214-K2218 WeakPolarHBondContact O-CB 3.2Å; D2214-K2218 VanDerWaalsContact O-CD 3.28Å; D2214-K2218 WeakPolarHBondContact O-CD 3.45Å; D2214-K2218 VanDerWaalsContact O-CG 3.23Å; D2214-K2218 WeakPolarHBondContact O-CG 3.3Å; D2214-K2218 PolarHBondContact O-N 3.15Å; D2214-H2229 IonicContact OD1-NE2 3.84Å; D2214-T2370 WeakPolarHBondContact OD1-CG2 3.3Å; D2214-T2370 PolarHBondContact OD1-OG1 2.94Å
2215	E	94.9	Very high	91.7	Very high	116.667 Å²	116.667	88.4 Å²	88.4	55%	0.545	43%	0.428	S	S	.	.	H	α-helix	trans	-68.3	-46.4	175.6	-149.5	175.1	-167.1	0	0	111.7	A2211 F2212 F2213 Y2217 K2218 N2219	A2211-E2215 VanDerWaalsContact O-CB 3.29Å; A2211-E2215 WeakPolarHBondContact O-CB 3.34Å; A2211-E2215 WeakPolarHBondContact O-CG 3.5Å; A2211-E2215 PolarHBondContact O-N 3.2Å; F2212-E2215 PolarHBondContact O-N 2.71Å; F2213-E2215 VanDerWaalsContact C-N 3.32Å; F2213-E2215 PolarHBondContact O-N 2.92Å; E2215-Y2217 VanDerWaalsContact C-N 3.28Å; E2215-Y2217 PolarHBondContact O-N 2.9Å; E2215-K2218 PolarHBondContact O-N 3.03Å; E2215-K2218 VanDerWaalsContact O-N 3.08Å; E2215-N2219 WeakPolarHBondContact CG-ND2 3.19Å; E2215-N2219 WeakPolarHBondContact O-CB 3.27Å; E2215-N2219 PolarHBondContact O-N 3.34Å
2216	R	93.3	Very high	91.6	Very high	95 Å²	95	89.8 Å²	89.8	36%	0.358	44%	0.44	S	S	.	.	H	α-helix	trans	-56.3	-40.8	174.1	-177.6	-175.8	-178.6	172.2	5.1	112.2	F2212 F2213 W2220 F2228 H2229	F2212-R2216 WeakPolarHBondContact O-CB 3.23Å; F2212-R2216 PolarHBondContact O-N 2.93Å; F2213-R2216 PolarHBondContact O-N 3.26Å; R2216-W2220 HydrophobicContact CG-CE3 4.39Å; R2216-W2220 HydrophobicContact CG-CZ3 4.36Å; R2216-F2228 VanDerWaalsContact NH2-CZ 3.28Å; R2216-H2229 PolarHBondContact NH1-O 3.3Å
2217	Y	94.5	Very high	91.6	Very high	51 Å²	51	89.7 Å²	89.7	20%	0.2	44%	0.442	C	S	.	.	H	α-helix	trans	-68.5	-38.2	178.8	-170.9	-83.1	0	0	0	112.3	F2213 D2214 E2215 W2220 P2227 H2229 V2367 V2372	F2213-Y2217 WeakPolarHBondContact O-CB 3.34Å; F2213-Y2217 PolarHBondContact O-N 3.22Å; D2214-Y2217 PolarHBondContact O-N 3.19Å; E2215-Y2217 VanDerWaalsContact C-N 3.28Å; E2215-Y2217 PolarHBondContact O-N 2.9Å; Y2217-W2220 WeakPolarHBondContact O-CB 3.45Å; Y2217-P2227 HydrophobicContact CD1-CB 4.46Å; Y2217-P2227 HydrophobicContact CD2-CB 4.03Å; Y2217-P2227 HydrophobicContact CE1-CB 4.26Å; Y2217-P2227 HydrophobicContact CE1-CG 4.2Å; Y2217-P2227 VanDerWaalsContact CE2-C 3.45Å; Y2217-P2227 HydrophobicContact CE2-CB 3.81Å; Y2217-P2227 HydrophobicContact CE2-CG 4.12Å; Y2217-P2227 VanDerWaalsContact CE2-O 3.27Å; Y2217-P2227 WeakPolarHBondContact CE2-O 3.43Å; Y2217-P2227 HydrophobicContact CG-CB 4.34Å; Y2217-H2229 AromaticContact CD2-CD2 3.96Å; Y2217-H2229 AromaticContact CD2-CE1 3.3Å; Y2217-H2229 VanDerWaalsContact CD2-CE1 3.4Å; Y2217-H2229 WeakPolarHBondContact CD2-CE1 3.35Å; Y2217-H2229 AromaticContact CD2-CG 3.95Å; Y2217-H2229 AromaticContact CD2-ND1 3.57Å; Y2217-H2229 WeakPolarHBondContact CD2-ND1 3.21Å; Y2217-H2229 AromaticContact CD2-NE2 3.62Å; Y2217-H2229 AromaticContact CE2-CE1 3.73Å; Y2217-H2229 AromaticContact CE2-ND1 3.95Å; Y2217-H2229 AromaticContact CG-CE1 3.71Å; Y2217-H2229 AromaticContact CG-NE2 3.58Å; Y2217-V2367 HydrophobicContact CD1-CG1 4.14Å; Y2217-V2367 HydrophobicContact CE1-CG1 3.62Å; Y2217-V2367 HydrophobicContact CE1-CG2 4.29Å; Y2217-V2367 HydrophobicContact CE2-CG2 4.43Å; Y2217-V2367 VanDerWaalsContact OH-CG2 3.25Å; Y2217-V2367 WeakPolarHBondContact OH-CG2 3.39Å; Y2217-V2372 HydrophobicContact CE2-CB 4.07Å; Y2217-V2372 HydrophobicContact CE2-CG1 4.22Å; Y2217-V2372 HydrophobicContact CE2-CG2 4.11Å
2218	K	94.1	Very high	91.7	Very high	164.667 Å²	164.667	85.3 Å²	85.3	72%	0.716	41%	0.412	S	S	*	.	H	α-helix	trans	-74.9	-37.5	-178.9	-101.5	174.3	-177.2	178.8	0	113	D2214 E2215 W2220	D2214-K2218 WeakPolarHBondContact O-CB 3.2Å; D2214-K2218 VanDerWaalsContact O-CD 3.28Å; D2214-K2218 WeakPolarHBondContact O-CD 3.45Å; D2214-K2218 VanDerWaalsContact O-CG 3.23Å; D2214-K2218 WeakPolarHBondContact O-CG 3.3Å; D2214-K2218 PolarHBondContact O-N 3.15Å; E2215-K2218 PolarHBondContact O-N 3.03Å; E2215-K2218 VanDerWaalsContact O-N 3.08Å; K2218-W2220 VanDerWaalsContact C-N 3.28Å; K2218-W2220 PolarHBondContact O-N 2.86Å
2219	N	93.4	Very high	91.8	Very high	105.333 Å²	105.333	76.7 Å²	76.7	56%	0.563	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	35.7	-176.5	-57.4	-11.1	0	0	0	111.3	E2215 E2221	E2215-N2219 WeakPolarHBondContact CG-ND2 3.19Å; E2215-N2219 WeakPolarHBondContact O-CB 3.27Å; E2215-N2219 PolarHBondContact O-N 3.34Å; N2219-E2221 PolarHBondContact O-N 3.43Å
2220	W	91.9	Very high	91.9	Very high	64 Å²	64	76.5 Å²	76.5	24%	0.242	37%	0.374	C	S	.	.			trans	-90.1	116.8	-176.9	-166.3	-89.1	0	0	0	110.7	R2216 Y2217 K2218 D2222 Q2225 P2227 F2228	R2216-W2220 HydrophobicContact CG-CE3 4.39Å; R2216-W2220 HydrophobicContact CG-CZ3 4.36Å; Y2217-W2220 WeakPolarHBondContact O-CB 3.45Å; K2218-W2220 VanDerWaalsContact C-N 3.28Å; K2218-W2220 PolarHBondContact O-N 2.86Å; W2220-D2222 HydrophobicContact CZ2-CB 4.48Å; W2220-Q2225 HydrophobicContact CZ2-CB 4.34Å; W2220-Q2225 HydrophobicContact CZ2-CG 4.03Å; W2220-Q2225 PolarHBondContact NE1-O 2.82Å; W2220-P2227 HydrophobicContact CB-CB 3.77Å; W2220-P2227 HydrophobicContact CD2-CB 4.34Å; W2220-P2227 HydrophobicContact CG-CB 3.71Å; W2220-F2228 AromaticContact CH2-CD1 3.94Å; W2220-F2228 HydrophobicContact CH2-CD1 4.02Å; W2220-F2228 AromaticContact CH2-CE1 3.25Å; W2220-F2228 HydrophobicContact CH2-CE1 3.25Å; W2220-F2228 HydrophobicContact CH2-CE2 4.24Å; W2220-F2228 AromaticContact CH2-CZ 3.47Å; W2220-F2228 HydrophobicContact CH2-CZ 3.47Å; W2220-F2228 AromaticContact CZ2-CD1 3.94Å; W2220-F2228 HydrophobicContact CZ2-CD1 4.09Å; W2220-F2228 AromaticContact CZ2-CE1 3.48Å; W2220-F2228 HydrophobicContact CZ2-CE1 3.48Å; W2220-F2228 VanDerWaalsContact CZ2-CE1 3.46Å; W2220-F2228 AromaticContact CZ2-CZ 3.93Å; W2220-F2228 HydrophobicContact CZ2-CZ 4.16Å; W2220-F2228 HydrophobicContact CZ3-CD1 4.42Å; W2220-F2228 AromaticContact CZ3-CE1 3.87Å; W2220-F2228 HydrophobicContact CZ3-CE1 4.03Å; W2220-F2228 HydrophobicContact CZ3-CE2 4.42Å; W2220-F2228 AromaticContact CZ3-CZ 3.98Å; W2220-F2228 HydrophobicContact CZ3-CZ 4.1Å
2221	E	87.5	Confident	91.6	Very high	183.333 Å²	183.333	74.9 Å²	74.9	86%	0.857	38%	0.376	S	S	*	.			trans	-108.9	-3.5	-170.5	-62.2	-177.4	165	0	0	114.2	N2219 E2223	N2219-E2221 PolarHBondContact O-N 3.43Å; E2221-E2223 PolarHBondContact O-N 2.99Å
2222	D	86.3	Confident	91.4	Very high	70 Å²	70	74.5 Å²	74.5	37%	0.374	37%	0.368	S	S	.	.			trans	-82.2	112.8	179.7	-173.1	-0.3	0	0	0	111.5	W2220 N2224 Q2225	W2220-D2222 HydrophobicContact CZ2-CB 4.48Å; D2222-N2224 VanDerWaalsContact C-N 3.3Å; D2222-N2224 PolarHBondContact O-N 2.94Å; D2222-N2224 WeakPolarHBondContact OD1-CB 3.37Å; D2222-N2224 PolarHBondContact OD1-N 3.22Å; D2222-N2224 PolarHBondContact OD1-ND2 3.06Å; D2222-Q2225 HydrophobicContact CB-CB 4.45Å; D2222-Q2225 PolarHBondContact O-N 3.29Å; D2222-Q2225 VanDerWaalsContact O-O 3.05Å
2223	E	82.2	Confident	91.4	Very high	191 Å²	191	70.1 Å²	70.1	89%	0.893	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-23.3	177.3	-63.6	-140.4	154.6	0	0	113.3	E2221 Q2225	E2221-E2223 PolarHBondContact O-N 2.99Å; E2223-Q2225 VanDerWaalsContact C-N 3.34Å
2224	N	83.5	Confident	91.4	Very high	147.333 Å²	147.333	70.4 Å²	70.4	79%	0.788	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-18.5	-178	-56	-69.4	0	0	0	112.5	D2222	D2222-N2224 VanDerWaalsContact C-N 3.3Å; D2222-N2224 PolarHBondContact O-N 2.94Å; D2222-N2224 WeakPolarHBondContact OD1-CB 3.37Å; D2222-N2224 PolarHBondContact OD1-N 3.22Å; D2222-N2224 PolarHBondContact OD1-ND2 3.06Å
2225	Q	86	Confident	91.4	Very high	36.6667 Å²	36.6667	68.8 Å²	68.8	17%	0.171	34%	0.342	C	S	.	.	S	Bend	trans	-128.7	120.9	-173	175.8	156.9	45.9	0	0	111.4	W2220 D2222 E2223 F2228 H2374 Y2375	W2220-Q2225 HydrophobicContact CZ2-CB 4.34Å; W2220-Q2225 HydrophobicContact CZ2-CG 4.03Å; W2220-Q2225 PolarHBondContact NE1-O 2.82Å; D2222-Q2225 HydrophobicContact CB-CB 4.45Å; D2222-Q2225 PolarHBondContact O-N 3.29Å; D2222-Q2225 VanDerWaalsContact O-O 3.05Å; E2223-Q2225 VanDerWaalsContact C-N 3.34Å; Q2225-F2228 VanDerWaalsContact CD-CE1 3.48Å; Q2225-F2228 HydrophobicContact CG-CD1 4.31Å; Q2225-F2228 HydrophobicContact CG-CE1 4.1Å; Q2225-H2374 PolarHBondContact NE2-CD2 2.85Å; Q2225-H2374 PolarHBondContact NE2-CE1 3.02Å; Q2225-H2374 PolarHBondContact NE2-NE2 2.93Å; Q2225-Y2375 HydrophobicContact CG-CD1 4.1Å; Q2225-Y2375 HydrophobicContact CG-CE1 4.04Å; Q2225-Y2375 VanDerWaalsContact NE2-CE1 3.34Å
2226	P	91.1	Very high	91.3	Very high	69.6667 Å²	69.6667	63.7 Å²	63.7	45%	0.452	32%	0.319	S	S	.	.			trans	-58.7	142.3	174	-8.3	12.3	0	0	0	112.1	F2228 Y2375	P2226-F2228 WeakPolarHBondContact O-CD1 3.45Å; P2226-Y2375 HydrophobicContact CG-CD1 4.16Å; P2226-Y2375 HydrophobicContact CG-CG 4.22Å
2227	P	94	Very high	91.2	Very high	45.3333 Å²	45.3333	59.9 Å²	59.9	29%	0.294	31%	0.307	S	S	.	.			trans	-61.6	143.2	-178.8	24.3	-34.5	0	0	0	112.2	Y2217 W2220	Y2217-P2227 HydrophobicContact CD1-CB 4.46Å; Y2217-P2227 HydrophobicContact CD2-CB 4.03Å; Y2217-P2227 HydrophobicContact CE1-CB 4.26Å; Y2217-P2227 HydrophobicContact CE1-CG 4.2Å; Y2217-P2227 VanDerWaalsContact CE2-C 3.45Å; Y2217-P2227 HydrophobicContact CE2-CB 3.81Å; Y2217-P2227 HydrophobicContact CE2-CG 4.12Å; Y2217-P2227 VanDerWaalsContact CE2-O 3.27Å; Y2217-P2227 WeakPolarHBondContact CE2-O 3.43Å; Y2217-P2227 HydrophobicContact CG-CB 4.34Å; W2220-P2227 HydrophobicContact CB-CB 3.77Å; W2220-P2227 HydrophobicContact CD2-CB 4.34Å; W2220-P2227 HydrophobicContact CG-CB 3.71Å
2228	F	94.3	Very high	91.1	Very high	8.66667 Å²	8.66667	59.7 Å²	59.7	4%	0.038	32%	0.317	C	S	.	.			trans	-144.5	154.5	178.3	62.2	-91.8	0	0	0	111.6	R2216 W2220 Q2225 P2226 Y2230 V2372 F2373 H2374	R2216-F2228 VanDerWaalsContact NH2-CZ 3.28Å; W2220-F2228 AromaticContact CH2-CD1 3.94Å; W2220-F2228 HydrophobicContact CH2-CD1 4.02Å; W2220-F2228 AromaticContact CH2-CE1 3.25Å; W2220-F2228 HydrophobicContact CH2-CE1 3.25Å; W2220-F2228 HydrophobicContact CH2-CE2 4.24Å; W2220-F2228 AromaticContact CH2-CZ 3.47Å; W2220-F2228 HydrophobicContact CH2-CZ 3.47Å; W2220-F2228 AromaticContact CZ2-CD1 3.94Å; W2220-F2228 HydrophobicContact CZ2-CD1 4.09Å; W2220-F2228 AromaticContact CZ2-CE1 3.48Å; W2220-F2228 HydrophobicContact CZ2-CE1 3.48Å; W2220-F2228 VanDerWaalsContact CZ2-CE1 3.46Å; W2220-F2228 AromaticContact CZ2-CZ 3.93Å; W2220-F2228 HydrophobicContact CZ2-CZ 4.16Å; W2220-F2228 HydrophobicContact CZ3-CD1 4.42Å; W2220-F2228 AromaticContact CZ3-CE1 3.87Å; W2220-F2228 HydrophobicContact CZ3-CE1 4.03Å; W2220-F2228 HydrophobicContact CZ3-CE2 4.42Å; W2220-F2228 AromaticContact CZ3-CZ 3.98Å; W2220-F2228 HydrophobicContact CZ3-CZ 4.1Å; Q2225-F2228 VanDerWaalsContact CD-CE1 3.48Å; Q2225-F2228 HydrophobicContact CG-CD1 4.31Å; Q2225-F2228 HydrophobicContact CG-CE1 4.1Å; P2226-F2228 WeakPolarHBondContact O-CD1 3.45Å; F2228-Y2230 VanDerWaalsContact CD2-C 3.43Å; F2228-Y2230 VanDerWaalsContact CD2-O 3.3Å; F2228-Y2230 WeakPolarHBondContact CD2-O 3.26Å; F2228-V2372 HydrophobicContact CB-CG1 4.34Å; F2228-F2373 WeakPolarHBondContact CB-O 3.32Å; F2228-H2374 AromaticContact CE1-CD2 3.96Å; F2228-H2374 AromaticContact CZ-CD2 3.99Å
2229	H	95	Very high	91.1	Very high	2 Å²	2	53.7 Å²	53.7	1%	0.009	29%	0.291	C	S	.	.	S	Bend	trans	-82.7	-46.3	176.3	-59.6	90.6	0	0	0	110.2	F2213 D2214 R2216 Y2217 T2370 V2372	F2213-H2229 HydrophobicContact CB-CB 4.24Å; F2213-H2229 VanDerWaalsContact CD1-O 3.22Å; F2213-H2229 WeakPolarHBondContact CD1-O 3.3Å; F2213-H2229 PolarHBondContact O-CD2 2.94Å; D2214-H2229 IonicContact OD1-NE2 3.84Å; R2216-H2229 PolarHBondContact NH1-O 3.3Å; Y2217-H2229 AromaticContact CD2-CD2 3.96Å; Y2217-H2229 AromaticContact CD2-CE1 3.3Å; Y2217-H2229 VanDerWaalsContact CD2-CE1 3.4Å; Y2217-H2229 WeakPolarHBondContact CD2-CE1 3.35Å; Y2217-H2229 AromaticContact CD2-CG 3.95Å; Y2217-H2229 AromaticContact CD2-ND1 3.57Å; Y2217-H2229 WeakPolarHBondContact CD2-ND1 3.21Å; Y2217-H2229 AromaticContact CD2-NE2 3.62Å; Y2217-H2229 AromaticContact CE2-CE1 3.73Å; Y2217-H2229 AromaticContact CE2-ND1 3.95Å; Y2217-H2229 AromaticContact CG-CE1 3.71Å; Y2217-H2229 AromaticContact CG-NE2 3.58Å; H2229-T2370 HydrophobicContact CB-CG2 4.38Å; H2229-T2370 VanDerWaalsContact CD2-CG2 3.48Å; H2229-T2370 WeakPolarHBondContact CD2-CG2 3.35Å; H2229-V2372 WeakPolarHBondContact CA-O 3.43Å; H2229-V2372 WeakPolarHBondContact CB-O 3.38Å; H2229-V2372 PolarHBondContact N-O 3.15Å; H2229-V2372 VanDerWaalsContact ND1-CB 3.3Å; H2229-V2372 WeakPolarHBondContact ND1-CB 3.42Å; H2229-V2372 PolarHBondContact ND1-N 3.07Å
2230	Y	93.7	Very high	91.2	Very high	4.66667 Å²	4.66667	48.7 Å²	48.7	2%	0.018	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-116.1	121.2	-170.6	-46.6	-62.8	0	0	0	112.6	G2203 F2213 F2228 T2232 V2286 T2370 V2372 F2373 H2374	G2203-Y2230 WeakPolarHBondContact CA-OH 3.15Å; F2213-Y2230 HydrophobicContact CD1-CD1 4.13Å; F2213-Y2230 HydrophobicContact CD1-CE1 4.16Å; F2213-Y2230 HydrophobicContact CD2-CD1 4.29Å; F2213-Y2230 AromaticContact CD2-CE1 3.57Å; F2213-Y2230 HydrophobicContact CD2-CE1 3.57Å; F2213-Y2230 AromaticContact CE1-CD1 3.88Å; F2213-Y2230 HydrophobicContact CE1-CD1 3.88Å; F2213-Y2230 HydrophobicContact CE1-CE1 4.13Å; F2213-Y2230 AromaticContact CE2-CD1 3.98Å; F2213-Y2230 HydrophobicContact CE2-CD1 4.02Å; F2213-Y2230 AromaticContact CE2-CE1 3.52Å; F2213-Y2230 HydrophobicContact CE2-CE1 3.52Å; F2213-Y2230 VanDerWaalsContact CE2-CE1 3.5Å; F2213-Y2230 HydrophobicContact CG-CD1 4.34Å; F2213-Y2230 AromaticContact CG-CE1 3.89Å; F2213-Y2230 HydrophobicContact CG-CE1 3.89Å; F2213-Y2230 AromaticContact CZ-CD1 3.81Å; F2213-Y2230 HydrophobicContact CZ-CD1 3.81Å; F2213-Y2230 AromaticContact CZ-CE1 3.82Å; F2213-Y2230 HydrophobicContact CZ-CE1 3.82Å; F2228-Y2230 VanDerWaalsContact CD2-C 3.43Å; F2228-Y2230 VanDerWaalsContact CD2-O 3.3Å; F2228-Y2230 WeakPolarHBondContact CD2-O 3.26Å; Y2230-T2232 VanDerWaalsContact C-N 3.32Å; Y2230-T2232 WeakPolarHBondContact CB-O 3.42Å; Y2230-V2286 HydrophobicContact CD1-CG1 3.85Å; Y2230-V2286 HydrophobicContact CD1-CG2 4.42Å; Y2230-V2286 HydrophobicContact CE1-CG1 4.04Å; Y2230-V2286 HydrophobicContact CG-CG1 4.39Å; Y2230-V2286 HydrophobicContact CG-CG2 4.45Å; Y2230-T2370 WeakPolarHBondContact CE2-O 3.31Å; Y2230-T2370 VanDerWaalsContact CZ-O 3.22Å; Y2230-T2370 PolarHBondContact OH-O 3.14Å; Y2230-V2372 PolarHBondContact N-O 3.24Å; Y2230-V2372 VanDerWaalsContact N-O 3.14Å; Y2230-F2373 AromaticContact CD2-CD1 3.86Å; Y2230-F2373 HydrophobicContact CD2-CD1 3.86Å; Y2230-F2373 HydrophobicContact CD2-CD2 4.28Å; Y2230-F2373 AromaticContact CD2-CE1 3.37Å; Y2230-F2373 HydrophobicContact CD2-CE1 3.37Å; Y2230-F2373 AromaticContact CD2-CE2 3.83Å; Y2230-F2373 HydrophobicContact CD2-CE2 3.83Å; Y2230-F2373 HydrophobicContact CD2-CG 4.27Å; Y2230-F2373 AromaticContact CD2-CZ 3.31Å; Y2230-F2373 HydrophobicContact CD2-CZ 3.31Å; Y2230-F2373 HydrophobicContact CE2-CE1 4.29Å; Y2230-F2373 HydrophobicContact CE2-CE2 4.23Å; Y2230-F2373 AromaticContact CE2-CZ 3.82Å; Y2230-F2373 HydrophobicContact CE2-CZ 3.82Å; Y2230-F2373 HydrophobicContact CG-CD1 4.18Å; Y2230-F2373 AromaticContact CG-CE1 3.78Å; Y2230-F2373 HydrophobicContact CG-CE1 3.78Å; Y2230-F2373 HydrophobicContact CG-CZ 4.16Å; Y2230-H2374 PolarHBondContact O-N 2.99Å; Y2230-H2374 VanDerWaalsContact O-N 3.12Å
2231	G	88.9	Confident	91.3	Very high	30.3333 Å²	30.3333	45.8 Å²	45.8	31%	0.313	25%	0.253	S	S	.	.	S	Bend	trans	-79.7	-17	171	0	0	0	0	0	113.4
2232	T	90.2	Very high	91.7	Very high	42 Å²	42	38.6 Å²	38.6	26%	0.258	22%	0.22	S	C	.	.	S	Bend	trans	-107.9	135.3	174.4	-42.3	0	0	0	0	109.1	Y2230 F2239 S2284 V2286 F2373	Y2230-T2232 VanDerWaalsContact C-N 3.32Å; Y2230-T2232 WeakPolarHBondContact CB-O 3.42Å; T2232-F2239 HydrophobicContact CG2-CE2 4.17Å; T2232-F2239 HydrophobicContact CG2-CZ 3.71Å; T2232-S2284 VanDerWaalsContact CB-O 3.3Å; T2232-S2284 WeakPolarHBondContact CB-O 3.34Å; T2232-S2284 WeakPolarHBondContact CG2-O 3.42Å; T2232-S2284 PolarHBondContact OG1-O 3.11Å; T2232-V2286 VanDerWaalsContact O-CG2 3.27Å; T2232-V2286 WeakPolarHBondContact O-CG2 3.34Å; T2232-F2373 WeakPolarHBondContact O-CD1 3.49Å
2233	H	94.1	Very high	92.2	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	20%	0.203	C	C	.	.			trans	-82.7	153.9	175	-168.9	-111.4	0	0	0	111.4	S2235 T2236 F2239 F2373 T2377 F2403 Q2405 T2406	H2233-S2235 PolarHBondContact ND1-N 3.02Å; H2233-S2235 PolarHBondContact ND1-O 3.03Å; H2233-S2235 PolarHBondContact O-N 3.07Å; H2233-S2235 VanDerWaalsContact O-N 3.16Å; H2233-T2236 HydrophobicContact CB-CG2 4.3Å; H2233-F2239 VanDerWaalsContact O-CE2 3.28Å; H2233-F2239 WeakPolarHBondContact O-CE2 3.18Å; H2233-F2373 HydrophobicContact CB-CD1 4.47Å; H2233-F2373 AromaticContact CD2-CD1 3.87Å; H2233-T2377 HydrophobicContact CB-CG2 4.31Å; H2233-F2403 WeakPolarHBondContact CB-O 3.35Å; H2233-Q2405 VanDerWaalsContact CE1-C 3.44Å; H2233-Q2405 PolarHBondContact CE1-O 3.2Å; H2233-T2406 PolarHBondContact CD2-OG1 3.16Å; H2233-T2406 WeakPolarHBondContact NE2-CA 3.3Å; H2233-T2406 PolarHBondContact NE2-N 3.4Å; H2233-T2406 PolarHBondContact NE2-OG1 2.84Å
2234	Y	95.1	Very high	92.9	Very high	8.66667 Å²	8.66667	26.4 Å²	26.4	3%	0.034	16%	0.161	C	C	.	.	S	Bend	trans	-70.6	-9.1	-179.1	47.3	-112.9	0	0	0	114.6	I2174 V2286 K2287 E2288 I2356 F2373 P2407	I2174-Y2234 HydrophobicContact CD1-CD2 3.68Å; I2174-Y2234 HydrophobicContact CD1-CE2 3.43Å; I2174-Y2234 HydrophobicContact CD1-CG 4.14Å; I2174-Y2234 HydrophobicContact CG2-CD2 4.44Å; Y2234-V2286 WeakPolarHBondContact CA-O 3.24Å; Y2234-V2286 VanDerWaalsContact CB-O 3.29Å; Y2234-V2286 WeakPolarHBondContact CB-O 3.35Å; Y2234-K2287 WeakPolarHBondContact O-CA 3.39Å; Y2234-E2288 HydrophobicContact CG-CG 4.4Å; Y2234-E2288 PolarHBondContact O-N 2.94Å; Y2234-I2356 HydrophobicContact CD1-CD1 4.16Å; Y2234-I2356 HydrophobicContact CE1-CD1 3.75Å; Y2234-I2356 HydrophobicContact CE2-CD1 4.25Å; Y2234-F2373 HydrophobicContact CD1-CD2 4.36Å; Y2234-F2373 AromaticContact CD1-CE1 3.8Å; Y2234-F2373 HydrophobicContact CD1-CE1 3.8Å; Y2234-F2373 AromaticContact CD1-CE2 3.73Å; Y2234-F2373 HydrophobicContact CD1-CE2 3.73Å; Y2234-F2373 AromaticContact CD1-CZ 3.32Å; Y2234-F2373 HydrophobicContact CD1-CZ 3.32Å; Y2234-F2373 HydrophobicContact CE1-CD2 4.18Å; Y2234-F2373 HydrophobicContact CE1-CE1 4.34Å; Y2234-F2373 AromaticContact CE1-CE2 3.59Å; Y2234-F2373 HydrophobicContact CE1-CE2 3.59Å; Y2234-F2373 AromaticContact CE1-CZ 3.72Å; Y2234-F2373 HydrophobicContact CE1-CZ 3.72Å; Y2234-F2373 HydrophobicContact CG-CZ 4.44Å; Y2234-P2407 WeakPolarHBondContact OH-CD 3.37Å
2235	S	94.5	Very high	93.4	Very high	7.66667 Å²	7.66667	19.4 Å²	19.4	5%	0.054	12%	0.124	C	C	.	.			trans	-149	119.1	-177.3	172.3	0	0	0	0	109.5	R2164 H2233	R2164-S2235 PolarHBondContact NH1-OG 2.98Å; R2164-S2235 VanDerWaalsContact NH1-OG 3.09Å; R2164-S2235 PolarHBondContact NH2-OG 2.72Å; H2233-S2235 PolarHBondContact ND1-N 3.02Å; H2233-S2235 PolarHBondContact ND1-O 3.03Å; H2233-S2235 PolarHBondContact O-N 3.07Å; H2233-S2235 VanDerWaalsContact O-N 3.16Å
2236	T	93	Very high	93.8	Very high	9.66667 Å²	9.66667	17.7 Å²	17.7	6%	0.059	12%	0.116	C	C	.	.			trans	-143.8	157.9	-178.9	64	0	0	0	0	108.7	H2233 A2238 F2239 V2240	H2233-T2236 HydrophobicContact CB-CG2 4.3Å; T2236-A2238 VanDerWaalsContact C-N 3.25Å; T2236-A2238 PolarHBondContact O-N 3.16Å; T2236-F2239 HydrophobicContact CG2-CD2 4.35Å; T2236-F2239 HydrophobicContact CG2-CE2 4.32Å; T2236-F2239 PolarHBondContact O-N 3.25Å; T2236-F2239 VanDerWaalsContact O-N 3.11Å; T2236-F2239 VanDerWaalsContact OG1-CD2 3.28Å; T2236-F2239 WeakPolarHBondContact OG1-CD2 3.49Å; T2236-F2239 VanDerWaalsContact OG1-CG 3.28Å; T2236-F2239 WeakPolarHBondContact OG1-CG 3.29Å; T2236-F2239 PolarHBondContact OG1-N 3Å; T2236-V2240 WeakPolarHBondContact O-CG2 3.48Å; T2236-V2240 PolarHBondContact O-N 3.24Å
2237	A	92.7	Very high	94	Very high	14.3333 Å²	14.3333	14.5 Å²	14.5	12%	0.118	10%	0.095	C	C	.	.	H	α-helix	trans	-56.5	-39.2	175.8	0	0	0	0	0	112.5	L2169 N2170 F2239 V2240 L2241	L2169-A2237 HydrophobicContact CB-CB 3.56Å; L2169-A2237 HydrophobicContact CD1-CB 4.49Å; L2169-A2237 WeakPolarHBondContact O-CA 3.49Å; L2169-A2237 PolarHBondContact O-N 2.95Å; N2170-A2237 WeakPolarHBondContact OD1-CB 3.35Å; N2170-A2237 PolarHBondContact OD1-N 3.09Å; N2170-A2237 VanDerWaalsContact OD1-N 3.1Å; A2237-F2239 VanDerWaalsContact C-N 3.31Å; A2237-F2239 PolarHBondContact O-N 3.22Å; A2237-V2240 PolarHBondContact O-N 2.79Å; A2237-L2241 WeakPolarHBondContact O-CB 3.35Å; A2237-L2241 VanDerWaalsContact O-CG 3.29Å; A2237-L2241 WeakPolarHBondContact O-CG 3.4Å; A2237-L2241 PolarHBondContact O-N 3.12Å
2238	A	91.5	Very high	93.9	Very high	47.6667 Å²	47.6667	12.4 Å²	12.4	39%	0.394	8%	0.081	S	C	.	.	H	α-helix	trans	-60.2	-36.9	177.8	0	0	0	0	0	113	T2236 N2242	T2236-A2238 VanDerWaalsContact C-N 3.25Å; T2236-A2238 PolarHBondContact O-N 3.16Å; A2238-N2242 VanDerWaalsContact O-CB 3.31Å; A2238-N2242 WeakPolarHBondContact O-CB 3.41Å; A2238-N2242 PolarHBondContact O-N 3.18Å; A2238-N2242 VanDerWaalsContact O-N 3.09Å
2239	F	93.7	Very high	93.9	Very high	38 Å²	38	12.5 Å²	12.5	17%	0.167	8%	0.083	C	C	.	.	H	α-helix	trans	-71.7	-41.2	176.8	-65.1	-14.3	0	0	0	112.2	T2232 H2233 T2236 A2237 N2242 Y2243 K2287	T2232-F2239 HydrophobicContact CG2-CE2 4.17Å; T2232-F2239 HydrophobicContact CG2-CZ 3.71Å; H2233-F2239 VanDerWaalsContact O-CE2 3.28Å; H2233-F2239 WeakPolarHBondContact O-CE2 3.18Å; T2236-F2239 HydrophobicContact CG2-CD2 4.35Å; T2236-F2239 HydrophobicContact CG2-CE2 4.32Å; T2236-F2239 PolarHBondContact O-N 3.25Å; T2236-F2239 VanDerWaalsContact O-N 3.11Å; T2236-F2239 VanDerWaalsContact OG1-CD2 3.28Å; T2236-F2239 WeakPolarHBondContact OG1-CD2 3.49Å; T2236-F2239 VanDerWaalsContact OG1-CG 3.28Å; T2236-F2239 WeakPolarHBondContact OG1-CG 3.29Å; T2236-F2239 PolarHBondContact OG1-N 3Å; A2237-F2239 VanDerWaalsContact C-N 3.31Å; A2237-F2239 PolarHBondContact O-N 3.22Å; F2239-N2242 PolarHBondContact O-N 2.86Å; F2239-Y2243 VanDerWaalsContact O-CD2 3.23Å; F2239-Y2243 WeakPolarHBondContact O-CD2 3.25Å; F2239-Y2243 PolarHBondContact O-N 2.9Å; F2239-K2287 HydrophobicContact CD1-CB 4.49Å; F2239-K2287 HydrophobicContact CD1-CD 4.24Å; F2239-K2287 HydrophobicContact CD2-CB 3.47Å; F2239-K2287 VanDerWaalsContact CD2-CB 3.45Å; F2239-K2287 HydrophobicContact CE2-CB 3.51Å; F2239-K2287 VanDerWaalsContact CE2-CB 3.5Å; F2239-K2287 HydrophobicContact CG-CB 4.17Å; F2239-K2287 HydrophobicContact CG-CD 4.29Å; F2239-K2287 HydrophobicContact CZ-CB 4.24Å
2240	V	95.5	Very high	93.8	Very high	1.33333 Å²	1.33333	12.9 Å²	12.9	1%	0.008	8%	0.084	C	C	.	.	H	α-helix	trans	-61.7	-48	176.4	179.7	0	0	0	0	110.4	L2169 Y2172 T2236 A2237 N2242 Y2243 L2244 I2290	L2169-V2240 HydrophobicContact CD2-CG1 4.14Å; Y2172-V2240 HydrophobicContact CD1-CG1 3.9Å; Y2172-V2240 HydrophobicContact CD1-CG2 3.9Å; Y2172-V2240 HydrophobicContact CD2-CG1 3.83Å; Y2172-V2240 HydrophobicContact CD2-CG2 4.26Å; Y2172-V2240 HydrophobicContact CE1-CG1 3.95Å; Y2172-V2240 HydrophobicContact CE1-CG2 4.48Å; Y2172-V2240 HydrophobicContact CE2-CG1 3.84Å; Y2172-V2240 HydrophobicContact CG-CB 4.45Å; Y2172-V2240 HydrophobicContact CG-CG1 3.84Å; Y2172-V2240 HydrophobicContact CG-CG2 3.73Å; T2236-V2240 WeakPolarHBondContact O-CG2 3.48Å; T2236-V2240 PolarHBondContact O-N 3.24Å; A2237-V2240 PolarHBondContact O-N 2.79Å; V2240-N2242 VanDerWaalsContact C-N 3.3Å; V2240-N2242 PolarHBondContact O-N 3.34Å; V2240-Y2243 PolarHBondContact O-N 3.25Å; V2240-L2244 HydrophobicContact CG1-CD1 3.92Å; V2240-L2244 WeakPolarHBondContact O-CB 3.27Å; V2240-L2244 WeakPolarHBondContact O-CG 3.25Å; V2240-L2244 PolarHBondContact O-N 3.03Å; V2240-I2290 HydrophobicContact CG2-CG2 4.21Å
2241	L	94.9	Very high	93.8	Very high	2.33333 Å²	2.33333	12.7 Å²	12.7	1%	0.012	8%	0.083	C	C	.	.	H	α-helix	trans	-64.5	-36	178.7	-67.8	170.4	0	0	0	112.6	L2169 A2237 L2244 L2245 F2250 V2253 F2254 L2257	L2169-L2241 HydrophobicContact CD1-CD1 4.23Å; L2169-L2241 HydrophobicContact CD1-CD2 3.75Å; L2169-L2241 HydrophobicContact CD1-CG 3.94Å; A2237-L2241 WeakPolarHBondContact O-CB 3.35Å; A2237-L2241 VanDerWaalsContact O-CG 3.29Å; A2237-L2241 WeakPolarHBondContact O-CG 3.4Å; A2237-L2241 PolarHBondContact O-N 3.12Å; L2241-L2244 CarbonylContact O-C 3.57Å; L2241-L2245 VanDerWaalsContact O-CA 3.27Å; L2241-L2245 WeakPolarHBondContact O-CA 3.45Å; L2241-L2245 WeakPolarHBondContact O-CB 3.27Å; L2241-L2245 PolarHBondContact O-N 3.19Å; L2241-F2250 HydrophobicContact CD2-CB 4.03Å; L2241-F2250 HydrophobicContact CD2-CD1 4.07Å; L2241-V2253 HydrophobicContact CD1-CG1 4.03Å; L2241-V2253 HydrophobicContact CD2-CB 3.93Å; L2241-V2253 HydrophobicContact CD2-CG1 3.75Å; L2241-F2254 HydrophobicContact CB-CB 4.29Å; L2241-F2254 HydrophobicContact CB-CD2 3.87Å; L2241-L2257 HydrophobicContact CD1-CD1 4.04Å; L2241-L2257 HydrophobicContact CD1-CD2 4.31Å
2242	N	94.8	Very high	93.9	Very high	31.3333 Å²	31.3333	11.4 Å²	11.4	17%	0.168	7%	0.069	C	C	.	.	H	α-helix	trans	-68.7	-41.6	175.9	-165.6	7.1	0	0	0	111.8	A2238 F2239 V2240 L2244 L2245 F2254 R2267 I2268 F2269	A2238-N2242 VanDerWaalsContact O-CB 3.31Å; A2238-N2242 WeakPolarHBondContact O-CB 3.41Å; A2238-N2242 PolarHBondContact O-N 3.18Å; A2238-N2242 VanDerWaalsContact O-N 3.09Å; F2239-N2242 PolarHBondContact O-N 2.86Å; V2240-N2242 VanDerWaalsContact C-N 3.3Å; V2240-N2242 PolarHBondContact O-N 3.34Å; N2242-L2244 PolarHBondContact O-N 2.78Å; N2242-L2245 WeakPolarHBondContact O-CB 3.28Å; N2242-F2254 HydrophobicContact CB-CE2 4.49Å; N2242-R2267 PolarHBondContact ND2-O 2.97Å; N2242-I2268 WeakPolarHBondContact OD1-CA 3.34Å; N2242-F2269 WeakPolarHBondContact O-CB 3.42Å; N2242-F2269 PolarHBondContact OD1-N 3.2Å
2243	Y	96.9	Very high	94	Very high	4.66667 Å²	4.66667	9.9 Å²	9.9	2%	0.018	6%	0.061	C	C	.	.	H	α-helix	trans	-63.5	-41.6	174.6	-75.3	-47.3	0	0	0	112.6	F2239 V2240 L2245 F2269 T2275 K2287 E2288 I2290 F2293 M2299	F2239-Y2243 VanDerWaalsContact O-CD2 3.23Å; F2239-Y2243 WeakPolarHBondContact O-CD2 3.25Å; F2239-Y2243 PolarHBondContact O-N 2.9Å; V2240-Y2243 PolarHBondContact O-N 3.25Å; Y2243-L2245 VanDerWaalsContact C-N 3.34Å; Y2243-F2269 HydrophobicContact CD1-CD1 4.07Å; Y2243-F2269 HydrophobicContact CD1-CD2 4.11Å; Y2243-F2269 HydrophobicContact CD1-CE1 4.19Å; Y2243-F2269 HydrophobicContact CD1-CE2 4.25Å; Y2243-F2269 AromaticContact CD1-CG 3.97Å; Y2243-F2269 HydrophobicContact CD1-CG 4.03Å; Y2243-F2269 HydrophobicContact CD1-CZ 4.29Å; Y2243-F2269 HydrophobicContact CE1-CD2 4.27Å; Y2243-F2269 HydrophobicContact CE1-CE2 4.25Å; Y2243-F2269 HydrophobicContact CE1-CZ 4.41Å; Y2243-T2275 HydrophobicContact CE1-CG2 4.27Å; Y2243-K2287 HydrophobicContact CE1-CD 4.37Å; Y2243-K2287 HydrophobicContact CE2-CD 4.12Å; Y2243-K2287 HydrophobicContact CE2-CG 4.34Å; Y2243-K2287 VanDerWaalsContact OH-CD 3.29Å; Y2243-K2287 WeakPolarHBondContact OH-CD 3.29Å; Y2243-K2287 VanDerWaalsContact OH-CG 3.31Å; Y2243-K2287 WeakPolarHBondContact OH-CG 3.35Å; Y2243-E2288 WeakPolarHBondContact CE2-O 3.48Å; Y2243-E2288 PolarHBondContact OH-O 2.87Å; Y2243-E2288 VanDerWaalsContact OH-O 3.12Å; Y2243-I2290 HydrophobicContact CD2-CD1 4.13Å; Y2243-I2290 HydrophobicContact CD2-CG1 4.16Å; Y2243-I2290 HydrophobicContact CD2-CG2 4.12Å; Y2243-I2290 HydrophobicContact CE2-CG2 4.41Å; Y2243-I2290 HydrophobicContact CG-CD1 4.25Å; Y2243-F2293 AromaticContact CD1-CE2 3.59Å; Y2243-F2293 HydrophobicContact CD1-CE2 3.59Å; Y2243-F2293 AromaticContact CD1-CZ 3.65Å; Y2243-F2293 HydrophobicContact CD1-CZ 3.65Å; Y2243-F2293 HydrophobicContact CD2-CE2 4.29Å; Y2243-F2293 AromaticContact CE1-CE2 3.71Å; Y2243-F2293 HydrophobicContact CE1-CE2 3.71Å; Y2243-F2293 AromaticContact CE1-CZ 3.54Å; Y2243-F2293 HydrophobicContact CE1-CZ 3.54Å; Y2243-F2293 VanDerWaalsContact CE1-CZ 3.43Å; Y2243-F2293 HydrophobicContact CE2-CE2 4.39Å; Y2243-F2293 AromaticContact CG-CE2 3.89Å; Y2243-F2293 HydrophobicContact CG-CE2 3.89Å; Y2243-F2293 HydrophobicContact CG-CZ 4.41Å; Y2243-M2299 WeakPolarHBondContact O-CE 3.16Å; Y2243-M2299 WeakPolarHBondContact O-CG 3.41Å
2244	L	96.4	Very high	93.8	Very high	1 Å²	1	10.3 Å²	10.3	1%	0.005	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	10.8	-175.9	-60.4	176.7	0	0	0	113.9	V2240 L2241 N2242 R2246 I2247 F2250 I2290 E2292 M2299	V2240-L2244 HydrophobicContact CG1-CD1 3.92Å; V2240-L2244 WeakPolarHBondContact O-CB 3.27Å; V2240-L2244 WeakPolarHBondContact O-CG 3.25Å; V2240-L2244 PolarHBondContact O-N 3.03Å; L2241-L2244 CarbonylContact O-C 3.57Å; N2242-L2244 PolarHBondContact O-N 2.78Å; L2244-R2246 PolarHBondContact O-N 3.05Å; L2244-I2247 PolarHBondContact O-N 3.05Å; L2244-F2250 HydrophobicContact CB-CB 3.9Å; L2244-F2250 HydrophobicContact CB-CD1 4.34Å; L2244-F2250 HydrophobicContact CB-CD2 3.7Å; L2244-F2250 HydrophobicContact CB-CE2 4.32Å; L2244-F2250 HydrophobicContact CB-CG 3.71Å; L2244-F2250 HydrophobicContact CD1-CD1 4.09Å; L2244-F2250 HydrophobicContact CD1-CD2 3.97Å; L2244-F2250 HydrophobicContact CD1-CE1 3.87Å; L2244-F2250 HydrophobicContact CD1-CE2 3.75Å; L2244-F2250 HydrophobicContact CD1-CG 4.13Å; L2244-F2250 HydrophobicContact CD1-CZ 3.69Å; L2244-F2250 HydrophobicContact CG-CD2 4.41Å; L2244-I2290 HydrophobicContact CD1-CD1 4.12Å; L2244-I2290 HydrophobicContact CD2-CD1 3.81Å; L2244-I2290 HydrophobicContact CG-CD1 3.76Å; L2244-E2292 HydrophobicContact CD2-CB 4.34Å; L2244-E2292 HydrophobicContact CD2-CG 4.09Å; L2244-M2299 HydrophobicContact CD2-CB 4.19Å; L2244-M2299 HydrophobicContact CD2-CE 4.11Å; L2244-M2299 HydrophobicContact CD2-CG 3.95Å; L2244-M2299 HydrophobicContact CD2-SD 4.09Å; L2244-M2299 VanDerWaalsContact CD2-SD 3.55Å; L2244-M2299 HydrophobicContact CG-SD 4.4Å
2245	L	94.8	Very high	93.5	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-30.2	-171	-178.8	62.5	0	0	0	114.9	L2241 N2242 Y2243 I2247 T2251 F2254 F2262 I2268 L2306 L2308	L2241-L2245 VanDerWaalsContact O-CA 3.27Å; L2241-L2245 WeakPolarHBondContact O-CA 3.45Å; L2241-L2245 WeakPolarHBondContact O-CB 3.27Å; L2241-L2245 PolarHBondContact O-N 3.19Å; N2242-L2245 WeakPolarHBondContact O-CB 3.28Å; Y2243-L2245 VanDerWaalsContact C-N 3.34Å; L2245-I2247 VanDerWaalsContact C-N 3.3Å; L2245-I2247 PolarHBondContact O-N 3.1Å; L2245-T2251 WeakPolarHBondContact O-CB 3.26Å; L2245-T2251 PolarHBondContact O-OG1 3.13Å; L2245-F2254 HydrophobicContact CD1-CB 3.84Å; L2245-F2254 HydrophobicContact CD1-CD1 3.38Å; L2245-F2254 VanDerWaalsContact CD1-CD1 3.48Å; L2245-F2254 HydrophobicContact CD1-CD2 4.04Å; L2245-F2254 HydrophobicContact CD1-CE1 3.83Å; L2245-F2254 HydrophobicContact CD1-CE2 4.37Å; L2245-F2254 HydrophobicContact CD1-CG 3.48Å; L2245-F2254 VanDerWaalsContact CD1-CG 3.45Å; L2245-F2254 HydrophobicContact CD1-CZ 4.32Å; L2245-F2254 HydrophobicContact CD2-CE1 4.45Å; L2245-F2262 HydrophobicContact CD1-CD1 4.14Å; L2245-F2262 HydrophobicContact CD1-CE1 4.09Å; L2245-F2262 HydrophobicContact CD2-CD1 4.44Å; L2245-I2268 HydrophobicContact CD2-CB 4.42Å; L2245-I2268 HydrophobicContact CD2-CD1 4.08Å; L2245-I2268 HydrophobicContact CD2-CG1 4.03Å; L2245-I2268 HydrophobicContact CD2-CG2 3.62Å; L2245-I2268 VanDerWaalsContact CD2-CG2 3.49Å; L2245-L2306 WeakPolarHBondContact O-CD1 3.29Å; L2245-L2308 HydrophobicContact CD2-CD2 4.04Å; L2245-L2308 HydrophobicContact CG-CD2 4.42Å
2246	R	94.4	Very high	93.1	Very high	0.333333 Å²	0.333333	12.8 Å²	12.8	0%	0.001	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-9.5	-177.4	-73	135.3	-178.7	104.4	-0.2	114.1	L2244 F2269 E2301 N2302 N2304 L2308 D2318	L2244-R2246 PolarHBondContact O-N 3.05Å; R2246-F2269 VanDerWaalsContact CZ-O 3.25Å; R2246-F2269 PolarHBondContact NH1-O 3.03Å; R2246-F2269 PolarHBondContact NH2-O 3.13Å; R2246-E2301 VanDerWaalsContact CB-O 3.27Å; R2246-E2301 WeakPolarHBondContact CB-O 3.34Å; R2246-E2301 WeakPolarHBondContact CG-O 3.35Å; R2246-N2302 HydrophobicContact CG-CB 4.48Å; R2246-N2304 PolarHBondContact O-ND2 3.48Å; R2246-L2308 HydrophobicContact CG-CD1 4.19Å; R2246-D2318 VanDerWaalsContact CZ-O 3.26Å; R2246-D2318 PolarHBondContact NE-O 3.22Å; R2246-D2318 PolarHBondContact NH2-O 3.04Å
2247	I	95	Very high	92.7	Very high	3.33333 Å²	3.33333	17.1 Å²	17.1	2%	0.017	10%	0.098	C	C	.	.	S	Bend	trans	-114.9	122.9	-169.9	-57.1	-65.2	0	0	0	109.1	L1884 L1897 L2244 L2245 F2250 T2251 F2296 E2298	L1884-I2247 HydrophobicContact CB-CG2 3.85Å; L1897-I2247 HydrophobicContact CD2-CD1 4.45Å; L1897-I2247 HydrophobicContact CD2-CG2 4.47Å; L2244-I2247 PolarHBondContact O-N 3.05Å; L2245-I2247 VanDerWaalsContact C-N 3.3Å; L2245-I2247 PolarHBondContact O-N 3.1Å; I2247-F2250 HydrophobicContact CB-CD2 4.31Å; I2247-F2250 HydrophobicContact CG2-CD2 4.22Å; I2247-F2250 HydrophobicContact CG2-CE2 4.4Å; I2247-F2250 WeakPolarHBondContact O-CA 3.37Å; I2247-F2250 VanDerWaalsContact O-CB 3.29Å; I2247-F2250 WeakPolarHBondContact O-CB 3.3Å; I2247-F2250 WeakPolarHBondContact O-CD2 3.3Å; I2247-F2250 PolarHBondContact O-N 3.02Å; I2247-T2251 PolarHBondContact O-N 2.99Å; I2247-T2251 PolarHBondContact O-OG1 3.15Å; I2247-F2296 HydrophobicContact CD1-CE1 4.2Å; I2247-F2296 HydrophobicContact CD1-CZ 4.28Å; I2247-F2296 HydrophobicContact CG1-CE1 4.03Å; I2247-F2296 HydrophobicContact CG1-CZ 4.46Å; I2247-F2296 HydrophobicContact CG2-CE1 4.31Å; I2247-F2296 HydrophobicContact CG2-CZ 4.41Å; I2247-E2298 HydrophobicContact CD1-CB 4.3Å
2248	E	93.2	Very high	92.2	Very high	2 Å²	2	20.3 Å²	20.3	1%	0.009	11%	0.11	C	C	.	.	B	Isolated β-bridge	trans	-71.7	140.7	169.3	-71.7	-79.1	-139.7	0	0	109.8	R1883 L1884 Y1906 Y2054 T2251 T2252	R1883-E2248 CarbonylContact C-O 3.56Å; R1883-E2248 VanDerWaalsContact CA-O 3.27Å; R1883-E2248 WeakPolarHBondContact CA-O 3.34Å; R1883-E2248 HydrophobicContact CB-CB 3.76Å; R1883-E2248 WeakPolarHBondContact CB-O 3.4Å; L1884-E2248 PolarHBondContact N-O 3.05Å; Y1906-E2248 VanDerWaalsContact CE2-OE1 3.29Å; Y1906-E2248 WeakPolarHBondContact CE2-OE1 3.33Å; Y1906-E2248 PolarHBondContact OH-OE1 3.12Å; Y2054-E2248 HydrophobicContact CE1-CB 4.41Å; Y2054-E2248 PolarHBondContact OH-OE1 2.93Å; E2248-T2251 WeakPolarHBondContact OE2-CB 3.39Å; E2248-T2252 PolarHBondContact OE1-OG1 3.02Å; E2248-T2252 WeakPolarHBondContact OE2-CB 3.34Å; E2248-T2252 PolarHBondContact OE2-N 3.21Å; E2248-T2252 PolarHBondContact OE2-OG1 3.22Å
2249	P	92.6	Very high	91.6	Very high	10.6667 Å²	10.6667	21.3 Å²	21.3	7%	0.069	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	cis	-88.5	-0.1	11.7	36	-37.9	0	0	0	115.5	L2018 Y2054 T2251 T2252 V2253	L2018-P2249 HydrophobicContact CD1-CB 3.99Å; L2018-P2249 HydrophobicContact CD1-CG 3.48Å; L2018-P2249 VanDerWaalsContact CD1-CG 3.47Å; L2018-P2249 HydrophobicContact CD2-CG 3.96Å; L2018-P2249 HydrophobicContact CG-CG 4.26Å; Y2054-P2249 HydrophobicContact CD1-CB 3.8Å; Y2054-P2249 HydrophobicContact CD2-CB 3.91Å; Y2054-P2249 HydrophobicContact CE1-CB 4.34Å; Y2054-P2249 HydrophobicContact CE2-CB 4.44Å; Y2054-P2249 HydrophobicContact CG-CB 3.51Å; Y2054-P2249 VanDerWaalsContact CG-CB 3.48Å; P2249-T2251 VanDerWaalsContact C-N 3.28Å; P2249-T2251 PolarHBondContact O-N 2.98Å; P2249-T2252 WeakPolarHBondContact O-CB 3.33Å; P2249-T2252 PolarHBondContact O-N 3.1Å; P2249-T2252 VanDerWaalsContact O-N 3.12Å; P2249-V2253 WeakPolarHBondContact O-CG2 3.3Å; P2249-V2253 PolarHBondContact O-N 3.04Å
2250	F	94.5	Very high	90.9	Very high	9.33333 Å²	9.33333	20.9 Å²	20.9	4%	0.041	13%	0.132	C	C	.	.	H	α-helix	trans	-65.4	-30.3	-173.9	-51.5	-78.4	0	0	0	112.6	L1884 L2018 L2169 L2241 L2244 I2247 V2253 F2254	L1884-F2250 HydrophobicContact CD2-CE2 3.77Å; L1884-F2250 HydrophobicContact CD2-CZ 4.23Å; L2018-F2250 HydrophobicContact CD2-CD1 4.41Å; L2018-F2250 HydrophobicContact CD2-CE1 4.05Å; L2018-F2250 HydrophobicContact CD2-CZ 4.24Å; L2169-F2250 HydrophobicContact CD2-CD1 4.47Å; L2169-F2250 HydrophobicContact CD2-CE1 4.22Å; L2241-F2250 HydrophobicContact CD2-CB 4.03Å; L2241-F2250 HydrophobicContact CD2-CD1 4.07Å; L2244-F2250 HydrophobicContact CB-CB 3.9Å; L2244-F2250 HydrophobicContact CB-CD1 4.34Å; L2244-F2250 HydrophobicContact CB-CD2 3.7Å; L2244-F2250 HydrophobicContact CB-CE2 4.32Å; L2244-F2250 HydrophobicContact CB-CG 3.71Å; L2244-F2250 HydrophobicContact CD1-CD1 4.09Å; L2244-F2250 HydrophobicContact CD1-CD2 3.97Å; L2244-F2250 HydrophobicContact CD1-CE1 3.87Å; L2244-F2250 HydrophobicContact CD1-CE2 3.75Å; L2244-F2250 HydrophobicContact CD1-CG 4.13Å; L2244-F2250 HydrophobicContact CD1-CZ 3.69Å; L2244-F2250 HydrophobicContact CG-CD2 4.41Å; I2247-F2250 HydrophobicContact CB-CD2 4.31Å; I2247-F2250 HydrophobicContact CG2-CD2 4.22Å; I2247-F2250 HydrophobicContact CG2-CE2 4.4Å; I2247-F2250 WeakPolarHBondContact O-CA 3.37Å; I2247-F2250 VanDerWaalsContact O-CB 3.29Å; I2247-F2250 WeakPolarHBondContact O-CB 3.3Å; I2247-F2250 WeakPolarHBondContact O-CD2 3.3Å; I2247-F2250 PolarHBondContact O-N 3.02Å; F2250-V2253 PolarHBondContact O-N 3.14Å; F2250-F2254 VanDerWaalsContact O-CB 3.24Å; F2250-F2254 WeakPolarHBondContact O-CB 3.4Å; F2250-F2254 PolarHBondContact O-N 3.02Å
2251	T	93.1	Very high	90.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-57.6	-51.5	170.1	-43.1	0	0	0	0	111.4	Y1906 L2245 I2247 E2248 P2249 V2253 F2254 L2255 F2262 L2306	Y1906-T2251 HydrophobicContact CD2-CG2 4.09Å; Y1906-T2251 HydrophobicContact CE2-CG2 4.07Å; L2245-T2251 WeakPolarHBondContact O-CB 3.26Å; L2245-T2251 PolarHBondContact O-OG1 3.13Å; I2247-T2251 PolarHBondContact O-N 2.99Å; I2247-T2251 PolarHBondContact O-OG1 3.15Å; E2248-T2251 WeakPolarHBondContact OE2-CB 3.39Å; P2249-T2251 VanDerWaalsContact C-N 3.28Å; P2249-T2251 PolarHBondContact O-N 2.98Å; T2251-V2253 PolarHBondContact O-N 2.85Å; T2251-F2254 PolarHBondContact O-N 3.15Å; T2251-L2255 HydrophobicContact CG2-CD1 4.35Å; T2251-L2255 WeakPolarHBondContact O-CB 3.4Å; T2251-L2255 VanDerWaalsContact O-CG 3.31Å; T2251-L2255 WeakPolarHBondContact O-CG 3.3Å; T2251-L2255 PolarHBondContact O-N 3.31Å; T2251-F2262 HydrophobicContact CG2-CE1 3.97Å; T2251-F2262 HydrophobicContact CG2-CZ 4.13Å; T2251-L2306 HydrophobicContact CG2-CD1 3.65Å; T2251-L2306 HydrophobicContact CG2-CD2 3.99Å; T2251-L2306 HydrophobicContact CG2-CG 4.47Å
2252	T	91.6	Very high	89.9	Confident	3.33333 Å²	3.33333	25.5 Å²	25.5	2%	0.02	15%	0.152	C	C	.	.	H	α-helix	trans	-61.8	-43.9	178.3	-55.5	0	0	0	0	112.1	Y1906 R2050 V2051 Y2054 E2248 P2249 L2255 N2256	Y1906-T2252 PolarHBondContact OH-OG1 3.26Å; R2050-T2252 HydrophobicContact CB-CG2 3.9Å; V2051-T2252 HydrophobicContact CG2-CG2 3.89Å; Y2054-T2252 HydrophobicContact CD2-CG2 4.24Å; Y2054-T2252 HydrophobicContact CE2-CG2 4.06Å; Y2054-T2252 VanDerWaalsContact CE2-OG1 3.28Å; Y2054-T2252 WeakPolarHBondContact CE2-OG1 3.39Å; E2248-T2252 PolarHBondContact OE1-OG1 3.02Å; E2248-T2252 WeakPolarHBondContact OE2-CB 3.34Å; E2248-T2252 PolarHBondContact OE2-N 3.21Å; E2248-T2252 PolarHBondContact OE2-OG1 3.22Å; P2249-T2252 WeakPolarHBondContact O-CB 3.33Å; P2249-T2252 PolarHBondContact O-N 3.1Å; P2249-T2252 VanDerWaalsContact O-N 3.12Å; T2252-L2255 PolarHBondContact O-N 2.87Å; T2252-N2256 PolarHBondContact O-N 3.16Å
2253	V	90.9	Very high	89.5	Confident	11.6667 Å²	11.6667	25.6 Å²	25.6	7%	0.071	15%	0.152	C	C	.	.	H	α-helix	trans	-66.5	-40.1	179.9	177.1	0	0	0	0	111.4	L2018 V2051 L2169 L2241 P2249 F2250 T2251 L2255 N2256 L2257	L2018-V2253 HydrophobicContact CB-CG2 4.27Å; L2018-V2253 HydrophobicContact CD1-CG2 4.33Å; L2018-V2253 VanDerWaalsContact O-CG1 3.26Å; L2018-V2253 WeakPolarHBondContact O-CG1 3.38Å; V2051-V2253 HydrophobicContact CG1-CG2 4.22Å; V2051-V2253 HydrophobicContact CG2-CG2 4.45Å; L2169-V2253 HydrophobicContact CD1-CG1 4.28Å; L2241-V2253 HydrophobicContact CD1-CG1 4.03Å; L2241-V2253 HydrophobicContact CD2-CB 3.93Å; L2241-V2253 HydrophobicContact CD2-CG1 3.75Å; P2249-V2253 WeakPolarHBondContact O-CG2 3.3Å; P2249-V2253 PolarHBondContact O-N 3.04Å; F2250-V2253 PolarHBondContact O-N 3.14Å; T2251-V2253 PolarHBondContact O-N 2.85Å; V2253-L2255 PolarHBondContact O-N 2.84Å; V2253-N2256 PolarHBondContact O-N 3.15Å; V2253-L2257 PolarHBondContact O-N 3.01Å
2254	F	91.3	Very high	89	Confident	8 Å²	8	27.9 Å²	27.9	4%	0.035	16%	0.163	C	C	.	.	H	α-helix	trans	-62.3	-45.4	174.3	-178.3	-87.9	0	0	0	111.7	L2241 N2242 L2245 F2250 T2251 N2256 L2257 Q2258 F2262 D2263	L2241-F2254 HydrophobicContact CB-CB 4.29Å; L2241-F2254 HydrophobicContact CB-CD2 3.87Å; N2242-F2254 HydrophobicContact CB-CE2 4.49Å; L2245-F2254 HydrophobicContact CD1-CB 3.84Å; L2245-F2254 HydrophobicContact CD1-CD1 3.38Å; L2245-F2254 VanDerWaalsContact CD1-CD1 3.48Å; L2245-F2254 HydrophobicContact CD1-CD2 4.04Å; L2245-F2254 HydrophobicContact CD1-CE1 3.83Å; L2245-F2254 HydrophobicContact CD1-CE2 4.37Å; L2245-F2254 HydrophobicContact CD1-CG 3.48Å; L2245-F2254 VanDerWaalsContact CD1-CG 3.45Å; L2245-F2254 HydrophobicContact CD1-CZ 4.32Å; L2245-F2254 HydrophobicContact CD2-CE1 4.45Å; F2250-F2254 VanDerWaalsContact O-CB 3.24Å; F2250-F2254 WeakPolarHBondContact O-CB 3.4Å; F2250-F2254 PolarHBondContact O-N 3.02Å; T2251-F2254 PolarHBondContact O-N 3.15Å; F2254-N2256 VanDerWaalsContact C-N 3.31Å; F2254-N2256 PolarHBondContact O-N 3.17Å; F2254-L2257 WeakPolarHBondContact O-CB 3.11Å; F2254-L2257 PolarHBondContact O-N 3.17Å; F2254-Q2258 HydrophobicContact CD1-CG 4.26Å; F2254-Q2258 HydrophobicContact CE1-CG 3.91Å; F2254-Q2258 HydrophobicContact CE2-CG 4.32Å; F2254-Q2258 HydrophobicContact CZ-CG 4.04Å; F2254-Q2258 WeakPolarHBondContact O-CB 3.25Å; F2254-Q2258 WeakPolarHBondContact O-CG 3.34Å; F2254-Q2258 PolarHBondContact O-N 3.15Å; F2254-F2262 HydrophobicContact CD1-CD1 4.43Å; F2254-F2262 HydrophobicContact CE1-CD1 4.39Å; F2254-D2263 HydrophobicContact CE1-CB 4.25Å; F2254-D2263 HydrophobicContact CZ-CB 3.77Å
2255	L	88.7	Confident	88.5	Confident	4.66667 Å²	4.66667	28.1 Å²	28.1	2%	0.024	16%	0.164	C	C	.	.	H	α-helix	trans	-61.8	-39	176.7	-72.2	173.9	0	0	0	111.7	Y1906 T2251 T2252 V2253 L2257 Q2258 G2259 G2260 K2261 F2262	Y1906-L2255 HydrophobicContact CD1-CD1 3.31Å; Y1906-L2255 HydrophobicContact CD2-CD1 4.1Å; Y1906-L2255 HydrophobicContact CE1-CD1 3.65Å; Y1906-L2255 HydrophobicContact CE2-CD1 4.37Å; Y1906-L2255 HydrophobicContact CG-CD1 3.56Å; T2251-L2255 HydrophobicContact CG2-CD1 4.35Å; T2251-L2255 WeakPolarHBondContact O-CB 3.4Å; T2251-L2255 VanDerWaalsContact O-CG 3.31Å; T2251-L2255 WeakPolarHBondContact O-CG 3.3Å; T2251-L2255 PolarHBondContact O-N 3.31Å; T2252-L2255 PolarHBondContact O-N 2.87Å; V2253-L2255 PolarHBondContact O-N 2.84Å; L2255-L2257 VanDerWaalsContact C-N 3.33Å; L2255-L2257 PolarHBondContact O-N 3.38Å; L2255-Q2258 CarbonylContact O-C 3.55Å; L2255-Q2258 PolarHBondContact O-N 3.13Å; L2255-G2259 PolarHBondContact O-N 2.9Å; L2255-G2260 VanDerWaalsContact O-CA 3.32Å; L2255-G2260 WeakPolarHBondContact O-CA 3.45Å; L2255-G2260 PolarHBondContact O-N 3.17Å; L2255-K2261 VanDerWaalsContact CD2-C 3.42Å; L2255-K2261 WeakPolarHBondContact CD2-O 3.27Å; L2255-F2262 HydrophobicContact CD1-CE1 4.33Å; L2255-F2262 HydrophobicContact CD1-CZ 4.15Å; L2255-F2262 HydrophobicContact CD2-CD1 3.77Å; L2255-F2262 HydrophobicContact CD2-CD2 4.26Å; L2255-F2262 HydrophobicContact CD2-CE1 3.78Å; L2255-F2262 HydrophobicContact CD2-CE2 4.27Å; L2255-F2262 HydrophobicContact CD2-CG 4.02Å; L2255-F2262 HydrophobicContact CD2-CZ 4.03Å; L2255-F2262 HydrophobicContact CG-CD1 4.48Å; L2255-F2262 HydrophobicContact CG-CE1 4.11Å; L2255-F2262 HydrophobicContact CG-CZ 4.39Å
2256	N	86.4	Confident	88.1	Confident	65 Å²	65	30.1 Å²	30.1	35%	0.348	18%	0.175	S	C	.	.	H	α-helix	trans	-62.1	-48.3	174.3	-175.3	-36.9	0	0	0	111.5	D2048 V2051 T2252 V2253 F2254 Q2258 G2259	D2048-N2256 VanDerWaalsContact CB-ND2 3.34Å; D2048-N2256 WeakPolarHBondContact CB-ND2 3.36Å; V2051-N2256 HydrophobicContact CG2-CB 3.76Å; V2051-N2256 WeakPolarHBondContact CG2-ND2 3.39Å; T2252-N2256 PolarHBondContact O-N 3.16Å; V2253-N2256 PolarHBondContact O-N 3.15Å; F2254-N2256 VanDerWaalsContact C-N 3.31Å; F2254-N2256 PolarHBondContact O-N 3.17Å; N2256-Q2258 VanDerWaalsContact C-N 3.29Å; N2256-Q2258 PolarHBondContact O-N 2.93Å; N2256-G2259 PolarHBondContact O-N 2.97Å
2257	L	83.7	Confident	87.9	Confident	100.667 Å²	100.667	37.3 Å²	37.3	53%	0.527	20%	0.202	S	C	.	.	H	α-helix	trans	-58.4	-35.8	178.2	-166.2	106.7	0	0	0	112.6	L2241 V2253 F2254 L2255	L2241-L2257 HydrophobicContact CD1-CD1 4.04Å; L2241-L2257 HydrophobicContact CD1-CD2 4.31Å; V2253-L2257 PolarHBondContact O-N 3.01Å; F2254-L2257 WeakPolarHBondContact O-CB 3.11Å; F2254-L2257 PolarHBondContact O-N 3.17Å; L2255-L2257 VanDerWaalsContact C-N 3.33Å; L2255-L2257 PolarHBondContact O-N 3.38Å
2258	Q	81.9	Confident	87.8	Confident	80 Å²	80	37.3 Å²	37.3	37%	0.374	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	20.1	-176.9	-84.5	-33.3	-4.8	0	0	114.4	F2254 L2255 N2256 G2260 K2261	F2254-Q2258 HydrophobicContact CD1-CG 4.26Å; F2254-Q2258 HydrophobicContact CE1-CG 3.91Å; F2254-Q2258 HydrophobicContact CE2-CG 4.32Å; F2254-Q2258 HydrophobicContact CZ-CG 4.04Å; F2254-Q2258 WeakPolarHBondContact O-CB 3.25Å; F2254-Q2258 WeakPolarHBondContact O-CG 3.34Å; F2254-Q2258 PolarHBondContact O-N 3.15Å; L2255-Q2258 CarbonylContact O-C 3.55Å; L2255-Q2258 PolarHBondContact O-N 3.13Å; N2256-Q2258 VanDerWaalsContact C-N 3.29Å; N2256-Q2258 PolarHBondContact O-N 2.93Å; Q2258-G2260 VanDerWaalsContact C-N 3.32Å; Q2258-G2260 PolarHBondContact O-N 3.05Å; Q2258-K2261 WeakPolarHBondContact CB-O 3.29Å
2259	G	78.7	Confident	87.9	Confident	69 Å²	69	37.4 Å²	37.4	71%	0.711	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	71	29	173.3	0	0	0	0	0	114.8	L2255 N2256	L2255-G2259 PolarHBondContact O-N 2.9Å; N2256-G2259 PolarHBondContact O-N 2.97Å
2260	G	80.4	Confident	88	Confident	29.6667 Å²	29.6667	37.9 Å²	37.9	31%	0.306	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	10	173.9	0	0	0	0	0	115.7	S1909 L2255 Q2258	S1909-G2260 WeakPolarHBondContact CB-O 3.24Å; S1909-G2260 PolarHBondContact OG-O 3.01Å; L2255-G2260 VanDerWaalsContact O-CA 3.32Å; L2255-G2260 WeakPolarHBondContact O-CA 3.45Å; L2255-G2260 PolarHBondContact O-N 3.17Å; Q2258-G2260 VanDerWaalsContact C-N 3.32Å; Q2258-G2260 PolarHBondContact O-N 3.05Å
2261	K	82.2	Confident	88	Confident	94.3333 Å²	94.3333	37.9 Å²	37.9	41%	0.41	21%	0.205	S	C	.	.	S	Bend	trans	-131.5	157.3	179.7	-67.4	-172.8	178.2	-170.6	0	112.1	S1909 A1910 F1911 Y1912 L2255 Q2258	S1909-K2261 WeakPolarHBondContact O-CA 3.49Å; A1910-K2261 VanDerWaalsContact O-CD 3.24Å; A1910-K2261 WeakPolarHBondContact O-CD 3.39Å; A1910-K2261 WeakPolarHBondContact O-CE 3.42Å; A1910-K2261 PolarHBondContact O-NZ 2.61Å; F1911-K2261 PolarHBondContact O-NZ 3.09Å; Y1912-K2261 HydrophobicContact CD2-CD 3.81Å; Y1912-K2261 HydrophobicContact CE1-CD 4.42Å; Y1912-K2261 HydrophobicContact CE2-CD 3.66Å; Y1912-K2261 HydrophobicContact CG-CD 4.27Å; L2255-K2261 VanDerWaalsContact CD2-C 3.42Å; L2255-K2261 WeakPolarHBondContact CD2-O 3.27Å; Q2258-K2261 WeakPolarHBondContact CB-O 3.29Å
2262	F	86.7	Confident	88.2	Confident	7.33333 Å²	7.33333	37.9 Å²	37.9	3%	0.032	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-69.2	152.5	168.1	-65.5	-67.4	0	0	0	111	S1909 F1911 L2245 T2251 F2254 L2255 I2268 L2306 L2308	S1909-F2262 PolarHBondContact O-N 3.11Å; F1911-F2262 HydrophobicContact CE1-CB 3.99Å; F1911-F2262 WeakPolarHBondContact CE2-O 3.37Å; F1911-F2262 HydrophobicContact CZ-CB 4.07Å; L2245-F2262 HydrophobicContact CD1-CD1 4.14Å; L2245-F2262 HydrophobicContact CD1-CE1 4.09Å; L2245-F2262 HydrophobicContact CD2-CD1 4.44Å; T2251-F2262 HydrophobicContact CG2-CE1 3.97Å; T2251-F2262 HydrophobicContact CG2-CZ 4.13Å; F2254-F2262 HydrophobicContact CD1-CD1 4.43Å; F2254-F2262 HydrophobicContact CE1-CD1 4.39Å; L2255-F2262 HydrophobicContact CD1-CE1 4.33Å; L2255-F2262 HydrophobicContact CD1-CZ 4.15Å; L2255-F2262 HydrophobicContact CD2-CD1 3.77Å; L2255-F2262 HydrophobicContact CD2-CD2 4.26Å; L2255-F2262 HydrophobicContact CD2-CE1 3.78Å; L2255-F2262 HydrophobicContact CD2-CE2 4.27Å; L2255-F2262 HydrophobicContact CD2-CG 4.02Å; L2255-F2262 HydrophobicContact CD2-CZ 4.03Å; L2255-F2262 HydrophobicContact CG-CD1 4.48Å; L2255-F2262 HydrophobicContact CG-CE1 4.11Å; L2255-F2262 HydrophobicContact CG-CZ 4.39Å; F2262-I2268 HydrophobicContact CB-CD1 4.29Å; F2262-L2306 HydrophobicContact CZ-CB 4.4Å; F2262-L2306 HydrophobicContact CZ-CD2 4.46Å; F2262-L2308 HydrophobicContact CD1-CD2 3.83Å; F2262-L2308 HydrophobicContact CD2-CD2 4.42Å; F2262-L2308 HydrophobicContact CE1-CD2 3.73Å; F2262-L2308 HydrophobicContact CE2-CD2 4.33Å; F2262-L2308 HydrophobicContact CG-CD2 4.19Å; F2262-L2308 HydrophobicContact CZ-CD2 4Å
2263	D	85.5	Confident	88.4	Confident	31.6667 Å²	31.6667	39.1 Å²	39.1	17%	0.169	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-75.1	170.5	173.7	-167.3	21.4	0	0	0	110.9	F1911 F2254 R2267 I2268	F1911-D2263 WeakPolarHBondContact CE1-O 3.33Å; F2254-D2263 HydrophobicContact CE1-CB 4.25Å; F2254-D2263 HydrophobicContact CZ-CB 3.77Å; D2263-R2267 VanDerWaalsContact CG-NE 3.33Å; D2263-R2267 IonicContact OD1-CZ 3.1Å; D2263-R2267 VanDerWaalsContact OD1-CZ 3.22Å; D2263-R2267 IonicContact OD1-NE 2.83Å; D2263-R2267 PolarHBondContact OD1-NE 3.12Å; D2263-R2267 IonicContact OD1-NH1 2.77Å; D2263-R2267 IonicContact OD1-NH2 3.62Å; D2263-R2267 PolarHBondContact OD1-NH2 3.09Å; D2263-R2267 VanDerWaalsContact OD2-CB 3.32Å; D2263-R2267 WeakPolarHBondContact OD2-CB 3.47Å; D2263-R2267 IonicContact OD2-CZ 2.92Å; D2263-R2267 IonicContact OD2-NE 3.35Å; D2263-R2267 PolarHBondContact OD2-NE 3.01Å; D2263-R2267 IonicContact OD2-NH2 3.16Å; D2263-I2268 HydrophobicContact CB-CG1 4.33Å; D2263-I2268 VanDerWaalsContact O-CD1 3.23Å; D2263-I2268 WeakPolarHBondContact O-CD1 3.4Å; D2263-I2268 WeakPolarHBondContact O-CG1 3.45Å
2264	H	86.2	Confident	88.6	Confident	53.6667 Å²	53.6667	42 Å²	42	25%	0.248	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-53.1	135	179.9	-156.1	-92.7	0	0	0	111.4	D2266 R2267 I2268 D2312	H2264-D2266 VanDerWaalsContact C-N 3.27Å; H2264-D2266 IonicContact CE1-OD2 3.4Å; H2264-D2266 PolarHBondContact CE1-OD2 2.94Å; H2264-D2266 VanDerWaalsContact CE1-OD2 3.27Å; H2264-D2266 PolarHBondContact ND1-N 3.2Å; H2264-D2266 IonicContact ND1-OD2 2.76Å; H2264-D2266 PolarHBondContact ND1-OD2 3.25Å; H2264-D2266 PolarHBondContact O-N 3.02Å; H2264-D2266 VanDerWaalsContact O-N 3.11Å; H2264-R2267 HydrophobicContact CB-CB 4.49Å; H2264-R2267 HydrophobicContact CB-CG 4.32Å; H2264-R2267 WeakPolarHBondContact O-CA 3.34Å; H2264-R2267 WeakPolarHBondContact O-CB 3.41Å; H2264-R2267 PolarHBondContact O-N 2.95Å; H2264-I2268 PolarHBondContact O-N 3.41Å; H2264-I2268 VanDerWaalsContact O-N 3.09Å; H2264-D2312 IonicContact CE1-OD1 3.28Å; H2264-D2312 IonicContact CE1-OD2 3.01Å
2265	P	86.9	Confident	88.8	Confident	4.66667 Å²	4.66667	42.2 Å²	42.2	3%	0.03	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-37.6	-175.6	-31.2	38.8	0	0	0	114.4	F1911 R2267 I2268 V2310 T2311 V2317	F1911-P2265 HydrophobicContact CD1-CG 4.35Å; F1911-P2265 HydrophobicContact CE1-CG 3.79Å; F1911-P2265 HydrophobicContact CE2-CG 4.31Å; F1911-P2265 HydrophobicContact CZ-CG 3.79Å; P2265-R2267 VanDerWaalsContact C-N 3.28Å; P2265-R2267 PolarHBondContact O-N 3.3Å; P2265-I2268 WeakPolarHBondContact O-CB 3.2Å; P2265-I2268 PolarHBondContact O-N 2.89Å; P2265-V2310 WeakPolarHBondContact CB-O 3.18Å; P2265-V2310 WeakPolarHBondContact CG-O 3.3Å; P2265-T2311 HydrophobicContact CB-CG2 4.22Å; P2265-V2317 HydrophobicContact CB-CG2 3.84Å
2266	D	87.3	Confident	89.2	Confident	43.3333 Å²	43.3333	43.3 Å²	43.3	23%	0.232	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-17.7	176.4	-59.5	-87.5	0	0	0	115.2	H2264 T2311 D2312	H2264-D2266 VanDerWaalsContact C-N 3.27Å; H2264-D2266 IonicContact CE1-OD2 3.4Å; H2264-D2266 PolarHBondContact CE1-OD2 2.94Å; H2264-D2266 VanDerWaalsContact CE1-OD2 3.27Å; H2264-D2266 PolarHBondContact ND1-N 3.2Å; H2264-D2266 IonicContact ND1-OD2 2.76Å; H2264-D2266 PolarHBondContact ND1-OD2 3.25Å; H2264-D2266 PolarHBondContact O-N 3.02Å; H2264-D2266 VanDerWaalsContact O-N 3.11Å; D2266-T2311 WeakPolarHBondContact OD1-CB 3.4Å; D2266-T2311 WeakPolarHBondContact OD2-CA 3.33Å; D2266-D2312 PolarHBondContact OD1-N 3.36Å; D2266-D2312 VanDerWaalsContact OD1-N 3.17Å; D2266-D2312 PolarHBondContact OD2-N 3.11Å; D2266-D2312 VanDerWaalsContact OD2-N 3.14Å
2267	R	89.3	Confident	89.6	Confident	150 Å²	150	44.1 Å²	44.1	57%	0.566	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-20.3	174.8	-67.1	-167.5	-77.8	-124.8	5.3	112.8	N2242 D2263 H2264 P2265	N2242-R2267 PolarHBondContact ND2-O 2.97Å; D2263-R2267 VanDerWaalsContact CG-NE 3.33Å; D2263-R2267 IonicContact OD1-CZ 3.1Å; D2263-R2267 VanDerWaalsContact OD1-CZ 3.22Å; D2263-R2267 IonicContact OD1-NE 2.83Å; D2263-R2267 PolarHBondContact OD1-NE 3.12Å; D2263-R2267 IonicContact OD1-NH1 2.77Å; D2263-R2267 IonicContact OD1-NH2 3.62Å; D2263-R2267 PolarHBondContact OD1-NH2 3.09Å; D2263-R2267 VanDerWaalsContact OD2-CB 3.32Å; D2263-R2267 WeakPolarHBondContact OD2-CB 3.47Å; D2263-R2267 IonicContact OD2-CZ 2.92Å; D2263-R2267 IonicContact OD2-NE 3.35Å; D2263-R2267 PolarHBondContact OD2-NE 3.01Å; D2263-R2267 IonicContact OD2-NH2 3.16Å; H2264-R2267 HydrophobicContact CB-CB 4.49Å; H2264-R2267 HydrophobicContact CB-CG 4.32Å; H2264-R2267 WeakPolarHBondContact O-CA 3.34Å; H2264-R2267 WeakPolarHBondContact O-CB 3.41Å; H2264-R2267 PolarHBondContact O-N 2.95Å; P2265-R2267 VanDerWaalsContact C-N 3.28Å; P2265-R2267 PolarHBondContact O-N 3.3Å
2268	I	92.2	Very high	90.1	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.026	22%	0.222	C	C	.	.	S	Bend	trans	-65.9	145.1	172.8	-69.8	174.7	0	0	0	109.6	N2242 L2245 F2262 D2263 H2264 P2265 Y2270 L2308 V2317	N2242-I2268 WeakPolarHBondContact OD1-CA 3.34Å; L2245-I2268 HydrophobicContact CD2-CB 4.42Å; L2245-I2268 HydrophobicContact CD2-CD1 4.08Å; L2245-I2268 HydrophobicContact CD2-CG1 4.03Å; L2245-I2268 HydrophobicContact CD2-CG2 3.62Å; L2245-I2268 VanDerWaalsContact CD2-CG2 3.49Å; F2262-I2268 HydrophobicContact CB-CD1 4.29Å; D2263-I2268 HydrophobicContact CB-CG1 4.33Å; D2263-I2268 VanDerWaalsContact O-CD1 3.23Å; D2263-I2268 WeakPolarHBondContact O-CD1 3.4Å; D2263-I2268 WeakPolarHBondContact O-CG1 3.45Å; H2264-I2268 PolarHBondContact O-N 3.41Å; H2264-I2268 VanDerWaalsContact O-N 3.09Å; P2265-I2268 WeakPolarHBondContact O-CB 3.2Å; P2265-I2268 PolarHBondContact O-N 2.89Å; I2268-Y2270 VanDerWaalsContact O-CD1 3.28Å; I2268-Y2270 WeakPolarHBondContact O-CD1 3.28Å; I2268-Y2270 PolarHBondContact O-N 3.03Å; I2268-L2308 HydrophobicContact CD1-CB 4.43Å; I2268-L2308 HydrophobicContact CD1-CD2 4.44Å; I2268-V2317 HydrophobicContact CG2-CG1 3.98Å
2269	F	95.1	Very high	90.6	Very high	4 Å²	4	38 Å²	38	2%	0.018	20%	0.204	C	C	.	.			trans	-64.3	93.8	170.4	178.2	-127	0	0	0	110.4	N2242 Y2243 R2246 V2272 T2275 F2293 M2299 F2300 V2320	N2242-F2269 WeakPolarHBondContact O-CB 3.42Å; N2242-F2269 PolarHBondContact OD1-N 3.2Å; Y2243-F2269 HydrophobicContact CD1-CD1 4.07Å; Y2243-F2269 HydrophobicContact CD1-CD2 4.11Å; Y2243-F2269 HydrophobicContact CD1-CE1 4.19Å; Y2243-F2269 HydrophobicContact CD1-CE2 4.25Å; Y2243-F2269 AromaticContact CD1-CG 3.97Å; Y2243-F2269 HydrophobicContact CD1-CG 4.03Å; Y2243-F2269 HydrophobicContact CD1-CZ 4.29Å; Y2243-F2269 HydrophobicContact CE1-CD2 4.27Å; Y2243-F2269 HydrophobicContact CE1-CE2 4.25Å; Y2243-F2269 HydrophobicContact CE1-CZ 4.41Å; R2246-F2269 VanDerWaalsContact CZ-O 3.25Å; R2246-F2269 PolarHBondContact NH1-O 3.03Å; R2246-F2269 PolarHBondContact NH2-O 3.13Å; F2269-V2272 HydrophobicContact CZ-CG2 4.19Å; F2269-T2275 HydrophobicContact CD2-CG2 4.35Å; F2269-T2275 VanDerWaalsContact CD2-OG1 3.25Å; F2269-T2275 WeakPolarHBondContact CD2-OG1 3.46Å; F2269-T2275 HydrophobicContact CE2-CG2 4.41Å; F2269-T2275 WeakPolarHBondContact CE2-OG1 3.39Å; F2269-F2293 HydrophobicContact CE1-CZ 4.21Å; F2269-F2293 HydrophobicContact CE2-CZ 4.31Å; F2269-F2293 HydrophobicContact CZ-CE1 4.14Å; F2269-F2293 AromaticContact CZ-CZ 3.7Å; F2269-F2293 HydrophobicContact CZ-CZ 3.7Å; F2269-M2299 HydrophobicContact CE1-CE 4.3Å; F2269-F2300 AromaticContact CE1-CD1 3.93Å; F2269-F2300 HydrophobicContact CE1-CD1 4.03Å; F2269-F2300 AromaticContact CE1-CE1 3.89Å; F2269-F2300 HydrophobicContact CE1-CE1 3.94Å; F2269-F2300 HydrophobicContact CZ-CD1 4.22Å; F2269-F2300 AromaticContact CZ-CE1 3.9Å; F2269-F2300 HydrophobicContact CZ-CE1 3.9Å; F2269-V2320 HydrophobicContact CD1-CG2 4.01Å; F2269-V2320 HydrophobicContact CE1-CG1 4.01Å; F2269-V2320 HydrophobicContact CE1-CG2 3.86Å; F2269-V2320 HydrophobicContact CE2-CG1 4.29Å; F2269-V2320 HydrophobicContact CZ-CG1 3.81Å; F2269-V2320 HydrophobicContact CZ-CG2 4.49Å
2270	Y	94.8	Very high	91.2	Very high	20 Å²	20	35.9 Å²	35.9	8%	0.078	18%	0.176	C	C	.	.			trans	-113.1	-15.2	-179.6	77.3	-93.6	0	0	0	114.3	I2268 K2274 T2311 I2315 V2317 V2320 I2321	I2268-Y2270 VanDerWaalsContact O-CD1 3.28Å; I2268-Y2270 WeakPolarHBondContact O-CD1 3.28Å; I2268-Y2270 PolarHBondContact O-N 3.03Å; Y2270-K2274 HydrophobicContact CE1-CG 4.23Å; Y2270-T2311 HydrophobicContact CD1-CG2 4.34Å; Y2270-T2311 HydrophobicContact CD2-CG2 4.49Å; Y2270-T2311 HydrophobicContact CE1-CG2 4.21Å; Y2270-T2311 HydrophobicContact CE2-CG2 4.41Å; Y2270-T2311 HydrophobicContact CG-CG2 4.46Å; Y2270-I2315 HydrophobicContact CE2-CD1 4.21Å; Y2270-V2317 HydrophobicContact CG-CG2 4.48Å; Y2270-V2320 CarbonylContact O-C 3.56Å; Y2270-V2320 WeakPolarHBondContact O-CA 3.38Å; Y2270-I2321 HydrophobicContact CD2-CD1 4.24Å; Y2270-I2321 PolarHBondContact O-N 3.07Å
2271	S	96	Very high	91.7	Very high	10 Å²	10	39.7 Å²	39.7	7%	0.07	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-149.5	135.1	177.8	175.2	0	0	0	0	111.9	A2273 K2274 T2275 I2321	S2271-A2273 PolarHBondContact OG-N 3.2Å; S2271-K2274 PolarHBondContact OG-N 3.25Å; S2271-T2275 VanDerWaalsContact O-CB 3.28Å; S2271-T2275 WeakPolarHBondContact O-CB 3.42Å; S2271-T2275 PolarHBondContact O-N 2.95Å; S2271-T2275 PolarHBondContact O-OG1 3.09Å; S2271-I2321 WeakPolarHBondContact CA-O 3.2Å; S2271-I2321 PolarHBondContact OG-O 2.9Å
2272	V	96.9	Very high	92.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.7	-46.8	174.2	-178.2	0	0	0	0	110.5	W2177 Y2182 F2269 T2275 W2276 F2300 V2320 I2321 L2322 P2323 F2332	W2177-V2272 HydrophobicContact CH2-CG1 4.35Å; W2177-V2272 HydrophobicContact CZ3-CG1 4.25Å; Y2182-V2272 HydrophobicContact CD1-CG1 4Å; Y2182-V2272 HydrophobicContact CE1-CG1 3.9Å; Y2182-V2272 HydrophobicContact CG-CG1 4.33Å; F2269-V2272 HydrophobicContact CZ-CG2 4.19Å; V2272-T2275 PolarHBondContact O-N 2.92Å; V2272-W2276 PolarHBondContact O-N 3.08Å; V2272-F2300 HydrophobicContact CG2-CD1 4.47Å; V2272-F2300 HydrophobicContact CG2-CE1 4.27Å; V2272-V2320 HydrophobicContact CG2-CG1 4.08Å; V2272-I2321 PolarHBondContact N-O 2.97Å; V2272-I2321 VanDerWaalsContact N-O 3.13Å; V2272-L2322 HydrophobicContact CG2-CD2 4.38Å; V2272-P2323 HydrophobicContact CB-CG 4.42Å; V2272-P2323 HydrophobicContact CG1-CG 4.45Å; V2272-F2332 HydrophobicContact CG1-CE2 4.05Å; V2272-F2332 HydrophobicContact CG1-CZ 3.93Å; V2272-F2332 HydrophobicContact CG2-CE1 4.48Å; V2272-F2332 HydrophobicContact CG2-CE2 4.36Å; V2272-F2332 HydrophobicContact CG2-CZ 4.14Å
2273	A	96.1	Very high	92.1	Very high	28.3333 Å²	28.3333	41.7 Å²	41.7	23%	0.234	21%	0.206	C	C	.	.	H	α-helix	trans	-63.7	-45.2	-178.7	0	0	0	0	0	112	S2271 T2275 W2276 E2277	S2271-A2273 PolarHBondContact OG-N 3.2Å; A2273-T2275 VanDerWaalsContact C-N 3.33Å; A2273-T2275 PolarHBondContact O-N 2.93Å; A2273-W2276 PolarHBondContact O-N 3.36Å; A2273-E2277 PolarHBondContact O-N 2.96Å
2274	K	94.3	Very high	92.3	Very high	72 Å²	72	43.2 Å²	43.2	31%	0.313	22%	0.22	S	C	.	.	H	α-helix	trans	-64.6	-38.4	176.8	-168.4	69.1	-173.6	174.5	0	112.1	Y2270 S2271 W2276 E2277 N2278	Y2270-K2274 HydrophobicContact CE1-CG 4.23Å; S2271-K2274 PolarHBondContact OG-N 3.25Å; K2274-W2276 VanDerWaalsContact C-N 3.35Å; K2274-W2276 PolarHBondContact O-N 3.26Å; K2274-E2277 WeakPolarHBondContact CD-OE2 3.38Å; K2274-E2277 WeakPolarHBondContact CE-OE2 3.33Å; K2274-E2277 IonicContact NZ-OE2 3.15Å; K2274-E2277 PolarHBondContact NZ-OE2 3.25Å; K2274-E2277 PolarHBondContact O-N 3.17Å; K2274-N2278 WeakPolarHBondContact O-CB 3.38Å; K2274-N2278 VanDerWaalsContact O-CG 3.23Å; K2274-N2278 PolarHBondContact O-N 3.14Å; K2274-N2278 PolarHBondContact O-OD1 3.46Å
2275	T	95.8	Very high	92.5	Very high	13 Å²	13	41.3 Å²	41.3	8%	0.08	21%	0.211	C	C	.	.	H	α-helix	trans	-63.3	-44.1	177.4	-57.5	0	0	0	0	111.2	W2177 Y2243 F2269 S2271 V2272 A2273 N2278 C2279 K2287	W2177-T2275 HydrophobicContact CH2-CG2 4.19Å; W2177-T2275 HydrophobicContact CZ2-CG2 4Å; Y2243-T2275 HydrophobicContact CE1-CG2 4.27Å; F2269-T2275 HydrophobicContact CD2-CG2 4.35Å; F2269-T2275 VanDerWaalsContact CD2-OG1 3.25Å; F2269-T2275 WeakPolarHBondContact CD2-OG1 3.46Å; F2269-T2275 HydrophobicContact CE2-CG2 4.41Å; F2269-T2275 WeakPolarHBondContact CE2-OG1 3.39Å; S2271-T2275 VanDerWaalsContact O-CB 3.28Å; S2271-T2275 WeakPolarHBondContact O-CB 3.42Å; S2271-T2275 PolarHBondContact O-N 2.95Å; S2271-T2275 PolarHBondContact O-OG1 3.09Å; V2272-T2275 PolarHBondContact O-N 2.92Å; A2273-T2275 VanDerWaalsContact C-N 3.33Å; A2273-T2275 PolarHBondContact O-N 2.93Å; T2275-N2278 PolarHBondContact O-N 3.01Å; T2275-C2279 WeakPolarHBondContact O-CB 3.31Å; T2275-C2279 PolarHBondContact O-N 3.07Å; T2275-C2279 PolarHBondContact O-SG 3.23Å; T2275-K2287 HydrophobicContact CG2-CD 4.27Å; T2275-K2287 PolarHBondContact O-NZ 2.73Å
2276	W	96.4	Very high	92.9	Very high	26.6667 Å²	26.6667	41.3 Å²	41.3	10%	0.101	21%	0.211	C	C	.	.	H	α-helix	trans	-63.1	-43.4	174.1	174.3	-113.4	0	0	0	112.5	W2177 S2180 Y2182 R2196 I2202 I2205 V2272 A2273 K2274 N2278 C2279 Q2280	W2177-W2276 HydrophobicContact CB-CE3 4.26Å; W2177-W2276 HydrophobicContact CB-CH2 4.43Å; W2177-W2276 HydrophobicContact CB-CZ3 3.68Å; W2177-W2276 AromaticContact CD2-CE3 3.61Å; W2177-W2276 HydrophobicContact CD2-CE3 3.61Å; W2177-W2276 AromaticContact CD2-CZ3 3.95Å; W2177-W2276 HydrophobicContact CD2-CZ3 3.95Å; W2177-W2276 HydrophobicContact CE3-CD2 4.39Å; W2177-W2276 AromaticContact CE3-CE3 3.68Å; W2177-W2276 HydrophobicContact CE3-CE3 3.68Å; W2177-W2276 HydrophobicContact CE3-CZ3 4.28Å; W2177-W2276 AromaticContact CG-CE3 3.89Å; W2177-W2276 HydrophobicContact CG-CE3 3.89Å; W2177-W2276 AromaticContact CG-CZ3 3.69Å; W2177-W2276 HydrophobicContact CG-CZ3 3.69Å; W2177-W2276 HydrophobicContact CH2-CB 4.13Å; W2177-W2276 HydrophobicContact CZ3-CB 4Å; W2177-W2276 HydrophobicContact CZ3-CE3 4.26Å; S2180-W2276 PolarHBondContact O-NE1 3.05Å; Y2182-W2276 HydrophobicContact CD2-CB 3.69Å; Y2182-W2276 AromaticContact CD2-CD1 3.67Å; Y2182-W2276 HydrophobicContact CD2-CD2 4.45Å; Y2182-W2276 AromaticContact CD2-CG 3.66Å; Y2182-W2276 HydrophobicContact CD2-CG 3.66Å; Y2182-W2276 HydrophobicContact CE2-CB 3.83Å; Y2182-W2276 AromaticContact CE2-CD1 3.99Å; Y2182-W2276 HydrophobicContact CE2-CD2 4.12Å; Y2182-W2276 AromaticContact CE2-CG 3.73Å; Y2182-W2276 HydrophobicContact CE2-CG 3.73Å; R2196-W2276 HydrophobicContact CB-CH2 4.33Å; R2196-W2276 HydrophobicContact CG-CH2 4.27Å; I2202-W2276 HydrophobicContact CD1-CZ3 4.08Å; I2205-W2276 HydrophobicContact CD1-CH2 3.97Å; V2272-W2276 PolarHBondContact O-N 3.08Å; A2273-W2276 PolarHBondContact O-N 3.36Å; K2274-W2276 VanDerWaalsContact C-N 3.35Å; K2274-W2276 PolarHBondContact O-N 3.26Å; W2276-N2278 VanDerWaalsContact C-N 3.35Å; W2276-N2278 PolarHBondContact O-N 2.83Å; W2276-C2279 CarbonylContact O-C 3.53Å; W2276-C2279 WeakPolarHBondContact O-CB 3.38Å; W2276-C2279 PolarHBondContact O-N 3.33Å; W2276-Q2280 HydrophobicContact CD2-CG 4.41Å; W2276-Q2280 HydrophobicContact CZ2-CG 4.24Å; W2276-Q2280 VanDerWaalsContact CZ3-NE2 3.3Å; W2276-Q2280 WeakPolarHBondContact O-CG 3.41Å; W2276-Q2280 PolarHBondContact O-N 3.04Å; W2276-Q2280 VanDerWaalsContact O-N 3.14Å
2277	E	94.7	Very high	93.3	Very high	83 Å²	83	40.2 Å²	40.2	39%	0.388	20%	0.204	S	C	.	.	H	α-helix	trans	-57.9	-48.6	174.7	-178	-176	-142.6	0	0	111.4	A2273 K2274 C2279 Q2280 I2281	A2273-E2277 PolarHBondContact O-N 2.96Å; K2274-E2277 WeakPolarHBondContact CD-OE2 3.38Å; K2274-E2277 WeakPolarHBondContact CE-OE2 3.33Å; K2274-E2277 IonicContact NZ-OE2 3.15Å; K2274-E2277 PolarHBondContact NZ-OE2 3.25Å; K2274-E2277 PolarHBondContact O-N 3.17Å; E2277-C2279 VanDerWaalsContact C-N 3.29Å; E2277-C2279 PolarHBondContact O-N 3.29Å; E2277-Q2280 WeakPolarHBondContact O-CA 3.44Å; E2277-Q2280 WeakPolarHBondContact O-CB 3.5Å; E2277-Q2280 PolarHBondContact O-N 3.24Å; E2277-I2281 HydrophobicContact CG-CD1 3.59Å; E2277-I2281 HydrophobicContact CG-CG1 4.31Å; E2277-I2281 WeakPolarHBondContact O-CG1 3.33Å; E2277-I2281 PolarHBondContact O-N 3.17Å
2278	N	93.6	Very high	93.6	Very high	52.3333 Å²	52.3333	33.4 Å²	33.4	28%	0.28	18%	0.179	S	C	.	.	H	α-helix	trans	-58.6	-42.1	176.3	-70.6	-9.7	0	0	0	111.2	K2274 T2275 W2276 Q2280 I2281 N2282	K2274-N2278 WeakPolarHBondContact O-CB 3.38Å; K2274-N2278 VanDerWaalsContact O-CG 3.23Å; K2274-N2278 PolarHBondContact O-N 3.14Å; K2274-N2278 PolarHBondContact O-OD1 3.46Å; T2275-N2278 PolarHBondContact O-N 3.01Å; W2276-N2278 VanDerWaalsContact C-N 3.35Å; W2276-N2278 PolarHBondContact O-N 2.83Å; N2278-Q2280 PolarHBondContact O-N 3.25Å; N2278-Q2280 VanDerWaalsContact O-N 3.16Å; N2278-I2281 PolarHBondContact O-N 3.19Å; N2278-N2282 WeakPolarHBondContact O-CB 3.26Å; N2278-N2282 PolarHBondContact O-N 3.29Å
2279	C	93.8	Very high	93.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.6	-15.7	173.5	-68.1	0	0	0	0	114	I2202 R2209 T2275 W2276 E2277 K2287	I2202-C2279 HydrophobicContact CG2-CB 4.14Å; I2202-C2279 VanDerWaalsContact CG2-O 3.23Å; I2202-C2279 WeakPolarHBondContact CG2-O 3.29Å; R2209-C2279 VanDerWaalsContact CZ-O 3.25Å; R2209-C2279 PolarHBondContact NH1-O 3.37Å; R2209-C2279 PolarHBondContact NH2-O 3.13Å; T2275-C2279 WeakPolarHBondContact O-CB 3.31Å; T2275-C2279 PolarHBondContact O-N 3.07Å; T2275-C2279 PolarHBondContact O-SG 3.23Å; W2276-C2279 CarbonylContact O-C 3.53Å; W2276-C2279 WeakPolarHBondContact O-CB 3.38Å; W2276-C2279 PolarHBondContact O-N 3.33Å; E2277-C2279 VanDerWaalsContact C-N 3.29Å; E2277-C2279 PolarHBondContact O-N 3.29Å; C2279-K2287 WeakPolarHBondContact SG-CG 3.24Å; C2279-K2287 PolarHBondContact SG-NZ 2.94Å
2280	Q	91.7	Very high	94.1	Very high	25 Å²	25	33.4 Å²	33.4	12%	0.117	18%	0.179	C	C	.	.	H	α-helix	trans	-101.8	-26.4	176.4	-64.9	-53.1	-43.1	0	0	113.7	N2206 W2276 E2277 N2278	N2206-Q2280 PolarHBondContact ND2-O 3.22Å; W2276-Q2280 HydrophobicContact CD2-CG 4.41Å; W2276-Q2280 HydrophobicContact CZ2-CG 4.24Å; W2276-Q2280 VanDerWaalsContact CZ3-NE2 3.3Å; W2276-Q2280 WeakPolarHBondContact O-CG 3.41Å; W2276-Q2280 PolarHBondContact O-N 3.04Å; W2276-Q2280 VanDerWaalsContact O-N 3.14Å; E2277-Q2280 WeakPolarHBondContact O-CA 3.44Å; E2277-Q2280 WeakPolarHBondContact O-CB 3.5Å; E2277-Q2280 PolarHBondContact O-N 3.24Å; N2278-Q2280 PolarHBondContact O-N 3.25Å; N2278-Q2280 VanDerWaalsContact O-N 3.16Å
2281	I	90.9	Very high	94.2	Very high	109.333 Å²	109.333	32.4 Å²	32.4	56%	0.561	18%	0.175	S	C	*	.	H	α-helix	trans	-102.3	-49.8	-173.4	-60.6	-179.6	0	0	0	112.1	E2277 N2278 T2283	E2277-I2281 HydrophobicContact CG-CD1 3.59Å; E2277-I2281 HydrophobicContact CG-CG1 4.31Å; E2277-I2281 WeakPolarHBondContact O-CG1 3.33Å; E2277-I2281 PolarHBondContact O-N 3.17Å; N2278-I2281 PolarHBondContact O-N 3.19Å; I2281-T2283 PolarHBondContact O-N 2.63Å
2282	N	89.8	Confident	94.3	Very high	70.6667 Å²	70.6667	32 Å²	32	38%	0.378	17%	0.172	S	C	.	.			trans	-72.3	130.3	-172.1	-177.2	-4.4	0	0	0	110.8	R2209 N2278 S2284 D2285	R2209-N2282 PolarHBondContact NH1-O 3.12Å; R2209-N2282 PolarHBondContact NH2-O 2.78Å; N2278-N2282 WeakPolarHBondContact O-CB 3.26Å; N2278-N2282 PolarHBondContact O-N 3.29Å; N2282-S2284 VanDerWaalsContact C-N 3.3Å; N2282-S2284 PolarHBondContact ND2-OG 2.79Å; N2282-S2284 VanDerWaalsContact ND2-OG 3.1Å; N2282-S2284 PolarHBondContact O-N 3.37Å; N2282-S2284 PolarHBondContact OD1-N 3.03Å; N2282-S2284 PolarHBondContact OD1-OG 3.29Å; N2282-D2285 HydrophobicContact CB-CB 3.88Å; N2282-D2285 PolarHBondContact O-N 3.06Å; N2282-D2285 VanDerWaalsContact O-N 3.07Å
2283	T	87.5	Confident	94.4	Very high	72 Å²	72	32 Å²	32	44%	0.442	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-25.1	179.9	48.5	0	0	0	0	113.7	R2209 F2212 F2213 I2281	R2209-T2283 HydrophobicContact CG-CG2 4.45Å; R2209-T2283 PolarHBondContact NH2-O 3.22Å; F2212-T2283 HydrophobicContact CD1-CG2 3.97Å; F2212-T2283 HydrophobicContact CE1-CG2 3.65Å; F2212-T2283 VanDerWaalsContact CE1-CG2 3.49Å; F2212-T2283 HydrophobicContact CZ-CG2 4.26Å; F2213-T2283 WeakPolarHBondContact CZ-O 3.42Å; I2281-T2283 PolarHBondContact O-N 2.63Å
2284	S	88.2	Confident	94.5	Very high	64.3333 Å²	64.3333	30.7 Å²	30.7	45%	0.45	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-6.5	176.7	36.6	0	0	0	0	113.7	T2232 N2282 V2286	T2232-S2284 VanDerWaalsContact CB-O 3.3Å; T2232-S2284 WeakPolarHBondContact CB-O 3.34Å; T2232-S2284 WeakPolarHBondContact CG2-O 3.42Å; T2232-S2284 PolarHBondContact OG1-O 3.11Å; N2282-S2284 VanDerWaalsContact C-N 3.3Å; N2282-S2284 PolarHBondContact ND2-OG 2.79Å; N2282-S2284 VanDerWaalsContact ND2-OG 3.1Å; N2282-S2284 PolarHBondContact O-N 3.37Å; N2282-S2284 PolarHBondContact OD1-N 3.03Å; N2282-S2284 PolarHBondContact OD1-OG 3.29Å; S2284-V2286 PolarHBondContact O-N 3.32Å
2285	D	91.9	Very high	94.6	Very high	14.6667 Å²	14.6667	27.9 Å²	27.9	8%	0.078	15%	0.149	C	C	.	.			trans	-108.4	105.4	-176.5	-161.6	-11.6	0	0	0	111.8	R2209 N2282 K2287	R2209-D2285 PolarHBondContact NH1-O 2.97Å; R2209-D2285 PolarHBondContact NH2-O 3.45Å; N2282-D2285 HydrophobicContact CB-CB 3.88Å; N2282-D2285 PolarHBondContact O-N 3.06Å; N2282-D2285 VanDerWaalsContact O-N 3.07Å; D2285-K2287 VanDerWaalsContact CG-CE 3.43Å; D2285-K2287 WeakPolarHBondContact OD1-CE 3.38Å; D2285-K2287 VanDerWaalsContact OD1-CG 3.28Å; D2285-K2287 WeakPolarHBondContact OD1-CG 3.4Å; D2285-K2287 PolarHBondContact OD1-N 2.99Å; D2285-K2287 IonicContact OD1-NZ 3Å; D2285-K2287 PolarHBondContact OD1-NZ 2.91Å; D2285-K2287 WeakPolarHBondContact OD2-CE 3.24Å; D2285-K2287 IonicContact OD2-NZ 3.26Å; D2285-K2287 PolarHBondContact OD2-NZ 3.02Å
2286	V	93.9	Very high	94.6	Very high	4.33333 Å²	4.33333	27.3 Å²	27.3	3%	0.026	15%	0.145	C	C	.	.			trans	-131.1	25.9	179	-65.2	0	0	0	0	112.1	I2202 F2213 Y2230 T2232 Y2234 S2284 F2373	I2202-V2286 HydrophobicContact CB-CB 4.36Å; I2202-V2286 HydrophobicContact CG2-CB 4.3Å; I2202-V2286 HydrophobicContact CG2-CG1 4.44Å; F2213-V2286 HydrophobicContact CZ-CG1 4.44Å; Y2230-V2286 HydrophobicContact CD1-CG1 3.85Å; Y2230-V2286 HydrophobicContact CD1-CG2 4.42Å; Y2230-V2286 HydrophobicContact CE1-CG1 4.04Å; Y2230-V2286 HydrophobicContact CG-CG1 4.39Å; Y2230-V2286 HydrophobicContact CG-CG2 4.45Å; T2232-V2286 VanDerWaalsContact O-CG2 3.27Å; T2232-V2286 WeakPolarHBondContact O-CG2 3.34Å; Y2234-V2286 WeakPolarHBondContact CA-O 3.24Å; Y2234-V2286 VanDerWaalsContact CB-O 3.29Å; Y2234-V2286 WeakPolarHBondContact CB-O 3.35Å; S2284-V2286 PolarHBondContact O-N 3.32Å; V2286-F2373 HydrophobicContact CG2-CE1 4.28Å
2287	K	95.4	Very high	94.6	Very high	19.6667 Å²	19.6667	26.9 Å²	26.9	9%	0.086	15%	0.146	C	C	.	.			trans	-66.8	139.5	-173.7	75.9	-171.5	89.5	89.6	0	113	W2177 Y2234 F2239 Y2243 T2275 C2279 D2285	W2177-K2287 PolarHBondContact NE1-O 2.83Å; W2177-K2287 VanDerWaalsContact NE1-O 3.08Å; Y2234-K2287 WeakPolarHBondContact O-CA 3.39Å; F2239-K2287 HydrophobicContact CD1-CB 4.49Å; F2239-K2287 HydrophobicContact CD1-CD 4.24Å; F2239-K2287 HydrophobicContact CD2-CB 3.47Å; F2239-K2287 VanDerWaalsContact CD2-CB 3.45Å; F2239-K2287 HydrophobicContact CE2-CB 3.51Å; F2239-K2287 VanDerWaalsContact CE2-CB 3.5Å; F2239-K2287 HydrophobicContact CG-CB 4.17Å; F2239-K2287 HydrophobicContact CG-CD 4.29Å; F2239-K2287 HydrophobicContact CZ-CB 4.24Å; Y2243-K2287 HydrophobicContact CE1-CD 4.37Å; Y2243-K2287 HydrophobicContact CE2-CD 4.12Å; Y2243-K2287 HydrophobicContact CE2-CG 4.34Å; Y2243-K2287 VanDerWaalsContact OH-CD 3.29Å; Y2243-K2287 WeakPolarHBondContact OH-CD 3.29Å; Y2243-K2287 VanDerWaalsContact OH-CG 3.31Å; Y2243-K2287 WeakPolarHBondContact OH-CG 3.35Å; T2275-K2287 HydrophobicContact CG2-CD 4.27Å; T2275-K2287 PolarHBondContact O-NZ 2.73Å; C2279-K2287 WeakPolarHBondContact SG-CG 3.24Å; C2279-K2287 PolarHBondContact SG-NZ 2.94Å; D2285-K2287 VanDerWaalsContact CG-CE 3.43Å; D2285-K2287 WeakPolarHBondContact OD1-CE 3.38Å; D2285-K2287 VanDerWaalsContact OD1-CG 3.28Å; D2285-K2287 WeakPolarHBondContact OD1-CG 3.4Å; D2285-K2287 PolarHBondContact OD1-N 2.99Å; D2285-K2287 IonicContact OD1-NZ 3Å; D2285-K2287 PolarHBondContact OD1-NZ 2.91Å; D2285-K2287 WeakPolarHBondContact OD2-CE 3.24Å; D2285-K2287 IonicContact OD2-NZ 3.26Å; D2285-K2287 PolarHBondContact OD2-NZ 3.02Å
2288	E	97.3	Very high	94.6	Very high	7.33333 Å²	7.33333	24 Å²	24	3%	0.034	13%	0.132	C	C	.	.			trans	-91.7	179.9	166.4	-74.2	-75.7	-162.7	0	0	110.2	I2174 P2176 W2177 R2196 I2202 Y2234 Y2243 W2352	I2174-E2288 HydrophobicContact CD1-CB 3.79Å; I2174-E2288 HydrophobicContact CD1-CG 4.13Å; I2174-E2288 HydrophobicContact CG1-CB 3.89Å; I2174-E2288 HydrophobicContact CG2-CB 3.79Å; I2174-E2288 HydrophobicContact CG2-CG 4.44Å; P2176-E2288 WeakPolarHBondContact CA-OE2 3.41Å; W2177-E2288 PolarHBondContact N-OE2 3.19Å; W2177-E2288 VanDerWaalsContact N-OE2 3.09Å; R2196-E2288 IonicContact CZ-OE1 3.03Å; R2196-E2288 VanDerWaalsContact CZ-OE1 3.24Å; R2196-E2288 IonicContact CZ-OE2 3.02Å; R2196-E2288 IonicContact NE-OE1 2.73Å; R2196-E2288 IonicContact NE-OE2 2.69Å; R2196-E2288 IonicContact NH1-OE1 3.3Å; R2196-E2288 PolarHBondContact NH1-OE1 3.4Å; R2196-E2288 IonicContact NH1-OE2 2.73Å; R2196-E2288 PolarHBondContact NH1-OE2 2.94Å; R2196-E2288 IonicContact NH2-OE1 3.4Å; R2196-E2288 PolarHBondContact NH2-OE1 3.06Å; I2202-E2288 HydrophobicContact CG1-CG 4.23Å; Y2234-E2288 HydrophobicContact CG-CG 4.4Å; Y2234-E2288 PolarHBondContact O-N 2.94Å; Y2243-E2288 WeakPolarHBondContact CE2-O 3.48Å; Y2243-E2288 PolarHBondContact OH-O 2.87Å; Y2243-E2288 VanDerWaalsContact OH-O 3.12Å; E2288-W2352 PolarHBondContact OE1-NE1 3.14Å; E2288-W2352 VanDerWaalsContact OE1-NE1 3.12Å
2289	L	98.2	Very high	94.8	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.01	12%	0.119	C	C	.	.	B	Isolated β-bridge	trans	-88.6	164.9	179.8	-65.9	-175.5	0	0	0	112.5	F2175 W2177 F2293 F2294	F2175-L2289 HydrophobicContact CB-CB 4.36Å; F2175-L2289 PolarHBondContact N-O 3.34Å; F2175-L2289 CarbonylContact O-C 3.58Å; F2175-L2289 WeakPolarHBondContact O-CA 3.38Å; F2175-L2289 WeakPolarHBondContact O-CB 3.13Å; F2175-L2289 PolarHBondContact O-N 3.08Å; F2175-L2289 VanDerWaalsContact O-O 3.11Å; W2177-L2289 HydrophobicContact CB-CD1 4.48Å; W2177-L2289 HydrophobicContact CB-CG 4.48Å; W2177-L2289 HydrophobicContact CD2-CD1 4.02Å; W2177-L2289 HydrophobicContact CD2-CD2 3.65Å; W2177-L2289 HydrophobicContact CD2-CG 3.71Å; W2177-L2289 VanDerWaalsContact CE2-CD2 3.42Å; W2177-L2289 HydrophobicContact CE3-CD1 4.07Å; W2177-L2289 HydrophobicContact CE3-CD2 4.01Å; W2177-L2289 HydrophobicContact CE3-CG 4.21Å; W2177-L2289 HydrophobicContact CG-CD1 4.22Å; W2177-L2289 HydrophobicContact CG-CD2 4.25Å; W2177-L2289 HydrophobicContact CG-CG 3.82Å; W2177-L2289 HydrophobicContact CH2-CD2 3.86Å; W2177-L2289 HydrophobicContact CZ2-CD2 3.5Å; W2177-L2289 HydrophobicContact CZ2-CG 4.4Å; W2177-L2289 HydrophobicContact CZ3-CD2 4.1Å; L2289-F2293 HydrophobicContact CB-CD2 4.43Å; L2289-F2293 HydrophobicContact CD1-CB 4.2Å; L2289-F2293 HydrophobicContact CD1-CD1 4.15Å; L2289-F2293 HydrophobicContact CD1-CG 4.13Å; L2289-F2293 HydrophobicContact CD2-CD1 3.94Å; L2289-F2293 HydrophobicContact CD2-CD2 3.96Å; L2289-F2293 HydrophobicContact CD2-CE1 3.86Å; L2289-F2293 HydrophobicContact CD2-CE2 3.87Å; L2289-F2293 HydrophobicContact CD2-CG 4Å; L2289-F2293 HydrophobicContact CD2-CZ 3.83Å; L2289-F2293 HydrophobicContact CG-CG 4.47Å; L2289-F2294 HydrophobicContact CB-CE2 4.3Å; L2289-F2294 HydrophobicContact CD1-CE2 4.02Å; L2289-F2294 HydrophobicContact CD1-CZ 3.94Å
2290	I	98.2	Very high	94.9	Very high	6 Å²	6	21.5 Å²	21.5	3%	0.031	12%	0.119	C	C	.	.			trans	-103.5	157.5	168.2	61.8	174.5	0	0	0	110	Y2172 V2240 Y2243 L2244 E2292 F2293 M2299	Y2172-I2290 HydrophobicContact CD1-CB 4.31Å; Y2172-I2290 HydrophobicContact CD1-CG2 3.96Å; Y2172-I2290 HydrophobicContact CE1-CB 4.18Å; Y2172-I2290 HydrophobicContact CE1-CG2 4.24Å; V2240-I2290 HydrophobicContact CG2-CG2 4.21Å; Y2243-I2290 HydrophobicContact CD2-CD1 4.13Å; Y2243-I2290 HydrophobicContact CD2-CG1 4.16Å; Y2243-I2290 HydrophobicContact CD2-CG2 4.12Å; Y2243-I2290 HydrophobicContact CE2-CG2 4.41Å; Y2243-I2290 HydrophobicContact CG-CD1 4.25Å; L2244-I2290 HydrophobicContact CD1-CD1 4.12Å; L2244-I2290 HydrophobicContact CD2-CD1 3.81Å; L2244-I2290 HydrophobicContact CG-CD1 3.76Å; I2290-E2292 VanDerWaalsContact CB-OE2 3.27Å; I2290-E2292 WeakPolarHBondContact CB-OE2 3.34Å; I2290-E2292 HydrophobicContact CD1-CB 4.24Å; I2290-E2292 HydrophobicContact CD1-CG 4.43Å; I2290-E2292 VanDerWaalsContact CD1-OE2 3.31Å; I2290-E2292 WeakPolarHBondContact CD1-OE2 3.45Å; I2290-E2292 HydrophobicContact CG1-CB 4.29Å; I2290-E2292 VanDerWaalsContact CG1-OE2 3.25Å; I2290-E2292 WeakPolarHBondContact CG1-OE2 3.34Å; I2290-E2292 PolarHBondContact O-N 2.93Å; I2290-E2292 VanDerWaalsContact O-N 3.11Å; I2290-F2293 HydrophobicContact CG1-CD2 3.83Å; I2290-F2293 HydrophobicContact CG1-CE2 4.12Å; I2290-F2293 PolarHBondContact O-N 2.9Å; I2290-M2299 HydrophobicContact CD1-CE 4.25Å; I2290-M2299 HydrophobicContact CD1-SD 3.96Å
2291	P	98.3	Very high	95	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-52.5	-31.9	-177.7	-26.6	31.7	0	0	0	115.5	F2152 M2156 P2173 F2175 F2293 F2294 Y2295	F2152-P2291 HydrophobicContact CE2-CB 4.25Å; F2152-P2291 HydrophobicContact CZ-CB 4.29Å; M2156-P2291 HydrophobicContact CE-CB 3.9Å; M2156-P2291 HydrophobicContact CE-CG 3.74Å; M2156-P2291 HydrophobicContact SD-CB 4.06Å; M2156-P2291 HydrophobicContact SD-CG 3.78Å; P2173-P2291 HydrophobicContact CB-CG 3.67Å; P2173-P2291 HydrophobicContact CG-CG 4.45Å; P2173-P2291 VanDerWaalsContact O-CD 3.29Å; P2173-P2291 WeakPolarHBondContact O-CD 3.42Å; F2175-P2291 HydrophobicContact CD2-CB 4.03Å; F2175-P2291 HydrophobicContact CD2-CG 3.67Å; F2175-P2291 HydrophobicContact CE2-CB 3.93Å; F2175-P2291 HydrophobicContact CE2-CG 3.7Å; F2175-P2291 HydrophobicContact CZ-CB 4.47Å; P2291-F2293 PolarHBondContact O-N 3.25Å; P2291-F2293 VanDerWaalsContact O-N 3.17Å; P2291-F2294 WeakPolarHBondContact O-CB 3.37Å; P2291-F2294 PolarHBondContact O-N 3.03Å; P2291-Y2295 HydrophobicContact CB-CD1 4.39Å; P2291-Y2295 HydrophobicContact CB-CE1 3.73Å; P2291-Y2295 VanDerWaalsContact O-CD1 3.32Å; P2291-Y2295 WeakPolarHBondContact O-CD1 3.25Å; P2291-Y2295 WeakPolarHBondContact O-CE1 3.38Å
2292	E	98	Very high	95.1	Very high	1.33333 Å²	1.33333	17.4 Å²	17.4	1%	0.006	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-60.7	-30.1	-171.8	-70	73.4	-163.4	0	0	112.3	Y2166 Y2172 L2244 I2290 F2294 Y2295 F2296 M2299	Y2166-E2292 WeakPolarHBondContact CE1-OE1 3.42Å; Y2166-E2292 PolarHBondContact OH-OE1 3.06Å; Y2172-E2292 WeakPolarHBondContact CE1-OE1 3.3Å; Y2172-E2292 PolarHBondContact OH-OE1 3.11Å; L2244-E2292 HydrophobicContact CD2-CB 4.34Å; L2244-E2292 HydrophobicContact CD2-CG 4.09Å; I2290-E2292 VanDerWaalsContact CB-OE2 3.27Å; I2290-E2292 WeakPolarHBondContact CB-OE2 3.34Å; I2290-E2292 HydrophobicContact CD1-CB 4.24Å; I2290-E2292 HydrophobicContact CD1-CG 4.43Å; I2290-E2292 VanDerWaalsContact CD1-OE2 3.31Å; I2290-E2292 WeakPolarHBondContact CD1-OE2 3.45Å; I2290-E2292 HydrophobicContact CG1-CB 4.29Å; I2290-E2292 VanDerWaalsContact CG1-OE2 3.25Å; I2290-E2292 WeakPolarHBondContact CG1-OE2 3.34Å; I2290-E2292 PolarHBondContact O-N 2.93Å; I2290-E2292 VanDerWaalsContact O-N 3.11Å; E2292-F2294 PolarHBondContact O-N 3.14Å; E2292-Y2295 HydrophobicContact CG-CE1 4.4Å; E2292-Y2295 HydrophobicContact CG-CE2 4.39Å; E2292-Y2295 PolarHBondContact O-N 3.12Å; E2292-Y2295 VanDerWaalsContact O-N 3.07Å; E2292-Y2295 PolarHBondContact OE1-OH 3.23Å; E2292-F2296 HydrophobicContact CB-CB 3.98Å; E2292-F2296 HydrophobicContact CB-CD1 4.4Å; E2292-F2296 HydrophobicContact CG-CB 4.28Å; E2292-F2296 HydrophobicContact CG-CD1 4.26Å; E2292-F2296 PolarHBondContact O-N 2.96Å; E2292-M2299 HydrophobicContact CB-CE 4.07Å; E2292-M2299 HydrophobicContact CB-SD 3.69Å; E2292-M2299 VanDerWaalsContact CB-SD 3.55Å
2293	F	98.1	Very high	95.1	Very high	0.333333 Å²	0.333333	16.7 Å²	16.7	0%	0.001	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-56.4	-15.7	172	-85.9	-99.6	0	0	0	114.2	Y2243 F2269 L2289 I2290 P2291 M2299 F2300 F2332 N2336	Y2243-F2293 AromaticContact CD1-CE2 3.59Å; Y2243-F2293 HydrophobicContact CD1-CE2 3.59Å; Y2243-F2293 AromaticContact CD1-CZ 3.65Å; Y2243-F2293 HydrophobicContact CD1-CZ 3.65Å; Y2243-F2293 HydrophobicContact CD2-CE2 4.29Å; Y2243-F2293 AromaticContact CE1-CE2 3.71Å; Y2243-F2293 HydrophobicContact CE1-CE2 3.71Å; Y2243-F2293 AromaticContact CE1-CZ 3.54Å; Y2243-F2293 HydrophobicContact CE1-CZ 3.54Å; Y2243-F2293 VanDerWaalsContact CE1-CZ 3.43Å; Y2243-F2293 HydrophobicContact CE2-CE2 4.39Å; Y2243-F2293 AromaticContact CG-CE2 3.89Å; Y2243-F2293 HydrophobicContact CG-CE2 3.89Å; Y2243-F2293 HydrophobicContact CG-CZ 4.41Å; F2269-F2293 HydrophobicContact CE1-CZ 4.21Å; F2269-F2293 HydrophobicContact CE2-CZ 4.31Å; F2269-F2293 HydrophobicContact CZ-CE1 4.14Å; F2269-F2293 AromaticContact CZ-CZ 3.7Å; F2269-F2293 HydrophobicContact CZ-CZ 3.7Å; L2289-F2293 HydrophobicContact CB-CD2 4.43Å; L2289-F2293 HydrophobicContact CD1-CB 4.2Å; L2289-F2293 HydrophobicContact CD1-CD1 4.15Å; L2289-F2293 HydrophobicContact CD1-CG 4.13Å; L2289-F2293 HydrophobicContact CD2-CD1 3.94Å; L2289-F2293 HydrophobicContact CD2-CD2 3.96Å; L2289-F2293 HydrophobicContact CD2-CE1 3.86Å; L2289-F2293 HydrophobicContact CD2-CE2 3.87Å; L2289-F2293 HydrophobicContact CD2-CG 4Å; L2289-F2293 HydrophobicContact CD2-CZ 3.83Å; L2289-F2293 HydrophobicContact CG-CG 4.47Å; I2290-F2293 HydrophobicContact CG1-CD2 3.83Å; I2290-F2293 HydrophobicContact CG1-CE2 4.12Å; I2290-F2293 PolarHBondContact O-N 2.9Å; P2291-F2293 PolarHBondContact O-N 3.25Å; P2291-F2293 VanDerWaalsContact O-N 3.17Å; F2293-M2299 HydrophobicContact CD2-CE 3.73Å; F2293-M2299 HydrophobicContact CD2-SD 4.14Å; F2293-M2299 HydrophobicContact CE2-CE 3.53Å; F2293-M2299 VanDerWaalsContact CE2-CE 3.46Å; F2293-M2299 HydrophobicContact CE2-SD 4.37Å; F2293-M2299 HydrophobicContact CG-CE 4.03Å; F2293-M2299 HydrophobicContact CZ-CE 4.1Å; F2293-F2300 HydrophobicContact CD1-CE1 4.22Å; F2293-F2300 AromaticContact CD1-CZ 3.83Å; F2293-F2300 HydrophobicContact CD1-CZ 3.83Å; F2293-F2300 AromaticContact CE1-CE1 3.86Å; F2293-F2300 HydrophobicContact CE1-CE1 3.86Å; F2293-F2300 AromaticContact CE1-CZ 3.92Å; F2293-F2300 HydrophobicContact CE1-CZ 3.95Å; F2293-F2300 HydrophobicContact CG-CZ 4.23Å; F2293-F2300 HydrophobicContact CZ-CE1 4.22Å; F2293-F2300 HydrophobicContact CZ-CZ 4.43Å; F2293-F2332 AromaticContact CD1-CE1 3.93Å; F2293-F2332 HydrophobicContact CD1-CE1 4.01Å; F2293-F2332 HydrophobicContact CD1-CZ 4.21Å; F2293-F2332 HydrophobicContact CE1-CE1 4.4Å; F2293-F2332 HydrophobicContact CE1-CZ 4.47Å; F2293-N2336 PolarHBondContact O-ND2 2.96Å
2294	F	97.8	Very high	95.1	Very high	1.66667 Å²	1.66667	13.4 Å²	13.4	1%	0.007	7%	0.073	C	C	.	.	G	3₁₀ helix	trans	-116.6	6.1	-176.1	-56.9	-84.4	0	0	0	113.6	F2152 F2175 P2176 V2178 L2289 P2291 E2292 N2336 R2337 L2340	F2152-F2294 HydrophobicContact CD2-CB 3.98Å; F2152-F2294 HydrophobicContact CE2-CB 4.03Å; F2175-F2294 HydrophobicContact CB-CD2 4.28Å; F2175-F2294 HydrophobicContact CB-CE2 3.76Å; F2175-F2294 AromaticContact CD1-CD2 3.67Å; F2175-F2294 HydrophobicContact CD1-CD2 3.67Å; F2175-F2294 AromaticContact CD1-CE2 3.78Å; F2175-F2294 HydrophobicContact CD1-CE2 3.78Å; F2175-F2294 HydrophobicContact CD1-CG 4.43Å; F2175-F2294 HydrophobicContact CD1-CZ 4.47Å; F2175-F2294 HydrophobicContact CE1-CD2 4.35Å; F2175-F2294 HydrophobicContact CG-CD2 4.22Å; F2175-F2294 HydrophobicContact CG-CE2 4.15Å; P2176-F2294 WeakPolarHBondContact O-CZ 3.4Å; V2178-F2294 HydrophobicContact CB-CE1 4.46Å; V2178-F2294 HydrophobicContact CG2-CE1 3.99Å; V2178-F2294 HydrophobicContact CG2-CZ 3.98Å; L2289-F2294 HydrophobicContact CB-CE2 4.3Å; L2289-F2294 HydrophobicContact CD1-CE2 4.02Å; L2289-F2294 HydrophobicContact CD1-CZ 3.94Å; P2291-F2294 WeakPolarHBondContact O-CB 3.37Å; P2291-F2294 PolarHBondContact O-N 3.03Å; E2292-F2294 PolarHBondContact O-N 3.14Å; F2294-N2336 HydrophobicContact CD1-CB 4.42Å; F2294-N2336 WeakPolarHBondContact CD1-ND2 3.36Å; F2294-N2336 WeakPolarHBondContact CD1-O 3.36Å; F2294-N2336 HydrophobicContact CE1-CB 4.47Å; F2294-N2336 VanDerWaalsContact CE1-CG 3.46Å; F2294-N2336 VanDerWaalsContact CE1-ND2 3.26Å; F2294-N2336 WeakPolarHBondContact CE1-ND2 3.26Å; F2294-N2336 WeakPolarHBondContact CE1-O 3.26Å; F2294-N2336 WeakPolarHBondContact CE1-OD1 3.44Å; F2294-R2337 PolarHBondContact O-NH1 3.29Å; F2294-L2340 HydrophobicContact CB-CD2 4.33Å; F2294-L2340 HydrophobicContact CD1-CB 3.82Å; F2294-L2340 HydrophobicContact CD1-CD2 3.69Å; F2294-L2340 HydrophobicContact CD1-CG 4.31Å; F2294-L2340 HydrophobicContact CD2-CD2 4.47Å; F2294-L2340 HydrophobicContact CE1-CB 3.8Å; F2294-L2340 HydrophobicContact CE1-CD1 4.48Å; F2294-L2340 HydrophobicContact CE1-CD2 4.08Å; F2294-L2340 HydrophobicContact CE1-CG 4.34Å; F2294-L2340 HydrophobicContact CG-CD2 3.91Å
2295	Y	96.5	Very high	95.1	Very high	12 Å²	12	15.1 Å²	15.1	5%	0.047	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-155.5	-13.9	174.8	72	-104	0	0	0	117.6	R1893 H1894 R1895 F2152 P2291 E2292 P2297	R1893-Y2295 HydrophobicContact CB-CD1 4.07Å; R1893-Y2295 HydrophobicContact CB-CD2 3.83Å; R1893-Y2295 HydrophobicContact CB-CE1 3.91Å; R1893-Y2295 HydrophobicContact CB-CE2 3.72Å; R1893-Y2295 HydrophobicContact CB-CG 4.01Å; R1893-Y2295 HydrophobicContact CG-CD1 3.63Å; R1893-Y2295 HydrophobicContact CG-CD2 4.21Å; R1893-Y2295 HydrophobicContact CG-CE1 3.74Å; R1893-Y2295 HydrophobicContact CG-CE2 4.36Å; R1893-Y2295 HydrophobicContact CG-CG 3.85Å; H1894-Y2295 PolarHBondContact N-OH 3.24Å; H1894-Y2295 VanDerWaalsContact N-OH 3.08Å; H1894-Y2295 VanDerWaalsContact O-CE2 3.32Å; H1894-Y2295 WeakPolarHBondContact O-CE2 3.37Å; R1895-Y2295 HydrophobicContact CG-CD2 3.62Å; R1895-Y2295 VanDerWaalsContact CG-CD2 3.48Å; R1895-Y2295 HydrophobicContact CG-CE2 3.93Å; R1895-Y2295 PolarHBondContact NE-O 3.5Å; F2152-Y2295 AromaticContact CE2-CD1 3.75Å; F2152-Y2295 HydrophobicContact CE2-CD1 3.75Å; F2152-Y2295 HydrophobicContact CE2-CE1 4.34Å; F2152-Y2295 AromaticContact CZ-CD1 3.52Å; F2152-Y2295 HydrophobicContact CZ-CD1 3.52Å; F2152-Y2295 VanDerWaalsContact CZ-CD1 3.49Å; F2152-Y2295 AromaticContact CZ-CE1 3.87Å; F2152-Y2295 HydrophobicContact CZ-CE1 3.87Å; P2291-Y2295 HydrophobicContact CB-CD1 4.39Å; P2291-Y2295 HydrophobicContact CB-CE1 3.73Å; P2291-Y2295 VanDerWaalsContact O-CD1 3.32Å; P2291-Y2295 WeakPolarHBondContact O-CD1 3.25Å; P2291-Y2295 WeakPolarHBondContact O-CE1 3.38Å; E2292-Y2295 HydrophobicContact CG-CE1 4.4Å; E2292-Y2295 HydrophobicContact CG-CE2 4.39Å; E2292-Y2295 PolarHBondContact O-N 3.12Å; E2292-Y2295 VanDerWaalsContact O-N 3.07Å; E2292-Y2295 PolarHBondContact OE1-OH 3.23Å; Y2295-P2297 WeakPolarHBondContact O-CD 3.33Å
2296	F	96.7	Very high	95	Very high	1 Å²	1	14.7 Å²	14.7	0%	0.004	8%	0.075	C	C	.	.			trans	-120.4	87.9	-167.9	-167.9	-133.5	0	0	0	111.8	L1884 L1897 I2247 E2292 E2298 M2299	L1884-F2296 HydrophobicContact CD1-CE1 4.11Å; L1884-F2296 HydrophobicContact CD1-CE2 4.03Å; L1884-F2296 HydrophobicContact CD1-CZ 3.6Å; L1884-F2296 VanDerWaalsContact CD1-CZ 3.49Å; L1897-F2296 HydrophobicContact CD2-CE2 4.48Å; L1897-F2296 HydrophobicContact CD2-CZ 4Å; L1897-F2296 HydrophobicContact CG-CE2 4.45Å; L1897-F2296 HydrophobicContact CG-CZ 4.35Å; I2247-F2296 HydrophobicContact CD1-CE1 4.2Å; I2247-F2296 HydrophobicContact CD1-CZ 4.28Å; I2247-F2296 HydrophobicContact CG1-CE1 4.03Å; I2247-F2296 HydrophobicContact CG1-CZ 4.46Å; I2247-F2296 HydrophobicContact CG2-CE1 4.31Å; I2247-F2296 HydrophobicContact CG2-CZ 4.41Å; E2292-F2296 HydrophobicContact CB-CB 3.98Å; E2292-F2296 HydrophobicContact CB-CD1 4.4Å; E2292-F2296 HydrophobicContact CG-CB 4.28Å; E2292-F2296 HydrophobicContact CG-CD1 4.26Å; E2292-F2296 PolarHBondContact O-N 2.96Å; F2296-E2298 VanDerWaalsContact C-N 3.31Å; F2296-E2298 HydrophobicContact CD2-CB 4.38Å; F2296-E2298 VanDerWaalsContact CD2-OE2 3.26Å; F2296-E2298 WeakPolarHBondContact CD2-OE2 3.3Å; F2296-E2298 HydrophobicContact CE1-CB 4.39Å; F2296-E2298 HydrophobicContact CE2-CB 3.88Å; F2296-E2298 VanDerWaalsContact CE2-CD 3.42Å; F2296-E2298 HydrophobicContact CE2-CG 4.3Å; F2296-E2298 VanDerWaalsContact CE2-OE2 3.26Å; F2296-E2298 WeakPolarHBondContact CE2-OE2 3.36Å; F2296-E2298 HydrophobicContact CZ-CB 3.87Å; F2296-E2298 PolarHBondContact O-N 3.02Å; F2296-M2299 HydrophobicContact CD1-CB 3.96Å; F2296-M2299 HydrophobicContact CE1-CB 4.35Å; F2296-M2299 WeakPolarHBondContact O-CG 3.2Å
2297	P	96.6	Very high	94.6	Very high	17 Å²	17	16 Å²	16	11%	0.11	9%	0.089	C	C	.	.	G	3₁₀ helix	trans	-64.4	-28.6	-177.5	23.7	-32	0	0	0	113.6	Y2295 M2299 F2300 P2329 E2330 V2333	Y2295-P2297 WeakPolarHBondContact O-CD 3.33Å; P2297-M2299 VanDerWaalsContact C-N 3.27Å; P2297-M2299 PolarHBondContact O-N 2.88Å; P2297-M2299 VanDerWaalsContact O-N 3.13Å; P2297-F2300 VanDerWaalsContact O-CD2 3.29Å; P2297-F2300 WeakPolarHBondContact O-CD2 3.39Å; P2297-F2300 PolarHBondContact O-N 3.04Å; P2297-F2300 VanDerWaalsContact O-N 3.11Å; P2297-P2329 HydrophobicContact CB-CB 3.73Å; P2297-P2329 VanDerWaalsContact O-CB 3.25Å; P2297-P2329 WeakPolarHBondContact O-CB 3.36Å; P2297-E2330 HydrophobicContact CB-CB 4.42Å; P2297-E2330 HydrophobicContact CB-CG 3.96Å; P2297-E2330 HydrophobicContact CG-CG 4Å; P2297-V2333 HydrophobicContact CB-CG2 4.22Å
2298	E	95	Very high	94.3	Very high	22 Å²	22	15.2 Å²	15.2	10%	0.103	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-65.5	-22.9	-174	-63.2	88.5	159.1	0	0	113.4	L1897 I2247 F2296 F2300 E2301 L2303 N2788	L1897-E2298 HydrophobicContact CD1-CB 4.04Å; L1897-E2298 HydrophobicContact CD1-CG 3.82Å; I2247-E2298 HydrophobicContact CD1-CB 4.3Å; F2296-E2298 VanDerWaalsContact C-N 3.31Å; F2296-E2298 HydrophobicContact CD2-CB 4.38Å; F2296-E2298 VanDerWaalsContact CD2-OE2 3.26Å; F2296-E2298 WeakPolarHBondContact CD2-OE2 3.3Å; F2296-E2298 HydrophobicContact CE1-CB 4.39Å; F2296-E2298 HydrophobicContact CE2-CB 3.88Å; F2296-E2298 VanDerWaalsContact CE2-CD 3.42Å; F2296-E2298 HydrophobicContact CE2-CG 4.3Å; F2296-E2298 VanDerWaalsContact CE2-OE2 3.26Å; F2296-E2298 WeakPolarHBondContact CE2-OE2 3.36Å; F2296-E2298 HydrophobicContact CZ-CB 3.87Å; F2296-E2298 PolarHBondContact O-N 3.02Å; E2298-F2300 PolarHBondContact O-N 3.22Å; E2298-F2300 VanDerWaalsContact O-N 3.12Å; E2298-E2301 PolarHBondContact O-N 2.99Å; E2298-E2301 VanDerWaalsContact O-N 3.08Å; E2298-L2303 HydrophobicContact CB-CD1 3.93Å; E2298-L2303 HydrophobicContact CG-CD1 4.01Å; E2298-N2788 PolarHBondContact OE1-ND2 3.36Å
2299	M	96.1	Very high	93.8	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	-59.5	-22.3	174.9	102.7	179.7	-51.3	0	0	113.7	Y2243 L2244 F2269 I2290 E2292 F2293 F2296 P2297	Y2243-M2299 WeakPolarHBondContact O-CE 3.16Å; Y2243-M2299 WeakPolarHBondContact O-CG 3.41Å; L2244-M2299 HydrophobicContact CD2-CB 4.19Å; L2244-M2299 HydrophobicContact CD2-CE 4.11Å; L2244-M2299 HydrophobicContact CD2-CG 3.95Å; L2244-M2299 HydrophobicContact CD2-SD 4.09Å; L2244-M2299 VanDerWaalsContact CD2-SD 3.55Å; L2244-M2299 HydrophobicContact CG-SD 4.4Å; F2269-M2299 HydrophobicContact CE1-CE 4.3Å; I2290-M2299 HydrophobicContact CD1-CE 4.25Å; I2290-M2299 HydrophobicContact CD1-SD 3.96Å; E2292-M2299 HydrophobicContact CB-CE 4.07Å; E2292-M2299 HydrophobicContact CB-SD 3.69Å; E2292-M2299 VanDerWaalsContact CB-SD 3.55Å; F2293-M2299 HydrophobicContact CD2-CE 3.73Å; F2293-M2299 HydrophobicContact CD2-SD 4.14Å; F2293-M2299 HydrophobicContact CE2-CE 3.53Å; F2293-M2299 VanDerWaalsContact CE2-CE 3.46Å; F2293-M2299 HydrophobicContact CE2-SD 4.37Å; F2293-M2299 HydrophobicContact CG-CE 4.03Å; F2293-M2299 HydrophobicContact CZ-CE 4.1Å; F2296-M2299 HydrophobicContact CD1-CB 3.96Å; F2296-M2299 HydrophobicContact CE1-CB 4.35Å; F2296-M2299 WeakPolarHBondContact O-CG 3.2Å; P2297-M2299 VanDerWaalsContact C-N 3.27Å; P2297-M2299 PolarHBondContact O-N 2.88Å; P2297-M2299 VanDerWaalsContact O-N 3.13Å
2300	F	97.2	Very high	93.4	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	-90	-9.9	179.6	-54.9	-72.6	0	0	0	112.8	F2269 V2272 F2293 P2297 E2298 T2319 V2320 L2322 P2329 F2332 V2333	F2269-F2300 AromaticContact CE1-CD1 3.93Å; F2269-F2300 HydrophobicContact CE1-CD1 4.03Å; F2269-F2300 AromaticContact CE1-CE1 3.89Å; F2269-F2300 HydrophobicContact CE1-CE1 3.94Å; F2269-F2300 HydrophobicContact CZ-CD1 4.22Å; F2269-F2300 AromaticContact CZ-CE1 3.9Å; F2269-F2300 HydrophobicContact CZ-CE1 3.9Å; V2272-F2300 HydrophobicContact CG2-CD1 4.47Å; V2272-F2300 HydrophobicContact CG2-CE1 4.27Å; F2293-F2300 HydrophobicContact CD1-CE1 4.22Å; F2293-F2300 AromaticContact CD1-CZ 3.83Å; F2293-F2300 HydrophobicContact CD1-CZ 3.83Å; F2293-F2300 AromaticContact CE1-CE1 3.86Å; F2293-F2300 HydrophobicContact CE1-CE1 3.86Å; F2293-F2300 AromaticContact CE1-CZ 3.92Å; F2293-F2300 HydrophobicContact CE1-CZ 3.95Å; F2293-F2300 HydrophobicContact CG-CZ 4.23Å; F2293-F2300 HydrophobicContact CZ-CE1 4.22Å; F2293-F2300 HydrophobicContact CZ-CZ 4.43Å; P2297-F2300 VanDerWaalsContact O-CD2 3.29Å; P2297-F2300 WeakPolarHBondContact O-CD2 3.39Å; P2297-F2300 PolarHBondContact O-N 3.04Å; P2297-F2300 VanDerWaalsContact O-N 3.11Å; E2298-F2300 PolarHBondContact O-N 3.22Å; E2298-F2300 VanDerWaalsContact O-N 3.12Å; F2300-T2319 CarbonylContact O-C 3.54Å; F2300-T2319 WeakPolarHBondContact O-CA 3.45Å; F2300-T2319 VanDerWaalsContact O-CG2 3.29Å; F2300-T2319 WeakPolarHBondContact O-CG2 3.2Å; F2300-V2320 HydrophobicContact CB-CB 4.15Å; F2300-V2320 HydrophobicContact CB-CG2 4.44Å; F2300-V2320 HydrophobicContact CD1-CB 4.09Å; F2300-V2320 HydrophobicContact CD1-CG1 4.11Å; F2300-V2320 HydrophobicContact CD1-CG2 4.31Å; F2300-V2320 PolarHBondContact O-N 3.15Å; F2300-L2322 HydrophobicContact CB-CD2 4.33Å; F2300-L2322 HydrophobicContact CD1-CD2 4.33Å; F2300-L2322 HydrophobicContact CG-CD2 4.26Å; F2300-P2329 HydrophobicContact CB-CB 4.12Å; F2300-P2329 HydrophobicContact CB-CG 4.21Å; F2300-P2329 HydrophobicContact CD2-CB 4.23Å; F2300-F2332 HydrophobicContact CD2-CD1 4.36Å; F2300-F2332 HydrophobicContact CE1-CD1 4.42Å; F2300-F2332 HydrophobicContact CE1-CE1 4.04Å; F2300-F2332 AromaticContact CE2-CD1 3.79Å; F2300-F2332 HydrophobicContact CE2-CD1 3.79Å; F2300-F2332 AromaticContact CE2-CE1 3.9Å; F2300-F2332 HydrophobicContact CE2-CE1 3.94Å; F2300-F2332 AromaticContact CZ-CD1 3.84Å; F2300-F2332 HydrophobicContact CZ-CD1 3.84Å; F2300-F2332 AromaticContact CZ-CE1 3.5Å; F2300-F2332 HydrophobicContact CZ-CE1 3.5Å; F2300-F2332 VanDerWaalsContact CZ-CE1 3.42Å; F2300-F2332 HydrophobicContact CZ-CZ 4.43Å; F2300-V2333 HydrophobicContact CD2-CG2 4.43Å; F2300-V2333 HydrophobicContact CE2-CG2 3.83Å
2301	E	94.2	Very high	93	Very high	40.6667 Å²	40.6667	19 Å²	19	19%	0.19	11%	0.114	C	C	.	.	S	Bend	trans	-105.1	143.1	-175.9	-59.3	-168.1	142.1	0	0	111.9	R2246 E2298 L2303 P2329 K2790	R2246-E2301 VanDerWaalsContact CB-O 3.27Å; R2246-E2301 WeakPolarHBondContact CB-O 3.34Å; R2246-E2301 WeakPolarHBondContact CG-O 3.35Å; E2298-E2301 PolarHBondContact O-N 2.99Å; E2298-E2301 VanDerWaalsContact O-N 3.08Å; E2301-L2303 VanDerWaalsContact C-N 3.29Å; E2301-L2303 HydrophobicContact CB-CD2 4.12Å; E2301-L2303 HydrophobicContact CB-CG 4.03Å; E2301-L2303 PolarHBondContact O-N 3.39Å; E2301-L2303 VanDerWaalsContact O-N 3.14Å; E2301-P2329 HydrophobicContact CG-CB 4.45Å; E2301-P2329 HydrophobicContact CG-CG 3.69Å; E2301-K2790 IonicContact OE1-NZ 2.74Å; E2301-K2790 PolarHBondContact OE1-NZ 3.39Å; E2301-K2790 IonicContact OE2-NZ 2.68Å
2302	N	92.8	Very high	92.5	Very high	8.33333 Å²	8.33333	25.2 Å²	25.2	5%	0.045	15%	0.147	C	C	.	.			trans	-88.1	57	175.9	-166.7	14.7	0	0	0	112.2	R2246 N2304 D2305 L2306 D2318	R2246-N2302 HydrophobicContact CG-CB 4.48Å; N2302-N2304 PolarHBondContact O-N 2.98Å; N2302-D2305 PolarHBondContact O-N 3.19Å; N2302-L2306 PolarHBondContact ND2-N 3Å; N2302-L2306 VanDerWaalsContact ND2-N 3.19Å; N2302-L2306 PolarHBondContact ND2-O 2.89Å; N2302-L2306 WeakPolarHBondContact OD1-CB 3.26Å; N2302-L2306 WeakPolarHBondContact OD1-CG 3.36Å; N2302-L2306 PolarHBondContact OD1-N 2.92Å; N2302-D2318 VanDerWaalsContact CB-OD1 3.27Å; N2302-D2318 WeakPolarHBondContact CB-OD1 3.36Å; N2302-D2318 PolarHBondContact ND2-OD1 3.16Å
2303	L	88.6	Confident	92	Very high	55.6667 Å²	55.6667	31.3 Å²	31.3	29%	0.291	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-24.5	-172.6	-64.7	176.3	0	0	0	114.5	K1879 L1897 E2298 E2301	K1879-L2303 PolarHBondContact NZ-O 2.75Å; L1897-L2303 HydrophobicContact CD1-CD1 3.44Å; L1897-L2303 VanDerWaalsContact CD1-CD1 3.44Å; E2298-L2303 HydrophobicContact CB-CD1 3.93Å; E2298-L2303 HydrophobicContact CG-CD1 4.01Å; E2301-L2303 VanDerWaalsContact C-N 3.29Å; E2301-L2303 HydrophobicContact CB-CD2 4.12Å; E2301-L2303 HydrophobicContact CB-CG 4.03Å; E2301-L2303 PolarHBondContact O-N 3.39Å; E2301-L2303 VanDerWaalsContact O-N 3.14Å
2304	N	88.8	Confident	91.5	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.016	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	2.5	-179.7	-69.7	-43.9	0	0	0	113.7	K1879 Y1881 F1882 R2246 N2302 L2306	K1879-N2304 PolarHBondContact NZ-O 2.98Å; Y1881-N2304 WeakPolarHBondContact CA-OD1 3.45Å; Y1881-N2304 WeakPolarHBondContact CB-OD1 3.37Å; Y1881-N2304 HydrophobicContact CD1-CB 4.11Å; Y1881-N2304 WeakPolarHBondContact CD1-OD1 3.31Å; Y1881-N2304 WeakPolarHBondContact CE1-O 3.24Å; F1882-N2304 PolarHBondContact N-OD1 3.13Å; F1882-N2304 PolarHBondContact O-ND2 2.91Å; F1882-N2304 VanDerWaalsContact O-ND2 3.16Å; F1882-N2304 PolarHBondContact O-OD1 2.83Å; R2246-N2304 PolarHBondContact O-ND2 3.48Å; N2302-N2304 PolarHBondContact O-N 2.98Å; N2304-L2306 HydrophobicContact CB-CD2 4.14Å; N2304-L2306 HydrophobicContact CB-CG 4.24Å
2305	D	88.3	Confident	91	Very high	100.667 Å²	100.667	36.7 Å²	36.7	54%	0.538	22%	0.221	S	C	.	.			trans	48.9	51.1	-171.8	-51.5	-29.1	0	0	0	113	K1879 N1905 N2302	K1879-D2305 VanDerWaalsContact CE-OD2 3.22Å; K1879-D2305 WeakPolarHBondContact CE-OD2 3.45Å; K1879-D2305 VanDerWaalsContact NZ-CB 3.28Å; K1879-D2305 VanDerWaalsContact NZ-CG 3.27Å; K1879-D2305 VanDerWaalsContact NZ-N 3.17Å; K1879-D2305 IonicContact NZ-OD1 3.28Å; K1879-D2305 PolarHBondContact NZ-OD1 3.14Å; K1879-D2305 IonicContact NZ-OD2 3.23Å; K1879-D2305 PolarHBondContact NZ-OD2 3.27Å; N1905-D2305 WeakPolarHBondContact CB-O 3.44Å; N2302-D2305 PolarHBondContact O-N 3.19Å
2306	L	88.2	Confident	90.7	Very high	5.33333 Å²	5.33333	41.3 Å²	41.3	3%	0.028	25%	0.246	C	C	.	.			trans	-67.3	136.1	177.4	-57.5	176.5	0	0	0	111.3	Y1906 L2245 T2251 F2262 N2302 N2304 L2308	Y1906-L2306 HydrophobicContact CD2-CD2 3.8Å; Y1906-L2306 HydrophobicContact CE2-CD2 4.43Å; L2245-L2306 WeakPolarHBondContact O-CD1 3.29Å; T2251-L2306 HydrophobicContact CG2-CD1 3.65Å; T2251-L2306 HydrophobicContact CG2-CD2 3.99Å; T2251-L2306 HydrophobicContact CG2-CG 4.47Å; F2262-L2306 HydrophobicContact CZ-CB 4.4Å; F2262-L2306 HydrophobicContact CZ-CD2 4.46Å; N2302-L2306 PolarHBondContact ND2-N 3Å; N2302-L2306 VanDerWaalsContact ND2-N 3.19Å; N2302-L2306 PolarHBondContact ND2-O 2.89Å; N2302-L2306 WeakPolarHBondContact OD1-CB 3.26Å; N2302-L2306 WeakPolarHBondContact OD1-CG 3.36Å; N2302-L2306 PolarHBondContact OD1-N 2.92Å; N2304-L2306 HydrophobicContact CB-CD2 4.14Å; N2304-L2306 HydrophobicContact CB-CG 4.24Å; L2306-L2308 VanDerWaalsContact C-N 3.33Å; L2306-L2308 HydrophobicContact CB-CD1 4.49Å; L2306-L2308 HydrophobicContact CB-CD2 3.87Å; L2306-L2308 HydrophobicContact CB-CG 3.96Å; L2306-L2308 HydrophobicContact CD1-CD2 4.33Å; L2306-L2308 PolarHBondContact O-N 2.92Å
2307	G	86.4	Confident	90.4	Very high	31.3333 Å²	31.3333	41.4 Å²	41.4	32%	0.323	25%	0.247	S	C	.	.			trans	-79.6	78.1	174.6	0	0	0	0	0	113	A1910 G2309	A1910-G2307 WeakPolarHBondContact CA-O 3.35Å; A1910-G2307 WeakPolarHBondContact CB-O 3.31Å; G2307-G2309 VanDerWaalsContact C-N 3.3Å; G2307-G2309 PolarHBondContact O-N 3.24Å
2308	L	88.2	Confident	90.1	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.016	26%	0.257	C	S	.	.			trans	-84.9	-1.5	-173.2	-55.1	175.3	0	0	0	115	F1911 L2245 R2246 F2262 I2268 L2306 V2317	F1911-L2308 VanDerWaalsContact CZ-O 3.31Å; F1911-L2308 WeakPolarHBondContact CZ-O 3.49Å; L2245-L2308 HydrophobicContact CD2-CD2 4.04Å; L2245-L2308 HydrophobicContact CG-CD2 4.42Å; R2246-L2308 HydrophobicContact CG-CD1 4.19Å; F2262-L2308 HydrophobicContact CD1-CD2 3.83Å; F2262-L2308 HydrophobicContact CD2-CD2 4.42Å; F2262-L2308 HydrophobicContact CE1-CD2 3.73Å; F2262-L2308 HydrophobicContact CE2-CD2 4.33Å; F2262-L2308 HydrophobicContact CG-CD2 4.19Å; F2262-L2308 HydrophobicContact CZ-CD2 4Å; I2268-L2308 HydrophobicContact CD1-CB 4.43Å; I2268-L2308 HydrophobicContact CD1-CD2 4.44Å; L2306-L2308 VanDerWaalsContact C-N 3.33Å; L2306-L2308 HydrophobicContact CB-CD1 4.49Å; L2306-L2308 HydrophobicContact CB-CD2 3.87Å; L2306-L2308 HydrophobicContact CB-CG 3.96Å; L2306-L2308 HydrophobicContact CD1-CD2 4.33Å; L2306-L2308 PolarHBondContact O-N 2.92Å; L2308-V2317 HydrophobicContact CB-CB 3.97Å; L2308-V2317 HydrophobicContact CB-CG1 3.68Å; L2308-V2317 WeakPolarHBondContact CB-O 3.47Å; L2308-V2317 HydrophobicContact CD1-CG1 4.04Å; L2308-V2317 HydrophobicContact CG-CG1 4.41Å
2309	G	88.5	Confident	90.1	Very high	19.3333 Å²	19.3333	45.5 Å²	45.5	20%	0.199	27%	0.271	C	S	.	.			trans	87	-166.4	172.8	0	0	0	0	0	115.1	F1911 G2307 N2316 V2317	F1911-G2309 VanDerWaalsContact CE2-CA 3.43Å; G2307-G2309 VanDerWaalsContact C-N 3.3Å; G2307-G2309 PolarHBondContact O-N 3.24Å; G2309-N2316 PolarHBondContact O-OD1 2.78Å; G2309-V2317 WeakPolarHBondContact O-CB 3.28Å; G2309-V2317 PolarHBondContact O-N 2.9Å
2310	V	89.6	Confident	90.1	Very high	69.6667 Å²	69.6667	45.7 Å²	45.7	42%	0.422	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-129.6	133.7	-176.4	-174.2	0	0	0	0	108.5	P2265 G2314 I2315 N2316	P2265-V2310 WeakPolarHBondContact CB-O 3.18Å; P2265-V2310 WeakPolarHBondContact CG-O 3.3Å; V2310-G2314 VanDerWaalsContact CG1-C 3.43Å; V2310-I2315 CarbonylContact C-O 3.55Å; V2310-I2315 WeakPolarHBondContact CA-O 3.37Å; V2310-N2316 HydrophobicContact CG2-CB 4.46Å
2311	T	89.2	Confident	90.1	Very high	6.33333 Å²	6.33333	49.3 Å²	49.3	4%	0.039	29%	0.291	C	S	.	.			trans	-66.9	164.2	177.1	63.4	0	0	0	0	112.5	P2265 D2266 Y2270 D2313 G2314 I2315 V2317	P2265-T2311 HydrophobicContact CB-CG2 4.22Å; D2266-T2311 WeakPolarHBondContact OD1-CB 3.4Å; D2266-T2311 WeakPolarHBondContact OD2-CA 3.33Å; Y2270-T2311 HydrophobicContact CD1-CG2 4.34Å; Y2270-T2311 HydrophobicContact CD2-CG2 4.49Å; Y2270-T2311 HydrophobicContact CE1-CG2 4.21Å; Y2270-T2311 HydrophobicContact CE2-CG2 4.41Å; Y2270-T2311 HydrophobicContact CG-CG2 4.46Å; T2311-D2313 PolarHBondContact O-N 3.05Å; T2311-D2313 PolarHBondContact OG1-N 3.38Å; T2311-G2314 WeakPolarHBondContact O-CA 3.36Å; T2311-G2314 PolarHBondContact O-N 2.97Å; T2311-G2314 PolarHBondContact OG1-N 3.11Å; T2311-I2315 HydrophobicContact CG2-CB 4.3Å; T2311-I2315 PolarHBondContact N-O 2.94Å; T2311-I2315 WeakPolarHBondContact OG1-CA 3.33Å; T2311-I2315 VanDerWaalsContact OG1-CB 3.28Å; T2311-I2315 WeakPolarHBondContact OG1-CB 3.44Å; T2311-I2315 PolarHBondContact OG1-N 3.22Å; T2311-I2315 PolarHBondContact OG1-O 3.03Å; T2311-V2317 HydrophobicContact CG2-CG2 3.8Å
2312	D	87.9	Confident	90.2	Very high	130.333 Å²	130.333	49 Å²	49	70%	0.697	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-31.8	173.3	-69.5	-26	0	0	0	112.4	H2264 D2266 G2314	H2264-D2312 IonicContact CE1-OD1 3.28Å; H2264-D2312 IonicContact CE1-OD2 3.01Å; D2266-D2312 PolarHBondContact OD1-N 3.36Å; D2266-D2312 VanDerWaalsContact OD1-N 3.17Å; D2266-D2312 PolarHBondContact OD2-N 3.11Å; D2266-D2312 VanDerWaalsContact OD2-N 3.14Å; D2312-G2314 PolarHBondContact O-N 3.11Å
2313	D	86.4	Confident	90.4	Very high	129 Å²	129	48.6 Å²	48.6	69%	0.69	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-0.1	173	-74.6	-29.5	0	0	0	114	T2311 I2315	T2311-D2313 PolarHBondContact O-N 3.05Å; T2311-D2313 PolarHBondContact OG1-N 3.38Å; D2313-I2315 VanDerWaalsContact C-N 3.34Å; D2313-I2315 HydrophobicContact CB-CD1 4.3Å; D2313-I2315 HydrophobicContact CB-CG1 4.31Å; D2313-I2315 PolarHBondContact O-N 2.8Å
2314	G	87.5	Confident	90.8	Very high	55.3333 Å²	55.3333	49.6 Å²	49.6	57%	0.57	30%	0.298	S	S	*	.	S	Bend	trans	81.1	11.7	-179.6	0	0	0	0	0	115.4	V2310 T2311 D2312	V2310-G2314 VanDerWaalsContact CG1-C 3.43Å; T2311-G2314 WeakPolarHBondContact O-CA 3.36Å; T2311-G2314 PolarHBondContact O-N 2.97Å; T2311-G2314 PolarHBondContact OG1-N 3.11Å; D2312-G2314 PolarHBondContact O-N 3.11Å
2315	I	88.7	Confident	91.1	Very high	60 Å²	60	50.1 Å²	50.1	31%	0.308	30%	0.3	S	S	.	.			trans	-81.8	118.7	178.4	-53.1	173.5	0	0	0	109.1	Y2270 V2310 T2311 D2313 V2317 I2321	Y2270-I2315 HydrophobicContact CE2-CD1 4.21Å; V2310-I2315 CarbonylContact C-O 3.55Å; V2310-I2315 WeakPolarHBondContact CA-O 3.37Å; T2311-I2315 HydrophobicContact CG2-CB 4.3Å; T2311-I2315 PolarHBondContact N-O 2.94Å; T2311-I2315 WeakPolarHBondContact OG1-CA 3.33Å; T2311-I2315 VanDerWaalsContact OG1-CB 3.28Å; T2311-I2315 WeakPolarHBondContact OG1-CB 3.44Å; T2311-I2315 PolarHBondContact OG1-N 3.22Å; T2311-I2315 PolarHBondContact OG1-O 3.03Å; D2313-I2315 VanDerWaalsContact C-N 3.34Å; D2313-I2315 HydrophobicContact CB-CD1 4.3Å; D2313-I2315 HydrophobicContact CB-CG1 4.31Å; D2313-I2315 PolarHBondContact O-N 2.8Å; I2315-V2317 PolarHBondContact O-N 3.09Å; I2315-I2321 HydrophobicContact CG2-CD1 3.94Å
2316	N	89.8	Confident	91.5	Very high	108.667 Å²	108.667	45.7 Å²	45.7	58%	0.581	28%	0.278	S	S	*	.	B	Isolated β-bridge	trans	-68.3	122.3	173	-175.1	61.6	0	0	0	110.3	G2309 V2310 D2318	G2309-N2316 PolarHBondContact O-OD1 2.78Å; V2310-N2316 HydrophobicContact CG2-CB 4.46Å; N2316-D2318 PolarHBondContact O-N 3.11Å
2317	V	90.4	Very high	91.7	Very high	4 Å²	4	54.2 Å²	54.2	2%	0.024	31%	0.314	C	S	.	.			trans	-83.7	115.9	179.8	-177.5	0	0	0	0	109	P2265 I2268 Y2270 L2308 G2309 T2311 I2315	P2265-V2317 HydrophobicContact CB-CG2 3.84Å; I2268-V2317 HydrophobicContact CG2-CG1 3.98Å; Y2270-V2317 HydrophobicContact CG-CG2 4.48Å; L2308-V2317 HydrophobicContact CB-CB 3.97Å; L2308-V2317 HydrophobicContact CB-CG1 3.68Å; L2308-V2317 WeakPolarHBondContact CB-O 3.47Å; L2308-V2317 HydrophobicContact CD1-CG1 4.04Å; L2308-V2317 HydrophobicContact CG-CG1 4.41Å; G2309-V2317 WeakPolarHBondContact O-CB 3.28Å; G2309-V2317 PolarHBondContact O-N 2.9Å; T2311-V2317 HydrophobicContact CG2-CG2 3.8Å; I2315-V2317 PolarHBondContact O-N 3.09Å
2318	D	91.4	Very high	92.2	Very high	59.6667 Å²	59.6667	54.6 Å²	54.6	32%	0.319	31%	0.312	S	S	.	.	S	Bend	trans	-143.8	-118.6	179.4	-179.3	69.2	0	0	0	107.6	R2246 N2302 N2316	R2246-D2318 VanDerWaalsContact CZ-O 3.26Å; R2246-D2318 PolarHBondContact NE-O 3.22Å; R2246-D2318 PolarHBondContact NH2-O 3.04Å; N2302-D2318 VanDerWaalsContact CB-OD1 3.27Å; N2302-D2318 WeakPolarHBondContact CB-OD1 3.36Å; N2302-D2318 PolarHBondContact ND2-OD1 3.16Å; N2316-D2318 PolarHBondContact O-N 3.11Å
2319	T	94	Very high	92.6	Very high	64.3333 Å²	64.3333	54.8 Å²	54.8	40%	0.395	31%	0.314	S	S	.	.	S	Bend	trans	-57.6	138.4	166.4	-59.4	0	0	0	0	110.2	F2300 I2321	F2300-T2319 CarbonylContact O-C 3.54Å; F2300-T2319 WeakPolarHBondContact O-CA 3.45Å; F2300-T2319 VanDerWaalsContact O-CG2 3.29Å; F2300-T2319 WeakPolarHBondContact O-CG2 3.2Å; T2319-I2321 PolarHBondContact O-N 3.15Å
2320	V	96.4	Very high	92.9	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.024	32%	0.315	C	S	.	.			trans	-68.5	130.4	-175.6	178.4	0	0	0	0	110.2	F2269 Y2270 V2272 F2300 L2322	F2269-V2320 HydrophobicContact CD1-CG2 4.01Å; F2269-V2320 HydrophobicContact CE1-CG1 4.01Å; F2269-V2320 HydrophobicContact CE1-CG2 3.86Å; F2269-V2320 HydrophobicContact CE2-CG1 4.29Å; F2269-V2320 HydrophobicContact CZ-CG1 3.81Å; F2269-V2320 HydrophobicContact CZ-CG2 4.49Å; Y2270-V2320 CarbonylContact O-C 3.56Å; Y2270-V2320 WeakPolarHBondContact O-CA 3.38Å; V2272-V2320 HydrophobicContact CG2-CG1 4.08Å; F2300-V2320 HydrophobicContact CB-CB 4.15Å; F2300-V2320 HydrophobicContact CB-CG2 4.44Å; F2300-V2320 HydrophobicContact CD1-CB 4.09Å; F2300-V2320 HydrophobicContact CD1-CG1 4.11Å; F2300-V2320 HydrophobicContact CD1-CG2 4.31Å; F2300-V2320 PolarHBondContact O-N 3.15Å; V2320-L2322 PolarHBondContact O-N 3.02Å; V2320-L2322 VanDerWaalsContact O-N 3.16Å
2321	I	96.6	Very high	93.2	Very high	77.6667 Å²	77.6667	55.1 Å²	55.1	40%	0.398	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-67.3	110.3	176.5	-58.5	174.8	0	0	0	109.2	Y2270 S2271 V2272 I2315 T2319	Y2270-I2321 HydrophobicContact CD2-CD1 4.24Å; Y2270-I2321 PolarHBondContact O-N 3.07Å; S2271-I2321 WeakPolarHBondContact CA-O 3.2Å; S2271-I2321 PolarHBondContact OG-O 2.9Å; V2272-I2321 PolarHBondContact N-O 2.97Å; V2272-I2321 VanDerWaalsContact N-O 3.13Å; I2315-I2321 HydrophobicContact CG2-CD1 3.94Å; T2319-I2321 PolarHBondContact O-N 3.15Å
2322	L	97.4	Very high	93.6	Very high	32.6667 Å²	32.6667	54.8 Å²	54.8	17%	0.171	30%	0.304	C	S	.	.			trans	-79.8	159.6	178.4	-60.7	-178.5	0	0	0	112	V2272 F2300 V2320 A2326 S2328 P2329 F2332	V2272-L2322 HydrophobicContact CG2-CD2 4.38Å; F2300-L2322 HydrophobicContact CB-CD2 4.33Å; F2300-L2322 HydrophobicContact CD1-CD2 4.33Å; F2300-L2322 HydrophobicContact CG-CD2 4.26Å; V2320-L2322 PolarHBondContact O-N 3.02Å; V2320-L2322 VanDerWaalsContact O-N 3.16Å; L2322-A2326 HydrophobicContact CB-CB 4.46Å; L2322-S2328 VanDerWaalsContact CD1-C 3.4Å; L2322-S2328 WeakPolarHBondContact CD1-O 3.46Å; L2322-P2329 HydrophobicContact CD1-CB 4.47Å; L2322-P2329 HydrophobicContact CD1-CG 4.09Å; L2322-F2332 HydrophobicContact CD1-CB 4.34Å; L2322-F2332 HydrophobicContact CD2-CB 4.23Å; L2322-F2332 HydrophobicContact CD2-CD1 4.45Å; L2322-F2332 HydrophobicContact CD2-CG 4.17Å
2323	P	96.9	Very high	94	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.006	27%	0.274	C	S	.	.			trans	-60.5	148.7	170.9	-21.2	34.2	0	0	0	111.8	Y2182 V2272 W2325 A2326 F2332	Y2182-P2323 HydrophobicContact CD1-CB 4.19Å; Y2182-P2323 HydrophobicContact CD1-CG 3.46Å; Y2182-P2323 VanDerWaalsContact CD1-CG 3.49Å; Y2182-P2323 HydrophobicContact CE1-CG 4.3Å; Y2182-P2323 HydrophobicContact CG-CG 4.23Å; V2272-P2323 HydrophobicContact CB-CG 4.42Å; V2272-P2323 HydrophobicContact CG1-CG 4.45Å; P2323-W2325 HydrophobicContact CB-CD2 3.86Å; P2323-W2325 VanDerWaalsContact CB-CE2 3.46Å; P2323-W2325 HydrophobicContact CB-CE3 4.45Å; P2323-W2325 HydrophobicContact CB-CG 4.13Å; P2323-W2325 HydrophobicContact CB-CZ2 3.87Å; P2323-W2325 HydrophobicContact CG-CD2 4.42Å; P2323-W2325 HydrophobicContact CG-CH2 4.21Å; P2323-W2325 HydrophobicContact CG-CZ2 3.74Å; P2323-W2325 PolarHBondContact O-N 3Å; P2323-A2326 PolarHBondContact O-N 3.19Å; P2323-F2332 HydrophobicContact CG-CD2 3.99Å; P2323-F2332 HydrophobicContact CG-CE2 3.88Å
2324	P	96.3	Very high	94.4	Very high	76.3333 Å²	76.3333	46.9 Å²	46.9	50%	0.496	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-16.9	-176.8	-24.6	35.4	0	0	0	115.4	Y2182 K2185 A2326	Y2182-P2324 VanDerWaalsContact O-CD 3.3Å; Y2182-P2324 WeakPolarHBondContact O-CD 3.28Å; K2185-P2324 HydrophobicContact CG-CB 4.43Å; P2324-A2326 VanDerWaalsContact C-N 3.29Å
2325	W	96.4	Very high	94.8	Very high	13 Å²	13	45.1 Å²	45.1	5%	0.049	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-6.4	174.3	54.2	-111.5	0	0	0	114.8	I2179 N2181 Y2182 T2184 K2185 L2187 P2323 F2332 I2335	I2179-W2325 HydrophobicContact CD1-CH2 3.9Å; I2179-W2325 HydrophobicContact CD1-CZ2 3.98Å; I2179-W2325 HydrophobicContact CG2-CZ2 4.19Å; N2181-W2325 PolarHBondContact O-NE1 3.08Å; N2181-W2325 VanDerWaalsContact O-NE1 3.11Å; Y2182-W2325 AromaticContact CD1-CZ2 3.76Å; Y2182-W2325 HydrophobicContact CD1-CZ2 3.76Å; Y2182-W2325 HydrophobicContact CE1-CH2 4.4Å; Y2182-W2325 AromaticContact CE1-CZ2 3.81Å; Y2182-W2325 HydrophobicContact CE1-CZ2 3.91Å; T2184-W2325 VanDerWaalsContact O-CD1 3.31Å; T2184-W2325 PolarHBondContact O-N 3.03Å; K2185-W2325 WeakPolarHBondContact O-CA 3.39Å; K2185-W2325 WeakPolarHBondContact O-CB 3.12Å; L2187-W2325 HydrophobicContact CB-CB 4.13Å; L2187-W2325 HydrophobicContact CB-CD2 4Å; L2187-W2325 HydrophobicContact CB-CG 3.77Å; L2187-W2325 HydrophobicContact CD2-CD2 4.22Å; L2187-W2325 HydrophobicContact CD2-CE3 4.49Å; L2187-W2325 HydrophobicContact CD2-CH2 4.3Å; L2187-W2325 HydrophobicContact CD2-CZ2 3.92Å; P2323-W2325 HydrophobicContact CB-CD2 3.86Å; P2323-W2325 VanDerWaalsContact CB-CE2 3.46Å; P2323-W2325 HydrophobicContact CB-CE3 4.45Å; P2323-W2325 HydrophobicContact CB-CG 4.13Å; P2323-W2325 HydrophobicContact CB-CZ2 3.87Å; P2323-W2325 HydrophobicContact CG-CD2 4.42Å; P2323-W2325 HydrophobicContact CG-CH2 4.21Å; P2323-W2325 HydrophobicContact CG-CZ2 3.74Å; P2323-W2325 PolarHBondContact O-N 3Å; W2325-F2332 AromaticContact CH2-CD2 3.52Å; W2325-F2332 HydrophobicContact CH2-CD2 3.52Å; W2325-F2332 VanDerWaalsContact CH2-CD2 3.43Å; W2325-F2332 AromaticContact CH2-CE2 3.68Å; W2325-F2332 HydrophobicContact CH2-CE2 3.68Å; W2325-F2332 HydrophobicContact CH2-CG 4.49Å; W2325-F2332 HydrophobicContact CZ2-CD2 4.39Å; W2325-F2332 HydrophobicContact CZ2-CE2 4.28Å; W2325-F2332 AromaticContact CZ3-CD2 3.82Å; W2325-F2332 HydrophobicContact CZ3-CD2 3.82Å; W2325-F2332 HydrophobicContact CZ3-CE2 4.38Å; W2325-I2335 HydrophobicContact CE3-CB 4.38Å; W2325-I2335 HydrophobicContact CE3-CD1 3.79Å; W2325-I2335 HydrophobicContact CE3-CG2 4.03Å; W2325-I2335 HydrophobicContact CH2-CG2 4.12Å; W2325-I2335 HydrophobicContact CZ3-CB 3.79Å; W2325-I2335 HydrophobicContact CZ3-CD1 4.02Å; W2325-I2335 HydrophobicContact CZ3-CG2 3.6Å
2326	A	96.2	Very high	95.2	Very high	8.66667 Å²	8.66667	42.3 Å²	42.3	7%	0.072	22%	0.218	C	C	.	.			trans	-118.5	115.4	175.3	0	0	0	0	0	110.9	L2322 P2323 P2324 E2331 F2332	L2322-A2326 HydrophobicContact CB-CB 4.46Å; P2323-A2326 PolarHBondContact O-N 3.19Å; P2324-A2326 VanDerWaalsContact C-N 3.29Å; A2326-E2331 HydrophobicContact CB-CG 4.48Å; A2326-F2332 HydrophobicContact CB-CB 3.68Å; A2326-F2332 HydrophobicContact CB-CD2 4.32Å; A2326-F2332 HydrophobicContact CB-CG 4.49Å
2327	K	92.9	Very high	95.5	Very high	184 Å²	184	38.9 Å²	38.9	80%	0.8	20%	0.197	S	C	*	.	S	Bend	trans	-83.1	-19.2	-178.3	-60.2	168.9	-162.9	137.9	0	113.1	E2331	K2327-E2331 VanDerWaalsContact CB-OE2 3.28Å; K2327-E2331 WeakPolarHBondContact CB-OE2 3.32Å; K2327-E2331 VanDerWaalsContact CG-OE2 3.32Å; K2327-E2331 WeakPolarHBondContact CG-OE2 3.36Å; K2327-E2331 PolarHBondContact N-OE2 3.39Å; K2327-E2331 VanDerWaalsContact NZ-CD 3.3Å; K2327-E2331 IonicContact NZ-OE1 3.31Å; K2327-E2331 PolarHBondContact NZ-OE1 3.04Å; K2327-E2331 IonicContact NZ-OE2 3Å; K2327-E2331 PolarHBondContact NZ-OE2 2.9Å
2328	S	95.5	Very high	95.7	Very high	38.6667 Å²	38.6667	41.9 Å²	41.9	27%	0.27	21%	0.211	S	C	.	.	S	Bend	trans	-146	161.8	176.5	83	0	0	0	0	111.2	L2322 E2330 E2331 F2332	L2322-S2328 VanDerWaalsContact CD1-C 3.4Å; L2322-S2328 WeakPolarHBondContact CD1-O 3.46Å; S2328-E2330 VanDerWaalsContact C-N 3.26Å; S2328-E2330 WeakPolarHBondContact CB-OE2 3.08Å; S2328-E2330 PolarHBondContact O-N 3.31Å; S2328-E2330 PolarHBondContact OG-N 3.14Å; S2328-E2330 PolarHBondContact OG-OE2 2.85Å; S2328-E2331 PolarHBondContact O-N 3.24Å; S2328-E2331 VanDerWaalsContact O-N 3.13Å; S2328-E2331 PolarHBondContact OG-N 2.92Å; S2328-F2332 PolarHBondContact O-N 3.14Å
2329	P	96.4	Very high	96	Very high	9 Å²	9	39.1 Å²	39.1	6%	0.058	20%	0.196	C	C	.	.	H	α-helix	trans	-58.3	-34.5	176.1	-27.6	37.5	0	0	0	113.6	P2297 F2300 E2301 L2322 F2332 V2333	P2297-P2329 HydrophobicContact CB-CB 3.73Å; P2297-P2329 VanDerWaalsContact O-CB 3.25Å; P2297-P2329 WeakPolarHBondContact O-CB 3.36Å; F2300-P2329 HydrophobicContact CB-CB 4.12Å; F2300-P2329 HydrophobicContact CB-CG 4.21Å; F2300-P2329 HydrophobicContact CD2-CB 4.23Å; E2301-P2329 HydrophobicContact CG-CB 4.45Å; E2301-P2329 HydrophobicContact CG-CG 3.69Å; L2322-P2329 HydrophobicContact CD1-CB 4.47Å; L2322-P2329 HydrophobicContact CD1-CG 4.09Å; P2329-F2332 WeakPolarHBondContact O-CB 3.32Å; P2329-F2332 PolarHBondContact O-N 2.77Å; P2329-V2333 WeakPolarHBondContact O-CB 3.42Å; P2329-V2333 WeakPolarHBondContact O-CG2 3.21Å; P2329-V2333 PolarHBondContact O-N 3.08Å
2330	E	95.2	Very high	96.2	Very high	48 Å²	48	36 Å²	36	22%	0.224	18%	0.177	C	C	.	.	H	α-helix	trans	-67.5	-38.8	175.9	-51.3	87.1	163.7	0	0	111.6	P2297 S2328 R2334 T2786 K2790 L2792	P2297-E2330 HydrophobicContact CB-CB 4.42Å; P2297-E2330 HydrophobicContact CB-CG 3.96Å; P2297-E2330 HydrophobicContact CG-CG 4Å; S2328-E2330 VanDerWaalsContact C-N 3.26Å; S2328-E2330 WeakPolarHBondContact CB-OE2 3.08Å; S2328-E2330 PolarHBondContact O-N 3.31Å; S2328-E2330 PolarHBondContact OG-N 3.14Å; S2328-E2330 PolarHBondContact OG-OE2 2.85Å; E2330-R2334 VanDerWaalsContact O-CB 3.23Å; E2330-R2334 WeakPolarHBondContact O-CB 3.29Å; E2330-R2334 PolarHBondContact O-N 3.16Å; E2330-T2786 HydrophobicContact CG-CG2 4.06Å; E2330-K2790 WeakPolarHBondContact OE1-CD 3.44Å; E2330-K2790 WeakPolarHBondContact OE1-CE 3.26Å; E2330-K2790 IonicContact OE1-NZ 2.91Å; E2330-K2790 PolarHBondContact OE1-NZ 3.31Å; E2330-K2790 IonicContact OE2-NZ 3.31Å; E2330-L2792 HydrophobicContact CB-CD2 4.4Å; E2330-L2792 HydrophobicContact CG-CD2 3.88Å
2331	E	95	Very high	96.1	Very high	47.3333 Å²	47.3333	37.9 Å²	37.9	22%	0.221	19%	0.186	C	C	.	.	H	α-helix	trans	-66.8	-41.1	174.1	-175.4	165.8	-123.9	0	0	111.3	A2326 K2327 S2328 R2334 I2335	A2326-E2331 HydrophobicContact CB-CG 4.48Å; K2327-E2331 VanDerWaalsContact CB-OE2 3.28Å; K2327-E2331 WeakPolarHBondContact CB-OE2 3.32Å; K2327-E2331 VanDerWaalsContact CG-OE2 3.32Å; K2327-E2331 WeakPolarHBondContact CG-OE2 3.36Å; K2327-E2331 PolarHBondContact N-OE2 3.39Å; K2327-E2331 VanDerWaalsContact NZ-CD 3.3Å; K2327-E2331 IonicContact NZ-OE1 3.31Å; K2327-E2331 PolarHBondContact NZ-OE1 3.04Å; K2327-E2331 IonicContact NZ-OE2 3Å; K2327-E2331 PolarHBondContact NZ-OE2 2.9Å; S2328-E2331 PolarHBondContact O-N 3.24Å; S2328-E2331 VanDerWaalsContact O-N 3.13Å; S2328-E2331 PolarHBondContact OG-N 2.92Å; E2331-R2334 PolarHBondContact O-N 3.11Å; E2331-R2334 IonicContact OE1-NH2 2.72Å; E2331-I2335 HydrophobicContact CG-CD1 3.74Å; E2331-I2335 HydrophobicContact CG-CG1 4.4Å; E2331-I2335 WeakPolarHBondContact O-CB 3.34Å; E2331-I2335 VanDerWaalsContact O-CG1 3.3Å; E2331-I2335 WeakPolarHBondContact O-CG1 3.28Å; E2331-I2335 PolarHBondContact O-N 2.94Å
2332	F	97.6	Very high	96	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.3	-53.7	173.7	175.4	-100.5	0	0	0	111.5	Y2182 V2272 F2293 F2300 L2322 P2323 W2325 A2326 S2328 P2329 R2334 I2335 N2336	Y2182-F2332 HydrophobicContact CE1-CE2 4.2Å; V2272-F2332 HydrophobicContact CG1-CE2 4.05Å; V2272-F2332 HydrophobicContact CG1-CZ 3.93Å; V2272-F2332 HydrophobicContact CG2-CE1 4.48Å; V2272-F2332 HydrophobicContact CG2-CE2 4.36Å; V2272-F2332 HydrophobicContact CG2-CZ 4.14Å; F2293-F2332 AromaticContact CD1-CE1 3.93Å; F2293-F2332 HydrophobicContact CD1-CE1 4.01Å; F2293-F2332 HydrophobicContact CD1-CZ 4.21Å; F2293-F2332 HydrophobicContact CE1-CE1 4.4Å; F2293-F2332 HydrophobicContact CE1-CZ 4.47Å; F2300-F2332 HydrophobicContact CD2-CD1 4.36Å; F2300-F2332 HydrophobicContact CE1-CD1 4.42Å; F2300-F2332 HydrophobicContact CE1-CE1 4.04Å; F2300-F2332 AromaticContact CE2-CD1 3.79Å; F2300-F2332 HydrophobicContact CE2-CD1 3.79Å; F2300-F2332 AromaticContact CE2-CE1 3.9Å; F2300-F2332 HydrophobicContact CE2-CE1 3.94Å; F2300-F2332 AromaticContact CZ-CD1 3.84Å; F2300-F2332 HydrophobicContact CZ-CD1 3.84Å; F2300-F2332 AromaticContact CZ-CE1 3.5Å; F2300-F2332 HydrophobicContact CZ-CE1 3.5Å; F2300-F2332 VanDerWaalsContact CZ-CE1 3.42Å; F2300-F2332 HydrophobicContact CZ-CZ 4.43Å; L2322-F2332 HydrophobicContact CD1-CB 4.34Å; L2322-F2332 HydrophobicContact CD2-CB 4.23Å; L2322-F2332 HydrophobicContact CD2-CD1 4.45Å; L2322-F2332 HydrophobicContact CD2-CG 4.17Å; P2323-F2332 HydrophobicContact CG-CD2 3.99Å; P2323-F2332 HydrophobicContact CG-CE2 3.88Å; W2325-F2332 AromaticContact CH2-CD2 3.52Å; W2325-F2332 HydrophobicContact CH2-CD2 3.52Å; W2325-F2332 VanDerWaalsContact CH2-CD2 3.43Å; W2325-F2332 AromaticContact CH2-CE2 3.68Å; W2325-F2332 HydrophobicContact CH2-CE2 3.68Å; W2325-F2332 HydrophobicContact CH2-CG 4.49Å; W2325-F2332 HydrophobicContact CZ2-CD2 4.39Å; W2325-F2332 HydrophobicContact CZ2-CE2 4.28Å; W2325-F2332 AromaticContact CZ3-CD2 3.82Å; W2325-F2332 HydrophobicContact CZ3-CD2 3.82Å; W2325-F2332 HydrophobicContact CZ3-CE2 4.38Å; A2326-F2332 HydrophobicContact CB-CB 3.68Å; A2326-F2332 HydrophobicContact CB-CD2 4.32Å; A2326-F2332 HydrophobicContact CB-CG 4.49Å; S2328-F2332 PolarHBondContact O-N 3.14Å; P2329-F2332 WeakPolarHBondContact O-CB 3.32Å; P2329-F2332 PolarHBondContact O-N 2.77Å; F2332-R2334 VanDerWaalsContact C-N 3.34Å; F2332-R2334 PolarHBondContact O-N 3.2Å; F2332-I2335 PolarHBondContact O-N 3.16Å; F2332-N2336 VanDerWaalsContact O-CB 3.26Å; F2332-N2336 WeakPolarHBondContact O-CB 3.3Å; F2332-N2336 PolarHBondContact O-N 3.24Å
2333	V	96.9	Very high	95.7	Very high	12 Å²	12	36.5 Å²	36.5	7%	0.073	18%	0.178	C	C	.	.	H	α-helix	trans	-61.7	-41.5	-179.5	165.8	0	0	0	0	111.6	P2297 F2300 P2329 N2336 R2337	P2297-V2333 HydrophobicContact CB-CG2 4.22Å; F2300-V2333 HydrophobicContact CD2-CG2 4.43Å; F2300-V2333 HydrophobicContact CE2-CG2 3.83Å; P2329-V2333 WeakPolarHBondContact O-CB 3.42Å; P2329-V2333 WeakPolarHBondContact O-CG2 3.21Å; P2329-V2333 PolarHBondContact O-N 3.08Å; V2333-N2336 PolarHBondContact O-N 2.97Å; V2333-R2337 VanDerWaalsContact O-CB 3.31Å; V2333-R2337 WeakPolarHBondContact O-CB 3.23Å; V2333-R2337 PolarHBondContact O-N 3.2Å
2334	R	95.5	Very high	95.5	Very high	81.3333 Å²	81.3333	39 Å²	39	31%	0.307	19%	0.191	S	C	.	.	H	α-helix	trans	-59.8	-53.6	176.4	-178.4	-171.8	63.7	72.4	2.3	111.3	E2330 E2331 F2332 N2336 R2337 E2338	E2330-R2334 VanDerWaalsContact O-CB 3.23Å; E2330-R2334 WeakPolarHBondContact O-CB 3.29Å; E2330-R2334 PolarHBondContact O-N 3.16Å; E2331-R2334 PolarHBondContact O-N 3.11Å; E2331-R2334 IonicContact OE1-NH2 2.72Å; F2332-R2334 VanDerWaalsContact C-N 3.34Å; F2332-R2334 PolarHBondContact O-N 3.2Å; R2334-N2336 VanDerWaalsContact C-N 3.34Å; R2334-N2336 PolarHBondContact O-N 3.19Å; R2334-R2337 PolarHBondContact O-N 2.85Å; R2334-E2338 WeakPolarHBondContact CG-OE1 3.36Å; R2334-E2338 IonicContact CZ-OE1 3.18Å; R2334-E2338 IonicContact CZ-OE2 3.32Å; R2334-E2338 IonicContact NH1-OE1 3.77Å; R2334-E2338 PolarHBondContact NH1-OE1 3.08Å; R2334-E2338 IonicContact NH1-OE2 2.87Å; R2334-E2338 PolarHBondContact NH1-OE2 3.04Å; R2334-E2338 WeakPolarHBondContact O-CG 3.33Å; R2334-E2338 PolarHBondContact O-N 2.96Å
2335	I	96.1	Very high	95.5	Very high	17.6667 Å²	17.6667	35.5 Å²	35.5	9%	0.091	17%	0.168	C	C	.	.	H	α-helix	trans	-64.4	-40.1	-178.8	-67.5	170.1	0	0	0	110.7	I2179 L2187 L2189 W2325 E2331 F2332 R2337 E2338 A2339	I2179-I2335 HydrophobicContact CD1-CG2 4.44Å; L2187-I2335 HydrophobicContact CD2-CG2 3.77Å; L2189-I2335 HydrophobicContact CD1-CG2 4.48Å; L2189-I2335 HydrophobicContact CD2-CG2 4.32Å; W2325-I2335 HydrophobicContact CE3-CB 4.38Å; W2325-I2335 HydrophobicContact CE3-CD1 3.79Å; W2325-I2335 HydrophobicContact CE3-CG2 4.03Å; W2325-I2335 HydrophobicContact CH2-CG2 4.12Å; W2325-I2335 HydrophobicContact CZ3-CB 3.79Å; W2325-I2335 HydrophobicContact CZ3-CD1 4.02Å; W2325-I2335 HydrophobicContact CZ3-CG2 3.6Å; E2331-I2335 HydrophobicContact CG-CD1 3.74Å; E2331-I2335 HydrophobicContact CG-CG1 4.4Å; E2331-I2335 WeakPolarHBondContact O-CB 3.34Å; E2331-I2335 VanDerWaalsContact O-CG1 3.3Å; E2331-I2335 WeakPolarHBondContact O-CG1 3.28Å; E2331-I2335 PolarHBondContact O-N 2.94Å; F2332-I2335 PolarHBondContact O-N 3.16Å; I2335-R2337 VanDerWaalsContact C-N 3.33Å; I2335-R2337 PolarHBondContact O-N 2.95Å; I2335-E2338 PolarHBondContact O-N 3.15Å; I2335-A2339 WeakPolarHBondContact O-CB 3.46Å; I2335-A2339 PolarHBondContact O-N 3.06Å
2336	N	97	Very high	95.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66	-35.9	177.8	-164	37.3	0	0	0	111.8	I2179 F2293 F2294 F2332 V2333 R2334 A2339 L2340	I2179-N2336 HydrophobicContact CD1-CB 4.44Å; F2293-N2336 PolarHBondContact O-ND2 2.96Å; F2294-N2336 HydrophobicContact CD1-CB 4.42Å; F2294-N2336 WeakPolarHBondContact CD1-ND2 3.36Å; F2294-N2336 WeakPolarHBondContact CD1-O 3.36Å; F2294-N2336 HydrophobicContact CE1-CB 4.47Å; F2294-N2336 VanDerWaalsContact CE1-CG 3.46Å; F2294-N2336 VanDerWaalsContact CE1-ND2 3.26Å; F2294-N2336 WeakPolarHBondContact CE1-ND2 3.26Å; F2294-N2336 WeakPolarHBondContact CE1-O 3.26Å; F2294-N2336 WeakPolarHBondContact CE1-OD1 3.44Å; F2332-N2336 VanDerWaalsContact O-CB 3.26Å; F2332-N2336 WeakPolarHBondContact O-CB 3.3Å; F2332-N2336 PolarHBondContact O-N 3.24Å; V2333-N2336 PolarHBondContact O-N 2.97Å; R2334-N2336 VanDerWaalsContact C-N 3.34Å; R2334-N2336 PolarHBondContact O-N 3.19Å; N2336-A2339 PolarHBondContact O-N 3.27Å; N2336-L2340 PolarHBondContact O-N 3Å
2337	R	96	Very high	95.3	Very high	38.3333 Å²	38.3333	37 Å²	37	15%	0.145	18%	0.18	C	C	.	.	H	α-helix	trans	-70.1	-41.1	172.3	-176.5	58.2	-179.4	-86	-1.7	112.4	S2150 F2152 F2294 V2333 R2334 I2335 A2339 L2340 E2341	S2150-R2337 PolarHBondContact OG-NH2 2.94Å; F2152-R2337 VanDerWaalsContact CG-CZ 3.48Å; F2294-R2337 PolarHBondContact O-NH1 3.29Å; V2333-R2337 VanDerWaalsContact O-CB 3.31Å; V2333-R2337 WeakPolarHBondContact O-CB 3.23Å; V2333-R2337 PolarHBondContact O-N 3.2Å; R2334-R2337 PolarHBondContact O-N 2.85Å; I2335-R2337 VanDerWaalsContact C-N 3.33Å; I2335-R2337 PolarHBondContact O-N 2.95Å; R2337-A2339 VanDerWaalsContact C-N 3.3Å; R2337-A2339 PolarHBondContact O-N 3.05Å; R2337-L2340 PolarHBondContact O-N 3.27Å; R2337-E2341 HydrophobicContact CG-CG 4.49Å; R2337-E2341 IonicContact CZ-OE1 3.71Å; R2337-E2341 IonicContact NE-OE1 3.11Å; R2337-E2341 PolarHBondContact NE-OE1 2.95Å; R2337-E2341 IonicContact NH2-OE1 3.73Å; R2337-E2341 PolarHBondContact NH2-OE1 2.81Å; R2337-E2341 WeakPolarHBondContact O-CG 3.23Å; R2337-E2341 PolarHBondContact O-N 2.89Å
2338	E	95.2	Very high	95.4	Very high	66.3333 Å²	66.3333	32.2 Å²	32.2	31%	0.31	16%	0.16	S	C	.	.	H	α-helix	trans	-60	-41.5	172.9	-74.9	167.7	-170.1	0	0	111.4	L2189 R2334 I2335 E2341 S2342	L2189-E2338 HydrophobicContact CD1-CB 3.77Å; R2334-E2338 WeakPolarHBondContact CG-OE1 3.36Å; R2334-E2338 IonicContact CZ-OE1 3.18Å; R2334-E2338 IonicContact CZ-OE2 3.32Å; R2334-E2338 IonicContact NH1-OE1 3.77Å; R2334-E2338 PolarHBondContact NH1-OE1 3.08Å; R2334-E2338 IonicContact NH1-OE2 2.87Å; R2334-E2338 PolarHBondContact NH1-OE2 3.04Å; R2334-E2338 WeakPolarHBondContact O-CG 3.33Å; R2334-E2338 PolarHBondContact O-N 2.96Å; I2335-E2338 PolarHBondContact O-N 3.15Å; E2338-E2341 CarbonylContact O-C 3.49Å; E2338-E2341 PolarHBondContact O-N 3.31Å; E2338-S2342 PolarHBondContact O-N 3.13Å; E2338-S2342 VanDerWaalsContact O-N 3.13Å
2339	A	96.8	Very high	95.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.7	-45	173.6	0	0	0	0	0	112	V2178 I2179 L2189 Y2195 I2335 N2336 R2337 E2341 S2342 V2345	V2178-A2339 HydrophobicContact CG1-CB 3.82Å; I2179-A2339 HydrophobicContact CD1-CB 3.89Å; I2179-A2339 HydrophobicContact CG1-CB 3.84Å; L2189-A2339 HydrophobicContact CD2-CB 3.81Å; Y2195-A2339 HydrophobicContact CE1-CB 4.03Å; I2335-A2339 WeakPolarHBondContact O-CB 3.46Å; I2335-A2339 PolarHBondContact O-N 3.06Å; N2336-A2339 PolarHBondContact O-N 3.27Å; R2337-A2339 VanDerWaalsContact C-N 3.3Å; R2337-A2339 PolarHBondContact O-N 3.05Å; A2339-E2341 VanDerWaalsContact C-N 3.32Å; A2339-E2341 PolarHBondContact O-N 3.24Å; A2339-S2342 VanDerWaalsContact O-CB 3.28Å; A2339-S2342 WeakPolarHBondContact O-CB 3.31Å; A2339-S2342 PolarHBondContact O-N 3.12Å; A2339-S2342 PolarHBondContact O-OG 3.17Å; A2339-S2342 VanDerWaalsContact O-OG 3.12Å; A2339-V2345 WeakPolarHBondContact O-CG2 3.36Å
2340	L	97.3	Very high	95.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.7	-37.1	177	177.6	66.1	0	0	0	112.8	N2151 F2152 L2155 F2175 P2176 V2178 F2294 N2336 R2337 S2342 V2345	N2151-L2340 HydrophobicContact CB-CD1 4.41Å; N2151-L2340 HydrophobicContact CB-CG 4.31Å; N2151-L2340 PolarHBondContact ND2-O 3.26Å; F2152-L2340 HydrophobicContact CB-CD2 4Å; F2152-L2340 HydrophobicContact CD2-CD2 4.1Å; L2155-L2340 HydrophobicContact CD1-CD1 4Å; F2175-L2340 HydrophobicContact CD1-CD2 4.13Å; F2175-L2340 HydrophobicContact CE1-CD2 3.91Å; P2176-L2340 HydrophobicContact CG-CD1 4.41Å; V2178-L2340 HydrophobicContact CG2-CB 4.33Å; V2178-L2340 HydrophobicContact CG2-CD1 3.85Å; F2294-L2340 HydrophobicContact CB-CD2 4.33Å; F2294-L2340 HydrophobicContact CD1-CB 3.82Å; F2294-L2340 HydrophobicContact CD1-CD2 3.69Å; F2294-L2340 HydrophobicContact CD1-CG 4.31Å; F2294-L2340 HydrophobicContact CD2-CD2 4.47Å; F2294-L2340 HydrophobicContact CE1-CB 3.8Å; F2294-L2340 HydrophobicContact CE1-CD1 4.48Å; F2294-L2340 HydrophobicContact CE1-CD2 4.08Å; F2294-L2340 HydrophobicContact CE1-CG 4.34Å; F2294-L2340 HydrophobicContact CG-CD2 3.91Å; N2336-L2340 PolarHBondContact O-N 3Å; R2337-L2340 PolarHBondContact O-N 3.27Å; L2340-S2342 VanDerWaalsContact C-N 3.33Å; L2340-V2345 HydrophobicContact CD1-CG1 4.31Å; L2340-V2345 VanDerWaalsContact O-CG1 3.25Å; L2340-V2345 WeakPolarHBondContact O-CG1 3.32Å
2341	E	95.3	Very high	95.7	Very high	44.3333 Å²	44.3333	30.5 Å²	30.5	21%	0.207	15%	0.148	C	C	.	.	H	α-helix	trans	-85.8	-5.7	179.8	-60.5	-59.2	160.1	0	0	113.7	S2150 N2151 F2152 R2337 E2338 A2339 S2346	S2150-E2341 WeakPolarHBondContact CB-OE1 3.3Å; S2150-E2341 WeakPolarHBondContact CB-OE2 3.44Å; S2150-E2341 PolarHBondContact OG-OE1 3.24Å; N2151-E2341 WeakPolarHBondContact CB-OE2 3.43Å; N2151-E2341 PolarHBondContact N-OE1 3.06Å; N2151-E2341 VanDerWaalsContact N-OE1 3.17Å; N2151-E2341 PolarHBondContact N-OE2 2.87Å; F2152-E2341 WeakPolarHBondContact CB-OE1 3.39Å; F2152-E2341 PolarHBondContact N-OE1 3.13Å; F2152-E2341 VanDerWaalsContact N-OE1 3.1Å; R2337-E2341 HydrophobicContact CG-CG 4.49Å; R2337-E2341 IonicContact CZ-OE1 3.71Å; R2337-E2341 IonicContact NE-OE1 3.11Å; R2337-E2341 PolarHBondContact NE-OE1 2.95Å; R2337-E2341 IonicContact NH2-OE1 3.73Å; R2337-E2341 PolarHBondContact NH2-OE1 2.81Å; R2337-E2341 WeakPolarHBondContact O-CG 3.23Å; R2337-E2341 PolarHBondContact O-N 2.89Å; E2338-E2341 CarbonylContact O-C 3.49Å; E2338-E2341 PolarHBondContact O-N 3.31Å; A2339-E2341 VanDerWaalsContact C-N 3.32Å; A2339-E2341 PolarHBondContact O-N 3.24Å; E2341-S2346 PolarHBondContact O-OG 3.32Å
2342	S	94.1	Very high	95.9	Very high	13.6667 Å²	13.6667	28.3 Å²	28.3	10%	0.096	14%	0.138	C	C	.	.	S	Bend	trans	-59	161	-177.5	76.9	0	0	0	0	113.9	Y2195 E2338 A2339 L2340 L2344 V2345 S2346 E2886	Y2195-S2342 WeakPolarHBondContact OH-CB 3.36Å; Y2195-S2342 PolarHBondContact OH-OG 2.99Å; Y2195-S2342 VanDerWaalsContact OH-OG 3.08Å; E2338-S2342 PolarHBondContact O-N 3.13Å; E2338-S2342 VanDerWaalsContact O-N 3.13Å; A2339-S2342 VanDerWaalsContact O-CB 3.28Å; A2339-S2342 WeakPolarHBondContact O-CB 3.31Å; A2339-S2342 PolarHBondContact O-N 3.12Å; A2339-S2342 PolarHBondContact O-OG 3.17Å; A2339-S2342 VanDerWaalsContact O-OG 3.12Å; L2340-S2342 VanDerWaalsContact C-N 3.33Å; S2342-L2344 VanDerWaalsContact C-N 3.3Å; S2342-L2344 PolarHBondContact O-N 3.16Å; S2342-L2344 PolarHBondContact OG-N 3.32Å; S2342-V2345 PolarHBondContact O-N 3.17Å; S2342-V2345 PolarHBondContact OG-N 2.93Å; S2342-V2345 VanDerWaalsContact OG-N 3.13Å; S2342-S2346 VanDerWaalsContact O-CB 3.23Å; S2342-S2346 WeakPolarHBondContact O-CB 3.22Å; S2342-S2346 PolarHBondContact O-N 2.97Å; S2342-S2346 PolarHBondContact O-OG 3.2Å; S2342-E2886 WeakPolarHBondContact CA-OE1 3.49Å; S2342-E2886 VanDerWaalsContact CB-OE1 3.24Å; S2342-E2886 WeakPolarHBondContact CB-OE1 3.14Å
2343	E	91.2	Very high	95.9	Very high	66 Å²	66	28.3 Å²	28.3	31%	0.308	14%	0.138	S	C	.	.	H	α-helix	trans	-66.9	-33	176.8	-166.7	63.6	-172.6	0	0	112.1	R2147 V2345 S2346 C2347 S2420 A2421 E2886	R2147-E2343 IonicContact CZ-OE1 3.58Å; R2147-E2343 IonicContact CZ-OE2 3.4Å; R2147-E2343 IonicContact NH1-OE2 2.81Å; R2147-E2343 PolarHBondContact NH1-OE2 2.87Å; R2147-E2343 IonicContact NH2-OE1 3.06Å; R2147-E2343 PolarHBondContact NH2-OE1 3.27Å; R2147-E2343 IonicContact NH2-OE2 3.12Å; R2147-E2343 PolarHBondContact NH2-OE2 3.08Å; E2343-V2345 PolarHBondContact O-N 3.02Å; E2343-S2346 PolarHBondContact O-N 2.98Å; E2343-C2347 PolarHBondContact O-N 3.03Å; E2343-C2347 PolarHBondContact O-SG 3.02Å; E2343-C2347 VanDerWaalsContact O-SG 3.37Å; E2343-S2420 WeakPolarHBondContact OE1-CA 3.14Å; E2343-A2421 PolarHBondContact OE1-N 3.02Å; E2343-E2886 PolarHBondContact N-OE1 3.4Å
2344	L	93.1	Very high	96	Very high	55.3333 Å²	55.3333	27.8 Å²	27.8	29%	0.29	14%	0.135	S	C	.	.	H	α-helix	trans	-64.1	-44.4	177.8	-67.7	172.5	0	0	0	111.4	P2192 Y2195 S2342 C2347	P2192-L2344 HydrophobicContact CB-CD2 4.49Å; P2192-L2344 HydrophobicContact CG-CD1 4.32Å; P2192-L2344 HydrophobicContact CG-CD2 4.15Å; Y2195-L2344 HydrophobicContact CD2-CB 4.47Å; Y2195-L2344 HydrophobicContact CD2-CD1 3.76Å; Y2195-L2344 HydrophobicContact CE2-CB 4.38Å; Y2195-L2344 HydrophobicContact CE2-CD1 3.43Å; Y2195-L2344 VanDerWaalsContact CE2-CD1 3.45Å; Y2195-L2344 HydrophobicContact CE2-CG 4.49Å; S2342-L2344 VanDerWaalsContact C-N 3.3Å; S2342-L2344 PolarHBondContact O-N 3.16Å; S2342-L2344 PolarHBondContact OG-N 3.32Å; L2344-C2347 PolarHBondContact O-SG 2.96Å; L2344-C2347 VanDerWaalsContact O-SG 3.36Å
2345	V	96.2	Very high	96.1	Very high	2.33333 Å²	2.33333	24 Å²	24	1%	0.014	12%	0.121	C	C	.	.	H	α-helix	trans	-70.2	-46.2	172.2	174.2	0	0	0	0	110.6	V2178 Y2195 L2198 A2339 L2340 S2342 E2343 C2347 Q2348 L2349	V2178-V2345 HydrophobicContact CG1-CG2 3.53Å; V2178-V2345 VanDerWaalsContact CG1-CG2 3.48Å; V2178-V2345 HydrophobicContact CG2-CG2 4.5Å; Y2195-V2345 HydrophobicContact CD1-CG2 3.77Å; Y2195-V2345 HydrophobicContact CE1-CG2 3.74Å; L2198-V2345 HydrophobicContact CD1-CB 4.38Å; L2198-V2345 HydrophobicContact CD1-CG1 3.95Å; L2198-V2345 HydrophobicContact CD1-CG2 4.28Å; A2339-V2345 WeakPolarHBondContact O-CG2 3.36Å; L2340-V2345 HydrophobicContact CD1-CG1 4.31Å; L2340-V2345 VanDerWaalsContact O-CG1 3.25Å; L2340-V2345 WeakPolarHBondContact O-CG1 3.32Å; S2342-V2345 PolarHBondContact O-N 3.17Å; S2342-V2345 PolarHBondContact OG-N 2.93Å; S2342-V2345 VanDerWaalsContact OG-N 3.13Å; E2343-V2345 PolarHBondContact O-N 3.02Å; V2345-C2347 VanDerWaalsContact C-N 3.27Å; V2345-C2347 PolarHBondContact O-N 3.11Å; V2345-Q2348 CarbonylContact O-C 3.48Å; V2345-Q2348 PolarHBondContact O-N 3.16Å; V2345-L2349 HydrophobicContact CG1-CB 4.26Å; V2345-L2349 HydrophobicContact CG1-CD1 4.3Å; V2345-L2349 HydrophobicContact CG1-CD2 4.44Å; V2345-L2349 VanDerWaalsContact O-CB 3.3Å; V2345-L2349 WeakPolarHBondContact O-CB 3.36Å; V2345-L2349 PolarHBondContact O-N 2.92Å
2346	S	94.8	Very high	96.2	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-55.5	-38.4	-177.4	-68.7	0	0	0	0	113.6	N2151 E2341 S2342 E2343 R2418	N2151-S2346 PolarHBondContact ND2-OG 3.34Å; E2341-S2346 PolarHBondContact O-OG 3.32Å; S2342-S2346 VanDerWaalsContact O-CB 3.23Å; S2342-S2346 WeakPolarHBondContact O-CB 3.22Å; S2342-S2346 PolarHBondContact O-N 2.97Å; S2342-S2346 PolarHBondContact O-OG 3.2Å; E2343-S2346 PolarHBondContact O-N 2.98Å; S2346-R2418 VanDerWaalsContact O-CB 3.23Å; S2346-R2418 WeakPolarHBondContact O-CB 3.38Å; S2346-R2418 PolarHBondContact OG-NH1 2.8Å
2347	C	93.1	Very high	96.2	Very high	53.6667 Å²	53.6667	23.4 Å²	23.4	36%	0.363	12%	0.117	S	C	.	.	H	α-helix	trans	-78.5	-19.2	178	69.8	0	0	0	0	113.6	E2343 L2344 V2345 H2350	E2343-C2347 PolarHBondContact O-N 3.03Å; E2343-C2347 PolarHBondContact O-SG 3.02Å; E2343-C2347 VanDerWaalsContact O-SG 3.37Å; L2344-C2347 PolarHBondContact O-SG 2.96Å; L2344-C2347 VanDerWaalsContact O-SG 3.36Å; V2345-C2347 VanDerWaalsContact C-N 3.27Å; V2345-C2347 PolarHBondContact O-N 3.11Å; C2347-H2350 PolarHBondContact O-CE1 2.94Å; C2347-H2350 PolarHBondContact O-ND1 2.95Å; C2347-H2350 VanDerWaalsContact O-ND1 3.13Å
2348	Q	95.5	Very high	96.2	Very high	82 Å²	82	21.6 Å²	21.6	38%	0.383	11%	0.11	S	C	.	.	H	α-helix	trans	-108.6	-18.9	-177.4	-65.8	-88	-18.7	0	0	115.5	L2198 V2345 H2350 N2351	L2198-Q2348 HydrophobicContact CB-CB 4.34Å; L2198-Q2348 HydrophobicContact CD1-CB 4.33Å; V2345-Q2348 CarbonylContact O-C 3.48Å; V2345-Q2348 PolarHBondContact O-N 3.16Å; Q2348-H2350 PolarHBondContact O-N 3.03Å; Q2348-H2350 VanDerWaalsContact O-N 3.11Å; Q2348-N2351 WeakPolarHBondContact O-CB 3.22Å; Q2348-N2351 PolarHBondContact O-N 2.95Å; Q2348-N2351 PolarHBondContact O-ND2 3.39Å; Q2348-N2351 PolarHBondContact OE1-ND2 3.28Å
2349	L	97.7	Very high	96.3	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-56.2	-31.9	-170.6	-173.9	61.2	0	0	0	113.9	W2144 N2151 L2155 P2176 L2198 V2345 N2351 W2352 V2353	W2144-L2349 HydrophobicContact CZ2-CB 4.42Å; W2144-L2349 HydrophobicContact CZ2-CD2 4.29Å; N2151-L2349 HydrophobicContact CB-CD2 3.82Å; L2155-L2349 HydrophobicContact CD1-CD1 4.33Å; L2155-L2349 HydrophobicContact CD1-CD2 4.3Å; L2155-L2349 HydrophobicContact CD2-CD1 4.28Å; L2155-L2349 HydrophobicContact CD2-CD2 4.39Å; L2155-L2349 HydrophobicContact CD2-CG 4.49Å; L2155-L2349 HydrophobicContact CG-CD2 4.27Å; P2176-L2349 HydrophobicContact CG-CD1 4.22Å; L2198-L2349 HydrophobicContact CD1-CD1 4.36Å; V2345-L2349 HydrophobicContact CG1-CB 4.26Å; V2345-L2349 HydrophobicContact CG1-CD1 4.3Å; V2345-L2349 HydrophobicContact CG1-CD2 4.44Å; V2345-L2349 VanDerWaalsContact O-CB 3.3Å; V2345-L2349 WeakPolarHBondContact O-CB 3.36Å; V2345-L2349 PolarHBondContact O-N 2.92Å; L2349-N2351 PolarHBondContact O-N 3.06Å; L2349-W2352 PolarHBondContact O-N 3.17Å; L2349-V2353 WeakPolarHBondContact O-CG2 3.32Å; L2349-V2353 PolarHBondContact O-N 3.08Å
2350	H	97.6	Very high	96.3	Very high	28 Å²	28	22.4 Å²	22.4	13%	0.13	11%	0.112	C	C	.	.	H	α-helix	trans	-55.7	-33.8	174.6	69.3	-72.8	0	0	0	113.3	W2144 C2347 Q2348 W2352 V2353 D2354 H2415 P2416	W2144-H2350 HydrophobicContact CH2-CB 4.4Å; C2347-H2350 PolarHBondContact O-CE1 2.94Å; C2347-H2350 PolarHBondContact O-ND1 2.95Å; C2347-H2350 VanDerWaalsContact O-ND1 3.13Å; Q2348-H2350 PolarHBondContact O-N 3.03Å; Q2348-H2350 VanDerWaalsContact O-N 3.11Å; H2350-W2352 VanDerWaalsContact C-N 3.34Å; H2350-W2352 PolarHBondContact O-N 2.78Å; H2350-V2353 PolarHBondContact O-N 3.05Å; H2350-D2354 PolarHBondContact O-N 3.14Å; H2350-H2415 HydrophobicContact CB-CB 4.15Å; H2350-H2415 PolarHBondContact CD2-O 3.23Å; H2350-P2416 WeakPolarHBondContact CB-O 3.39Å
2351	N	98	Very high	96.3	Very high	33 Å²	33	22.5 Å²	22.5	18%	0.176	11%	0.113	C	C	.	.	H	α-helix	trans	-68.6	-34	176.6	-67.7	-59	0	0	0	112.7	L2198 Q2348 L2349 D2354 L2355	L2198-N2351 CarbonylContact O-C 3.56Å; Q2348-N2351 WeakPolarHBondContact O-CB 3.22Å; Q2348-N2351 PolarHBondContact O-N 2.95Å; Q2348-N2351 PolarHBondContact O-ND2 3.39Å; Q2348-N2351 PolarHBondContact OE1-ND2 3.28Å; L2349-N2351 PolarHBondContact O-N 3.06Å; N2351-D2354 WeakPolarHBondContact O-CB 3.43Å; N2351-D2354 PolarHBondContact O-N 3.13Å; N2351-L2355 PolarHBondContact O-N 3.05Å
2352	W	98.4	Very high	96.2	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-73.5	-38.9	174.1	-176.7	87.5	0	0	0	111.1	L2155 I2174 P2176 L2198 E2288 L2349 H2350 D2354 L2355 I2356 F2357	L2155-W2352 HydrophobicContact CD2-CE3 4.07Å; L2155-W2352 HydrophobicContact CD2-CZ3 3.62Å; I2174-W2352 HydrophobicContact CG1-CH2 4.37Å; I2174-W2352 HydrophobicContact CG1-CZ2 4.21Å; I2174-W2352 HydrophobicContact CG2-CH2 4.16Å; I2174-W2352 HydrophobicContact CG2-CZ2 4Å; P2176-W2352 HydrophobicContact CB-CD2 3.91Å; P2176-W2352 HydrophobicContact CB-CG 4.1Å; P2176-W2352 HydrophobicContact CB-CZ2 4Å; P2176-W2352 HydrophobicContact CG-CD2 4.24Å; P2176-W2352 HydrophobicContact CG-CE3 4.37Å; P2176-W2352 HydrophobicContact CG-CZ2 4.42Å; P2176-W2352 VanDerWaalsContact N-CZ2 3.35Å; L2198-W2352 HydrophobicContact CB-CB 4.15Å; L2198-W2352 HydrophobicContact CD2-CB 4.29Å; L2198-W2352 HydrophobicContact CD2-CG 4.39Å; L2198-W2352 WeakPolarHBondContact O-CA 3.34Å; L2198-W2352 WeakPolarHBondContact O-CB 3.4Å; L2198-W2352 PolarHBondContact O-N 3.1Å; E2288-W2352 PolarHBondContact OE1-NE1 3.14Å; E2288-W2352 VanDerWaalsContact OE1-NE1 3.12Å; L2349-W2352 PolarHBondContact O-N 3.17Å; H2350-W2352 VanDerWaalsContact C-N 3.34Å; H2350-W2352 PolarHBondContact O-N 2.78Å; W2352-D2354 PolarHBondContact O-N 3.26Å; W2352-L2355 WeakPolarHBondContact O-CB 3.31Å; W2352-L2355 PolarHBondContact O-N 3.2Å; W2352-L2355 VanDerWaalsContact O-N 3.09Å; W2352-I2356 HydrophobicContact CD2-CG1 3.91Å; W2352-I2356 VanDerWaalsContact CE2-CG1 3.49Å; W2352-I2356 HydrophobicContact CE3-CG1 4.22Å; W2352-I2356 HydrophobicContact CH2-CB 4.41Å; W2352-I2356 HydrophobicContact CH2-CG1 3.95Å; W2352-I2356 HydrophobicContact CH2-CG2 4.38Å; W2352-I2356 HydrophobicContact CZ2-CB 4.47Å; W2352-I2356 HydrophobicContact CZ2-CD1 4.35Å; W2352-I2356 HydrophobicContact CZ2-CG1 3.62Å; W2352-I2356 HydrophobicContact CZ3-CB 4.44Å; W2352-I2356 HydrophobicContact CZ3-CG1 4.22Å; W2352-I2356 PolarHBondContact O-N 3.1Å; W2352-I2356 VanDerWaalsContact O-N 3.1Å; W2352-F2357 HydrophobicContact CH2-CE2 4.32Å; W2352-F2357 AromaticContact CZ3-CE2 3.96Å; W2352-F2357 HydrophobicContact CZ3-CE2 3.99Å
2353	V	98.2	Very high	96.2	Very high	0.333333 Å²	0.333333	25.4 Å²	25.4	0%	0.002	13%	0.133	C	C	.	.	H	α-helix	trans	-58	-38	171.5	176.1	0	0	0	0	110.8	L2155 L2158 L2349 H2350 L2355 I2356 F2357 G2358 H2415	L2155-V2353 HydrophobicContact CD2-CG2 4.41Å; L2158-V2353 HydrophobicContact CD1-CB 4.34Å; L2158-V2353 HydrophobicContact CD1-CG1 3.7Å; L2158-V2353 HydrophobicContact CD1-CG2 3.6Å; L2349-V2353 WeakPolarHBondContact O-CG2 3.32Å; L2349-V2353 PolarHBondContact O-N 3.08Å; H2350-V2353 PolarHBondContact O-N 3.05Å; V2353-L2355 VanDerWaalsContact C-N 3.33Å; V2353-L2355 PolarHBondContact O-N 3.12Å; V2353-I2356 PolarHBondContact O-N 3.21Å; V2353-F2357 HydrophobicContact CG1-CB 4.3Å; V2353-F2357 HydrophobicContact CG1-CD2 4.26Å; V2353-F2357 CarbonylContact O-C 3.53Å; V2353-F2357 WeakPolarHBondContact O-CA 3.36Å; V2353-F2357 PolarHBondContact O-N 3.07Å; V2353-G2358 PolarHBondContact O-N 3.11Å; V2353-H2415 HydrophobicContact CG1-CB 4.41Å; V2353-H2415 WeakPolarHBondContact CG1-CD2 3.34Å
2354	D	98.2	Very high	96.4	Very high	2.33333 Å²	2.33333	27.1 Å²	27.1	1%	0.012	15%	0.15	C	C	.	.	H	α-helix	trans	-64.3	-31.9	175.1	-82.4	-34.1	0	0	0	114.1	H2350 N2351 W2352 G2358 Y2359 K2360 Q2361 H2415	H2350-D2354 PolarHBondContact O-N 3.14Å; N2351-D2354 WeakPolarHBondContact O-CB 3.43Å; N2351-D2354 PolarHBondContact O-N 3.13Å; W2352-D2354 PolarHBondContact O-N 3.26Å; D2354-G2358 CarbonylContact O-C 3.53Å; D2354-G2358 WeakPolarHBondContact O-CA 3.48Å; D2354-G2358 PolarHBondContact O-N 2.78Å; D2354-Y2359 HydrophobicContact CB-CD1 4.03Å; D2354-Y2359 HydrophobicContact CB-CE1 3.93Å; D2354-Y2359 VanDerWaalsContact CG-CE1 3.43Å; D2354-Y2359 PolarHBondContact O-N 3.3Å; D2354-Y2359 VanDerWaalsContact OD1-CD1 3.29Å; D2354-Y2359 WeakPolarHBondContact OD1-CD1 3.35Å; D2354-Y2359 WeakPolarHBondContact OD2-CE1 3.36Å; D2354-K2360 HydrophobicContact CB-CD 4.36Å; D2354-K2360 HydrophobicContact CB-CG 4.36Å; D2354-K2360 CarbonylContact O-C 3.51Å; D2354-K2360 WeakPolarHBondContact O-CA 3.38Å; D2354-K2360 WeakPolarHBondContact O-CB 3.34Å; D2354-K2360 PolarHBondContact O-N 3.04Å; D2354-Q2361 PolarHBondContact O-N 2.79Å; D2354-H2415 VanDerWaalsContact CG-N 3.33Å; D2354-H2415 VanDerWaalsContact OD1-CB 3.25Å; D2354-H2415 WeakPolarHBondContact OD1-CB 3.16Å; D2354-H2415 PolarHBondContact OD1-N 3.03Å; D2354-H2415 PolarHBondContact OD2-N 3.19Å; D2354-H2415 VanDerWaalsContact OD2-N 3.1Å
2355	L	97.9	Very high	96.5	Very high	1.66667 Å²	1.66667	28.5 Å²	28.5	1%	0.009	16%	0.155	C	C	.	.	H	α-helix	trans	-73.3	-41	175	-65.8	170.3	0	0	0	112.7	K2200 N2351 W2352 V2353 K2360 Q2361 A2369 N2371	K2200-L2355 VanDerWaalsContact C-CD1 3.49Å; K2200-L2355 WeakPolarHBondContact O-CD1 3.43Å; N2351-L2355 PolarHBondContact O-N 3.05Å; W2352-L2355 WeakPolarHBondContact O-CB 3.31Å; W2352-L2355 PolarHBondContact O-N 3.2Å; W2352-L2355 VanDerWaalsContact O-N 3.09Å; V2353-L2355 VanDerWaalsContact C-N 3.33Å; V2353-L2355 PolarHBondContact O-N 3.12Å; L2355-K2360 HydrophobicContact CD2-CB 3.98Å; L2355-K2360 HydrophobicContact CD2-CD 4.05Å; L2355-Q2361 VanDerWaalsContact O-CA 3.3Å; L2355-Q2361 WeakPolarHBondContact O-CA 3.37Å; L2355-A2369 HydrophobicContact CD2-CB 3.9Å; L2355-N2371 HydrophobicContact CD2-CB 4.11Å; L2355-N2371 PolarHBondContact O-ND2 2.82Å
2356	I	97.7	Very high	96.5	Very high	3.66667 Å²	3.66667	28.4 Å²	28.4	2%	0.019	15%	0.154	C	C	.	.	H	α-helix	trans	-93.9	-37.7	-170.3	-57.8	-58	0	0	0	112.8	I2174 Y2234 W2352 V2353 Q2361 P2407	I2174-I2356 HydrophobicContact CD1-CD1 4.46Å; I2174-I2356 HydrophobicContact CD1-CG2 4.42Å; I2174-I2356 HydrophobicContact CG2-CG2 4.01Å; Y2234-I2356 HydrophobicContact CD1-CD1 4.16Å; Y2234-I2356 HydrophobicContact CE1-CD1 3.75Å; Y2234-I2356 HydrophobicContact CE2-CD1 4.25Å; W2352-I2356 HydrophobicContact CD2-CG1 3.91Å; W2352-I2356 VanDerWaalsContact CE2-CG1 3.49Å; W2352-I2356 HydrophobicContact CE3-CG1 4.22Å; W2352-I2356 HydrophobicContact CH2-CB 4.41Å; W2352-I2356 HydrophobicContact CH2-CG1 3.95Å; W2352-I2356 HydrophobicContact CH2-CG2 4.38Å; W2352-I2356 HydrophobicContact CZ2-CB 4.47Å; W2352-I2356 HydrophobicContact CZ2-CD1 4.35Å; W2352-I2356 HydrophobicContact CZ2-CG1 3.62Å; W2352-I2356 HydrophobicContact CZ3-CB 4.44Å; W2352-I2356 HydrophobicContact CZ3-CG1 4.22Å; W2352-I2356 PolarHBondContact O-N 3.1Å; W2352-I2356 VanDerWaalsContact O-N 3.1Å; V2353-I2356 PolarHBondContact O-N 3.21Å; I2356-Q2361 PolarHBondContact O-NE2 2.98Å; I2356-P2407 HydrophobicContact CG2-CG 3.96Å
2357	F	97.6	Very high	96.6	Very high	0.333333 Å²	0.333333	30.7 Å²	30.7	0%	0.001	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.5	-18.6	-173.9	-55.6	-76.6	0	0	0	114	L2158 A2162 I2174 W2352 V2353 P2407 Q2409 L2410 L2411	L2158-F2357 HydrophobicContact CB-CD2 4.29Å; L2158-F2357 HydrophobicContact CB-CE2 4.13Å; L2158-F2357 HydrophobicContact CB-CZ 4.34Å; L2158-F2357 HydrophobicContact CD1-CD2 4.33Å; L2158-F2357 HydrophobicContact CD1-CE2 4.43Å; A2162-F2357 HydrophobicContact CB-CD1 3.57Å; A2162-F2357 HydrophobicContact CB-CE1 3.55Å; I2174-F2357 HydrophobicContact CG2-CZ 3.95Å; W2352-F2357 HydrophobicContact CH2-CE2 4.32Å; W2352-F2357 AromaticContact CZ3-CE2 3.96Å; W2352-F2357 HydrophobicContact CZ3-CE2 3.99Å; V2353-F2357 HydrophobicContact CG1-CB 4.3Å; V2353-F2357 HydrophobicContact CG1-CD2 4.26Å; V2353-F2357 CarbonylContact O-C 3.53Å; V2353-F2357 WeakPolarHBondContact O-CA 3.36Å; V2353-F2357 PolarHBondContact O-N 3.07Å; F2357-P2407 HydrophobicContact CD1-CB 3.74Å; F2357-P2407 HydrophobicContact CD1-CG 4.19Å; F2357-P2407 HydrophobicContact CE1-CB 3.62Å; F2357-P2407 HydrophobicContact CE1-CG 3.83Å; F2357-Q2409 WeakPolarHBondContact O-CG 3.39Å; F2357-L2410 HydrophobicContact CB-CB 4.38Å; F2357-L2410 HydrophobicContact CB-CD1 3.98Å; F2357-L2410 HydrophobicContact CB-CG 4.15Å; F2357-L2410 HydrophobicContact CD1-CD1 4.21Å; F2357-L2410 HydrophobicContact CD1-CG 4.4Å; F2357-L2410 HydrophobicContact CG-CD1 4.25Å; F2357-L2410 PolarHBondContact O-N 3.1Å; F2357-L2411 PolarHBondContact O-N 3.33Å
2358	G	96.4	Very high	96.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.185	C	C	.	.	S	Bend	trans	-103.1	-152.2	-173.3	0	0	0	0	0	114.7	V2353 D2354 K2360 Q2361 Q2409 L2411	V2353-G2358 PolarHBondContact O-N 3.11Å; D2354-G2358 CarbonylContact O-C 3.53Å; D2354-G2358 WeakPolarHBondContact O-CA 3.48Å; D2354-G2358 PolarHBondContact O-N 2.78Å; G2358-K2360 VanDerWaalsContact C-N 3.3Å; G2358-K2360 PolarHBondContact O-N 3.09Å; G2358-Q2361 VanDerWaalsContact O-CB 3.3Å; G2358-Q2361 WeakPolarHBondContact O-CB 3.34Å; G2358-Q2361 PolarHBondContact O-N 2.96Å; G2358-Q2409 PolarHBondContact O-NE2 3.17Å; G2358-L2411 CarbonylContact C-O 3.55Å; G2358-L2411 VanDerWaalsContact CA-O 3.25Å; G2358-L2411 WeakPolarHBondContact CA-O 3.27Å
2359	Y	96.8	Very high	96.8	Very high	51.3333 Å²	51.3333	32.5 Å²	32.5	20%	0.201	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-18.5	-165.5	79.8	-78.9	0	0	0	114.6	D2354 Q2361 E2365 L2411 T2412 P2414	D2354-Y2359 HydrophobicContact CB-CD1 4.03Å; D2354-Y2359 HydrophobicContact CB-CE1 3.93Å; D2354-Y2359 VanDerWaalsContact CG-CE1 3.43Å; D2354-Y2359 PolarHBondContact O-N 3.3Å; D2354-Y2359 VanDerWaalsContact OD1-CD1 3.29Å; D2354-Y2359 WeakPolarHBondContact OD1-CD1 3.35Å; D2354-Y2359 WeakPolarHBondContact OD2-CE1 3.36Å; Y2359-Q2361 VanDerWaalsContact C-N 3.32Å; Y2359-E2365 HydrophobicContact CD2-CB 3.85Å; Y2359-E2365 HydrophobicContact CD2-CG 3.74Å; Y2359-E2365 HydrophobicContact CE2-CB 3.93Å; Y2359-E2365 HydrophobicContact CE2-CG 3.72Å; Y2359-E2365 WeakPolarHBondContact CE2-OE2 3.39Å; Y2359-L2411 PolarHBondContact N-O 3.15Å; Y2359-T2412 VanDerWaalsContact CB-C 3.43Å; Y2359-T2412 VanDerWaalsContact CB-O 3.25Å; Y2359-T2412 WeakPolarHBondContact CB-O 3.37Å; Y2359-P2414 VanDerWaalsContact CD1-CA 3.48Å; Y2359-P2414 HydrophobicContact CD1-CB 4.2Å; Y2359-P2414 HydrophobicContact CD1-CG 4.11Å; Y2359-P2414 VanDerWaalsContact CE1-CA 3.44Å; Y2359-P2414 HydrophobicContact CE1-CB 3.75Å; Y2359-P2414 HydrophobicContact CE1-CG 3.69Å
2360	K	97.7	Very high	96.7	Very high	33.3333 Å²	33.3333	32.5 Å²	32.5	15%	0.145	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	4.8	176.1	-56.9	-179.6	177.7	178.4	0	113.3	D2354 L2355 G2358 E2365 A2366 A2369 N2371	D2354-K2360 HydrophobicContact CB-CD 4.36Å; D2354-K2360 HydrophobicContact CB-CG 4.36Å; D2354-K2360 CarbonylContact O-C 3.51Å; D2354-K2360 WeakPolarHBondContact O-CA 3.38Å; D2354-K2360 WeakPolarHBondContact O-CB 3.34Å; D2354-K2360 PolarHBondContact O-N 3.04Å; L2355-K2360 HydrophobicContact CD2-CB 3.98Å; L2355-K2360 HydrophobicContact CD2-CD 4.05Å; G2358-K2360 VanDerWaalsContact C-N 3.3Å; G2358-K2360 PolarHBondContact O-N 3.09Å; K2360-E2365 HydrophobicContact CG-CB 4.32Å; K2360-A2366 WeakPolarHBondContact O-CA 3.38Å; K2360-A2366 VanDerWaalsContact O-CB 3.26Å; K2360-A2366 WeakPolarHBondContact O-CB 3.33Å; K2360-A2369 HydrophobicContact CB-CB 4.45Å; K2360-A2369 HydrophobicContact CD-CB 4.26Å; K2360-N2371 PolarHBondContact O-ND2 3.18Å
2361	Q	96.6	Very high	96.7	Very high	1.33333 Å²	1.33333	31.3 Å²	31.3	1%	0.006	17%	0.168	C	C	.	.	S	Bend	trans	-69	-38.1	176	-168.2	-159.5	81.3	0	0	112.3	D2354 L2355 I2356 G2358 Y2359 Y2378 T2406 P2407	D2354-Q2361 PolarHBondContact O-N 2.79Å; L2355-Q2361 VanDerWaalsContact O-CA 3.3Å; L2355-Q2361 WeakPolarHBondContact O-CA 3.37Å; I2356-Q2361 PolarHBondContact O-NE2 2.98Å; G2358-Q2361 VanDerWaalsContact O-CB 3.3Å; G2358-Q2361 WeakPolarHBondContact O-CB 3.34Å; G2358-Q2361 PolarHBondContact O-N 2.96Å; Y2359-Q2361 VanDerWaalsContact C-N 3.32Å; Q2361-Y2378 HydrophobicContact CG-CE1 4.34Å; Q2361-Y2378 VanDerWaalsContact O-CE1 3.26Å; Q2361-Y2378 WeakPolarHBondContact O-CE1 3.35Å; Q2361-Y2378 PolarHBondContact O-OH 3Å; Q2361-Y2378 VanDerWaalsContact O-OH 3.1Å; Q2361-T2406 HydrophobicContact CG-CG2 3.88Å; Q2361-P2407 PolarHBondContact NE2-O 3.2Å
2362	R	94	Very high	96.6	Very high	75.3333 Å²	75.3333	30.7 Å²	30.7	28%	0.284	17%	0.166	S	C	.	.	S	Bend	trans	-146.1	161.1	-174.9	32.5	-178	105.2	-158.2	3.6	111.8	Y2378 D2379	R2362-Y2378 HydrophobicContact CB-CD1 4.26Å; R2362-Y2378 HydrophobicContact CB-CE1 3.94Å; R2362-Y2378 HydrophobicContact CG-CD1 3.97Å; R2362-Y2378 HydrophobicContact CG-CE1 3.79Å; R2362-D2379 PolarHBondContact NH1-O 3.02Å; R2362-D2379 VanDerWaalsContact NH2-N 3.2Å; R2362-D2379 PolarHBondContact NH2-O 2.97Å
2363	G	93.4	Very high	96.4	Very high	43.3333 Å²	43.3333	30.9 Å²	30.9	45%	0.447	17%	0.167	S	C	.	.	S	Bend	trans	81	-165.6	177.9	0	0	0	0	0	114.1	E2365 A2366 V2367	G2363-E2365 VanDerWaalsContact C-N 3.28Å; G2363-E2365 PolarHBondContact O-N 3.2Å; G2363-A2366 WeakPolarHBondContact O-CA 3.44Å; G2363-A2366 VanDerWaalsContact O-CB 3.3Å; G2363-A2366 WeakPolarHBondContact O-CB 3.36Å; G2363-A2366 PolarHBondContact O-N 2.91Å; G2363-A2366 VanDerWaalsContact O-N 3.07Å; G2363-V2367 PolarHBondContact O-N 3.3Å
2364	P	95.1	Very high	96.2	Very high	102.333 Å²	102.333	31.6 Å²	31.6	67%	0.665	17%	0.17	S	C	*	.	H	α-helix	trans	-58.6	-35	-171.6	-10.9	14	0	0	0	114	A2366 V2367 H2368	P2364-A2366 VanDerWaalsContact C-N 3.3Å; P2364-A2366 PolarHBondContact O-N 3.09Å; P2364-V2367 WeakPolarHBondContact O-CB 3.34Å; P2364-V2367 PolarHBondContact O-N 3.03Å; P2364-V2367 VanDerWaalsContact O-N 3.1Å; P2364-H2368 PolarHBondContact O-N 2.87Å; P2364-H2368 PolarHBondContact O-ND1 2.87Å
2365	E	96.5	Very high	95.8	Very high	84.6667 Å²	84.6667	35.5 Å²	35.5	40%	0.396	19%	0.185	S	C	.	.	H	α-helix	trans	-69.7	-29.4	178.4	-66.1	-64.3	134.4	0	0	112.4	Y2359 K2360 G2363 V2367 H2368 A2369	Y2359-E2365 HydrophobicContact CD2-CB 3.85Å; Y2359-E2365 HydrophobicContact CD2-CG 3.74Å; Y2359-E2365 HydrophobicContact CE2-CB 3.93Å; Y2359-E2365 HydrophobicContact CE2-CG 3.72Å; Y2359-E2365 WeakPolarHBondContact CE2-OE2 3.39Å; K2360-E2365 HydrophobicContact CG-CB 4.32Å; G2363-E2365 VanDerWaalsContact C-N 3.28Å; G2363-E2365 PolarHBondContact O-N 3.2Å; E2365-V2367 VanDerWaalsContact C-N 3.34Å; E2365-H2368 PolarHBondContact O-N 2.76Å; E2365-A2369 VanDerWaalsContact O-CB 3.27Å; E2365-A2369 WeakPolarHBondContact O-CB 3.34Å; E2365-A2369 PolarHBondContact O-N 3.03Å; E2365-A2369 VanDerWaalsContact O-N 3.1Å
2366	A	96.2	Very high	95.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-70.1	-35.1	170	0	0	0	0	0	111.8	K2360 G2363 P2364 A2369 T2370 N2371 V2372	K2360-A2366 WeakPolarHBondContact O-CA 3.38Å; K2360-A2366 VanDerWaalsContact O-CB 3.26Å; K2360-A2366 WeakPolarHBondContact O-CB 3.33Å; G2363-A2366 WeakPolarHBondContact O-CA 3.44Å; G2363-A2366 VanDerWaalsContact O-CB 3.3Å; G2363-A2366 WeakPolarHBondContact O-CB 3.36Å; G2363-A2366 PolarHBondContact O-N 2.91Å; G2363-A2366 VanDerWaalsContact O-N 3.07Å; P2364-A2366 VanDerWaalsContact C-N 3.3Å; P2364-A2366 PolarHBondContact O-N 3.09Å; A2366-A2369 PolarHBondContact O-N 3.39Å; A2366-T2370 PolarHBondContact O-N 3Å; A2366-N2371 HydrophobicContact CB-CB 4.45Å; A2366-N2371 WeakPolarHBondContact O-CA 3.33Å; A2366-N2371 PolarHBondContact O-N 3.33Å; A2366-V2372 HydrophobicContact CB-CG2 3.96Å
2367	V	96.4	Very high	95.2	Very high	48.6667 Å²	48.6667	35.6 Å²	35.6	30%	0.295	19%	0.186	S	C	.	.	H	α-helix	trans	-65	-49.1	173.5	-174.3	0	0	0	0	110.2	Y2217 G2363 P2364 E2365 A2369 T2370 V2372	Y2217-V2367 HydrophobicContact CD1-CG1 4.14Å; Y2217-V2367 HydrophobicContact CE1-CG1 3.62Å; Y2217-V2367 HydrophobicContact CE1-CG2 4.29Å; Y2217-V2367 HydrophobicContact CE2-CG2 4.43Å; Y2217-V2367 VanDerWaalsContact OH-CG2 3.25Å; Y2217-V2367 WeakPolarHBondContact OH-CG2 3.39Å; G2363-V2367 PolarHBondContact O-N 3.3Å; P2364-V2367 WeakPolarHBondContact O-CB 3.34Å; P2364-V2367 PolarHBondContact O-N 3.03Å; P2364-V2367 VanDerWaalsContact O-N 3.1Å; E2365-V2367 VanDerWaalsContact C-N 3.34Å; V2367-A2369 VanDerWaalsContact C-N 3.26Å; V2367-A2369 PolarHBondContact O-N 3.2Å; V2367-T2370 PolarHBondContact O-N 3.03Å; V2367-V2372 HydrophobicContact CG2-CG2 3.92Å
2368	H	95.4	Very high	94.9	Very high	154.667 Å²	154.667	36.6 Å²	36.6	72%	0.716	19%	0.19	S	C	*	.	H	α-helix	trans	-62.4	-30.8	179.5	-129.7	79.9	0	0	0	113.2	P2364 E2365 T2370	P2364-H2368 PolarHBondContact O-N 2.87Å; P2364-H2368 PolarHBondContact O-ND1 2.87Å; E2365-H2368 PolarHBondContact O-N 2.76Å; H2368-T2370 VanDerWaalsContact C-N 3.3Å
2369	A	96.1	Very high	94.4	Very high	17.6667 Å²	17.6667	38.2 Å²	38.2	15%	0.146	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	0.2	175.5	0	0	0	0	0	114.6	P2201 L2355 K2360 E2365 A2366 V2367 N2371	P2201-A2369 VanDerWaalsContact CD-O 3.27Å; P2201-A2369 WeakPolarHBondContact CD-O 3.42Å; P2201-A2369 WeakPolarHBondContact CG-O 3.42Å; L2355-A2369 HydrophobicContact CD2-CB 3.9Å; K2360-A2369 HydrophobicContact CB-CB 4.45Å; K2360-A2369 HydrophobicContact CD-CB 4.26Å; E2365-A2369 VanDerWaalsContact O-CB 3.27Å; E2365-A2369 WeakPolarHBondContact O-CB 3.34Å; E2365-A2369 PolarHBondContact O-N 3.03Å; E2365-A2369 VanDerWaalsContact O-N 3.1Å; A2366-A2369 PolarHBondContact O-N 3.39Å; V2367-A2369 VanDerWaalsContact C-N 3.26Å; V2367-A2369 PolarHBondContact O-N 3.2Å; A2369-N2371 VanDerWaalsContact C-N 3.32Å; A2369-N2371 HydrophobicContact CB-CB 4.09Å; A2369-N2371 PolarHBondContact O-N 3.24Å
2370	T	96.7	Very high	93.8	Very high	0.666667 Å²	0.666667	39.1 Å²	39.1	0%	0.004	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	47.9	-172.1	-46.8	0	0	0	0	110.8	P2201 A2204 K2210 F2213 D2214 H2229 Y2230 A2366 V2367 H2368	P2201-T2370 VanDerWaalsContact CG-O 3.24Å; P2201-T2370 WeakPolarHBondContact CG-O 3.2Å; A2204-T2370 HydrophobicContact CB-CG2 4.42Å; K2210-T2370 VanDerWaalsContact CE-OG1 3.3Å; K2210-T2370 WeakPolarHBondContact CE-OG1 3.29Å; K2210-T2370 HydrophobicContact CG-CG2 4.23Å; K2210-T2370 PolarHBondContact NZ-OG1 3.1Å; F2213-T2370 HydrophobicContact CB-CG2 4.04Å; D2214-T2370 WeakPolarHBondContact OD1-CG2 3.3Å; D2214-T2370 PolarHBondContact OD1-OG1 2.94Å; H2229-T2370 HydrophobicContact CB-CG2 4.38Å; H2229-T2370 VanDerWaalsContact CD2-CG2 3.48Å; H2229-T2370 WeakPolarHBondContact CD2-CG2 3.35Å; Y2230-T2370 WeakPolarHBondContact CE2-O 3.31Å; Y2230-T2370 VanDerWaalsContact CZ-O 3.22Å; Y2230-T2370 PolarHBondContact OH-O 3.14Å; A2366-T2370 PolarHBondContact O-N 3Å; V2367-T2370 PolarHBondContact O-N 3.03Å; H2368-T2370 VanDerWaalsContact C-N 3.3Å
2371	N	97	Very high	93	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.011	23%	0.23	C	C	.	.			trans	-126.3	28.8	-169.3	-164.4	48.6	0	0	0	113.3	P2201 L2355 K2360 A2366 A2369 F2373 Y2378	P2201-N2371 WeakPolarHBondContact CB-OD1 3.44Å; P2201-N2371 HydrophobicContact CG-CB 4.14Å; L2355-N2371 HydrophobicContact CD2-CB 4.11Å; L2355-N2371 PolarHBondContact O-ND2 2.82Å; K2360-N2371 PolarHBondContact O-ND2 3.18Å; A2366-N2371 HydrophobicContact CB-CB 4.45Å; A2366-N2371 WeakPolarHBondContact O-CA 3.33Å; A2366-N2371 PolarHBondContact O-N 3.33Å; A2369-N2371 VanDerWaalsContact C-N 3.32Å; A2369-N2371 HydrophobicContact CB-CB 4.09Å; A2369-N2371 PolarHBondContact O-N 3.24Å; N2371-F2373 WeakPolarHBondContact OD1-CE2 3.36Å; N2371-Y2378 PolarHBondContact O-OH 3.1Å
2372	V	96.1	Very high	92.3	Very high	20 Å²	20	40.5 Å²	40.5	12%	0.121	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-99.5	121.9	179.2	-171.2	0	0	0	0	110.6	Y2217 F2228 H2229 Y2230 A2366 V2367	Y2217-V2372 HydrophobicContact CE2-CB 4.07Å; Y2217-V2372 HydrophobicContact CE2-CG1 4.22Å; Y2217-V2372 HydrophobicContact CE2-CG2 4.11Å; F2228-V2372 HydrophobicContact CB-CG1 4.34Å; H2229-V2372 WeakPolarHBondContact CA-O 3.43Å; H2229-V2372 WeakPolarHBondContact CB-O 3.38Å; H2229-V2372 PolarHBondContact N-O 3.15Å; H2229-V2372 VanDerWaalsContact ND1-CB 3.3Å; H2229-V2372 WeakPolarHBondContact ND1-CB 3.42Å; H2229-V2372 PolarHBondContact ND1-N 3.07Å; Y2230-V2372 PolarHBondContact N-O 3.24Å; Y2230-V2372 VanDerWaalsContact N-O 3.14Å; A2366-V2372 HydrophobicContact CB-CG2 3.96Å; V2367-V2372 HydrophobicContact CG2-CG2 3.92Å
2373	F	94.8	Very high	91.7	Very high	6 Å²	6	40.5 Å²	40.5	3%	0.026	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-97.4	172.6	176.5	-67	-91.1	0	0	0	111.3	F2228 Y2230 T2232 H2233 Y2234 V2286 N2371 Y2375 Y2378	F2228-F2373 WeakPolarHBondContact CB-O 3.32Å; Y2230-F2373 AromaticContact CD2-CD1 3.86Å; Y2230-F2373 HydrophobicContact CD2-CD1 3.86Å; Y2230-F2373 HydrophobicContact CD2-CD2 4.28Å; Y2230-F2373 AromaticContact CD2-CE1 3.37Å; Y2230-F2373 HydrophobicContact CD2-CE1 3.37Å; Y2230-F2373 AromaticContact CD2-CE2 3.83Å; Y2230-F2373 HydrophobicContact CD2-CE2 3.83Å; Y2230-F2373 HydrophobicContact CD2-CG 4.27Å; Y2230-F2373 AromaticContact CD2-CZ 3.31Å; Y2230-F2373 HydrophobicContact CD2-CZ 3.31Å; Y2230-F2373 HydrophobicContact CE2-CE1 4.29Å; Y2230-F2373 HydrophobicContact CE2-CE2 4.23Å; Y2230-F2373 AromaticContact CE2-CZ 3.82Å; Y2230-F2373 HydrophobicContact CE2-CZ 3.82Å; Y2230-F2373 HydrophobicContact CG-CD1 4.18Å; Y2230-F2373 AromaticContact CG-CE1 3.78Å; Y2230-F2373 HydrophobicContact CG-CE1 3.78Å; Y2230-F2373 HydrophobicContact CG-CZ 4.16Å; T2232-F2373 WeakPolarHBondContact O-CD1 3.49Å; H2233-F2373 HydrophobicContact CB-CD1 4.47Å; H2233-F2373 AromaticContact CD2-CD1 3.87Å; Y2234-F2373 HydrophobicContact CD1-CD2 4.36Å; Y2234-F2373 AromaticContact CD1-CE1 3.8Å; Y2234-F2373 HydrophobicContact CD1-CE1 3.8Å; Y2234-F2373 AromaticContact CD1-CE2 3.73Å; Y2234-F2373 HydrophobicContact CD1-CE2 3.73Å; Y2234-F2373 AromaticContact CD1-CZ 3.32Å; Y2234-F2373 HydrophobicContact CD1-CZ 3.32Å; Y2234-F2373 HydrophobicContact CE1-CD2 4.18Å; Y2234-F2373 HydrophobicContact CE1-CE1 4.34Å; Y2234-F2373 AromaticContact CE1-CE2 3.59Å; Y2234-F2373 HydrophobicContact CE1-CE2 3.59Å; Y2234-F2373 AromaticContact CE1-CZ 3.72Å; Y2234-F2373 HydrophobicContact CE1-CZ 3.72Å; Y2234-F2373 HydrophobicContact CG-CZ 4.44Å; V2286-F2373 HydrophobicContact CG2-CE1 4.28Å; N2371-F2373 WeakPolarHBondContact OD1-CE2 3.36Å; F2373-Y2375 PolarHBondContact O-N 3.1Å; F2373-Y2378 HydrophobicContact CB-CE2 4.06Å; F2373-Y2378 PolarHBondContact N-OH 3.08Å; F2373-Y2378 VanDerWaalsContact N-OH 3.13Å; F2373-Y2378 WeakPolarHBondContact O-CE2 3.43Å
2374	H	92.6	Very high	91	Very high	15 Å²	15	40 Å²	40	7%	0.069	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-52.4	131.2	173.5	-173.9	-75.6	0	0	0	111.5	Q2225 F2228 Y2230 L2376 T2377 F2403	Q2225-H2374 PolarHBondContact NE2-CD2 2.85Å; Q2225-H2374 PolarHBondContact NE2-CE1 3.02Å; Q2225-H2374 PolarHBondContact NE2-NE2 2.93Å; F2228-H2374 AromaticContact CE1-CD2 3.96Å; F2228-H2374 AromaticContact CZ-CD2 3.99Å; Y2230-H2374 PolarHBondContact O-N 2.99Å; Y2230-H2374 VanDerWaalsContact O-N 3.12Å; H2374-L2376 VanDerWaalsContact C-N 3.27Å; H2374-L2376 PolarHBondContact ND1-N 3.14Å; H2374-L2376 PolarHBondContact O-N 3.03Å; H2374-L2376 VanDerWaalsContact O-N 3.11Å; H2374-T2377 HydrophobicContact CB-CG2 4.33Å; H2374-T2377 WeakPolarHBondContact O-CG2 3.31Å; H2374-T2377 PolarHBondContact O-N 3.19Å; H2374-T2377 PolarHBondContact O-OG1 2.98Å; H2374-F2403 AromaticContact CD2-CE2 3.7Å; H2374-F2403 AromaticContact CE1-CD2 3.89Å; H2374-F2403 AromaticContact CE1-CE2 3.68Å; H2374-F2403 AromaticContact CG-CD2 3.93Å; H2374-F2403 AromaticContact ND1-CD2 3.81Å; H2374-F2403 AromaticContact NE2-CE2 3.45Å; H2374-F2403 WeakPolarHBondContact NE2-CE2 3.41Å
2375	Y	90.8	Very high	90.2	Very high	83 Å²	83	42.6 Å²	42.6	33%	0.325	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-54.6	-36.7	-168.9	73.2	-81.6	0	0	0	114.8	Q2225 P2226 F2373 T2377 Y2378 S2381	Q2225-Y2375 HydrophobicContact CG-CD1 4.1Å; Q2225-Y2375 HydrophobicContact CG-CE1 4.04Å; Q2225-Y2375 VanDerWaalsContact NE2-CE1 3.34Å; P2226-Y2375 HydrophobicContact CG-CD1 4.16Å; P2226-Y2375 HydrophobicContact CG-CG 4.22Å; F2373-Y2375 PolarHBondContact O-N 3.1Å; Y2375-T2377 PolarHBondContact O-N 3.09Å; Y2375-T2377 VanDerWaalsContact O-N 3.16Å; Y2375-Y2378 PolarHBondContact O-N 2.9Å; Y2375-Y2378 VanDerWaalsContact O-N 3.09Å; Y2375-S2381 VanDerWaalsContact O-CB 3.24Å; Y2375-S2381 WeakPolarHBondContact O-CB 3.36Å; Y2375-S2381 PolarHBondContact O-OG 2.99Å
2376	L	91.1	Very high	89.5	Confident	5.33333 Å²	5.33333	46.1 Å²	46.1	3%	0.028	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-62.2	-15.2	176.8	-66.4	179	0	0	0	115.2	H2077 H2374 Y2378 V2382 Q2399 F2403	H2077-L2376 PolarHBondContact CD2-O 3.09Å; H2077-L2376 PolarHBondContact NE2-O 3.12Å; H2077-L2376 VanDerWaalsContact NE2-O 3.09Å; H2374-L2376 VanDerWaalsContact C-N 3.27Å; H2374-L2376 PolarHBondContact ND1-N 3.14Å; H2374-L2376 PolarHBondContact O-N 3.03Å; H2374-L2376 VanDerWaalsContact O-N 3.11Å; L2376-Y2378 VanDerWaalsContact C-N 3.3Å; L2376-Y2378 PolarHBondContact O-N 3.32Å; L2376-V2382 HydrophobicContact CD2-CG2 3.48Å; L2376-V2382 VanDerWaalsContact CD2-CG2 3.44Å; L2376-Q2399 HydrophobicContact CD1-CB 4.29Å; L2376-Q2399 HydrophobicContact CD1-CG 3.89Å; L2376-F2403 HydrophobicContact CB-CD2 4.32Å; L2376-F2403 HydrophobicContact CD1-CD2 4.13Å; L2376-F2403 HydrophobicContact CD1-CE2 3.99Å
2377	T	91.7	Very high	88.8	Confident	2.33333 Å²	2.33333	47.7 Å²	47.7	1%	0.014	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-76.9	-15.3	176.3	72.9	0	0	0	0	112.2	H2077 H2233 H2374 Y2375 F2403 G2404 T2406	H2077-T2377 PolarHBondContact CE1-O 3.26Å; H2077-T2377 PolarHBondContact NE2-O 3Å; H2233-T2377 HydrophobicContact CB-CG2 4.31Å; H2374-T2377 HydrophobicContact CB-CG2 4.33Å; H2374-T2377 WeakPolarHBondContact O-CG2 3.31Å; H2374-T2377 PolarHBondContact O-N 3.19Å; H2374-T2377 PolarHBondContact O-OG1 2.98Å; Y2375-T2377 PolarHBondContact O-N 3.09Å; Y2375-T2377 VanDerWaalsContact O-N 3.16Å; T2377-F2403 HydrophobicContact CG2-CB 4.13Å; T2377-G2404 VanDerWaalsContact CB-O 3.25Å; T2377-G2404 WeakPolarHBondContact CB-O 3.26Å; T2377-G2404 WeakPolarHBondContact CG2-O 3.37Å; T2377-T2406 WeakPolarHBondContact CB-OG1 3.45Å; T2377-T2406 WeakPolarHBondContact O-CA 3.38Å; T2377-T2406 VanDerWaalsContact O-CB 3.31Å; T2377-T2406 WeakPolarHBondContact O-CB 3.38Å; T2377-T2406 PolarHBondContact O-N 3.04Å; T2377-T2406 PolarHBondContact O-OG1 3.29Å; T2377-T2406 PolarHBondContact OG1-OG1 3.17Å
2378	Y	91.8	Very high	88	Confident	20.6667 Å²	20.6667	52 Å²	52	8%	0.081	28%	0.283	C	S	.	.	S	Bend	trans	-92.8	128.9	-175.5	-66.2	-84.1	0	0	0	111.9	Q2361 R2362 N2371 F2373 Y2375 L2376 G2380 S2381 T2406	Q2361-Y2378 HydrophobicContact CG-CE1 4.34Å; Q2361-Y2378 VanDerWaalsContact O-CE1 3.26Å; Q2361-Y2378 WeakPolarHBondContact O-CE1 3.35Å; Q2361-Y2378 PolarHBondContact O-OH 3Å; Q2361-Y2378 VanDerWaalsContact O-OH 3.1Å; R2362-Y2378 HydrophobicContact CB-CD1 4.26Å; R2362-Y2378 HydrophobicContact CB-CE1 3.94Å; R2362-Y2378 HydrophobicContact CG-CD1 3.97Å; R2362-Y2378 HydrophobicContact CG-CE1 3.79Å; N2371-Y2378 PolarHBondContact O-OH 3.1Å; F2373-Y2378 HydrophobicContact CB-CE2 4.06Å; F2373-Y2378 PolarHBondContact N-OH 3.08Å; F2373-Y2378 VanDerWaalsContact N-OH 3.13Å; F2373-Y2378 WeakPolarHBondContact O-CE2 3.43Å; Y2375-Y2378 PolarHBondContact O-N 2.9Å; Y2375-Y2378 VanDerWaalsContact O-N 3.09Å; L2376-Y2378 VanDerWaalsContact C-N 3.3Å; L2376-Y2378 PolarHBondContact O-N 3.32Å; Y2378-G2380 PolarHBondContact O-N 3.12Å; Y2378-S2381 WeakPolarHBondContact O-CB 3.35Å; Y2378-S2381 PolarHBondContact O-N 3.29Å; Y2378-S2381 VanDerWaalsContact O-N 3.1Å; Y2378-S2381 PolarHBondContact O-OG 3.3Å; Y2378-T2406 HydrophobicContact CD1-CG2 3.87Å; Y2378-T2406 HydrophobicContact CE1-CG2 3.85Å
2379	D	85.7	Confident	87.5	Confident	35.3333 Å²	35.3333	48.5 Å²	48.5	19%	0.189	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	132.6	166.8	178	29.2	0	0	0	111.1	K2079 R2362	K2079-D2379 WeakPolarHBondContact CE-OD2 3.24Å; K2079-D2379 IonicContact NZ-OD1 3.18Å; K2079-D2379 PolarHBondContact NZ-OD1 2.98Å; K2079-D2379 IonicContact NZ-OD2 3.87Å; K2079-D2379 PolarHBondContact NZ-OD2 3.28Å; R2362-D2379 PolarHBondContact NH1-O 3.02Å; R2362-D2379 VanDerWaalsContact NH2-N 3.2Å; R2362-D2379 PolarHBondContact NH2-O 2.97Å
2380	G	83.6	Confident	86.9	Confident	69.6667 Å²	69.6667	52.1 Å²	52.1	72%	0.718	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.1	2.8	-175.4	0	0	0	0	0	116.2	Y2378	Y2378-G2380 PolarHBondContact O-N 3.12Å
2381	S	81.8	Confident	86.3	Confident	42 Å²	42	58.6 Å²	58.6	29%	0.294	33%	0.328	S	S	.	.			trans	-79.2	-29.5	-179.7	56.7	0	0	0	0	114.8	Y2375 Y2378	Y2375-S2381 VanDerWaalsContact O-CB 3.24Å; Y2375-S2381 WeakPolarHBondContact O-CB 3.36Å; Y2375-S2381 PolarHBondContact O-OG 2.99Å; Y2378-S2381 WeakPolarHBondContact O-CB 3.35Å; Y2378-S2381 PolarHBondContact O-N 3.29Å; Y2378-S2381 VanDerWaalsContact O-N 3.1Å; Y2378-S2381 PolarHBondContact O-OG 3.3Å
2382	V	82.3	Confident	85.8	Confident	22 Å²	22	62.7 Å²	62.7	13%	0.133	35%	0.35	C	S	.	.			trans	-108.3	120.8	-179	-179.2	0	0	0	0	109.9	L2376 W2384 I2387 V2396 I2400	L2376-V2382 HydrophobicContact CD2-CG2 3.48Å; L2376-V2382 VanDerWaalsContact CD2-CG2 3.44Å; V2382-W2384 HydrophobicContact CB-CD2 4.4Å; V2382-W2384 HydrophobicContact CB-CZ2 4.42Å; V2382-W2384 HydrophobicContact CG1-CD2 3.63Å; V2382-W2384 HydrophobicContact CG1-CE3 3.79Å; V2382-W2384 HydrophobicContact CG1-CG 4.18Å; V2382-W2384 HydrophobicContact CG1-CH2 4.29Å; V2382-W2384 HydrophobicContact CG1-CZ2 4.12Å; V2382-W2384 HydrophobicContact CG1-CZ3 4.12Å; V2382-W2384 PolarHBondContact O-N 3Å; V2382-I2387 HydrophobicContact CG1-CD1 3.74Å; V2382-V2396 HydrophobicContact CG1-CG1 4.08Å; V2382-V2396 HydrophobicContact CG2-CG1 3.91Å; V2382-I2400 HydrophobicContact CG2-CD1 4.31Å
2383	D	80.1	Confident	85.2	Confident	74.3333 Å²	74.3333	63.7 Å²	63.7	40%	0.398	35%	0.354	S	S	.	.			trans	-90	88.9	173.2	-168.5	-14.3	0	0	0	109.5	D2385 K2386	D2383-D2385 PolarHBondContact O-N 2.8Å; D2383-D2385 PolarHBondContact OD1-N 2.64Å; D2383-K2386 HydrophobicContact CB-CD 4.17Å; D2383-K2386 HydrophobicContact CB-CG 4.39Å; D2383-K2386 PolarHBondContact O-N 3.03Å; D2383-K2386 VanDerWaalsContact O-N 3.16Å; D2383-K2386 VanDerWaalsContact OD2-CD 3.28Å; D2383-K2386 WeakPolarHBondContact OD2-CD 3.4Å; D2383-K2386 VanDerWaalsContact OD2-CE 3.22Å; D2383-K2386 WeakPolarHBondContact OD2-CE 3.29Å; D2383-K2386 IonicContact OD2-NZ 3.54Å; D2383-K2386 PolarHBondContact OD2-NZ 3.21Å
2384	W	79.1	Confident	84.7	Confident	33.6667 Å²	33.6667	68.9 Å²	68.9	13%	0.128	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-62.6	-27	-172.8	-64.1	107.3	0	0	0	113.8	L2076 R2078 V2382 K2386 I2387 I2393 V2396 Q2397 I2400	L2076-W2384 WeakPolarHBondContact O-CZ2 3.35Å; R2078-W2384 HydrophobicContact CG-CG 4.32Å; R2078-W2384 VanDerWaalsContact NE-CD1 3.32Å; R2078-W2384 VanDerWaalsContact NE-CD2 3.32Å; R2078-W2384 VanDerWaalsContact NE-CE2 3.28Å; R2078-W2384 VanDerWaalsContact NE-CG 3.25Å; R2078-W2384 VanDerWaalsContact NH2-CD2 3.3Å; V2382-W2384 HydrophobicContact CB-CD2 4.4Å; V2382-W2384 HydrophobicContact CB-CZ2 4.42Å; V2382-W2384 HydrophobicContact CG1-CD2 3.63Å; V2382-W2384 HydrophobicContact CG1-CE3 3.79Å; V2382-W2384 HydrophobicContact CG1-CG 4.18Å; V2382-W2384 HydrophobicContact CG1-CH2 4.29Å; V2382-W2384 HydrophobicContact CG1-CZ2 4.12Å; V2382-W2384 HydrophobicContact CG1-CZ3 4.12Å; V2382-W2384 PolarHBondContact O-N 3Å; W2384-K2386 PolarHBondContact O-N 2.83Å; W2384-I2387 HydrophobicContact CE3-CD1 4.39Å; W2384-I2387 PolarHBondContact O-N 3.09Å; W2384-I2393 HydrophobicContact CZ3-CG2 4.18Å; W2384-V2396 HydrophobicContact CH2-CB 4.39Å; W2384-V2396 HydrophobicContact CH2-CG1 3.77Å; W2384-V2396 HydrophobicContact CZ3-CB 4.32Å; W2384-V2396 HydrophobicContact CZ3-CG1 4Å; W2384-Q2397 HydrophobicContact CH2-CG 3.73Å; W2384-Q2397 HydrophobicContact CZ3-CG 4.13Å; W2384-I2400 HydrophobicContact CH2-CD1 3.82Å; W2384-I2400 HydrophobicContact CZ2-CD1 3.62Å
2385	D	78.7	Confident	84.4	Confident	156.333 Å²	156.333	70.6 Å²	70.6	84%	0.836	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-72.1	-16.5	-178.9	-62.2	-22.6	0	0	0	112.1	D2383	D2383-D2385 PolarHBondContact O-N 2.8Å; D2383-D2385 PolarHBondContact OD1-N 2.64Å
2386	K	81	Confident	84.2	Confident	159.667 Å²	159.667	67.4 Å²	67.4	69%	0.694	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-89.8	-16.3	175.3	-69.6	178.9	178.9	138.5	0	114	D2383 W2384 T2388	D2383-K2386 HydrophobicContact CB-CD 4.17Å; D2383-K2386 HydrophobicContact CB-CG 4.39Å; D2383-K2386 PolarHBondContact O-N 3.03Å; D2383-K2386 VanDerWaalsContact O-N 3.16Å; D2383-K2386 VanDerWaalsContact OD2-CD 3.28Å; D2383-K2386 WeakPolarHBondContact OD2-CD 3.4Å; D2383-K2386 VanDerWaalsContact OD2-CE 3.22Å; D2383-K2386 WeakPolarHBondContact OD2-CE 3.29Å; D2383-K2386 IonicContact OD2-NZ 3.54Å; D2383-K2386 PolarHBondContact OD2-NZ 3.21Å; W2384-K2386 PolarHBondContact O-N 2.83Å; K2386-T2388 PolarHBondContact O-N 3.15Å
2387	I	81.5	Confident	84	Confident	33.3333 Å²	33.3333	69.5 Å²	69.5	17%	0.171	39%	0.391	C	S	.	.			trans	-95	98	-176.8	-51.6	179.6	0	0	0	108.7	V2382 W2384 L2392 I2393	V2382-I2387 HydrophobicContact CG1-CD1 3.74Å; W2384-I2387 HydrophobicContact CE3-CD1 4.39Å; W2384-I2387 PolarHBondContact O-N 3.09Å; I2387-L2392 HydrophobicContact CG2-CB 4.05Å; I2387-L2392 HydrophobicContact CG2-CD2 3.99Å; I2387-L2392 HydrophobicContact CG2-CG 3.92Å; I2387-I2393 HydrophobicContact CB-CG1 4.14Å; I2387-I2393 HydrophobicContact CG2-CD1 4.42Å; I2387-I2393 HydrophobicContact CG2-CG1 3.61Å; I2387-I2393 VanDerWaalsContact CG2-CG1 3.48Å; I2387-I2393 WeakPolarHBondContact O-CD1 3.41Å
2388	T	80.3	Confident	83.7	Confident	137.667 Å²	137.667	72.6 Å²	72.6	85%	0.845	41%	0.408	S	S	*	.			trans	-88.2	-22.7	178.8	45.6	0	0	0	0	113.8	K2386 S2390	K2386-T2388 PolarHBondContact O-N 3.15Å; T2388-S2390 PolarHBondContact O-N 2.97Å
2389	D	84.8	Confident	83.4	Confident	82 Å²	82	75.1 Å²	75.1	44%	0.439	42%	0.42	S	S	.	.			trans	-77.6	119.7	179.4	174.5	24.4	0	0	0	111.7	L2391 L2392 I2393	D2389-L2391 VanDerWaalsContact C-N 3.29Å; D2389-L2391 PolarHBondContact O-N 3.26Å; D2389-L2391 PolarHBondContact OD1-N 3.04Å; D2389-L2391 VanDerWaalsContact OD1-N 3.08Å; D2389-L2391 WeakPolarHBondContact OD2-CB 3.3Å; D2389-L2392 HydrophobicContact CB-CB 4.05Å; D2389-L2392 PolarHBondContact O-N 2.97Å; D2389-L2392 VanDerWaalsContact OD2-CB 3.3Å; D2389-L2392 WeakPolarHBondContact OD2-CB 3.34Å; D2389-L2392 PolarHBondContact OD2-N 3.12Å; D2389-I2393 WeakPolarHBondContact O-CG1 3.43Å; D2389-I2393 PolarHBondContact O-N 3.34Å
2390	S	83.3	Confident	83.5	Confident	92.3333 Å²	92.3333	73.4 Å²	73.4	65%	0.646	41%	0.412	S	S	*	.	H	α-helix	trans	-61.9	-31.8	178.7	-172.7	0	0	0	0	113.5	T2388 I2393 K2394	T2388-S2390 PolarHBondContact O-N 2.97Å; S2390-I2393 PolarHBondContact O-N 3.03Å; S2390-K2394 PolarHBondContact O-N 3.19Å; S2390-K2394 VanDerWaalsContact O-N 3.16Å
2391	L	85	Confident	83.5	Confident	137.667 Å²	137.667	73.8 Å²	73.8	72%	0.721	39%	0.394	S	S	*	.	H	α-helix	trans	-70.2	-44.7	176.8	-79	171.1	0	0	0	110.7	D2389 K2394 A2395	D2389-L2391 VanDerWaalsContact C-N 3.29Å; D2389-L2391 PolarHBondContact O-N 3.26Å; D2389-L2391 PolarHBondContact OD1-N 3.04Å; D2389-L2391 VanDerWaalsContact OD1-N 3.08Å; D2389-L2391 WeakPolarHBondContact OD2-CB 3.3Å; L2391-K2394 PolarHBondContact O-N 3.11Å; L2391-A2395 WeakPolarHBondContact O-CB 3.43Å; L2391-A2395 PolarHBondContact O-N 2.97Å
2392	L	85.2	Confident	83.6	Confident	88.6667 Å²	88.6667	76 Å²	76	46%	0.464	41%	0.41	S	S	.	.	H	α-helix	trans	-65.1	-40.1	175.5	-173.3	58.1	0	0	0	112.4	I2387 D2389 K2394 A2395 V2396	I2387-L2392 HydrophobicContact CG2-CB 4.05Å; I2387-L2392 HydrophobicContact CG2-CD2 3.99Å; I2387-L2392 HydrophobicContact CG2-CG 3.92Å; D2389-L2392 HydrophobicContact CB-CB 4.05Å; D2389-L2392 PolarHBondContact O-N 2.97Å; D2389-L2392 VanDerWaalsContact OD2-CB 3.3Å; D2389-L2392 WeakPolarHBondContact OD2-CB 3.34Å; D2389-L2392 PolarHBondContact OD2-N 3.12Å; L2392-K2394 VanDerWaalsContact C-N 3.31Å; L2392-K2394 PolarHBondContact O-N 2.97Å; L2392-A2395 PolarHBondContact O-N 3.3Å; L2392-V2396 HydrophobicContact CD1-CG2 4.27Å; L2392-V2396 WeakPolarHBondContact O-CB 3.43Å; L2392-V2396 VanDerWaalsContact O-CG2 3.29Å; L2392-V2396 WeakPolarHBondContact O-CG2 3.44Å; L2392-V2396 PolarHBondContact O-N 3.12Å
2393	I	84.4	Confident	83.6	Confident	40 Å²	40	77.9 Å²	77.9	21%	0.205	42%	0.417	C	S	.	.	H	α-helix	trans	-55	-50.1	171.9	-68.8	170.6	0	0	0	109.8	W2384 I2387 D2389 S2390 A2395 V2396 Q2397	W2384-I2393 HydrophobicContact CZ3-CG2 4.18Å; I2387-I2393 HydrophobicContact CB-CG1 4.14Å; I2387-I2393 HydrophobicContact CG2-CD1 4.42Å; I2387-I2393 HydrophobicContact CG2-CG1 3.61Å; I2387-I2393 VanDerWaalsContact CG2-CG1 3.48Å; I2387-I2393 WeakPolarHBondContact O-CD1 3.41Å; D2389-I2393 WeakPolarHBondContact O-CG1 3.43Å; D2389-I2393 PolarHBondContact O-N 3.34Å; S2390-I2393 PolarHBondContact O-N 3.03Å; I2393-A2395 PolarHBondContact O-N 3.16Å; I2393-V2396 PolarHBondContact O-N 3.04Å; I2393-Q2397 HydrophobicContact CG2-CG 4.34Å; I2393-Q2397 WeakPolarHBondContact O-CB 3.24Å; I2393-Q2397 VanDerWaalsContact O-CG 3.29Å; I2393-Q2397 WeakPolarHBondContact O-CG 3.38Å; I2393-Q2397 PolarHBondContact O-N 3.09Å
2394	K	84.4	Confident	83.9	Confident	115.667 Å²	115.667	74.3 Å²	74.3	50%	0.503	40%	0.398	S	S	.	.	H	α-helix	trans	-64.6	-45	-177.9	-176.4	141.5	178.4	168.8	0	111.8	S2390 L2391 L2392 V2396 Q2397 D2398	S2390-K2394 PolarHBondContact O-N 3.19Å; S2390-K2394 VanDerWaalsContact O-N 3.16Å; L2391-K2394 PolarHBondContact O-N 3.11Å; L2392-K2394 VanDerWaalsContact C-N 3.31Å; L2392-K2394 PolarHBondContact O-N 2.97Å; K2394-V2396 VanDerWaalsContact C-N 3.28Å; K2394-V2396 PolarHBondContact O-N 3.15Å; K2394-Q2397 WeakPolarHBondContact O-CB 3.42Å; K2394-Q2397 PolarHBondContact O-N 3.37Å; K2394-D2398 WeakPolarHBondContact CE-OD1 3.35Å; K2394-D2398 WeakPolarHBondContact CE-OD2 3.43Å; K2394-D2398 WeakPolarHBondContact CG-OD2 3.43Å; K2394-D2398 IonicContact NZ-OD1 2.66Å; K2394-D2398 PolarHBondContact NZ-OD1 3.48Å; K2394-D2398 IonicContact NZ-OD2 2.89Å; K2394-D2398 VanDerWaalsContact O-CG 3.29Å; K2394-D2398 PolarHBondContact O-N 3.02Å
2395	A	86.1	Confident	84.5	Confident	50 Å²	50	72.9 Å²	72.9	41%	0.413	39%	0.392	S	S	.	.	H	α-helix	trans	-58	-42.6	177	0	0	0	0	0	112.2	L2391 L2392 I2393 D2398 Q2399	L2391-A2395 WeakPolarHBondContact O-CB 3.43Å; L2391-A2395 PolarHBondContact O-N 2.97Å; L2392-A2395 PolarHBondContact O-N 3.3Å; I2393-A2395 PolarHBondContact O-N 3.16Å; A2395-D2398 PolarHBondContact O-N 3.3Å; A2395-Q2399 VanDerWaalsContact O-CB 3.25Å; A2395-Q2399 WeakPolarHBondContact O-CB 3.32Å; A2395-Q2399 VanDerWaalsContact O-CG 3.31Å; A2395-Q2399 WeakPolarHBondContact O-CG 3.49Å; A2395-Q2399 PolarHBondContact O-N 3.18Å
2396	V	86.3	Confident	85.3	Confident	16.3333 Å²	16.3333	65.8 Å²	65.8	10%	0.099	36%	0.355	C	S	.	.	H	α-helix	trans	-68.2	-37.7	176.3	174.5	0	0	0	0	111.7	V2382 W2384 L2392 I2393 K2394 Q2399 I2400	V2382-V2396 HydrophobicContact CG1-CG1 4.08Å; V2382-V2396 HydrophobicContact CG2-CG1 3.91Å; W2384-V2396 HydrophobicContact CH2-CB 4.39Å; W2384-V2396 HydrophobicContact CH2-CG1 3.77Å; W2384-V2396 HydrophobicContact CZ3-CB 4.32Å; W2384-V2396 HydrophobicContact CZ3-CG1 4Å; L2392-V2396 HydrophobicContact CD1-CG2 4.27Å; L2392-V2396 WeakPolarHBondContact O-CB 3.43Å; L2392-V2396 VanDerWaalsContact O-CG2 3.29Å; L2392-V2396 WeakPolarHBondContact O-CG2 3.44Å; L2392-V2396 PolarHBondContact O-N 3.12Å; I2393-V2396 PolarHBondContact O-N 3.04Å; K2394-V2396 VanDerWaalsContact C-N 3.28Å; K2394-V2396 PolarHBondContact O-N 3.15Å; V2396-Q2399 PolarHBondContact O-N 3.22Å; V2396-I2400 HydrophobicContact CG1-CD1 3.84Å; V2396-I2400 HydrophobicContact CG1-CG1 4.46Å; V2396-I2400 WeakPolarHBondContact O-CB 3.47Å; V2396-I2400 WeakPolarHBondContact O-CD1 3.42Å; V2396-I2400 VanDerWaalsContact O-CG1 3.25Å; V2396-I2400 WeakPolarHBondContact O-CG1 3.38Å; V2396-I2400 PolarHBondContact O-N 3.25Å
2397	Q	87.2	Confident	85.9	Confident	49.3333 Å²	49.3333	58.3 Å²	58.3	23%	0.231	32%	0.323	C	S	.	.	H	α-helix	trans	-62.5	-48.8	174	-74.3	175.5	-20	0	0	112.1	L2076 W2384 I2393 K2394 Q2399 I2400 Q2401	L2076-Q2397 HydrophobicContact CD1-CB 4.06Å; L2076-Q2397 HydrophobicContact CD1-CG 3.88Å; W2384-Q2397 HydrophobicContact CH2-CG 3.73Å; W2384-Q2397 HydrophobicContact CZ3-CG 4.13Å; I2393-Q2397 HydrophobicContact CG2-CG 4.34Å; I2393-Q2397 WeakPolarHBondContact O-CB 3.24Å; I2393-Q2397 VanDerWaalsContact O-CG 3.29Å; I2393-Q2397 WeakPolarHBondContact O-CG 3.38Å; I2393-Q2397 PolarHBondContact O-N 3.09Å; K2394-Q2397 WeakPolarHBondContact O-CB 3.42Å; K2394-Q2397 PolarHBondContact O-N 3.37Å; Q2397-Q2399 VanDerWaalsContact C-N 3.28Å; Q2397-Q2399 PolarHBondContact O-N 3.02Å; Q2397-I2400 PolarHBondContact O-N 2.9Å; Q2397-Q2401 WeakPolarHBondContact O-CB 3.41Å; Q2397-Q2401 WeakPolarHBondContact O-CG 3.29Å; Q2397-Q2401 PolarHBondContact O-N 3.26Å
2398	D	84.9	Confident	86.5	Confident	68.3333 Å²	68.3333	57.6 Å²	57.6	37%	0.365	32%	0.323	S	S	.	.	H	α-helix	trans	-62.9	-36	179.1	-64.7	-16.3	0	0	0	110.8	K2394 A2395 Q2401 S2402	K2394-D2398 WeakPolarHBondContact CE-OD1 3.35Å; K2394-D2398 WeakPolarHBondContact CE-OD2 3.43Å; K2394-D2398 WeakPolarHBondContact CG-OD2 3.43Å; K2394-D2398 IonicContact NZ-OD1 2.66Å; K2394-D2398 PolarHBondContact NZ-OD1 3.48Å; K2394-D2398 IonicContact NZ-OD2 2.89Å; K2394-D2398 VanDerWaalsContact O-CG 3.29Å; K2394-D2398 PolarHBondContact O-N 3.02Å; A2395-D2398 PolarHBondContact O-N 3.3Å; D2398-Q2401 PolarHBondContact O-N 3.46Å; D2398-S2402 VanDerWaalsContact O-CB 3.32Å; D2398-S2402 WeakPolarHBondContact O-CB 3.26Å; D2398-S2402 PolarHBondContact O-N 3.03Å; D2398-S2402 PolarHBondContact O-OG 2.97Å
2399	Q	85.4	Confident	87.2	Confident	72.3333 Å²	72.3333	53.3 Å²	53.3	34%	0.338	29%	0.293	S	S	.	.	H	α-helix	trans	-67.7	-44.3	173.9	-141.5	174.8	11.8	0	0	112.7	L2376 A2395 V2396 Q2397 Q2401 S2402 F2403	L2376-Q2399 HydrophobicContact CD1-CB 4.29Å; L2376-Q2399 HydrophobicContact CD1-CG 3.89Å; A2395-Q2399 VanDerWaalsContact O-CB 3.25Å; A2395-Q2399 WeakPolarHBondContact O-CB 3.32Å; A2395-Q2399 VanDerWaalsContact O-CG 3.31Å; A2395-Q2399 WeakPolarHBondContact O-CG 3.49Å; A2395-Q2399 PolarHBondContact O-N 3.18Å; V2396-Q2399 PolarHBondContact O-N 3.22Å; Q2397-Q2399 VanDerWaalsContact C-N 3.28Å; Q2397-Q2399 PolarHBondContact O-N 3.02Å; Q2399-Q2401 VanDerWaalsContact C-N 3.3Å; Q2399-Q2401 PolarHBondContact O-N 3.15Å; Q2399-S2402 PolarHBondContact O-N 2.95Å; Q2399-F2403 HydrophobicContact CB-CD2 4.2Å; Q2399-F2403 HydrophobicContact CB-CE2 4.05Å; Q2399-F2403 HydrophobicContact CG-CD2 3.74Å; Q2399-F2403 HydrophobicContact CG-CE1 4.39Å; Q2399-F2403 HydrophobicContact CG-CE2 3.99Å; Q2399-F2403 HydrophobicContact CG-CG 4.26Å; Q2399-F2403 HydrophobicContact CG-CZ 3.91Å; Q2399-F2403 WeakPolarHBondContact O-CB 3.43Å; Q2399-F2403 WeakPolarHBondContact O-CD2 3.26Å; Q2399-F2403 WeakPolarHBondContact O-CG 3.48Å; Q2399-F2403 PolarHBondContact O-N 2.86Å
2400	I	87.2	Confident	87.7	Confident	0.666667 Å²	0.666667	49.4 Å²	49.4	0%	0.003	27%	0.273	C	S	.	.	H	α-helix	trans	-61.8	-39.8	175.5	-71.8	163.8	0	0	0	111.1	L2076 V2382 W2384 V2396 Q2397 S2402 F2403 G2404 Q2405	L2076-I2400 HydrophobicContact CB-CG2 4.48Å; L2076-I2400 HydrophobicContact CD2-CG2 4.22Å; V2382-I2400 HydrophobicContact CG2-CD1 4.31Å; W2384-I2400 HydrophobicContact CH2-CD1 3.82Å; W2384-I2400 HydrophobicContact CZ2-CD1 3.62Å; V2396-I2400 HydrophobicContact CG1-CD1 3.84Å; V2396-I2400 HydrophobicContact CG1-CG1 4.46Å; V2396-I2400 WeakPolarHBondContact O-CB 3.47Å; V2396-I2400 WeakPolarHBondContact O-CD1 3.42Å; V2396-I2400 VanDerWaalsContact O-CG1 3.25Å; V2396-I2400 WeakPolarHBondContact O-CG1 3.38Å; V2396-I2400 PolarHBondContact O-N 3.25Å; Q2397-I2400 PolarHBondContact O-N 2.9Å; I2400-S2402 PolarHBondContact O-N 3.21Å; I2400-F2403 PolarHBondContact O-N 3.02Å; I2400-G2404 PolarHBondContact O-N 3.17Å; I2400-Q2405 HydrophobicContact CG2-CG 3.94Å
2401	Q	84.8	Confident	88.2	Confident	76.5 Å²	76.5	46.1 Å²	46.1	36%	0.357	25%	0.247	S	C	.	.	H	α-helix	trans	-63.7	-40.3	174.8	-119.5	175.6	3.7	0	0	111.6	L2076 N2170 Q2397 D2398 Q2399 F2403 G2404	L2076-Q2401 HydrophobicContact CD2-CB 4.43Å; L2076-Q2401 HydrophobicContact CD2-CG 3.52Å; N2170-Q2401 WeakPolarHBondContact ND2-CG 3.3Å; N2170-Q2401 PolarHBondContact ND2-O 2.8Å; N2170-Q2401 PolarHBondContact OD1-O 3.02Å; N2170-Q2401 VanDerWaalsContact OD1-O 3.13Å; Q2397-Q2401 WeakPolarHBondContact O-CB 3.41Å; Q2397-Q2401 WeakPolarHBondContact O-CG 3.29Å; Q2397-Q2401 PolarHBondContact O-N 3.26Å; D2398-Q2401 PolarHBondContact O-N 3.46Å; Q2399-Q2401 VanDerWaalsContact C-N 3.3Å; Q2399-Q2401 PolarHBondContact O-N 3.15Å; Q2401-F2403 PolarHBondContact O-N 2.75Å; Q2401-G2404 PolarHBondContact O-N 2.84Å
2402	S	83.1	Confident	88.7	Confident	89 Å²	89	44.8 Å²	44.8	62%	0.622	25%	0.246	S	C	*	.	H	α-helix	trans	-74.2	-37.4	-177.9	-59.4	0	0	0	0	113.5	D2398 Q2399 I2400	D2398-S2402 VanDerWaalsContact O-CB 3.32Å; D2398-S2402 WeakPolarHBondContact O-CB 3.26Å; D2398-S2402 PolarHBondContact O-N 3.03Å; D2398-S2402 PolarHBondContact O-OG 2.97Å; Q2399-S2402 PolarHBondContact O-N 2.95Å; I2400-S2402 PolarHBondContact O-N 3.21Å
2403	F	82.9	Confident	89.1	Confident	61.5 Å²	61.5	48.1 Å²	48.1	27%	0.27	26%	0.256	S	S	.	.	H	α-helix	trans	-82.2	-18.2	-177.1	-71.1	-32.2	0	0	0	113.6	H2233 H2374 L2376 T2377 Q2399 I2400 Q2401	H2233-F2403 WeakPolarHBondContact CB-O 3.35Å; H2374-F2403 AromaticContact CD2-CE2 3.7Å; H2374-F2403 AromaticContact CE1-CD2 3.89Å; H2374-F2403 AromaticContact CE1-CE2 3.68Å; H2374-F2403 AromaticContact CG-CD2 3.93Å; H2374-F2403 AromaticContact ND1-CD2 3.81Å; H2374-F2403 AromaticContact NE2-CE2 3.45Å; H2374-F2403 WeakPolarHBondContact NE2-CE2 3.41Å; L2376-F2403 HydrophobicContact CB-CD2 4.32Å; L2376-F2403 HydrophobicContact CD1-CD2 4.13Å; L2376-F2403 HydrophobicContact CD1-CE2 3.99Å; T2377-F2403 HydrophobicContact CG2-CB 4.13Å; Q2399-F2403 HydrophobicContact CB-CD2 4.2Å; Q2399-F2403 HydrophobicContact CB-CE2 4.05Å; Q2399-F2403 HydrophobicContact CG-CD2 3.74Å; Q2399-F2403 HydrophobicContact CG-CE1 4.39Å; Q2399-F2403 HydrophobicContact CG-CE2 3.99Å; Q2399-F2403 HydrophobicContact CG-CG 4.26Å; Q2399-F2403 HydrophobicContact CG-CZ 3.91Å; Q2399-F2403 WeakPolarHBondContact O-CB 3.43Å; Q2399-F2403 WeakPolarHBondContact O-CD2 3.26Å; Q2399-F2403 WeakPolarHBondContact O-CG 3.48Å; Q2399-F2403 PolarHBondContact O-N 2.86Å; I2400-F2403 PolarHBondContact O-N 3.02Å; Q2401-F2403 PolarHBondContact O-N 2.75Å
2404	G	86.4	Confident	89.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.273	C	S	.	.			trans	81.5	161.8	-174.6	0	0	0	0	0	113	T2377 I2400 Q2401	T2377-G2404 VanDerWaalsContact CB-O 3.25Å; T2377-G2404 WeakPolarHBondContact CB-O 3.26Å; T2377-G2404 WeakPolarHBondContact CG2-O 3.37Å; I2400-G2404 PolarHBondContact O-N 3.17Å; Q2401-G2404 PolarHBondContact O-N 2.84Å
2405	Q	92.1	Very high	90.3	Very high	3 Å²	3	45 Å²	45	1%	0.014	25%	0.25	C	C	.	.			trans	-114.9	128.6	-172.5	-64.9	177.9	70.3	0	0	111.1	R2164 N2170 Q2171 H2233 I2400	R2164-Q2405 VanDerWaalsContact CZ-O 3.22Å; R2164-Q2405 PolarHBondContact NH1-O 2.78Å; R2164-Q2405 PolarHBondContact NH2-O 2.86Å; N2170-Q2405 PolarHBondContact O-N 2.88Å; Q2171-Q2405 HydrophobicContact CG-CB 4.13Å; H2233-Q2405 VanDerWaalsContact CE1-C 3.44Å; H2233-Q2405 PolarHBondContact CE1-O 3.2Å; I2400-Q2405 HydrophobicContact CG2-CG 3.94Å
2406	T	94.8	Very high	90.8	Very high	7.5 Å²	7.5	45 Å²	45	5%	0.046	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-72.3	139.2	173.8	-57.6	0	0	0	0	110.4	H2233 Q2361 T2377 Y2378	H2233-T2406 PolarHBondContact CD2-OG1 3.16Å; H2233-T2406 WeakPolarHBondContact NE2-CA 3.3Å; H2233-T2406 PolarHBondContact NE2-N 3.4Å; H2233-T2406 PolarHBondContact NE2-OG1 2.84Å; Q2361-T2406 HydrophobicContact CG-CG2 3.88Å; T2377-T2406 WeakPolarHBondContact CB-OG1 3.45Å; T2377-T2406 WeakPolarHBondContact O-CA 3.38Å; T2377-T2406 VanDerWaalsContact O-CB 3.31Å; T2377-T2406 WeakPolarHBondContact O-CB 3.38Å; T2377-T2406 PolarHBondContact O-N 3.04Å; T2377-T2406 PolarHBondContact O-OG1 3.29Å; T2377-T2406 PolarHBondContact OG1-OG1 3.17Å; Y2378-T2406 HydrophobicContact CD1-CG2 3.87Å; Y2378-T2406 HydrophobicContact CE1-CG2 3.85Å
2407	P	94.9	Very high	91.2	Very high	3.5 Å²	3.5	52.7 Å²	52.7	2%	0.023	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-61.3	156.2	-178.8	-16.8	27.6	0	0	0	113.3	A2162 R2164 I2174 Y2234 I2356 F2357 Q2361 Q2409	A2162-P2407 HydrophobicContact CB-CB 3.91Å; R2164-P2407 VanDerWaalsContact NH1-CG 3.32Å; R2164-P2407 VanDerWaalsContact NH2-CD 3.35Å; I2174-P2407 HydrophobicContact CD1-CG 4.21Å; Y2234-P2407 WeakPolarHBondContact OH-CD 3.37Å; I2356-P2407 HydrophobicContact CG2-CG 3.96Å; F2357-P2407 HydrophobicContact CD1-CB 3.74Å; F2357-P2407 HydrophobicContact CD1-CG 4.19Å; F2357-P2407 HydrophobicContact CE1-CB 3.62Å; F2357-P2407 HydrophobicContact CE1-CG 3.83Å; Q2361-P2407 PolarHBondContact NE2-O 3.2Å; P2407-Q2409 PolarHBondContact O-N 3.16Å
2408	G	92.5	Very high	91.5	Very high	17 Å²	17	51.3 Å²	51.3	18%	0.175	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-59	126.4	169.9	0	0	0	0	0	111.5	A2162 L2410	A2162-G2408 PolarHBondContact O-N 3.26Å; A2162-G2408 VanDerWaalsContact O-N 3.11Å; G2408-L2410 PolarHBondContact O-N 2.99Å
2409	Q	95.2	Very high	91.7	Very high	47 Å²	47	50.7 Å²	50.7	22%	0.22	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-66.5	121.3	178.9	-164.2	179.3	25.9	0	0	110.2	S2132 F2357 G2358 P2407 L2411	S2132-Q2409 PolarHBondContact OG-O 3.18Å; F2357-Q2409 WeakPolarHBondContact O-CG 3.39Å; G2358-Q2409 PolarHBondContact O-NE2 3.17Å; P2407-Q2409 PolarHBondContact O-N 3.16Å; Q2409-L2411 WeakPolarHBondContact CG-O 3.39Å; Q2409-L2411 PolarHBondContact NE2-O 3.05Å
2410	L	95.9	Very high	91.5	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	26%	0.262	C	S	.	.			trans	-89.9	-32.8	-175.7	-60.1	-179.1	0	0	0	112.2	P2131 S2132 F2135 L2158 I2161 A2162 F2357 G2408	P2131-L2410 HydrophobicContact CB-CD2 3.61Å; S2132-L2410 WeakPolarHBondContact CA-O 3.4Å; S2132-L2410 WeakPolarHBondContact CB-O 3.29Å; S2132-L2410 PolarHBondContact OG-O 2.93Å; F2135-L2410 HydrophobicContact CB-CB 4.32Å; F2135-L2410 HydrophobicContact CB-CD2 4.48Å; F2135-L2410 HydrophobicContact CD2-CB 4.32Å; F2135-L2410 HydrophobicContact CD2-CD1 4.21Å; F2135-L2410 HydrophobicContact CG-CB 4.18Å; L2158-L2410 HydrophobicContact CB-CD1 4.2Å; L2158-L2410 HydrophobicContact CD2-CD1 3.69Å; L2158-L2410 HydrophobicContact CG-CD1 4.49Å; I2161-L2410 HydrophobicContact CD1-CD1 3.74Å; I2161-L2410 HydrophobicContact CD1-CD2 3.95Å; I2161-L2410 HydrophobicContact CD1-CG 4.41Å; I2161-L2410 HydrophobicContact CG1-CD1 3.88Å; I2161-L2410 HydrophobicContact CG1-CD2 3.98Å; A2162-L2410 HydrophobicContact CB-CD1 4.34Å; A2162-L2410 HydrophobicContact CB-CD2 4.13Å; A2162-L2410 HydrophobicContact CB-CG 4.31Å; F2357-L2410 HydrophobicContact CB-CB 4.38Å; F2357-L2410 HydrophobicContact CB-CD1 3.98Å; F2357-L2410 HydrophobicContact CB-CG 4.15Å; F2357-L2410 HydrophobicContact CD1-CD1 4.21Å; F2357-L2410 HydrophobicContact CD1-CG 4.4Å; F2357-L2410 HydrophobicContact CG-CD1 4.25Å; F2357-L2410 PolarHBondContact O-N 3.1Å; G2408-L2410 PolarHBondContact O-N 2.99Å
2411	L	94.7	Very high	90.9	Very high	21.5 Å²	21.5	50.5 Å²	50.5	11%	0.113	27%	0.27	C	S	.	.			trans	-141.9	142.4	-174.2	-3.7	166	0	0	0	112.2	F2135 F2357 G2358 Y2359 Q2409 K2413 H2415	F2135-L2411 HydrophobicContact CD1-CB 4.26Å; F2135-L2411 HydrophobicContact CD1-CD2 3.91Å; F2135-L2411 HydrophobicContact CD1-CG 4.07Å; F2135-L2411 HydrophobicContact CE1-CB 3.91Å; F2135-L2411 HydrophobicContact CE1-CD1 3.86Å; F2135-L2411 HydrophobicContact CE1-CD2 3.85Å; F2135-L2411 VanDerWaalsContact CE1-CD2 3.5Å; F2135-L2411 HydrophobicContact CE1-CG 3.97Å; F2135-L2411 HydrophobicContact CZ-CD1 3.91Å; F2135-L2411 HydrophobicContact CZ-CD2 4.26Å; F2135-L2411 HydrophobicContact CZ-CG 4.08Å; F2357-L2411 PolarHBondContact O-N 3.33Å; G2358-L2411 CarbonylContact C-O 3.55Å; G2358-L2411 VanDerWaalsContact CA-O 3.25Å; G2358-L2411 WeakPolarHBondContact CA-O 3.27Å; Y2359-L2411 PolarHBondContact N-O 3.15Å; Q2409-L2411 WeakPolarHBondContact CG-O 3.39Å; Q2409-L2411 PolarHBondContact NE2-O 3.05Å; L2411-K2413 VanDerWaalsContact CD1-O 3.22Å; L2411-K2413 WeakPolarHBondContact CD1-O 3.45Å; L2411-K2413 WeakPolarHBondContact CG-O 3.49Å; L2411-H2415 HydrophobicContact CD1-CB 4.12Å; L2411-H2415 WeakPolarHBondContact CD1-CD2 3.46Å
2412	T	93.6	Very high	90.1	Very high	111.5 Å²	111.5	51.4 Å²	51.4	68%	0.684	28%	0.277	S	S	*	.	S	Bend	trans	-107.2	4.1	174.3	53.7	0	0	0	0	112.8	Y2359	Y2359-T2412 VanDerWaalsContact CB-C 3.43Å; Y2359-T2412 VanDerWaalsContact CB-O 3.25Å; Y2359-T2412 WeakPolarHBondContact CB-O 3.37Å
2413	K	95	Very high	89.3	Confident	156.5 Å²	156.5	54.2 Å²	54.2	68%	0.68	28%	0.28	S	S	*	.	S	Bend	trans	-118	160.3	174.1	-65.2	-176.3	-179.9	-178.4	0	109.1	L2411 H2415	L2411-K2413 VanDerWaalsContact CD1-O 3.22Å; L2411-K2413 WeakPolarHBondContact CD1-O 3.45Å; L2411-K2413 WeakPolarHBondContact CG-O 3.49Å; K2413-H2415 PolarHBondContact O-N 3.16Å
2414	P	96.5	Very high	88.1	Confident	86 Å²	86	55.8 Å²	55.8	56%	0.558	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-54	137	175	-25.8	34.2	0	0	0	113.1	Y2359	Y2359-P2414 VanDerWaalsContact CD1-CA 3.48Å; Y2359-P2414 HydrophobicContact CD1-CB 4.2Å; Y2359-P2414 HydrophobicContact CD1-CG 4.11Å; Y2359-P2414 VanDerWaalsContact CE1-CA 3.44Å; Y2359-P2414 HydrophobicContact CE1-CB 3.75Å; Y2359-P2414 HydrophobicContact CE1-CG 3.69Å
2415	H	97.6	Very high	86.9	Confident	5.5 Å²	5.5	58.5 Å²	58.5	3%	0.025	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-68.3	134.5	179.9	-167.3	-76.9	0	0	0	110.7	F2135 W2144 Y2154 H2350 V2353 D2354 L2411 K2413 R2417	F2135-H2415 AromaticContact CZ-CD2 3.99Å; F2135-H2415 AromaticContact CZ-NE2 3.88Å; W2144-H2415 AromaticContact CZ3-CE1 3.69Å; Y2154-H2415 AromaticContact CE1-CE1 3.81Å; Y2154-H2415 AromaticContact CE1-NE2 3.78Å; Y2154-H2415 AromaticContact CZ-CE1 3.93Å; Y2154-H2415 AromaticContact CZ-NE2 3.81Å; Y2154-H2415 PolarHBondContact OH-CE1 3.25Å; Y2154-H2415 VanDerWaalsContact OH-CE1 3.28Å; Y2154-H2415 PolarHBondContact OH-NE2 2.92Å; H2350-H2415 HydrophobicContact CB-CB 4.15Å; H2350-H2415 PolarHBondContact CD2-O 3.23Å; V2353-H2415 HydrophobicContact CG1-CB 4.41Å; V2353-H2415 WeakPolarHBondContact CG1-CD2 3.34Å; D2354-H2415 VanDerWaalsContact CG-N 3.33Å; D2354-H2415 VanDerWaalsContact OD1-CB 3.25Å; D2354-H2415 WeakPolarHBondContact OD1-CB 3.16Å; D2354-H2415 PolarHBondContact OD1-N 3.03Å; D2354-H2415 PolarHBondContact OD2-N 3.19Å; D2354-H2415 VanDerWaalsContact OD2-N 3.1Å; L2411-H2415 HydrophobicContact CD1-CB 4.12Å; L2411-H2415 WeakPolarHBondContact CD1-CD2 3.46Å; K2413-H2415 PolarHBondContact O-N 3.16Å; H2415-R2417 PolarHBondContact O-N 3.16Å
2416	P	95	Very high	85.1	Confident	50.5 Å²	50.5	62.7 Å²	62.7	33%	0.328	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-60.6	138.8	175.9	1.6	-1	0	0	0	111.8	T2141 W2144 H2350	T2141-P2416 HydrophobicContact CG2-CG 3.93Å; W2144-P2416 WeakPolarHBondContact CZ3-O 3.44Å; H2350-P2416 WeakPolarHBondContact CB-O 3.39Å
2417	R	94.8	Very high	83.3	Confident	178 Å²	178	66 Å²	66	67%	0.672	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-70.1	149.4	173.3	59.2	178.6	147.5	-134.7	-0.3	111.9	Q2145 H2415	Q2145-R2417 WeakPolarHBondContact CG-O 3.24Å; Q2145-R2417 PolarHBondContact NE2-O 3.13Å; H2415-R2417 PolarHBondContact O-N 3.16Å
2418	R	94.2	Very high	81.4	Confident	20 Å²	20	68.6 Å²	68.6	8%	0.075	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-65.7	145.3	169.5	-149.2	-178	-170.7	-169.2	3.3	109.5	W2144 L2149 N2151 S2346	W2144-R2418 HydrophobicContact CD2-CG 4.02Å; W2144-R2418 HydrophobicContact CE3-CB 4.48Å; W2144-R2418 HydrophobicContact CE3-CG 4.35Å; W2144-R2418 HydrophobicContact CG-CG 4.48Å; W2144-R2418 HydrophobicContact CH2-CB 3.73Å; W2144-R2418 HydrophobicContact CH2-CG 4.25Å; W2144-R2418 HydrophobicContact CZ2-CB 3.72Å; W2144-R2418 HydrophobicContact CZ2-CG 3.88Å; W2144-R2418 HydrophobicContact CZ3-CB 4.13Å; W2144-R2418 HydrophobicContact CZ3-CG 4.45Å; W2144-R2418 WeakPolarHBondContact O-CG 3.37Å; W2144-R2418 PolarHBondContact O-NE 2.93Å; W2144-R2418 VanDerWaalsContact O-NE 3.17Å; L2149-R2418 PolarHBondContact O-NH2 3.23Å; N2151-R2418 PolarHBondContact OD1-NE 3.33Å; N2151-R2418 PolarHBondContact OD1-NH1 2.99Å; S2346-R2418 VanDerWaalsContact O-CB 3.23Å; S2346-R2418 WeakPolarHBondContact O-CB 3.38Å; S2346-R2418 PolarHBondContact OG-NH1 2.8Å
2419	N	89	Confident	79.6	Confident	54.5 Å²	54.5	72.5 Å²	72.5	29%	0.291	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-74	143.4	175	-60	-21.6	0	0	0	109.7	Q2145 R2147	Q2145-N2419 VanDerWaalsContact O-CB 3.24Å; Q2145-N2419 WeakPolarHBondContact O-CB 3.32Å; Q2145-N2419 PolarHBondContact O-N 3.15Å; Q2145-N2419 PolarHBondContact O-ND2 3.4Å; R2147-N2419 VanDerWaalsContact CZ-O 3.29Å; R2147-N2419 PolarHBondContact NE-O 3.3Å; R2147-N2419 PolarHBondContact NH2-O 2.89Å
2420	S	81.9	Confident	77.7	Confident	46.5 Å²	46.5	73.6 Å²	73.6	33%	0.325	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-61.4	146.6	174.6	118.9	0	0	0	0	110.8	E2343 L2422 H2423 H2424	E2343-S2420 WeakPolarHBondContact OE1-CA 3.14Å; S2420-L2422 PolarHBondContact O-N 3.09Å; S2420-H2423 PolarHBondContact O-N 3.37Å; S2420-H2423 VanDerWaalsContact OG-CB 3.24Å; S2420-H2423 WeakPolarHBondContact OG-CB 3.1Å; S2420-H2423 PolarHBondContact OG-N 3.4Å; S2420-H2423 VanDerWaalsContact OG-N 3.16Å; S2420-H2424 PolarHBondContact O-N 2.81Å; S2420-H2424 VanDerWaalsContact O-N 3.16Å
2421	A	73.4	Confident	75.8	Confident	23 Å²	23	78.3 Å²	78.3	19%	0.19	40%	0.403	C	S	.	.	H	α-helix	trans	-54.3	-43.6	178.6	0	0	0	0	0	111.8	R2147 E2343 H2423 H2424 N2425 F2887	R2147-A2421 VanDerWaalsContact CZ-N 3.34Å; E2343-A2421 PolarHBondContact OE1-N 3.02Å; A2421-H2423 PolarHBondContact O-N 2.85Å; A2421-H2423 VanDerWaalsContact O-N 3.12Å; A2421-H2424 PolarHBondContact O-N 3.02Å; A2421-N2425 PolarHBondContact O-N 2.98Å; A2421-N2425 VanDerWaalsContact O-N 3.17Å; A2421-F2887 HydrophobicContact CB-CZ 4.28Å
2422	L	69.1	Low	74.1	Confident	96 Å²	96	81.2 Å²	81.2	50%	0.503	42%	0.418	S	S	.	.	H	α-helix	trans	-57.7	-33.6	176.5	-70	166.3	0	0	0	113.6	S2420 N2425 P2426 F2429	S2420-L2422 PolarHBondContact O-N 3.09Å; L2422-N2425 CarbonylContact O-C 3.5Å; L2422-P2426 WeakPolarHBondContact O-CA 3.38Å; L2422-F2429 HydrophobicContact CD2-CD2 3.58Å; L2422-F2429 HydrophobicContact CD2-CE2 3.87Å; L2422-F2429 HydrophobicContact CG-CD2 4.46Å; L2422-F2429 HydrophobicContact CG-CE2 3.77Å
2423	H	66.2	Low	72.4	Confident	146.5 Å²	146.5	81.8 Å²	81.8	68%	0.678	42%	0.417	S	S	*	.	H	α-helix	trans	-78.9	-26.1	-179.5	-125.5	70.9	0	0	0	112.6	S2420 A2421	S2420-H2423 PolarHBondContact O-N 3.37Å; S2420-H2423 VanDerWaalsContact OG-CB 3.24Å; S2420-H2423 WeakPolarHBondContact OG-CB 3.1Å; S2420-H2423 PolarHBondContact OG-N 3.4Å; S2420-H2423 VanDerWaalsContact OG-N 3.16Å; A2421-H2423 PolarHBondContact O-N 2.85Å; A2421-H2423 VanDerWaalsContact O-N 3.12Å
2424	H	58.4	Low	70.9	Confident	96 Å²	96	81.4 Å²	81.4	44%	0.444	42%	0.417	S	S	.	.	H	α-helix	trans	-94.2	-24.6	-178.9	-156.6	-18.1	0	0	0	113.4	R2146 S2420 A2421	R2146-H2424 WeakPolarHBondContact CB-NE2 3.13Å; R2146-H2424 WeakPolarHBondContact CG-NE2 3.24Å; R2146-H2424 PolarHBondContact O-CD2 3.18Å; R2146-H2424 PolarHBondContact O-NE2 2.85Å; R2146-H2424 VanDerWaalsContact O-NE2 3.1Å; S2420-H2424 PolarHBondContact O-N 2.81Å; S2420-H2424 VanDerWaalsContact O-N 3.16Å; A2421-H2424 PolarHBondContact O-N 3.02Å
2425	N	59.3	Low	69.6	Low	55.5 Å²	55.5	82.7 Å²	82.7	30%	0.297	42%	0.416	S	S	.	.			trans	-140.2	83.8	170	-169.2	4.1	0	0	0	110.5	A2421 L2422 E2427 I2428	A2421-N2425 PolarHBondContact O-N 2.98Å; A2421-N2425 VanDerWaalsContact O-N 3.17Å; L2422-N2425 CarbonylContact O-C 3.5Å; N2425-E2427 PolarHBondContact O-N 2.96Å; N2425-E2427 WeakPolarHBondContact OD1-CA 3.31Å; N2425-E2427 VanDerWaalsContact OD1-CB 3.26Å; N2425-E2427 WeakPolarHBondContact OD1-CB 3.47Å; N2425-E2427 PolarHBondContact OD1-N 3.43Å; N2425-E2427 VanDerWaalsContact OD1-N 3.08Å; N2425-I2428 HydrophobicContact CB-CB 4.04Å; N2425-I2428 HydrophobicContact CB-CD1 4.2Å; N2425-I2428 HydrophobicContact CB-CG1 3.99Å; N2425-I2428 WeakPolarHBondContact O-CB 3.08Å; N2425-I2428 WeakPolarHBondContact O-CG1 3.37Å; N2425-I2428 VanDerWaalsContact O-CG2 3.3Å; N2425-I2428 WeakPolarHBondContact O-CG2 3.42Å; N2425-I2428 PolarHBondContact O-N 3.07Å; N2425-I2428 PolarHBondContact OD1-N 2.79Å
2426	P	54.3	Low	68.4	Low	91.5 Å²	91.5	88.4 Å²	88.4	59%	0.594	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-64.2	-23.7	175.7	25.9	-33.6	0	0	0	112.2	L2422 I2428	L2422-P2426 WeakPolarHBondContact O-CA 3.38Å; P2426-I2428 PolarHBondContact O-N 3.08Å
2427	E	57	Low	67.3	Low	77.5 Å²	77.5	89.1 Å²	89.1	36%	0.362	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-76.2	1.4	177.5	-53	-177.8	166.3	0	0	113	N2425 F2429 N2430 R2492	N2425-E2427 PolarHBondContact O-N 2.96Å; N2425-E2427 WeakPolarHBondContact OD1-CA 3.31Å; N2425-E2427 VanDerWaalsContact OD1-CB 3.26Å; N2425-E2427 WeakPolarHBondContact OD1-CB 3.47Å; N2425-E2427 PolarHBondContact OD1-N 3.43Å; N2425-E2427 VanDerWaalsContact OD1-N 3.08Å; E2427-F2429 PolarHBondContact O-N 2.96Å; E2427-F2429 VanDerWaalsContact O-N 3.1Å; E2427-N2430 HydrophobicContact CB-CB 4.46Å; E2427-N2430 PolarHBondContact O-N 3.04Å; E2427-N2430 VanDerWaalsContact O-O 3.09Å; E2427-R2492 PolarHBondContact O-NH1 2.85Å; E2427-R2492 IonicContact OE2-NH1 3.82Å
2428	I	56.2	Low	66.5	Low	59 Å²	59	83.9 Å²	83.9	30%	0.303	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-58.7	-24.6	177.9	-113.3	168.5	0	0	0	112.2	N2425 P2426 N2881 F2887 Y2891	N2425-I2428 HydrophobicContact CB-CB 4.04Å; N2425-I2428 HydrophobicContact CB-CD1 4.2Å; N2425-I2428 HydrophobicContact CB-CG1 3.99Å; N2425-I2428 WeakPolarHBondContact O-CB 3.08Å; N2425-I2428 WeakPolarHBondContact O-CG1 3.37Å; N2425-I2428 VanDerWaalsContact O-CG2 3.3Å; N2425-I2428 WeakPolarHBondContact O-CG2 3.42Å; N2425-I2428 PolarHBondContact O-N 3.07Å; N2425-I2428 PolarHBondContact OD1-N 2.79Å; P2426-I2428 PolarHBondContact O-N 3.08Å; I2428-N2881 HydrophobicContact CG1-CB 4.33Å; I2428-F2887 HydrophobicContact CD1-CE2 4.42Å; I2428-Y2891 VanDerWaalsContact O-CZ 3.28Å; I2428-Y2891 PolarHBondContact O-OH 3.3Å
2429	F	54.4	Low	65.8	Low	98.5 Å²	98.5	86.8 Å²	86.8	43%	0.432	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-102.7	0.4	178	-61.7	-72.9	0	0	0	114.4	L2422 E2427 L2431 F2887 R2890 Y2891	L2422-F2429 HydrophobicContact CD2-CD2 3.58Å; L2422-F2429 HydrophobicContact CD2-CE2 3.87Å; L2422-F2429 HydrophobicContact CG-CD2 4.46Å; L2422-F2429 HydrophobicContact CG-CE2 3.77Å; E2427-F2429 PolarHBondContact O-N 2.96Å; E2427-F2429 VanDerWaalsContact O-N 3.1Å; F2429-L2431 PolarHBondContact O-N 3.09Å; F2429-F2887 HydrophobicContact CE1-CB 3.74Å; F2429-F2887 AromaticContact CE1-CD1 3.64Å; F2429-F2887 HydrophobicContact CE1-CD1 3.64Å; F2429-F2887 AromaticContact CE1-CG 3.79Å; F2429-F2887 HydrophobicContact CE1-CG 3.79Å; F2429-F2887 AromaticContact CZ-CD1 3.64Å; F2429-F2887 HydrophobicContact CZ-CD1 3.64Å; F2429-F2887 HydrophobicContact CZ-CE1 4.11Å; F2429-F2887 HydrophobicContact CZ-CG 4.21Å; F2429-R2890 HydrophobicContact CD1-CB 3.65Å; F2429-R2890 HydrophobicContact CE1-CB 3.67Å; F2429-R2890 HydrophobicContact CE1-CG 4.26Å; F2429-R2890 HydrophobicContact CG-CB 4.36Å; F2429-R2890 HydrophobicContact CZ-CB 4.42Å; F2429-Y2891 HydrophobicContact CD1-CD2 4.09Å; F2429-Y2891 AromaticContact CD1-CE2 3.91Å; F2429-Y2891 HydrophobicContact CD1-CE2 3.91Å; F2429-Y2891 HydrophobicContact CE1-CE2 4.41Å
2430	N	56	Low	65.3	Low	70.5 Å²	70.5	86.7 Å²	86.7	38%	0.377	45%	0.453	S	S	.	.			trans	-84.4	116.2	173.4	-72.6	-5.7	0	0	0	108.8	E2427 L2432 R2492 I2493	E2427-N2430 HydrophobicContact CB-CB 4.46Å; E2427-N2430 PolarHBondContact O-N 3.04Å; E2427-N2430 VanDerWaalsContact O-O 3.09Å; N2430-L2432 PolarHBondContact O-N 3.01Å; N2430-L2432 VanDerWaalsContact O-N 3.12Å; N2430-R2492 HydrophobicContact CB-CB 4.07Å; N2430-I2493 WeakPolarHBondContact CB-O 3.22Å; N2430-I2493 PolarHBondContact ND2-O 3.45Å; N2430-I2493 VanDerWaalsContact ND2-O 3.15Å
2431	L	55.1	Low	65.2	Low	100.5 Å²	100.5	92.6 Å²	92.6	53%	0.526	47%	0.473	S	S	.	.			trans	-62.7	133.2	166.7	-83.3	82.5	0	0	0	109.3	F2429 N2433 R2492 I2493 Y2891	F2429-L2431 PolarHBondContact O-N 3.09Å; L2431-N2433 WeakPolarHBondContact CB-OD1 3.32Å; L2431-N2433 PolarHBondContact O-N 3.44Å; L2431-R2492 CarbonylContact O-C 3.57Å; L2431-R2492 WeakPolarHBondContact O-CA 3.35Å; L2431-I2493 HydrophobicContact CB-CD1 3.9Å; L2431-I2493 PolarHBondContact O-N 3.46Å; L2431-Y2891 HydrophobicContact CD1-CD1 3.62Å; L2431-Y2891 HydrophobicContact CD1-CE1 4.47Å; L2431-Y2891 HydrophobicContact CD1-CG 4.48Å; L2431-Y2891 HydrophobicContact CG-CD1 3.95Å
2432	L	59.5	Low	65.4	Low	82 Å²	82	93.1 Å²	93.1	43%	0.429	47%	0.471	S	S	.	.	B	Isolated β-bridge	trans	-72.8	100.6	166.1	-72.3	166.5	0	0	0	108.8	N2430 E2434 Y2488 A2491 R2492 D2879	N2430-L2432 PolarHBondContact O-N 3.01Å; N2430-L2432 VanDerWaalsContact O-N 3.12Å; L2432-E2434 PolarHBondContact O-N 2.87Å; L2432-Y2488 HydrophobicContact CD2-CE2 4.26Å; L2432-A2491 CarbonylContact C-O 3.58Å; L2432-A2491 WeakPolarHBondContact CA-O 3.25Å; L2432-A2491 HydrophobicContact CD2-CB 4.15Å; L2432-R2492 HydrophobicContact CD2-CG 3.88Å; L2432-D2879 HydrophobicContact CD1-CB 4.24Å
2433	N	58	Low	65.5	Low	123 Å²	123	95.4 Å²	95.4	66%	0.658	48%	0.479	S	S	*	.	S	Bend	trans	-69.6	-9.6	179.5	-89.7	-25.1	0	0	0	113.4	L2431 A2491 I2493	L2431-N2433 WeakPolarHBondContact CB-OD1 3.32Å; L2431-N2433 PolarHBondContact O-N 3.44Å; N2433-A2491 PolarHBondContact N-O 3.32Å; N2433-I2493 VanDerWaalsContact CG-CG1 3.49Å; N2433-I2493 WeakPolarHBondContact OD1-CG1 3.48Å
2434	E	63.4	Low	65.7	Low	148.5 Å²	148.5	90.4 Å²	90.4	69%	0.694	46%	0.461	S	S	*	.			trans	-125.5	108.7	174.9	-67.3	-174.4	177.6	0	0	109.4	L2432 F2436 Y2877	L2432-E2434 PolarHBondContact O-N 2.87Å; E2434-F2436 PolarHBondContact O-N 3.34Å; E2434-Y2877 WeakPolarHBondContact O-CD2 3.44Å
2435	E	68.6	Low	66.8	Low	113.5 Å²	113.5	92.8 Å²	92.8	53%	0.53	47%	0.472	S	S	.	.	S	Bend	trans	-77.9	41	171.3	-67.3	-170.1	161.9	0	0	110.8	C2437 H2843 F2845 P2846 F2876 Y2877	E2435-C2437 PolarHBondContact O-N 2.88Å; E2435-H2843 IonicContact OE1-CD2 2.7Å; E2435-H2843 IonicContact OE1-CE1 3.6Å; E2435-H2843 PolarHBondContact OE1-CE1 3.34Å; E2435-H2843 VanDerWaalsContact OE1-CE1 3.24Å; E2435-H2843 IonicContact OE1-NE2 3.68Å; E2435-H2843 PolarHBondContact OE1-NE2 2.83Å; E2435-H2843 IonicContact OE2-NE2 3.22Å; E2435-F2845 HydrophobicContact CB-CD1 4.04Å; E2435-F2845 HydrophobicContact CB-CE1 4.08Å; E2435-F2845 HydrophobicContact CG-CD1 4.47Å; E2435-F2845 HydrophobicContact CG-CE1 4.31Å; E2435-F2845 VanDerWaalsContact OE2-CD1 3.24Å; E2435-F2845 WeakPolarHBondContact OE2-CD1 3.1Å; E2435-P2846 WeakPolarHBondContact OE2-CD 3.36Å; E2435-F2876 CarbonylContact O-C 3.57Å; E2435-F2876 WeakPolarHBondContact O-CA 3.32Å; E2435-F2876 WeakPolarHBondContact O-CB 3.46Å; E2435-F2876 WeakPolarHBondContact O-CD1 3.36Å; E2435-Y2877 PolarHBondContact O-N 3.25Å
2436	F	72.6	Confident	68.1	Low	124.5 Å²	124.5	91 Å²	91	55%	0.546	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	103.5	178.8	-175.9	-96.5	0	0	0	111.2	E2434 M2438 V2874 F2876 Y2877	E2434-F2436 PolarHBondContact O-N 3.34Å; F2436-M2438 HydrophobicContact CE1-CB 4.46Å; F2436-M2438 HydrophobicContact CE1-CE 4.05Å; F2436-M2438 PolarHBondContact O-N 2.98Å; F2436-V2874 HydrophobicContact CD2-CG1 4.14Å; F2436-V2874 HydrophobicContact CE2-CG1 3.88Å; F2436-F2876 HydrophobicContact CD2-CE1 4.33Å; F2436-Y2877 WeakPolarHBondContact O-CE2 3.08Å
2437	C	72.4	Confident	69.9	Low	67 Å²	67	89.1 Å²	89.1	45%	0.453	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	19.1	179.9	-179.8	0	0	0	0	111.8	E2435 V2875 Y2877	E2435-C2437 PolarHBondContact O-N 2.88Å; C2437-V2875 HydrophobicContact CB-CB 4.12Å; C2437-V2875 HydrophobicContact CB-CG1 4.06Å; C2437-V2875 VanDerWaalsContact CB-O 3.31Å; C2437-V2875 WeakPolarHBondContact CB-O 3.37Å; C2437-V2875 PolarHBondContact N-O 3.24Å; C2437-Y2877 HydrophobicContact CB-CD1 4.2Å; C2437-Y2877 HydrophobicContact CB-CD2 4.12Å; C2437-Y2877 HydrophobicContact CB-CE1 3.77Å; C2437-Y2877 HydrophobicContact CB-CE2 3.63Å; C2437-Y2877 HydrophobicContact CB-CG 4.38Å; C2437-Y2877 VanDerWaalsContact CB-CZ 3.41Å; C2437-Y2877 VanDerWaalsContact SG-CZ 3.56Å; C2437-Y2877 PolarHBondContact SG-OH 3.2Å
2438	M	77.9	Confident	71.5	Confident	67 Å²	67	86.8 Å²	86.8	33%	0.33	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	132.2	176.8	126.5	179.8	-62.2	0	0	111.6	F2436 L2440 L2571 L2573 V2875	F2436-M2438 HydrophobicContact CE1-CB 4.46Å; F2436-M2438 HydrophobicContact CE1-CE 4.05Å; F2436-M2438 PolarHBondContact O-N 2.98Å; M2438-L2440 HydrophobicContact CE-CD1 4.04Å; M2438-L2440 HydrophobicContact CE-CD2 3.72Å; M2438-L2440 HydrophobicContact CE-CG 3.72Å; M2438-L2440 HydrophobicContact CG-CD2 4.36Å; M2438-L2440 HydrophobicContact CG-CG 4.2Å; M2438-L2440 PolarHBondContact O-N 3.48Å; M2438-L2440 HydrophobicContact SD-CD1 4.47Å; M2438-L2440 HydrophobicContact SD-CD2 4.02Å; M2438-L2440 HydrophobicContact SD-CG 4.27Å; M2438-L2571 HydrophobicContact CE-CB 4.22Å; M2438-L2571 HydrophobicContact CE-CD1 4.15Å; M2438-L2571 HydrophobicContact CE-CD2 4.21Å; M2438-L2571 HydrophobicContact CE-CG 4.43Å; M2438-L2573 HydrophobicContact CE-CB 4.31Å; M2438-L2573 HydrophobicContact SD-CB 4.04Å; M2438-L2573 HydrophobicContact SD-CD1 4.46Å; M2438-V2875 HydrophobicContact CG-CB 3.82Å; M2438-V2875 HydrophobicContact CG-CG2 3.66Å; M2438-V2875 PolarHBondContact N-O 3.02Å; M2438-V2875 PolarHBondContact O-N 2.94Å; M2438-V2875 HydrophobicContact SD-CG2 4.41Å
2439	S	79.6	Confident	73.3	Confident	82.5 Å²	82.5	85.1 Å²	85.1	58%	0.577	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	124.9	172.5	-177.8	0	0	0	0	111.2	L2873	S2439-L2873 CarbonylContact C-O 3.55Å; S2439-L2873 WeakPolarHBondContact CA-O 3.24Å
2440	L	78.7	Confident	75.1	Confident	52.5 Å²	52.5	81.5 Å²	81.5	28%	0.275	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	125.2	178.2	-69.4	164.4	0	0	0	110.3	M2438 C2477 L2573 C2872 L2873	M2438-L2440 HydrophobicContact CE-CD1 4.04Å; M2438-L2440 HydrophobicContact CE-CD2 3.72Å; M2438-L2440 HydrophobicContact CE-CG 3.72Å; M2438-L2440 HydrophobicContact CG-CD2 4.36Å; M2438-L2440 HydrophobicContact CG-CG 4.2Å; M2438-L2440 PolarHBondContact O-N 3.48Å; M2438-L2440 HydrophobicContact SD-CD1 4.47Å; M2438-L2440 HydrophobicContact SD-CD2 4.02Å; M2438-L2440 HydrophobicContact SD-CG 4.27Å; L2440-C2477 WeakPolarHBondContact CD1-SG 3.39Å; L2440-L2573 HydrophobicContact CD1-CB 3.72Å; L2440-L2573 HydrophobicContact CD1-CD1 3.88Å; L2440-L2573 HydrophobicContact CD1-CG 4.45Å; L2440-C2872 CarbonylContact O-C 3.48Å; L2440-C2872 VanDerWaalsContact O-CA 3.26Å; L2440-C2872 WeakPolarHBondContact O-CA 3.45Å; L2440-L2873 HydrophobicContact CB-CB 4.35Å; L2440-L2873 HydrophobicContact CD1-CD2 4.45Å; L2440-L2873 PolarHBondContact N-O 3.18Å; L2440-L2873 PolarHBondContact O-N 3.41Å
2441	K	78.8	Confident	76.9	Confident	169 Å²	169	81.3 Å²	81.3	74%	0.735	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	123	175.8	-120	177.2	-174	-177.6	0	110.7	H2445	K2441-H2445 VanDerWaalsContact CE-CE1 3.42Å; K2441-H2445 WeakPolarHBondContact CE-CE1 3.39Å; K2441-H2445 WeakPolarHBondContact CE-ND1 3.17Å
2442	F	77.4	Confident	78.7	Confident	35 Å²	35	79.1 Å²	79.1	15%	0.154	40%	0.404	C	S	.	.			trans	-84.2	138.5	177.9	-60.9	-68.2	0	0	0	111.3	S2444 H2445 V2448 A2467 T2469 V2475 G2871 L2873	F2442-S2444 VanDerWaalsContact C-N 3.27Å; F2442-S2444 PolarHBondContact O-N 3.03Å; F2442-H2445 PolarHBondContact O-N 3.41Å; F2442-H2445 VanDerWaalsContact O-N 3.16Å; F2442-H2445 PolarHBondContact O-ND1 3.16Å; F2442-V2448 HydrophobicContact CD2-CG2 4.14Å; F2442-V2448 HydrophobicContact CE1-CG2 4.06Å; F2442-V2448 HydrophobicContact CE2-CG2 3.78Å; F2442-V2448 HydrophobicContact CZ-CG2 3.71Å; F2442-A2467 HydrophobicContact CE1-CB 3.71Å; F2442-A2467 HydrophobicContact CE2-CB 3.5Å; F2442-A2467 HydrophobicContact CZ-CB 3.59Å; F2442-T2469 HydrophobicContact CD1-CG2 3.74Å; F2442-T2469 HydrophobicContact CD2-CG2 4.13Å; F2442-T2469 HydrophobicContact CE1-CG2 4.2Å; F2442-T2469 HydrophobicContact CG-CG2 4.36Å; F2442-V2475 HydrophobicContact CD1-CB 4.43Å; F2442-V2475 HydrophobicContact CD1-CG1 4.04Å; F2442-V2475 HydrophobicContact CD1-CG2 4.06Å; F2442-V2475 HydrophobicContact CD2-CG2 4.31Å; F2442-V2475 HydrophobicContact CE1-CB 4.09Å; F2442-V2475 HydrophobicContact CE1-CG1 4.05Å; F2442-V2475 HydrophobicContact CE1-CG2 3.63Å; F2442-V2475 HydrophobicContact CG-CG2 4.23Å; F2442-V2475 HydrophobicContact CZ-CB 4.34Å; F2442-V2475 HydrophobicContact CZ-CG1 4.16Å; F2442-G2871 WeakPolarHBondContact CB-O 3.45Å; F2442-G2871 WeakPolarHBondContact CD2-O 3.3Å; F2442-G2871 WeakPolarHBondContact CG-O 3.26Å; F2442-G2871 PolarHBondContact N-O 3.43Å; F2442-L2873 HydrophobicContact CE1-CB 4.37Å; F2442-L2873 HydrophobicContact CE2-CB 4.32Å; F2442-L2873 HydrophobicContact CZ-CB 3.76Å; F2442-L2873 HydrophobicContact CZ-CD2 4.25Å
2443	Q	71.7	Confident	80.1	Confident	144 Å²	144	77.3 Å²	77.3	67%	0.673	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-25.3	-178.2	-119.5	130	-17.5	0	0	113.7	H2445 P2580	Q2443-H2445 PolarHBondContact O-CD2 3.5Å; Q2443-H2445 PolarHBondContact O-N 2.81Å; Q2443-P2580 HydrophobicContact CB-CG 4.2Å
2444	S	71	Confident	81.5	Confident	41.5 Å²	41.5	72.5 Å²	72.5	29%	0.29	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-15.2	-176.3	57.2	0	0	0	0	113.8	F2442 S2446 N2471	F2442-S2444 VanDerWaalsContact C-N 3.27Å; F2442-S2444 PolarHBondContact O-N 3.03Å; S2444-S2446 PolarHBondContact O-N 3.14Å; S2444-S2446 PolarHBondContact OG-N 2.98Å; S2444-N2471 WeakPolarHBondContact CB-ND2 3.49Å; S2444-N2471 PolarHBondContact OG-OD1 2.75Å
2445	H	80	Confident	82.4	Confident	145.5 Å²	145.5	68 Å²	68	67%	0.674	36%	0.355	S	S	*	.			trans	50.7	12.3	-168.9	-64.3	-75.8	0	0	0	114.6	K2441 F2442 Q2443	K2441-H2445 VanDerWaalsContact CE-CE1 3.42Å; K2441-H2445 WeakPolarHBondContact CE-CE1 3.39Å; K2441-H2445 WeakPolarHBondContact CE-ND1 3.17Å; F2442-H2445 PolarHBondContact O-N 3.41Å; F2442-H2445 VanDerWaalsContact O-N 3.16Å; F2442-H2445 PolarHBondContact O-ND1 3.16Å; Q2443-H2445 PolarHBondContact O-CD2 3.5Å; Q2443-H2445 PolarHBondContact O-N 2.81Å
2446	S	87.9	Confident	82.8	Confident	18.5 Å²	18.5	64.4 Å²	64.4	13%	0.129	34%	0.343	C	S	.	.			trans	-87.3	139.6	-176.4	177.2	0	0	0	0	109.6	S2444 V2448 T2469 E2470 N2471 G2871	S2444-S2446 PolarHBondContact O-N 3.14Å; S2444-S2446 PolarHBondContact OG-N 2.98Å; S2446-V2448 PolarHBondContact O-N 3.37Å; S2446-T2469 VanDerWaalsContact O-CG2 3.3Å; S2446-T2469 WeakPolarHBondContact O-CG2 3.43Å; S2446-E2470 WeakPolarHBondContact OG-CB 3.27Å; S2446-E2470 PolarHBondContact OG-N 2.96Å; S2446-N2471 PolarHBondContact OG-N 3.38Å; S2446-G2871 WeakPolarHBondContact O-CA 3.48Å
2447	P	91.5	Very high	82.5	Confident	50.5 Å²	50.5	62.3 Å²	62.3	33%	0.328	34%	0.344	S	S	.	.			trans	-57.7	141.5	-177.7	-2.2	1.6	0	0	0	112.4	V2449 T2469 E2470 K2869	P2447-V2449 PolarHBondContact O-N 3Å; P2447-T2469 CarbonylContact O-C 3.51Å; P2447-T2469 WeakPolarHBondContact O-CA 3.46Å; P2447-T2469 WeakPolarHBondContact O-CB 3.39Å; P2447-E2470 HydrophobicContact CB-CB 4.26Å; P2447-E2470 HydrophobicContact CG-CB 4.26Å; P2447-E2470 VanDerWaalsContact CG-OE2 3.29Å; P2447-E2470 WeakPolarHBondContact CG-OE2 3.24Å; P2447-E2470 PolarHBondContact O-N 2.88Å; P2447-K2869 HydrophobicContact CB-CG 4.07Å; P2447-K2869 HydrophobicContact CG-CG 3.77Å; P2447-K2869 WeakPolarHBondContact CG-O 3.42Å
2448	V	91.5	Very high	82.2	Confident	29.5 Å²	29.5	68.4 Å²	68.4	18%	0.179	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	111.9	174.9	-175.8	0	0	0	0	109.2	F2442 S2446 L2451 A2467 T2469 S2854 L2868	F2442-V2448 HydrophobicContact CD2-CG2 4.14Å; F2442-V2448 HydrophobicContact CE1-CG2 4.06Å; F2442-V2448 HydrophobicContact CE2-CG2 3.78Å; F2442-V2448 HydrophobicContact CZ-CG2 3.71Å; S2446-V2448 PolarHBondContact O-N 3.37Å; V2448-L2451 HydrophobicContact CG1-CD2 3.93Å; V2448-L2451 HydrophobicContact CG1-CG 3.95Å; V2448-A2467 HydrophobicContact CG1-CB 4.02Å; V2448-T2469 HydrophobicContact CG2-CG2 4.22Å; V2448-S2854 PolarHBondContact O-OG 3.3Å; V2448-L2868 PolarHBondContact N-O 3.04Å
2449	V	92	Very high	81.7	Confident	24 Å²	24	67.9 Å²	67.9	15%	0.145	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-20.4	-174.6	-63.9	0	0	0	0	113.4	P2447 I2468 E2470 I2595 S2597 F2600	P2447-V2449 PolarHBondContact O-N 3Å; V2449-I2468 WeakPolarHBondContact CG2-O 3.27Å; V2449-I2468 PolarHBondContact N-O 3.1Å; V2449-E2470 HydrophobicContact CG1-CB 3.79Å; V2449-E2470 HydrophobicContact CG1-CG 4.27Å; V2449-I2595 HydrophobicContact CB-CG2 4.46Å; V2449-I2595 HydrophobicContact CG1-CG2 4.37Å; V2449-I2595 HydrophobicContact CG2-CD1 4.34Å; V2449-I2595 HydrophobicContact CG2-CG1 4.33Å; V2449-I2595 HydrophobicContact CG2-CG2 3.98Å; V2449-S2597 VanDerWaalsContact O-CA 3.28Å; V2449-S2597 WeakPolarHBondContact O-CA 3.5Å; V2449-S2597 VanDerWaalsContact O-CB 3.32Å; V2449-S2597 WeakPolarHBondContact O-CB 3.32Å; V2449-S2597 PolarHBondContact O-N 3.13Å; V2449-F2600 HydrophobicContact CG2-CD2 4.41Å; V2449-F2600 HydrophobicContact CG2-CE2 3.83Å; V2449-F2600 HydrophobicContact CG2-CZ 4.3Å
2450	H	93	Very high	81.4	Confident	23 Å²	23	64.9 Å²	64.9	11%	0.106	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	134.4	177.5	-176.5	97.7	0	0	0	110.6	I2468 S2597 F2600	H2450-I2468 HydrophobicContact CB-CB 4.28Å; H2450-I2468 PolarHBondContact N-O 2.92Å; H2450-I2468 PolarHBondContact O-N 3.16Å; H2450-S2597 PolarHBondContact ND1-O 3.16Å; H2450-F2600 HydrophobicContact CB-CB 4.08Å; H2450-F2600 HydrophobicContact CB-CD2 3.99Å; H2450-F2600 HydrophobicContact CB-CG 4.23Å; H2450-F2600 PolarHBondContact CE1-O 3.12Å; H2450-F2600 PolarHBondContact ND1-O 2.92Å
2451	L	94	Very high	81.1	Confident	66.5 Å²	66.5	67.5 Å²	67.5	35%	0.348	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	137.2	173.2	-77	173.4	0	0	0	109.6	V2448 F2466 A2467 S2854 C2856 F2865 G2867 L2873	V2448-L2451 HydrophobicContact CG1-CD2 3.93Å; V2448-L2451 HydrophobicContact CG1-CG 3.95Å; L2451-F2466 WeakPolarHBondContact CA-O 3.26Å; L2451-F2466 WeakPolarHBondContact CD2-O 3.44Å; L2451-A2467 HydrophobicContact CD2-CB 3.7Å; L2451-S2854 WeakPolarHBondContact CG-OG 3.28Å; L2451-C2856 HydrophobicContact CB-CB 4.22Å; L2451-F2865 HydrophobicContact CD1-CB 4.16Å; L2451-F2865 WeakPolarHBondContact CD1-O 3.47Å; L2451-G2867 VanDerWaalsContact CD1-N 3.25Å; L2451-L2873 HydrophobicContact CD1-CD1 3.8Å; L2451-L2873 HydrophobicContact CD2-CD1 3.78Å; L2451-L2873 HydrophobicContact CG-CD1 4.48Å
2452	F	92	Very high	80.9	Confident	54 Å²	54	66 Å²	66	24%	0.237	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	135.3	174.1	-171.1	-94.2	0	0	0	110.7	N2454 V2465 F2466 V2602	F2452-N2454 HydrophobicContact CE1-CB 4.04Å; F2452-N2454 WeakPolarHBondContact CE1-OD1 3.41Å; F2452-V2465 CarbonylContact O-C 3.35Å; F2452-V2465 WeakPolarHBondContact O-CA 3.29Å; F2452-F2466 HydrophobicContact CB-CB 4.36Å; F2452-F2466 PolarHBondContact N-O 2.97Å; F2452-F2466 PolarHBondContact O-N 3.04Å; F2452-V2602 HydrophobicContact CB-CB 4.06Å; F2452-V2602 HydrophobicContact CB-CG2 3.8Å; F2452-V2602 HydrophobicContact CD1-CB 3.52Å; F2452-V2602 HydrophobicContact CD1-CG1 3.64Å; F2452-V2602 HydrophobicContact CD1-CG2 4.15Å; F2452-V2602 HydrophobicContact CD2-CB 4.45Å; F2452-V2602 HydrophobicContact CE1-CB 4.03Å; F2452-V2602 HydrophobicContact CE1-CG1 3.98Å; F2452-V2602 HydrophobicContact CG-CB 3.75Å; F2452-V2602 HydrophobicContact CG-CG1 4.37Å; F2452-V2602 HydrophobicContact CG-CG2 4.09Å
2453	S	91	Very high	81.3	Confident	44 Å²	44	65.1 Å²	65.1	31%	0.308	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	135.2	-178.7	57	0	0	0	0	111.3	C2856 L2857	S2453-C2856 PolarHBondContact OG-SG 3.12Å; S2453-L2857 WeakPolarHBondContact CB-O 3.13Å; S2453-L2857 PolarHBondContact OG-O 2.86Å
2454	N	85.9	Confident	82	Confident	21.5 Å²	21.5	58.6 Å²	58.6	12%	0.115	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	77.7	178	-125.9	-4.1	0	0	0	107.9	F2452 L2460 P2463 S2464 A2604 S2606	F2452-N2454 HydrophobicContact CE1-CB 4.04Å; F2452-N2454 WeakPolarHBondContact CE1-OD1 3.41Å; N2454-L2460 HydrophobicContact CB-CD1 3.72Å; N2454-L2460 WeakPolarHBondContact ND2-CD1 3.33Å; N2454-L2460 WeakPolarHBondContact ND2-CD2 3.45Å; N2454-L2460 WeakPolarHBondContact OD1-CD1 3.29Å; N2454-P2463 CarbonylContact O-C 3.48Å; N2454-P2463 VanDerWaalsContact O-CA 3.25Å; N2454-P2463 WeakPolarHBondContact O-CA 3.33Å; N2454-S2464 CarbonylContact C-O 3.59Å; N2454-S2464 PolarHBondContact N-O 2.94Å; N2454-S2464 PolarHBondContact O-N 3.16Å; N2454-A2604 PolarHBondContact ND2-O 3.43Å; N2454-S2606 WeakPolarHBondContact CB-OG 3.31Å; N2454-S2606 PolarHBondContact ND2-OG 3.1Å
2455	T	83.4	Confident	82.9	Confident	53.5 Å²	53.5	58.1 Å²	58.1	33%	0.328	32%	0.324	S	S	.	.			trans	-97.4	-0.7	-165.6	57.6	0	0	0	0	114.5	S2457 V2465 W2479 H2859 F2865	T2455-S2457 PolarHBondContact O-N 3.19Å; T2455-V2465 HydrophobicContact CG2-CG2 4.07Å; T2455-W2479 VanDerWaalsContact CB-CD1 3.5Å; T2455-W2479 HydrophobicContact CG2-CB 4.19Å; T2455-W2479 HydrophobicContact CG2-CD2 3.66Å; T2455-W2479 HydrophobicContact CG2-CE3 4.21Å; T2455-W2479 HydrophobicContact CG2-CG 3.64Å; T2455-H2859 WeakPolarHBondContact OG1-CB 3.32Å; T2455-H2859 PolarHBondContact OG1-N 3.37Å; T2455-F2865 HydrophobicContact CG2-CE2 4.43Å; T2455-F2865 HydrophobicContact CG2-CZ 4.41Å
2456	S	76.9	Confident	83.4	Confident	39.5 Å²	39.5	51.2 Å²	51.2	28%	0.276	29%	0.292	S	S	.	.			trans	-74	99.9	-177	-173.1	0	0	0	0	112.4	K2458 A2459 L2460	S2456-K2458 PolarHBondContact O-N 2.97Å; S2456-A2459 PolarHBondContact O-N 3.35Å; S2456-L2460 PolarHBondContact O-N 3.44Å
2457	S	66.2	Low	83.6	Confident	80.5 Å²	80.5	50.6 Å²	50.6	56%	0.563	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-21.2	176.1	-2.4	0	0	0	0	114.3	T2455 A2459 S2481	T2455-S2457 PolarHBondContact O-N 3.19Å; S2457-A2459 VanDerWaalsContact C-N 3.26Å; S2457-S2481 WeakPolarHBondContact OG-CB 3.45Å; S2457-S2481 PolarHBondContact OG-OG 3.17Å
2458	K	66.1	Low	83.6	Confident	194 Å²	194	48.2 Å²	48.2	84%	0.843	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-26.2	175.6	-67.2	-177.7	-179.5	176.8	0	112.6	S2456	S2456-K2458 PolarHBondContact O-N 2.97Å
2459	A	67.5	Low	83.5	Confident	57.5 Å²	57.5	46.8 Å²	46.8	48%	0.475	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-26.2	-173.4	0	0	0	0	0	113.2	S2456 S2457	S2456-A2459 PolarHBondContact O-N 3.35Å; S2457-A2459 VanDerWaalsContact C-N 3.26Å
2460	L	73	Confident	83.3	Confident	18 Å²	18	49.7 Å²	49.7	9%	0.094	28%	0.275	C	S	.	.			trans	-128.2	134.2	-168.1	-58.6	165.6	0	0	0	111.4	N2454 S2456 F2462 A2604	N2454-L2460 HydrophobicContact CB-CD1 3.72Å; N2454-L2460 WeakPolarHBondContact ND2-CD1 3.33Å; N2454-L2460 WeakPolarHBondContact ND2-CD2 3.45Å; N2454-L2460 WeakPolarHBondContact OD1-CD1 3.29Å; S2456-L2460 PolarHBondContact O-N 3.44Å; L2460-F2462 VanDerWaalsContact C-N 3.32Å; L2460-F2462 PolarHBondContact O-N 3.2Å; L2460-A2604 WeakPolarHBondContact CD2-O 3.1Å
2461	P	71.7	Confident	83	Confident	107 Å²	107	52 Å²	52	70%	0.695	29%	0.288	S	S	*	.	S	Bend	trans	-67.5	-27.6	177.5	27.3	-34.1	0	0	0	112.6
2462	F	75.7	Confident	82.6	Confident	139.5 Å²	139.5	51.3 Å²	51.3	61%	0.612	28%	0.281	S	S	*	.	S	Bend	trans	-134.6	86.9	178.8	-57.2	-71.9	0	0	0	110.4	L2460 S2464	L2460-F2462 VanDerWaalsContact C-N 3.32Å; L2460-F2462 PolarHBondContact O-N 3.2Å; F2462-S2464 PolarHBondContact O-N 3.26Å; F2462-S2464 PolarHBondContact O-OG 3.18Å; F2462-S2464 VanDerWaalsContact O-OG 3.14Å
2463	P	84.4	Confident	82.3	Confident	15.5 Å²	15.5	49.6 Å²	49.6	10%	0.101	28%	0.275	C	S	.	.			trans	-53.6	138.7	172	-24.9	34.9	0	0	0	110.9	N2454 W2479	N2454-P2463 CarbonylContact O-C 3.48Å; N2454-P2463 VanDerWaalsContact O-CA 3.25Å; N2454-P2463 WeakPolarHBondContact O-CA 3.33Å; P2463-W2479 HydrophobicContact CB-CB 3.99Å; P2463-W2479 HydrophobicContact CB-CG 4.49Å; P2463-W2479 HydrophobicContact CG-CB 4.41Å; P2463-W2479 WeakPolarHBondContact O-CB 3.36Å; P2463-W2479 PolarHBondContact O-N 3.19Å
2464	S	87.3	Confident	82.1	Confident	6.5 Å²	6.5	48 Å²	48	5%	0.045	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	152.2	-169.7	32	0	0	0	0	113.6	N2454 F2462 F2466 C2477	N2454-S2464 CarbonylContact C-O 3.59Å; N2454-S2464 PolarHBondContact N-O 2.94Å; N2454-S2464 PolarHBondContact O-N 3.16Å; F2462-S2464 PolarHBondContact O-N 3.26Å; F2462-S2464 PolarHBondContact O-OG 3.18Å; F2462-S2464 VanDerWaalsContact O-OG 3.14Å; S2464-F2466 WeakPolarHBondContact OG-CE2 3.35Å; S2464-C2477 CarbonylContact C-O 3.58Å; S2464-C2477 VanDerWaalsContact CA-O 3.27Å; S2464-C2477 WeakPolarHBondContact CA-O 3.42Å; S2464-C2477 WeakPolarHBondContact CB-O 3.49Å
2465	V	90.2	Very high	82.2	Confident	32.5 Å²	32.5	47.5 Å²	47.5	20%	0.197	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.7	170.2	-178.9	0	0	0	0	108.1	F2452 T2455 C2477 W2479 L2573 F2865 L2873	F2452-V2465 CarbonylContact O-C 3.35Å; F2452-V2465 WeakPolarHBondContact O-CA 3.29Å; T2455-V2465 HydrophobicContact CG2-CG2 4.07Å; V2465-C2477 HydrophobicContact CB-CB 4.47Å; V2465-C2477 PolarHBondContact N-O 3.14Å; V2465-C2477 PolarHBondContact O-N 3.13Å; V2465-W2479 HydrophobicContact CG2-CE3 4.49Å; V2465-L2573 HydrophobicContact CB-CD2 4.05Å; V2465-L2573 HydrophobicContact CG2-CD2 3.81Å; V2465-F2865 HydrophobicContact CG1-CD1 4.42Å; V2465-F2865 HydrophobicContact CG1-CG 4.39Å; V2465-F2865 HydrophobicContact CG2-CD1 4.42Å; V2465-F2865 HydrophobicContact CG2-CE1 4.01Å; V2465-F2865 HydrophobicContact CG2-CE2 4.1Å; V2465-F2865 HydrophobicContact CG2-CZ 3.83Å; V2465-L2873 HydrophobicContact CG1-CD2 4.42Å
2466	F	90.7	Very high	82.3	Confident	0.5 Å²	0.5	47 Å²	47	0%	0.002	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.5	178.3	-72.9	-106.8	0	0	0	109	L2451 F2452 S2464 I2474 V2476 V2602 V2609	L2451-F2466 WeakPolarHBondContact CA-O 3.26Å; L2451-F2466 WeakPolarHBondContact CD2-O 3.44Å; F2452-F2466 HydrophobicContact CB-CB 4.36Å; F2452-F2466 PolarHBondContact N-O 2.97Å; F2452-F2466 PolarHBondContact O-N 3.04Å; S2464-F2466 WeakPolarHBondContact OG-CE2 3.35Å; F2466-I2474 HydrophobicContact CD1-CG2 4.05Å; F2466-V2476 HydrophobicContact CD1-CG1 4.4Å; F2466-V2476 HydrophobicContact CD1-CG2 3.73Å; F2466-V2476 HydrophobicContact CD2-CG1 4.41Å; F2466-V2476 HydrophobicContact CE1-CB 4.37Å; F2466-V2476 HydrophobicContact CE1-CG1 3.97Å; F2466-V2476 HydrophobicContact CE1-CG2 3.51Å; F2466-V2476 VanDerWaalsContact CE1-CG2 3.45Å; F2466-V2476 HydrophobicContact CE2-CG1 4.11Å; F2466-V2476 HydrophobicContact CZ-CG1 3.8Å; F2466-V2476 HydrophobicContact CZ-CG2 4.2Å; F2466-V2602 HydrophobicContact CB-CG2 4.15Å; F2466-V2602 HydrophobicContact CD1-CG1 4.36Å; F2466-V2602 HydrophobicContact CD1-CG2 4.34Å; F2466-V2602 HydrophobicContact CD2-CG1 4.06Å; F2466-V2602 HydrophobicContact CE1-CG1 4.41Å; F2466-V2602 HydrophobicContact CE2-CG1 4.12Å; F2466-V2602 HydrophobicContact CG-CG1 4.19Å; F2466-V2602 HydrophobicContact CG-CG2 4.16Å; F2466-V2602 HydrophobicContact CZ-CG1 4.3Å; F2466-V2609 HydrophobicContact CD1-CG2 4.17Å; F2466-V2609 HydrophobicContact CE1-CG2 4.15Å
2467	A	91.4	Very high	82.7	Confident	4.5 Å²	4.5	46 Å²	46	4%	0.037	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.1	168.3	0	0	0	0	0	109	F2442 V2448 L2451 V2475	F2442-A2467 HydrophobicContact CE1-CB 3.71Å; F2442-A2467 HydrophobicContact CE2-CB 3.5Å; F2442-A2467 HydrophobicContact CZ-CB 3.59Å; V2448-A2467 HydrophobicContact CG1-CB 4.02Å; L2451-A2467 HydrophobicContact CD2-CB 3.7Å; A2467-V2475 HydrophobicContact CB-CB 4.41Å; A2467-V2475 PolarHBondContact N-O 2.9Å; A2467-V2475 PolarHBondContact O-N 3.17Å
2468	I	91	Very high	83.6	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.4	175.8	-51.8	175.2	0	0	0	107.7	V2449 H2450 T2473 I2474 L2585 F2600 V2609	V2449-I2468 WeakPolarHBondContact CG2-O 3.27Å; V2449-I2468 PolarHBondContact N-O 3.1Å; H2450-I2468 HydrophobicContact CB-CB 4.28Å; H2450-I2468 PolarHBondContact N-O 2.92Å; H2450-I2468 PolarHBondContact O-N 3.16Å; I2468-T2473 WeakPolarHBondContact CA-O 3.42Å; I2468-I2474 HydrophobicContact CG1-CG1 4.4Å; I2468-L2585 HydrophobicContact CG2-CD1 4.45Å; I2468-F2600 HydrophobicContact CB-CD1 4.41Å; I2468-F2600 HydrophobicContact CD1-CB 3.88Å; I2468-F2600 HydrophobicContact CD1-CD1 3.69Å; I2468-F2600 HydrophobicContact CD1-CE1 4.42Å; I2468-F2600 HydrophobicContact CD1-CG 3.97Å; I2468-F2600 HydrophobicContact CG2-CD1 3.9Å; I2468-F2600 HydrophobicContact CG2-CE1 3.69Å; I2468-F2600 HydrophobicContact CG2-CZ 4.17Å; I2468-V2609 HydrophobicContact CD1-CG1 3.76Å
2469	T	90.7	Very high	84.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	161.2	178.1	53.7	0	0	0	0	112	F2442 S2446 P2447 V2448 N2471 R2472 T2473	F2442-T2469 HydrophobicContact CD1-CG2 3.74Å; F2442-T2469 HydrophobicContact CD2-CG2 4.13Å; F2442-T2469 HydrophobicContact CE1-CG2 4.2Å; F2442-T2469 HydrophobicContact CG-CG2 4.36Å; S2446-T2469 VanDerWaalsContact O-CG2 3.3Å; S2446-T2469 WeakPolarHBondContact O-CG2 3.43Å; P2447-T2469 CarbonylContact O-C 3.51Å; P2447-T2469 WeakPolarHBondContact O-CA 3.46Å; P2447-T2469 WeakPolarHBondContact O-CB 3.39Å; V2448-T2469 HydrophobicContact CG2-CG2 4.22Å; T2469-N2471 WeakPolarHBondContact CB-OD1 3.35Å; T2469-N2471 PolarHBondContact O-N 3.34Å; T2469-N2471 PolarHBondContact OG1-OD1 3.41Å; T2469-R2472 WeakPolarHBondContact O-CA 3.38Å; T2469-R2472 PolarHBondContact O-N 3.18Å; T2469-T2473 PolarHBondContact N-O 2.97Å; T2469-T2473 VanDerWaalsContact N-O 3.16Å; T2469-T2473 VanDerWaalsContact OG1-CB 3.27Å; T2469-T2473 WeakPolarHBondContact OG1-CB 3.39Å; T2469-T2473 PolarHBondContact OG1-N 3.18Å; T2469-T2473 PolarHBondContact OG1-O 3.24Å
2470	E	88.3	Confident	85.2	Confident	85.5 Å²	85.5	42.2 Å²	42.2	40%	0.4	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-36	-179.8	-175	171.4	-148.9	0	0	112.7	S2446 P2447 V2449 R2472 I2595	S2446-E2470 WeakPolarHBondContact OG-CB 3.27Å; S2446-E2470 PolarHBondContact OG-N 2.96Å; P2447-E2470 HydrophobicContact CB-CB 4.26Å; P2447-E2470 HydrophobicContact CG-CB 4.26Å; P2447-E2470 VanDerWaalsContact CG-OE2 3.29Å; P2447-E2470 WeakPolarHBondContact CG-OE2 3.24Å; P2447-E2470 PolarHBondContact O-N 2.88Å; V2449-E2470 HydrophobicContact CG1-CB 3.79Å; V2449-E2470 HydrophobicContact CG1-CG 4.27Å; E2470-R2472 PolarHBondContact O-N 3.1Å; E2470-I2595 HydrophobicContact CG-CB 4.18Å; E2470-I2595 HydrophobicContact CG-CD1 4.28Å; E2470-I2595 HydrophobicContact CG-CG2 4.02Å; E2470-I2595 WeakPolarHBondContact O-CD1 3.46Å
2471	N	85.5	Confident	85.5	Confident	70.5 Å²	70.5	43.6 Å²	43.6	38%	0.377	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	21	171.8	79.1	-25.4	0	0	0	114.3	S2444 S2446 T2469 T2473	S2444-N2471 WeakPolarHBondContact CB-ND2 3.49Å; S2444-N2471 PolarHBondContact OG-OD1 2.75Å; S2446-N2471 PolarHBondContact OG-N 3.38Å; T2469-N2471 WeakPolarHBondContact CB-OD1 3.35Å; T2469-N2471 PolarHBondContact O-N 3.34Å; T2469-N2471 PolarHBondContact OG1-OD1 3.41Å; N2471-T2473 VanDerWaalsContact C-N 3.32Å; N2471-T2473 PolarHBondContact ND2-OG1 2.97Å; N2471-T2473 PolarHBondContact O-N 3.25Å; N2471-T2473 VanDerWaalsContact OD1-CB 3.26Å; N2471-T2473 WeakPolarHBondContact OD1-CB 3.13Å; N2471-T2473 PolarHBondContact OD1-N 2.65Å; N2471-T2473 PolarHBondContact OD1-OG1 2.82Å; N2471-T2473 VanDerWaalsContact OD1-OG1 3.13Å
2472	R	85.5	Confident	85.9	Confident	53.5 Å²	53.5	45.2 Å²	45.2	20%	0.202	23%	0.228	C	C	.	.			trans	54.6	36.1	177.7	-56.5	150.4	-124.4	-128.5	1.2	114.5	T2469 E2470 C2584 L2585 G2586 F2589 I2595	T2469-R2472 WeakPolarHBondContact O-CA 3.38Å; T2469-R2472 PolarHBondContact O-N 3.18Å; E2470-R2472 PolarHBondContact O-N 3.1Å; R2472-C2584 WeakPolarHBondContact O-CA 3.47Å; R2472-L2585 HydrophobicContact CB-CB 4.29Å; R2472-L2585 HydrophobicContact CB-CD1 4.43Å; R2472-L2585 WeakPolarHBondContact O-CD1 3.39Å; R2472-L2585 WeakPolarHBondContact O-CG 3.11Å; R2472-L2585 PolarHBondContact O-N 3.22Å; R2472-L2585 VanDerWaalsContact O-N 3.11Å; R2472-G2586 PolarHBondContact NE-O 3.32Å; R2472-G2586 PolarHBondContact NH2-O 3.35Å; R2472-F2589 HydrophobicContact CB-CZ 4.27Å; R2472-F2589 VanDerWaalsContact CD-CE2 3.49Å; R2472-F2589 HydrophobicContact CG-CE1 4.22Å; R2472-F2589 HydrophobicContact CG-CE2 4.16Å; R2472-F2589 HydrophobicContact CG-CZ 3.81Å; R2472-F2589 VanDerWaalsContact CZ-CB 3.4Å; R2472-I2595 HydrophobicContact CG-CD1 4.3Å
2473	T	86.7	Confident	86	Confident	18.5 Å²	18.5	39.7 Å²	39.7	11%	0.113	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	122.8	175.6	-59.4	0	0	0	0	110	I2468 T2469 N2471 G2582 R2583	I2468-T2473 WeakPolarHBondContact CA-O 3.42Å; T2469-T2473 PolarHBondContact N-O 2.97Å; T2469-T2473 VanDerWaalsContact N-O 3.16Å; T2469-T2473 VanDerWaalsContact OG1-CB 3.27Å; T2469-T2473 WeakPolarHBondContact OG1-CB 3.39Å; T2469-T2473 PolarHBondContact OG1-N 3.18Å; T2469-T2473 PolarHBondContact OG1-O 3.24Å; N2471-T2473 VanDerWaalsContact C-N 3.32Å; N2471-T2473 PolarHBondContact ND2-OG1 2.97Å; N2471-T2473 PolarHBondContact O-N 3.25Å; N2471-T2473 VanDerWaalsContact OD1-CB 3.26Å; N2471-T2473 WeakPolarHBondContact OD1-CB 3.13Å; N2471-T2473 PolarHBondContact OD1-N 2.65Å; N2471-T2473 PolarHBondContact OD1-OG1 2.82Å; N2471-T2473 VanDerWaalsContact OD1-OG1 3.13Å; T2473-G2582 VanDerWaalsContact CG2-CA 3.41Å; T2473-R2583 WeakPolarHBondContact CA-O 3.31Å
2474	I	86.6	Confident	85.7	Confident	9 Å²	9	39.7 Å²	39.7	5%	0.046	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	131.9	170.9	-47.1	-178.3	0	0	0	110	F2466 I2468 V2476 G2582 R2583 L2585 V2609	F2466-I2474 HydrophobicContact CD1-CG2 4.05Å; I2468-I2474 HydrophobicContact CG1-CG1 4.4Å; I2474-V2476 HydrophobicContact CG2-CG2 3.7Å; I2474-G2582 WeakPolarHBondContact O-CA 3.21Å; I2474-R2583 PolarHBondContact N-O 3.15Å; I2474-R2583 PolarHBondContact O-N 3.14Å; I2474-L2585 HydrophobicContact CD1-CD1 3.62Å; I2474-L2585 HydrophobicContact CD1-CD2 3.5Å; I2474-L2585 HydrophobicContact CD1-CG 3.9Å; I2474-L2585 HydrophobicContact CG1-CD1 3.27Å; I2474-L2585 HydrophobicContact CG1-CD2 3.94Å; I2474-L2585 HydrophobicContact CG1-CG 3.76Å; I2474-V2609 HydrophobicContact CD1-CB 3.73Å; I2474-V2609 HydrophobicContact CD1-CG1 3.88Å; I2474-V2609 HydrophobicContact CD1-CG2 3.69Å
2475	V	86.5	Confident	85.2	Confident	10.5 Å²	10.5	42.2 Å²	42.2	6%	0.064	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	127.9	161.1	175.8	0	0	0	0	108.7	F2442 A2467 P2580	F2442-V2475 HydrophobicContact CD1-CB 4.43Å; F2442-V2475 HydrophobicContact CD1-CG1 4.04Å; F2442-V2475 HydrophobicContact CD1-CG2 4.06Å; F2442-V2475 HydrophobicContact CD2-CG2 4.31Å; F2442-V2475 HydrophobicContact CE1-CB 4.09Å; F2442-V2475 HydrophobicContact CE1-CG1 4.05Å; F2442-V2475 HydrophobicContact CE1-CG2 3.63Å; F2442-V2475 HydrophobicContact CG-CG2 4.23Å; F2442-V2475 HydrophobicContact CZ-CB 4.34Å; F2442-V2475 HydrophobicContact CZ-CG1 4.16Å; A2467-V2475 HydrophobicContact CB-CB 4.41Å; A2467-V2475 PolarHBondContact N-O 2.9Å; A2467-V2475 PolarHBondContact O-N 3.17Å; V2475-P2580 HydrophobicContact CG1-CB 3.78Å; V2475-P2580 HydrophobicContact CG1-CG 4.14Å; V2475-P2580 HydrophobicContact CG2-CB 4.26Å; V2475-P2580 HydrophobicContact CG2-CG 4.4Å
2476	V	86.4	Confident	84.5	Confident	44 Å²	44	41.9 Å²	41.9	27%	0.267	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	111	178	-172.1	0	0	0	0	109.2	F2466 I2474 K2478	F2466-V2476 HydrophobicContact CD1-CG1 4.4Å; F2466-V2476 HydrophobicContact CD1-CG2 3.73Å; F2466-V2476 HydrophobicContact CD2-CG1 4.41Å; F2466-V2476 HydrophobicContact CE1-CB 4.37Å; F2466-V2476 HydrophobicContact CE1-CG1 3.97Å; F2466-V2476 HydrophobicContact CE1-CG2 3.51Å; F2466-V2476 VanDerWaalsContact CE1-CG2 3.45Å; F2466-V2476 HydrophobicContact CE2-CG1 4.11Å; F2466-V2476 HydrophobicContact CZ-CG1 3.8Å; F2466-V2476 HydrophobicContact CZ-CG2 4.2Å; I2474-V2476 HydrophobicContact CG2-CG2 3.7Å; V2476-K2478 HydrophobicContact CG1-CG 4.3Å
2477	C	86	Confident	83.8	Confident	18 Å²	18	44.7 Å²	44.7	12%	0.122	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	117.5	178.3	-59.7	0	0	0	0	109.3	L2440 S2464 V2465 L2573	L2440-C2477 WeakPolarHBondContact CD1-SG 3.39Å; S2464-C2477 CarbonylContact C-O 3.58Å; S2464-C2477 VanDerWaalsContact CA-O 3.27Å; S2464-C2477 WeakPolarHBondContact CA-O 3.42Å; S2464-C2477 WeakPolarHBondContact CB-O 3.49Å; V2465-C2477 HydrophobicContact CB-CB 4.47Å; V2465-C2477 PolarHBondContact N-O 3.14Å; V2465-C2477 PolarHBondContact O-N 3.13Å; C2477-L2573 HydrophobicContact CB-CD2 3.78Å
2478	K	85	Confident	83	Confident	104 Å²	104	47.5 Å²	47.5	45%	0.452	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	132.2	178.2	-70.3	177.9	-177.4	166.4	0	110	V2476 N2480 K2574 E2576	V2476-K2478 HydrophobicContact CG1-CG 4.3Å; K2478-N2480 PolarHBondContact O-N 3.41Å; K2478-K2574 PolarHBondContact N-O 2.75Å; K2478-K2574 PolarHBondContact O-N 2.72Å; K2478-K2574 VanDerWaalsContact O-N 3.12Å; K2478-E2576 WeakPolarHBondContact CE-OE1 3.42Å; K2478-E2576 IonicContact NZ-OE1 3.18Å; K2478-E2576 PolarHBondContact NZ-OE1 2.8Å
2479	W	83.2	Confident	82.1	Confident	75 Å²	75	54 Å²	54	28%	0.284	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	125.1	176.3	-175.9	-101	0	0	0	110.7	T2455 P2463 V2465 S2481 A2484 P2572 L2573 F2863 F2865	T2455-W2479 VanDerWaalsContact CB-CD1 3.5Å; T2455-W2479 HydrophobicContact CG2-CB 4.19Å; T2455-W2479 HydrophobicContact CG2-CD2 3.66Å; T2455-W2479 HydrophobicContact CG2-CE3 4.21Å; T2455-W2479 HydrophobicContact CG2-CG 3.64Å; P2463-W2479 HydrophobicContact CB-CB 3.99Å; P2463-W2479 HydrophobicContact CB-CG 4.49Å; P2463-W2479 HydrophobicContact CG-CB 4.41Å; P2463-W2479 WeakPolarHBondContact O-CB 3.36Å; P2463-W2479 PolarHBondContact O-N 3.19Å; V2465-W2479 HydrophobicContact CG2-CE3 4.49Å; W2479-S2481 VanDerWaalsContact CD1-OG 3.26Å; W2479-S2481 PolarHBondContact NE1-OG 2.79Å; W2479-A2484 HydrophobicContact CH2-CB 4.05Å; W2479-A2484 HydrophobicContact CZ2-CB 3.36Å; W2479-A2484 VanDerWaalsContact CZ2-CB 3.49Å; W2479-P2572 HydrophobicContact CE3-CB 4.39Å; W2479-P2572 HydrophobicContact CH2-CB 4.04Å; W2479-P2572 HydrophobicContact CZ3-CB 3.8Å; W2479-L2573 HydrophobicContact CE3-CD2 3.63Å; W2479-L2573 HydrophobicContact CE3-CG 3.91Å; W2479-L2573 HydrophobicContact CZ3-CD2 4.23Å; W2479-L2573 HydrophobicContact CZ3-CG 4.05Å; W2479-F2863 HydrophobicContact CH2-CB 4.4Å; W2479-F2863 HydrophobicContact CH2-CD1 4.26Å; W2479-F2863 AromaticContact CH2-CD2 3.72Å; W2479-F2863 HydrophobicContact CH2-CD2 3.72Å; W2479-F2863 HydrophobicContact CH2-CE1 4.44Å; W2479-F2863 AromaticContact CH2-CE2 3.99Å; W2479-F2863 HydrophobicContact CH2-CE2 3.99Å; W2479-F2863 AromaticContact CH2-CG 3.88Å; W2479-F2863 HydrophobicContact CH2-CG 3.88Å; W2479-F2863 HydrophobicContact CH2-CZ 4.34Å; W2479-F2863 AromaticContact CZ2-CD2 3.95Å; W2479-F2863 HydrophobicContact CZ2-CD2 3.95Å; W2479-F2863 HydrophobicContact CZ2-CE2 4.07Å; W2479-F2865 HydrophobicContact CE3-CE1 4.31Å; W2479-F2865 HydrophobicContact CE3-CZ 4.01Å; W2479-F2865 HydrophobicContact CH2-CE1 4.36Å; W2479-F2865 AromaticContact CH2-CZ 3.87Å; W2479-F2865 HydrophobicContact CH2-CZ 3.87Å; W2479-F2865 AromaticContact CZ3-CE1 3.69Å; W2479-F2865 HydrophobicContact CZ3-CE1 3.69Å; W2479-F2865 AromaticContact CZ3-CZ 3.49Å; W2479-F2865 HydrophobicContact CZ3-CZ 3.49Å; W2479-F2865 VanDerWaalsContact CZ3-CZ 3.49Å
2480	N	82.7	Confident	81.3	Confident	74.5 Å²	74.5	58.8 Å²	58.8	40%	0.398	30%	0.299	S	S	.	.			trans	-102.2	94.9	174.6	-177.5	-9.5	0	0	0	109.8	K2478 L2482 A2483 A2484 P2572	K2478-N2480 PolarHBondContact O-N 3.41Å; N2480-L2482 VanDerWaalsContact C-N 3.29Å; N2480-L2482 PolarHBondContact O-N 3.23Å; N2480-L2482 PolarHBondContact OD1-N 3.26Å; N2480-L2482 VanDerWaalsContact OD1-N 3.15Å; N2480-A2483 HydrophobicContact CB-CB 3.99Å; N2480-A2483 PolarHBondContact O-N 2.97Å; N2480-A2483 VanDerWaalsContact O-N 3.12Å; N2480-A2483 PolarHBondContact OD1-N 3.19Å; N2480-A2483 VanDerWaalsContact OD1-N 3.15Å; N2480-A2484 WeakPolarHBondContact O-CB 3.29Å; N2480-A2484 PolarHBondContact O-N 3.45Å; N2480-P2572 PolarHBondContact N-O 3.42Å
2481	S	79.7	Confident	80.5	Confident	46.5 Å²	46.5	55.7 Å²	55.7	33%	0.325	29%	0.289	S	S	.	.	H	α-helix	trans	-59.8	-30.5	-178.8	-53.2	0	0	0	0	113.9	S2457 W2479 D2485	S2457-S2481 WeakPolarHBondContact OG-CB 3.45Å; S2457-S2481 PolarHBondContact OG-OG 3.17Å; W2479-S2481 VanDerWaalsContact CD1-OG 3.26Å; W2479-S2481 PolarHBondContact NE1-OG 2.79Å; S2481-D2485 VanDerWaalsContact O-CB 3.26Å; S2481-D2485 WeakPolarHBondContact O-CB 3.37Å; S2481-D2485 PolarHBondContact O-N 3.4Å
2482	L	79.6	Confident	79.6	Confident	141 Å²	141	56.8 Å²	56.8	74%	0.738	29%	0.287	S	S	*	.	H	α-helix	trans	-72.3	-41.5	178	-66.7	172.8	0	0	0	111.5	N2480 A2486	N2480-L2482 VanDerWaalsContact C-N 3.29Å; N2480-L2482 PolarHBondContact O-N 3.23Å; N2480-L2482 PolarHBondContact OD1-N 3.26Å; N2480-L2482 VanDerWaalsContact OD1-N 3.15Å; L2482-A2486 VanDerWaalsContact O-CB 3.24Å; L2482-A2486 WeakPolarHBondContact O-CB 3.41Å; L2482-A2486 PolarHBondContact O-N 2.93Å; L2482-A2486 VanDerWaalsContact O-N 3.07Å
2483	A	78.9	Confident	78.6	Confident	23 Å²	23	58.7 Å²	58.7	19%	0.19	30%	0.301	C	S	.	.	H	α-helix	trans	-65.8	-43.7	173.1	0	0	0	0	0	111.2	N2480 D2485 A2486 V2487 G2570	N2480-A2483 HydrophobicContact CB-CB 3.99Å; N2480-A2483 PolarHBondContact O-N 2.97Å; N2480-A2483 VanDerWaalsContact O-N 3.12Å; N2480-A2483 PolarHBondContact OD1-N 3.19Å; N2480-A2483 VanDerWaalsContact OD1-N 3.15Å; A2483-D2485 PolarHBondContact O-N 3.06Å; A2483-A2486 PolarHBondContact O-N 3.16Å; A2483-V2487 VanDerWaalsContact O-CG2 3.31Å; A2483-V2487 WeakPolarHBondContact O-CG2 3.4Å; A2483-V2487 PolarHBondContact O-N 2.88Å; A2483-G2570 VanDerWaalsContact CB-O 3.27Å; A2483-G2570 WeakPolarHBondContact CB-O 3.32Å
2484	A	78.4	Confident	77	Confident	17 Å²	17	61.7 Å²	61.7	14%	0.14	32%	0.316	C	S	.	.	H	α-helix	trans	-58.7	-47.3	176.7	0	0	0	0	0	112.1	W2479 N2480 A2486 V2487 Y2488 P2572 F2863	W2479-A2484 HydrophobicContact CH2-CB 4.05Å; W2479-A2484 HydrophobicContact CZ2-CB 3.36Å; W2479-A2484 VanDerWaalsContact CZ2-CB 3.49Å; N2480-A2484 WeakPolarHBondContact O-CB 3.29Å; N2480-A2484 PolarHBondContact O-N 3.45Å; A2484-A2486 PolarHBondContact O-N 3.48Å; A2484-V2487 PolarHBondContact O-N 3.14Å; A2484-Y2488 VanDerWaalsContact O-CB 3.29Å; A2484-Y2488 WeakPolarHBondContact O-CB 3.38Å; A2484-Y2488 PolarHBondContact O-N 2.94Å; A2484-P2572 HydrophobicContact CB-CB 4.02Å; A2484-P2572 HydrophobicContact CB-CG 4.46Å; A2484-F2863 HydrophobicContact CB-CE2 3.89Å; A2484-F2863 HydrophobicContact CB-CZ 3.93Å; A2484-F2863 WeakPolarHBondContact O-CZ 3.39Å
2485	D	76	Confident	75.3	Confident	59 Å²	59	65.6 Å²	65.6	32%	0.316	34%	0.342	S	S	.	.	H	α-helix	trans	-65.8	-38.5	177.3	-176.7	66	0	0	0	112.4	S2481 A2483 Y2488 R2489 R2862	S2481-D2485 VanDerWaalsContact O-CB 3.26Å; S2481-D2485 WeakPolarHBondContact O-CB 3.37Å; S2481-D2485 PolarHBondContact O-N 3.4Å; A2483-D2485 PolarHBondContact O-N 3.06Å; D2485-Y2488 PolarHBondContact O-N 3.11Å; D2485-R2489 WeakPolarHBondContact O-CB 3.45Å; D2485-R2489 VanDerWaalsContact O-CG 3.28Å; D2485-R2489 WeakPolarHBondContact O-CG 3.37Å; D2485-R2489 PolarHBondContact O-N 3.17Å; D2485-R2489 IonicContact OD1-NE 3.9Å; D2485-R2489 IonicContact OD2-CZ 2.97Å; D2485-R2489 IonicContact OD2-NE 3.72Å; D2485-R2489 PolarHBondContact OD2-NE 3.2Å; D2485-R2489 IonicContact OD2-NH2 2.91Å; D2485-R2489 PolarHBondContact OD2-NH2 3.14Å; D2485-R2862 IonicContact OD1-CZ 2.85Å; D2485-R2862 IonicContact OD1-NH1 3.96Å; D2485-R2862 PolarHBondContact OD1-NH1 3.4Å
2486	A	76	Confident	73.6	Confident	26 Å²	26	73.4 Å²	73.4	22%	0.215	38%	0.378	C	S	.	.	H	α-helix	trans	-62.1	-47	175.1	0	0	0	0	0	112.1	L2482 A2483 A2484 R2489 I2490 V2568	L2482-A2486 VanDerWaalsContact O-CB 3.24Å; L2482-A2486 WeakPolarHBondContact O-CB 3.41Å; L2482-A2486 PolarHBondContact O-N 2.93Å; L2482-A2486 VanDerWaalsContact O-N 3.07Å; A2483-A2486 PolarHBondContact O-N 3.16Å; A2484-A2486 PolarHBondContact O-N 3.48Å; A2486-R2489 PolarHBondContact O-N 3.27Å; A2486-I2490 WeakPolarHBondContact O-CD1 3.27Å; A2486-I2490 VanDerWaalsContact O-CG1 3.28Å; A2486-I2490 WeakPolarHBondContact O-CG1 3.34Å; A2486-I2490 PolarHBondContact O-N 2.86Å; A2486-I2490 VanDerWaalsContact O-N 3.1Å; A2486-V2568 HydrophobicContact CB-CG1 3.52Å
2487	V	76.7	Confident	71.6	Confident	58.5 Å²	58.5	76 Å²	76	36%	0.355	39%	0.394	S	S	.	.	H	α-helix	trans	-66.3	-40.4	177.6	-177.9	0	0	0	0	110.9	A2483 A2484 R2489 I2490 A2491 P2572 Y2877	A2483-V2487 VanDerWaalsContact O-CG2 3.31Å; A2483-V2487 WeakPolarHBondContact O-CG2 3.4Å; A2483-V2487 PolarHBondContact O-N 2.88Å; A2484-V2487 PolarHBondContact O-N 3.14Å; V2487-R2489 VanDerWaalsContact C-N 3.34Å; V2487-R2489 PolarHBondContact O-N 3.08Å; V2487-I2490 PolarHBondContact O-N 2.85Å; V2487-I2490 VanDerWaalsContact O-N 3.11Å; V2487-A2491 WeakPolarHBondContact O-CB 3.31Å; V2487-A2491 PolarHBondContact O-N 3.28Å; V2487-P2572 HydrophobicContact CG2-CG 4.32Å; V2487-Y2877 WeakPolarHBondContact CG1-OH 3.5Å
2488	Y	74.4	Confident	69.3	Low	62.5 Å²	62.5	84.4 Å²	84.4	25%	0.245	42%	0.424	C	S	.	.	H	α-helix	trans	-61.9	-38.9	176.5	-168.2	-102.9	0	0	0	112.7	L2432 A2484 D2485 A2491 R2492 R2862 F2863 Y2877 I2878	L2432-Y2488 HydrophobicContact CD2-CE2 4.26Å; A2484-Y2488 VanDerWaalsContact O-CB 3.29Å; A2484-Y2488 WeakPolarHBondContact O-CB 3.38Å; A2484-Y2488 PolarHBondContact O-N 2.94Å; D2485-Y2488 PolarHBondContact O-N 3.11Å; Y2488-A2491 PolarHBondContact O-N 3.46Å; Y2488-R2492 VanDerWaalsContact CE1-NE 3.3Å; Y2488-R2492 WeakPolarHBondContact O-CB 3.46Å; Y2488-R2492 WeakPolarHBondContact O-CG 3.45Å; Y2488-R2492 PolarHBondContact O-N 3.15Å; Y2488-R2492 VanDerWaalsContact O-N 3.08Å; Y2488-R2492 PolarHBondContact OH-NE 3.01Å; Y2488-R2492 PolarHBondContact OH-NH2 3.45Å; Y2488-R2862 HydrophobicContact CD1-CG 4.36Å; Y2488-R2862 HydrophobicContact CD2-CB 3.77Å; Y2488-R2862 HydrophobicContact CD2-CG 4.25Å; Y2488-R2862 HydrophobicContact CE1-CB 4.5Å; Y2488-R2862 HydrophobicContact CE1-CG 3.96Å; Y2488-R2862 HydrophobicContact CE2-CB 3.56Å; Y2488-R2862 HydrophobicContact CE2-CG 3.9Å; Y2488-R2862 VanDerWaalsContact CE2-O 3.28Å; Y2488-R2862 WeakPolarHBondContact CE2-O 3.4Å; Y2488-R2862 HydrophobicContact CG-CB 4.38Å; Y2488-R2862 HydrophobicContact CG-CG 4.49Å; Y2488-F2863 HydrophobicContact CD2-CE2 4.15Å; Y2488-F2863 HydrophobicContact CD2-CZ 4.04Å; Y2488-F2863 HydrophobicContact CG-CZ 4.47Å; Y2488-Y2877 AromaticContact CD2-CD1 3.6Å; Y2488-Y2877 HydrophobicContact CD2-CD1 3.6Å; Y2488-Y2877 HydrophobicContact CD2-CE1 4.22Å; Y2488-Y2877 HydrophobicContact CD2-CG 4.44Å; Y2488-Y2877 HydrophobicContact CE2-CD1 4.13Å; Y2488-I2878 PolarHBondContact OH-O 3.49Å; Y2488-I2878 VanDerWaalsContact OH-O 3.07Å
2489	R	71.9	Confident	66.8	Low	136.5 Å²	136.5	83.9 Å²	83.9	52%	0.515	43%	0.434	S	S	.	.	H	α-helix	trans	-67.1	-40.7	173.4	-73.4	-174.4	-109.4	157.8	4.6	112.3	D2485 A2486 V2487 A2491 R2492 I2493	D2485-R2489 WeakPolarHBondContact O-CB 3.45Å; D2485-R2489 VanDerWaalsContact O-CG 3.28Å; D2485-R2489 WeakPolarHBondContact O-CG 3.37Å; D2485-R2489 PolarHBondContact O-N 3.17Å; D2485-R2489 IonicContact OD1-NE 3.9Å; D2485-R2489 IonicContact OD2-CZ 2.97Å; D2485-R2489 IonicContact OD2-NE 3.72Å; D2485-R2489 PolarHBondContact OD2-NE 3.2Å; D2485-R2489 IonicContact OD2-NH2 2.91Å; D2485-R2489 PolarHBondContact OD2-NH2 3.14Å; A2486-R2489 PolarHBondContact O-N 3.27Å; V2487-R2489 VanDerWaalsContact C-N 3.34Å; V2487-R2489 PolarHBondContact O-N 3.08Å; R2489-A2491 VanDerWaalsContact C-N 3.3Å; R2489-A2491 PolarHBondContact O-N 2.87Å; R2489-R2492 PolarHBondContact O-N 3.17Å; R2489-I2493 WeakPolarHBondContact O-CB 3.41Å; R2489-I2493 WeakPolarHBondContact O-CD1 3.47Å; R2489-I2493 WeakPolarHBondContact O-CG1 3.5Å; R2489-I2493 PolarHBondContact O-N 2.87Å
2490	I	72.9	Confident	64.3	Low	101.5 Å²	101.5	86.2 Å²	86.2	52%	0.521	46%	0.456	S	S	.	.	H	α-helix	trans	-63.5	-41.7	176.7	-68.4	163	0	0	0	110.9	A2486 V2487 R2492 I2493 N2494 Y2498	A2486-I2490 WeakPolarHBondContact O-CD1 3.27Å; A2486-I2490 VanDerWaalsContact O-CG1 3.28Å; A2486-I2490 WeakPolarHBondContact O-CG1 3.34Å; A2486-I2490 PolarHBondContact O-N 2.86Å; A2486-I2490 VanDerWaalsContact O-N 3.1Å; V2487-I2490 PolarHBondContact O-N 2.85Å; V2487-I2490 VanDerWaalsContact O-N 3.11Å; I2490-R2492 VanDerWaalsContact C-N 3.34Å; I2490-R2492 PolarHBondContact O-N 3.37Å; I2490-I2493 PolarHBondContact O-N 3.25Å; I2490-I2493 VanDerWaalsContact O-N 3.15Å; I2490-N2494 PolarHBondContact O-N 3.44Å; I2490-Y2498 HydrophobicContact CG2-CE2 4.46Å
2491	A	71.3	Confident	61.8	Low	21.5 Å²	21.5	89.7 Å²	89.7	18%	0.178	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-27.7	177.7	0	0	0	0	0	113	L2432 N2433 V2487 Y2488 R2489 I2493 Y2877	L2432-A2491 CarbonylContact C-O 3.58Å; L2432-A2491 WeakPolarHBondContact CA-O 3.25Å; L2432-A2491 HydrophobicContact CD2-CB 4.15Å; N2433-A2491 PolarHBondContact N-O 3.32Å; V2487-A2491 WeakPolarHBondContact O-CB 3.31Å; V2487-A2491 PolarHBondContact O-N 3.28Å; Y2488-A2491 PolarHBondContact O-N 3.46Å; R2489-A2491 VanDerWaalsContact C-N 3.3Å; R2489-A2491 PolarHBondContact O-N 2.87Å; A2491-I2493 VanDerWaalsContact C-N 3.34Å; A2491-I2493 PolarHBondContact O-N 3.11Å; A2491-Y2877 HydrophobicContact CB-CD2 3.89Å; A2491-Y2877 HydrophobicContact CB-CE1 4.24Å; A2491-Y2877 HydrophobicContact CB-CE2 3.63Å; A2491-Y2877 HydrophobicContact CB-CG 4.33Å
2492	R	68.2	Low	59.5	Low	93 Å²	93	93.8 Å²	93.8	35%	0.351	50%	0.498	S	S	.	.	B	Isolated β-bridge	trans	-77.5	58.7	175.7	-77.5	-177.4	168.6	-151.6	-5.3	113.2	E2427 N2430 L2431 L2432 Y2488 R2489 I2490 N2494 D2879	E2427-R2492 PolarHBondContact O-NH1 2.85Å; E2427-R2492 IonicContact OE2-NH1 3.82Å; N2430-R2492 HydrophobicContact CB-CB 4.07Å; L2431-R2492 CarbonylContact O-C 3.57Å; L2431-R2492 WeakPolarHBondContact O-CA 3.35Å; L2432-R2492 HydrophobicContact CD2-CG 3.88Å; Y2488-R2492 VanDerWaalsContact CE1-NE 3.3Å; Y2488-R2492 WeakPolarHBondContact O-CB 3.46Å; Y2488-R2492 WeakPolarHBondContact O-CG 3.45Å; Y2488-R2492 PolarHBondContact O-N 3.15Å; Y2488-R2492 VanDerWaalsContact O-N 3.08Å; Y2488-R2492 PolarHBondContact OH-NE 3.01Å; Y2488-R2492 PolarHBondContact OH-NH2 3.45Å; R2489-R2492 PolarHBondContact O-N 3.17Å; I2490-R2492 VanDerWaalsContact C-N 3.34Å; I2490-R2492 PolarHBondContact O-N 3.37Å; R2492-N2494 PolarHBondContact O-N 2.95Å; R2492-D2879 IonicContact CZ-OD2 3.99Å; R2492-D2879 IonicContact NH2-OD2 3.36Å; R2492-D2879 PolarHBondContact NH2-OD2 3.13Å
2493	I	63.5	Low	57.1	Low	93 Å²	93	94.3 Å²	94.3	48%	0.477	50%	0.5	S	S	.	.			trans	-76.5	40.1	177.1	-67	170.4	0	0	0	109.9	N2430 L2431 N2433 R2489 I2490 A2491 P2495	N2430-I2493 WeakPolarHBondContact CB-O 3.22Å; N2430-I2493 PolarHBondContact ND2-O 3.45Å; N2430-I2493 VanDerWaalsContact ND2-O 3.15Å; L2431-I2493 HydrophobicContact CB-CD1 3.9Å; L2431-I2493 PolarHBondContact O-N 3.46Å; N2433-I2493 VanDerWaalsContact CG-CG1 3.49Å; N2433-I2493 WeakPolarHBondContact OD1-CG1 3.48Å; R2489-I2493 WeakPolarHBondContact O-CB 3.41Å; R2489-I2493 WeakPolarHBondContact O-CD1 3.47Å; R2489-I2493 WeakPolarHBondContact O-CG1 3.5Å; R2489-I2493 PolarHBondContact O-N 2.87Å; I2490-I2493 PolarHBondContact O-N 3.25Å; I2490-I2493 VanDerWaalsContact O-N 3.15Å; A2491-I2493 VanDerWaalsContact C-N 3.34Å; A2491-I2493 PolarHBondContact O-N 3.11Å; I2493-P2495 WeakPolarHBondContact O-CD 3.2Å
2494	N	52.3	Low	54.7	Low	81 Å²	81	101.5 Å²	101.5	43%	0.433	53%	0.532	S	S	.	.			trans	-110.8	92.2	174.4	-85.3	-13.2	0	0	0	110.9	I2490 R2492 E2496 V2497	I2490-N2494 PolarHBondContact O-N 3.44Å; R2492-N2494 PolarHBondContact O-N 2.95Å; N2494-E2496 PolarHBondContact O-N 3.12Å; N2494-V2497 HydrophobicContact CB-CB 4.25Å; N2494-V2497 HydrophobicContact CB-CG2 4.13Å; N2494-V2497 PolarHBondContact O-N 3.14Å
2495	P	52.2	Low	52.5	Low	91.5 Å²	91.5	107.8 Å²	107.8	59%	0.594	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-20.6	179.1	24.1	-32.3	0	0	0	113.6	I2493 V2497 Y2498	I2493-P2495 WeakPolarHBondContact O-CD 3.2Å; P2495-V2497 PolarHBondContact O-N 3.26Å; P2495-V2497 VanDerWaalsContact O-N 3.17Å; P2495-Y2498 PolarHBondContact O-N 2.9Å
2496	E	49.7	Very low	50.3	Low	175 Å²	175	112.8 Å²	112.8	82%	0.818	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-78.3	-8.8	-176.4	-63.4	-173.1	162.4	0	0	114.3	N2494 Y2498 S2499	N2494-E2496 PolarHBondContact O-N 3.12Å; E2496-Y2498 VanDerWaalsContact C-N 3.26Å; E2496-Y2498 PolarHBondContact O-N 3.44Å; E2496-S2499 PolarHBondContact O-N 3.05Å
2497	V	44.5	Very low	48.4	Very low	99 Å²	99	120.2 Å²	120.2	60%	0.6	62%	0.62	S	S	*	*	S	Bend	trans	-89.2	-12	-173.7	-176.9	0	0	0	0	113.4	N2494 P2495	N2494-V2497 HydrophobicContact CB-CB 4.25Å; N2494-V2497 HydrophobicContact CB-CG2 4.13Å; N2494-V2497 PolarHBondContact O-N 3.14Å; P2495-V2497 PolarHBondContact O-N 3.26Å; P2495-V2497 VanDerWaalsContact O-N 3.17Å
2498	Y	38.8	Very low	46.3	Very low	192.5 Å²	192.5	125 Å²	125	76%	0.755	64%	0.644	S	S	*	*	S	Bend	trans	-106.3	11.2	178.4	-70.9	-72.6	0	0	0	114.8	I2490 P2495 E2496 T2500	I2490-Y2498 HydrophobicContact CG2-CE2 4.46Å; P2495-Y2498 PolarHBondContact O-N 2.9Å; E2496-Y2498 VanDerWaalsContact C-N 3.26Å; E2496-Y2498 PolarHBondContact O-N 3.44Å; Y2498-T2500 PolarHBondContact O-N 2.75Å
2499	S	31.5	Very low	44.3	Very low	94.5 Å²	94.5	127.3 Å²	127.3	66%	0.661	67%	0.666	S	S	*	*			trans	-90.5	95.3	171	-63	0	0	0	0	111.3	E2496	E2496-S2499 PolarHBondContact O-N 3.05Å
2500	T	30.8	Very low	42.4	Very low	123.5 Å²	123.5	129.2 Å²	129.2	76%	0.758	68%	0.681	S	S	*	*			trans	156.8	88	164.7	11.6	0	0	0	0	115.4	Y2498 T2502	Y2498-T2500 PolarHBondContact O-N 2.75Å; T2500-T2502 VanDerWaalsContact C-N 3.34Å; T2500-T2502 PolarHBondContact O-N 2.99Å
2501	D	30.9	Very low	40.3	Very low	147 Å²	147	130.6 Å²	130.6	79%	0.786	69%	0.688	S	S	*	*			trans	-1.4	87.1	153.3	-68.5	-13	0	0	0	114.5	I2503	D2501-I2503 PolarHBondContact O-N 2.91Å
2502	T	30.5	Very low	38.4	Very low	132.5 Å²	132.5	137.8 Å²	137.8	81%	0.813	72%	0.718	S	S	*	*			trans	-95.2	126.6	152.5	-43	0	0	0	0	111.4	T2500 M2504	T2500-T2502 VanDerWaalsContact C-N 3.34Å; T2500-T2502 PolarHBondContact O-N 2.99Å; T2502-M2504 PolarHBondContact O-N 3.35Å
2503	I	30.1	Very low	36.5	Very low	153 Å²	153	141.4 Å²	141.4	79%	0.785	74%	0.738	S	S	*	*	S	Bend	trans	6.2	81.3	170	-48.5	175.3	0	0	0	112	D2501 N2505	D2501-I2503 PolarHBondContact O-N 2.91Å; I2503-N2505 PolarHBondContact O-N 3.18Å
2504	M	29.3	Very low	35.2	Very low	174 Å²	174	142.3 Å²	142.3	86%	0.857	75%	0.75	S	S	*	*			trans	-96.9	101.6	154.9	-72.2	-155.5	155.1	0	0	109.4	T2502 N2506	T2502-M2504 PolarHBondContact O-N 3.35Å; M2504-N2506 PolarHBondContact O-N 2.87Å; M2504-N2506 VanDerWaalsContact O-N 3.14Å
2505	N	32	Very low	34.2	Very low	149.5 Å²	149.5	147.8 Å²	147.8	80%	0.799	77%	0.77	S	S	*	*			trans	-128.3	111.1	153	-94.2	-21.6	0	0	0	109.4	I2503 Q2507	I2503-N2505 PolarHBondContact O-N 3.18Å; N2505-Q2507 PolarHBondContact O-N 2.79Å
2506	N	29.7	Very low	33.2	Very low	162.5 Å²	162.5	149.4 Å²	149.4	87%	0.869	78%	0.779	S	S	*	*			trans	-68.4	107.3	160.7	-76.7	-28.3	0	0	0	108.8	M2504	M2504-N2506 PolarHBondContact O-N 2.87Å; M2504-N2506 VanDerWaalsContact O-N 3.14Å
2507	Q	34.4	Very low	32.5	Very low	182.5 Å²	182.5	146.5 Å²	146.5	85%	0.853	78%	0.778	S	S	*	*			trans	-143.6	136	160.8	-96.2	170.5	34.8	0	0	110.3	N2505	N2505-Q2507 PolarHBondContact O-N 2.79Å
2508	D	32.8	Very low	32	Very low	158.5 Å²	158.5	146.2 Å²	146.2	85%	0.848	78%	0.78	S	S	*	*			trans	-69.2	159.8	-174.3	-88.7	-49.9	0	0	0	113.7	Q2510	D2508-Q2510 PolarHBondContact O-N 2.84Å
2509	P	33.2	Very low	31.8	Very low	110.5 Å²	110.5	143.5 Å²	143.5	72%	0.718	78%	0.779	S	S	*	*			trans	-88.7	141.4	-163.3	34.7	-35.9	0	0	0	113.4
2510	Q	31.7	Very low	32	Very low	177 Å²	177	145.5 Å²	145.5	83%	0.827	78%	0.782	S	S	*	*			trans	-144	127.3	146.4	-90.2	-139.3	17.4	0	0	113	D2508	D2508-Q2510 PolarHBondContact O-N 2.84Å
2511	I	29.9	Very low	32.1	Very low	130.5 Å²	130.5	145 Å²	145	67%	0.669	78%	0.779	S	S	*	*			trans	0.1	120.9	156	-64.5	160.8	0	0	0	115.9
2512	Q	29.8	Very low	32.3	Very low	174 Å²	174	144.7 Å²	144.7	81%	0.813	78%	0.777	S	S	*	*			trans	122.8	152.6	136.5	-81.8	166	33.9	0	0	117.8
2513	H	29	Very low	32.4	Very low	167 Å²	167	147.3 Å²	147.3	77%	0.773	78%	0.777	S	S	*	*				-112.5	157.2	-72	-105.1	-69.4	0	0	0	114.6
2514	P	36.5	Very low	32.5	Very low	112 Å²	112	147 Å²	147	73%	0.727	78%	0.777	S	S	*	*			trans	-104.2	156.9	-171.6	38.6	-32.6	0	0	0	114.9
2515	K	31.6	Very low	32.7	Very low	196.5 Å²	196.5	145.7 Å²	145.7	85%	0.854	77%	0.774	S	S	*	*			trans	-146.6	132.5	167.5	-74.1	-171.3	-179.6	175.7	0	109.3
2516	T	30.6	Very low	32.6	Very low	126 Å²	126	147.4 Å²	147.4	77%	0.773	78%	0.777	S	S	*	*				103.2	137.4	61.7	43.5	0	0	0	0	111.6
2517	S	35.2	Very low	32.5	Very low	114.5 Å²	114.5	145.7 Å²	145.7	80%	0.801	78%	0.778	S	S	*	*				-175.9	153.2	54	-13.9	0	0	0	0	109
2518	S	33.6	Very low	32.2	Very low	91.5 Å²	91.5	141.9 Å²	141.9	64%	0.64	77%	0.772	S	S	*	*				-127.6	172.1	-87.3	43.6	0	0	0	0	111.7
2519	N	33.9	Very low	31.9	Very low	136 Å²	136	140.6 Å²	140.6	73%	0.727	77%	0.769	S	S	*	*			trans	78.7	121	158.5	-56.9	-14	0	0	0	117.1
2520	N	35.8	Very low	31.4	Very low	137.5 Å²	137.5	142.5 Å²	142.5	74%	0.735	77%	0.772	S	S	*	*			cis	-177	140.7	44.3	-99.7	-11.3	0	0	0	109.3
2521	T	33.6	Very low	31.3	Very low	113 Å²	113	141.7 Å²	141.7	69%	0.693	77%	0.773	S	S	*	*				105.4	151.8	62.3	43.2	0	0	0	0	113.5
2522	N	34.4	Very low	31	Very low	140 Å²	140	141.8 Å²	141.8	75%	0.749	78%	0.78	S	S	*	*				131.3	127.1	71	-107.8	-6	0	0	0	115.9
2523	K	33.8	Very low	30.9	Very low	187.5 Å²	187.5	140.9 Å²	140.9	82%	0.815	78%	0.78	S	S	*	*				-82	129.2	123.7	-79.5	172.4	-178.1	-175.6	0	116.7
2524	N	32.2	Very low	30.7	Very low	146 Å²	146	138.8 Å²	138.8	78%	0.781	79%	0.785	S	S	*	*				-117.5	141.9	127.5	-81.8	-17.1	0	0	0	112.4
2525	N	33.8	Very low	30.4	Very low	147.5 Å²	147.5	138.2 Å²	138.2	79%	0.789	78%	0.783	S	S	*	*			trans	123.1	126.1	143	-74.8	1.7	0	0	0	115.3
2526	E	28.2	Very low	30.1	Very low	185 Å²	185	135.9 Å²	135.9	86%	0.864	78%	0.78	S	S	*	*			trans	-39	126.5	163.6	-59.4	173.9	147	0	0	114.8	S2528	E2526-S2528 PolarHBondContact O-N 3.49Å
2527	S	29.4	Very low	29.8	Very low	127.5 Å²	127.5	134.8 Å²	134.8	89%	0.892	78%	0.778	S	S	*	*			trans	-113.7	111.7	160.3	-59.9	0	0	0	0	110.2	V2529	S2527-V2529 PolarHBondContact O-N 2.9Å
2528	S	26.5	Very low	29.3	Very low	102.5 Å²	102.5	134.3 Å²	134.3	72%	0.717	77%	0.774	S	S	*	*			trans	-93.4	155.9	174.3	60.4	0	0	0	0	110.5	E2526 L2530	E2526-S2528 PolarHBondContact O-N 3.49Å; S2528-L2530 PolarHBondContact O-N 2.9Å
2529	V	26.7	Very low	28.9	Very low	131.5 Å²	131.5	138.8 Å²	138.8	80%	0.797	78%	0.783	S	S	*	*			trans	7.6	117.7	176.4	-178.4	0	0	0	0	111.7	S2527 L2531	S2527-V2529 PolarHBondContact O-N 2.9Å; V2529-L2531 PolarHBondContact O-N 2.71Å
2530	L	24	Very low	28.3	Very low	149.5 Å²	149.5	140.6 Å²	140.6	78%	0.783	79%	0.788	S	S	*	*				-124.7	141.7	-113.3	-96.9	163.7	0	0	0	108.9	S2528 T2532	S2528-L2530 PolarHBondContact O-N 2.9Å; L2530-T2532 PolarHBondContact O-N 2.84Å
2531	L	28.8	Very low	27.8	Very low	159.5 Å²	159.5	139.3 Å²	139.3	84%	0.835	79%	0.79	S	S	*	*			trans	-71	121.3	164.4	-71.6	156	0	0	0	109.6	V2529 N2533	V2529-L2531 PolarHBondContact O-N 2.71Å; L2531-N2533 PolarHBondContact O-N 2.81Å
2532	T	24.5	Very low	27.4	Very low	132.5 Å²	132.5	139.4 Å²	139.4	81%	0.813	80%	0.796	S	S	*	*			trans	-112.4	132.2	162.8	41.7	0	0	0	0	111	L2530 S2534	L2530-T2532 PolarHBondContact O-N 2.84Å; T2532-S2534 PolarHBondContact O-N 2.86Å
2533	N	26.9	Very low	26.9	Very low	155.5 Å²	155.5	138.3 Å²	138.3	83%	0.832	80%	0.799	S	S	*	*			trans	-67.3	128	167.1	-70.4	-25.5	0	0	0	110.6	L2531 S2535	L2531-N2533 PolarHBondContact O-N 2.81Å; N2533-S2535 VanDerWaalsContact C-N 3.33Å; N2533-S2535 PolarHBondContact O-N 3.02Å
2534	S	25.7	Very low	26.5	Very low	124 Å²	124	134.8 Å²	134.8	87%	0.867	80%	0.798	S	S	*	*			trans	-115.3	108.6	158.4	-6.3	0	0	0	0	109.2	T2532 N2536	T2532-S2534 PolarHBondContact O-N 2.86Å; S2534-N2536 PolarHBondContact O-N 2.83Å
2535	S	28.4	Very low	26.1	Very low	98.5 Å²	98.5	131.6 Å²	131.6	69%	0.689	80%	0.8	S	S	*	*			trans	-83.8	153.7	171	4.2	0	0	0	0	110.9	N2533 S2537	N2533-S2535 VanDerWaalsContact C-N 3.33Å; N2533-S2535 PolarHBondContact O-N 3.02Å; S2535-S2537 PolarHBondContact O-N 2.84Å
2536	N	25.6	Very low	25.7	Very low	147.5 Å²	147.5	130.7 Å²	130.7	79%	0.789	80%	0.799	S	S	*	*			trans	61.1	85.2	153.6	-54	-15.7	0	0	0	117.7	S2534	S2534-N2536 PolarHBondContact O-N 2.83Å
2537	S	25.6	Very low	25.6	Very low	104.5 Å²	104.5	127.8 Å²	127.8	73%	0.731	79%	0.794	S	S	*	*			trans	-134.6	108.1	138.8	36.9	0	0	0	0	108.7	S2535 F2539	S2535-S2537 PolarHBondContact O-N 2.84Å; S2537-F2539 WeakPolarHBondContact O-CD2 3.32Å; S2537-F2539 PolarHBondContact O-N 2.86Å; S2537-F2539 VanDerWaalsContact O-N 3.16Å; S2537-F2539 WeakPolarHBondContact OG-CE2 3.42Å
2538	S	23.7	Very low	25.4	Very low	102.5 Å²	102.5	129.7 Å²	129.7	72%	0.717	80%	0.795	S	S	*	*				10.4	122.2	110.9	-53.3	0	0	0	0	111.7	M2540	S2538-M2540 PolarHBondContact O-N 2.96Å
2539	F	25	Very low	25.3	Very low	187.5 Å²	187.5	133 Å²	133	82%	0.822	80%	0.799	S	S	*	*			trans	-8.4	100.2	176.6	-67.5	-80.7	0	0	0	112.1	S2537 S2541	S2537-F2539 WeakPolarHBondContact O-CD2 3.32Å; S2537-F2539 PolarHBondContact O-N 2.86Å; S2537-F2539 VanDerWaalsContact O-N 3.16Å; S2537-F2539 WeakPolarHBondContact OG-CE2 3.42Å; F2539-S2541 PolarHBondContact O-N 2.93Å
2540	M	22.5	Very low	25.2	Very low	172.5 Å²	172.5	132.1 Å²	132.1	85%	0.85	80%	0.798	S	S	*	*				3.2	117.7	108.1	-66	-178.4	67.5	0	0	111.8	S2538	S2538-M2540 PolarHBondContact O-N 2.96Å
2541	S	25.6	Very low	25.4	Very low	110 Å²	110	132.9 Å²	132.9	77%	0.769	80%	0.801	S	S	*	*			trans	-56.8	123.4	162.7	58.5	0	0	0	0	112.7	F2539 S2543	F2539-S2541 PolarHBondContact O-N 2.93Å; S2541-S2543 PolarHBondContact O-N 3.35Å
2542	S	23.4	Very low	25.2	Very low	115.5 Å²	115.5	130.2 Å²	130.2	81%	0.808	80%	0.796	S	S	*	*			trans	-111	141.1	149.7	43.1	0	0	0	0	111.5	S2544	S2542-S2544 PolarHBondContact O-N 3.07Å
2543	S	24.5	Very low	25.3	Very low	117.5 Å²	117.5	128.8 Å²	128.8	82%	0.822	79%	0.791	S	S	*	*			trans	-79.2	115.5	174.5	49.1	0	0	0	0	111.3	S2541	S2541-S2543 PolarHBondContact O-N 3.35Å
2544	S	24.7	Very low	25.3	Very low	114.5 Å²	114.5	130 Å²	130	80%	0.801	79%	0.792	S	S	*	*			trans	-134	126.9	147	37.5	0	0	0	0	108.8	S2542 V2546	S2542-S2544 PolarHBondContact O-N 3.07Å; S2544-V2546 PolarHBondContact O-N 3.06Å
2545	G	24.6	Very low	25.4	Very low	78.5 Å²	78.5	132.4 Å²	132.4	81%	0.809	79%	0.794	S	S	*	*			trans	-84	130.1	173.8	0	0	0	0	0	110.6
2546	V	26.6	Very low	25.4	Very low	128.5 Å²	128.5	137.1 Å²	137.1	78%	0.779	80%	0.802	S	S	*	*			trans	-127.2	128.8	157.3	167.7	0	0	0	0	107.5	S2544 N2548	S2544-V2546 PolarHBondContact O-N 3.06Å; V2546-N2548 PolarHBondContact O-N 3.2Å
2547	T	24.5	Very low	25.4	Very low	124 Å²	124	138.9 Å²	138.9	76%	0.761	81%	0.806	S	S	*	*			trans	-56.7	130.7	171.3	41.4	0	0	0	0	111.5	Q2549	T2547-Q2549 PolarHBondContact O-N 2.83Å; T2547-Q2549 VanDerWaalsContact O-N 3.09Å
2548	N	26	Very low	25.4	Very low	168 Å²	168	141.1 Å²	141.1	90%	0.898	81%	0.809	S	S	*	*			trans	-110.3	125	157.7	-98.8	-25.6	0	0	0	110.7	V2546	V2546-N2548 PolarHBondContact O-N 3.2Å
2549	Q	24.6	Very low	25.6	Very low	172 Å²	172	141.9 Å²	141.9	80%	0.804	81%	0.81	S	S	*	*			trans	-88.1	148.9	173.9	-71.6	176.8	-12.1	0	0	110.3	T2547 I2551	T2547-Q2549 PolarHBondContact O-N 2.83Å; T2547-Q2549 VanDerWaalsContact O-N 3.09Å; Q2549-I2551 PolarHBondContact O-N 2.87Å
2550	S	23.6	Very low	25.7	Very low	112 Å²	112	138.7 Å²	138.7	78%	0.783	81%	0.811	S	S	*	*			trans	-1.1	125.1	162.1	54.6	0	0	0	0	116.3
2551	I	28.5	Very low	26	Very low	166.5 Å²	166.5	135.4 Å²	135.4	85%	0.854	80%	0.8	S	S	*	*			trans	-140.1	136.2	135.1	-81.9	164.8	0	0	0	108.6	Q2549	Q2549-I2551 PolarHBondContact O-N 2.87Å
2552	S	25	Very low	26	Very low	103 Å²	103	139.9 Å²	139.9	72%	0.72	81%	0.806	S	S	*	*			trans	-86.5	143.4	179.7	53.8	0	0	0	0	112.8
2553	S	27.2	Very low	26.4	Very low	102.5 Å²	102.5	144.2 Å²	144.2	72%	0.717	81%	0.806	S	S	*	*			trans	-72.5	125.6	152	51.1	0	0	0	0	112.6
2554	H	26.5	Very low	26.6	Very low	180.5 Å²	180.5	141.2 Å²	141.2	84%	0.836	79%	0.794	S	S	*	*				129.7	96.4	89.8	-94.6	-61.9	0	0	0	112.2	K2556	H2554-K2556 PolarHBondContact O-N 2.89Å
2555	L	27.6	Very low	27	Very low	173.5 Å²	173.5	141.7 Å²	141.7	91%	0.908	79%	0.794	S	S	*	*			trans	-83.4	122	156	-74.7	157.3	0	0	0	108.6
2556	K	28.9	Very low	27.5	Very low	198 Å²	198	144.7 Å²	144.7	86%	0.861	79%	0.792	S	S	*	*			trans	-115.4	131.4	163.4	-86.6	179.9	178.5	178.6	0	109.3	H2554	H2554-K2556 PolarHBondContact O-N 2.89Å
2557	E	24.5	Very low	27.9	Very low	186 Å²	186	147.2 Å²	147.2	87%	0.869	80%	0.795	S	S	*	*			trans	-62.2	147	164.6	-62.6	170.1	134.4	0	0	110.3
2558	N	25.4	Very low	28.5	Very low	150.5 Å²	150.5	146.4 Å²	146.4	81%	0.805	79%	0.789	S	S	*	*			trans	132.1	129.4	159.8	-101.6	-18.8	0	0	0	116.3
2559	T	28.6	Very low	29.2	Very low	119 Å²	119	147.3 Å²	147.3	73%	0.73	79%	0.788	S	S	*	*			trans	127.3	113.1	140.1	37.8	0	0	0	0	114.2	T2561	T2559-T2561 VanDerWaalsContact C-N 3.3Å; T2559-T2561 PolarHBondContact O-N 2.8Å
2560	S	26.6	Very low	30.2	Very low	120 Å²	120	141.1 Å²	141.1	84%	0.839	77%	0.771	S	S	*	*			trans	-52.2	112.2	159.6	52.8	0	0	0	0	112.6	K2562	S2560-K2562 PolarHBondContact O-N 2.88Å
2561	T	29.1	Very low	31.6	Very low	102.5 Å²	102.5	141.8 Å²	141.8	63%	0.629	77%	0.765	S	S	*	*			trans	-107.6	124.1	163.6	46.7	0	0	0	0	109.6	T2559 Y2563	T2559-T2561 VanDerWaalsContact C-N 3.3Å; T2559-T2561 PolarHBondContact O-N 2.8Å; T2561-Y2563 VanDerWaalsContact C-N 3.31Å; T2561-Y2563 VanDerWaalsContact O-CD2 3.27Å; T2561-Y2563 WeakPolarHBondContact O-CD2 3.44Å; T2561-Y2563 PolarHBondContact O-N 2.97Å; T2561-Y2563 WeakPolarHBondContact OG1-CE2 3.32Å
2562	K	26.5	Very low	33	Very low	205 Å²	205	136.6 Å²	136.6	89%	0.891	74%	0.742	S	S	*	*			trans	-70.6	109	170.8	-70	175.1	175.7	177.9	0	109.3	S2560 G2564	S2560-K2562 PolarHBondContact O-N 2.88Å; K2562-G2564 PolarHBondContact O-N 2.53Å
2563	Y	30.6	Very low	34.5	Very low	206 Å²	206	135.2 Å²	135.2	81%	0.808	73%	0.726	S	S	*	*			trans	-102.8	130.7	163.2	-74.9	-81.4	0	0	0	108.9	T2561	T2561-Y2563 VanDerWaalsContact C-N 3.31Å; T2561-Y2563 VanDerWaalsContact O-CD2 3.27Å; T2561-Y2563 WeakPolarHBondContact O-CD2 3.44Å; T2561-Y2563 PolarHBondContact O-N 2.97Å; T2561-Y2563 WeakPolarHBondContact OG1-CE2 3.32Å
2564	G	29.1	Very low	35.6	Very low	55.5 Å²	55.5	137.6 Å²	137.6	57%	0.572	72%	0.724	S	S	*	*			trans	-74.7	161.3	178.8	0	0	0	0	0	112.3	K2562 D2566	K2562-G2564 PolarHBondContact O-N 2.53Å; G2564-D2566 PolarHBondContact O-N 2.88Å; G2564-D2566 VanDerWaalsContact O-N 3.09Å
2565	P	33.2	Very low	36.5	Very low	124 Å²	124	133 Å²	133	81%	0.805	71%	0.711	S	S	*	*	S	Bend	trans	-74.9	29.1	-174.3	8.8	-2.3	0	0	0	113.5	Q2567	P2565-Q2567 PolarHBondContact O-N 3.5Å
2566	D	34.5	Very low	37	Very low	142 Å²	142	130.9 Å²	130.9	76%	0.759	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-112.6	76.9	-178.7	-79.3	-35.1	0	0	0	113	G2564	G2564-D2566 PolarHBondContact O-N 2.88Å; G2564-D2566 VanDerWaalsContact O-N 3.09Å
2567	Q	35.4	Very low	37.3	Very low	181 Å²	181	128.1 Å²	128.1	85%	0.846	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	160.7	35	-178.5	-60.4	-177.4	34.8	0	0	117.1	P2565	P2565-Q2567 PolarHBondContact O-N 3.5Å
2568	V	37.9	Very low	38	Very low	106 Å²	106	124.9 Å²	124.9	64%	0.642	69%	0.69	S	S	*	*			trans	-119.1	42	167.1	-164.1	0	0	0	0	112.6	A2486 G2570	A2486-V2568 HydrophobicContact CB-CG1 3.52Å; V2568-G2570 PolarHBondContact O-N 3.02Å
2569	H	40	Very low	38.6	Very low	187.5 Å²	187.5	124 Å²	124	87%	0.868	68%	0.684	S	S	*	*			trans	-84.6	82.2	170.5	-76.7	-71.5	0	0	0	112.2
2570	G	46.3	Very low	39.5	Very low	43 Å²	43	120.7 Å²	120.7	44%	0.443	67%	0.665	S	S	.	*			trans	-174	108.4	166.7	0	0	0	0	0	114.2	A2483 V2568	A2483-G2570 VanDerWaalsContact CB-O 3.27Å; A2483-G2570 WeakPolarHBondContact CB-O 3.32Å; V2568-G2570 PolarHBondContact O-N 3.02Å
2571	L	53	Low	40.5	Very low	126 Å²	126	121.9 Å²	121.9	66%	0.66	66%	0.661	S	S	*	*			trans	-99.4	138.1	156.5	-76.3	169.4	0	0	0	109.4	M2438 L2573	M2438-L2571 HydrophobicContact CE-CB 4.22Å; M2438-L2571 HydrophobicContact CE-CD1 4.15Å; M2438-L2571 HydrophobicContact CE-CD2 4.21Å; M2438-L2571 HydrophobicContact CE-CG 4.43Å; L2571-L2573 VanDerWaalsContact C-N 3.26Å; L2571-L2573 PolarHBondContact O-N 3.41Å
2572	P	56.5	Low	41.8	Very low	58 Å²	58	118.3 Å²	118.3	38%	0.377	64%	0.644	S	S	.	*	S	Bend	trans	-69.4	44.7	-175.9	1.9	0.6	0	0	0	112.9	W2479 N2480 A2484 V2487 K2574	W2479-P2572 HydrophobicContact CE3-CB 4.39Å; W2479-P2572 HydrophobicContact CH2-CB 4.04Å; W2479-P2572 HydrophobicContact CZ3-CB 3.8Å; N2480-P2572 PolarHBondContact N-O 3.42Å; A2484-P2572 HydrophobicContact CB-CB 4.02Å; A2484-P2572 HydrophobicContact CB-CG 4.46Å; V2487-P2572 HydrophobicContact CG2-CG 4.32Å; P2572-K2574 VanDerWaalsContact C-N 3.28Å; P2572-K2574 PolarHBondContact O-N 3.47Å
2573	L	56.1	Low	43.8	Very low	73.5 Å²	73.5	113.1 Å²	113.1	39%	0.385	62%	0.619	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.3	107	168.3	-82.6	123.4	0	0	0	110.1	M2438 L2440 V2465 C2477 W2479 L2571 F2865 L2873 V2875	M2438-L2573 HydrophobicContact CE-CB 4.31Å; M2438-L2573 HydrophobicContact SD-CB 4.04Å; M2438-L2573 HydrophobicContact SD-CD1 4.46Å; L2440-L2573 HydrophobicContact CD1-CB 3.72Å; L2440-L2573 HydrophobicContact CD1-CD1 3.88Å; L2440-L2573 HydrophobicContact CD1-CG 4.45Å; V2465-L2573 HydrophobicContact CB-CD2 4.05Å; V2465-L2573 HydrophobicContact CG2-CD2 3.81Å; C2477-L2573 HydrophobicContact CB-CD2 3.78Å; W2479-L2573 HydrophobicContact CE3-CD2 3.63Å; W2479-L2573 HydrophobicContact CE3-CG 3.91Å; W2479-L2573 HydrophobicContact CZ3-CD2 4.23Å; W2479-L2573 HydrophobicContact CZ3-CG 4.05Å; L2571-L2573 VanDerWaalsContact C-N 3.26Å; L2571-L2573 PolarHBondContact O-N 3.41Å; L2573-F2865 HydrophobicContact CD1-CD1 4.19Å; L2573-F2865 HydrophobicContact CD1-CE1 3.89Å; L2573-F2865 HydrophobicContact CG-CE1 4.48Å; L2573-L2873 HydrophobicContact CD1-CD2 4.02Å; L2573-V2875 HydrophobicContact CD1-CG2 3.82Å
2574	K	50.9	Low	45.9	Very low	152 Å²	152	106.5 Å²	106.5	66%	0.661	60%	0.602	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-107.6	114.8	158.8	-73	-172.3	176.9	-176.7	0	108.9	K2478 P2572 E2576	K2478-K2574 PolarHBondContact N-O 2.75Å; K2478-K2574 PolarHBondContact O-N 2.72Å; K2478-K2574 VanDerWaalsContact O-N 3.12Å; P2572-K2574 VanDerWaalsContact C-N 3.28Å; P2572-K2574 PolarHBondContact O-N 3.47Å; K2574-E2576 VanDerWaalsContact C-N 3.25Å; K2574-E2576 PolarHBondContact O-N 2.97Å
2575	S	45	Very low	48	Very low	83 Å²	83	103.8 Å²	103.8	58%	0.58	58%	0.575	S	S	*	*			trans	-71.4	117.5	163.8	180	0	0	0	0	108.6	T2577	S2575-T2577 PolarHBondContact O-N 3.02Å; S2575-T2577 VanDerWaalsContact O-N 3.08Å
2576	E	38.5	Very low	49.7	Very low	129.5 Å²	129.5	99 Å²	99	61%	0.605	55%	0.548	S	S	*	.			trans	-56.7	126.8	167	-72.5	-167.3	149.2	0	0	109.2	K2478 K2574 V2578	K2478-E2576 WeakPolarHBondContact CE-OE1 3.42Å; K2478-E2576 IonicContact NZ-OE1 3.18Å; K2478-E2576 PolarHBondContact NZ-OE1 2.8Å; K2574-E2576 VanDerWaalsContact C-N 3.25Å; K2574-E2576 PolarHBondContact O-N 2.97Å; E2576-V2578 PolarHBondContact O-N 3.19Å; E2576-V2578 VanDerWaalsContact O-O 3.12Å
2577	T	35.6	Very low	51.4	Low	139.5 Å²	139.5	98.6 Å²	98.6	86%	0.856	54%	0.541	S	S	*	.	S	Bend	trans	-71.5	40.6	177.5	23.7	0	0	0	0	111.4	S2575 L2579	S2575-T2577 PolarHBondContact O-N 3.02Å; S2575-T2577 VanDerWaalsContact O-N 3.08Å; T2577-L2579 PolarHBondContact O-N 2.71Å
2578	V	38.2	Very low	53.5	Low	120 Å²	120	94.7 Å²	94.7	73%	0.727	53%	0.526	S	S	*	.	S	Bend	trans	-74.4	101.2	161.7	-177.9	0	0	0	0	105.9	E2576	E2576-V2578 PolarHBondContact O-N 3.19Å; E2576-V2578 VanDerWaalsContact O-O 3.12Å
2579	L	38.6	Very low	55.7	Low	130.5 Å²	130.5	90.9 Å²	90.9	68%	0.683	50%	0.501	S	S	*	.			trans	-33.9	123.9	171.3	-71.4	162.9	0	0	0	108.9	T2577 L2581	T2577-L2579 PolarHBondContact O-N 2.71Å; L2579-L2581 PolarHBondContact O-N 2.89Å
2580	P	47.3	Very low	57.9	Low	49.5 Å²	49.5	82.5 Å²	82.5	32%	0.321	46%	0.463	S	S	.	.			trans	-63.2	96	-173	25.2	-33.5	0	0	0	109	Q2443 V2475 G2582	Q2443-P2580 HydrophobicContact CB-CG 4.2Å; V2475-P2580 HydrophobicContact CG1-CB 3.78Å; V2475-P2580 HydrophobicContact CG1-CG 4.14Å; V2475-P2580 HydrophobicContact CG2-CB 4.26Å; V2475-P2580 HydrophobicContact CG2-CG 4.4Å; P2580-G2582 VanDerWaalsContact C-N 3.32Å; P2580-G2582 PolarHBondContact O-N 2.92Å
2581	L	47.3	Very low	59.6	Low	145 Å²	145	89.8 Å²	89.8	76%	0.759	49%	0.485	S	S	*	.			trans	-70.3	84.4	171	-164	79.6	0	0	0	106.2	L2579 R2583	L2579-L2581 PolarHBondContact O-N 2.89Å; L2581-R2583 WeakPolarHBondContact O-CG 3.37Å; L2581-R2583 PolarHBondContact O-N 3.01Å
2582	G	56.8	Low	61.1	Low	27 Å²	27	90.3 Å²	90.3	28%	0.278	49%	0.489	S	S	.	.			trans	-55.1	129.7	178.2	0	0	0	0	0	109.2	T2473 I2474 P2580 C2584	T2473-G2582 VanDerWaalsContact CG2-CA 3.41Å; I2474-G2582 WeakPolarHBondContact O-CA 3.21Å; P2580-G2582 VanDerWaalsContact C-N 3.32Å; P2580-G2582 PolarHBondContact O-N 2.92Å; G2582-C2584 PolarHBondContact O-N 3.07Å
2583	R	68.9	Low	62.5	Low	96.5 Å²	96.5	88.8 Å²	88.8	36%	0.364	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	116.3	-172.8	-57.9	-177.6	-173.1	-100.1	-4	108.8	T2473 I2474 L2581 N2625 N2626	T2473-R2583 WeakPolarHBondContact CA-O 3.31Å; I2474-R2583 PolarHBondContact N-O 3.15Å; I2474-R2583 PolarHBondContact O-N 3.14Å; L2581-R2583 WeakPolarHBondContact O-CG 3.37Å; L2581-R2583 PolarHBondContact O-N 3.01Å; R2583-N2625 PolarHBondContact NE-O 2.95Å; R2583-N2625 PolarHBondContact NH1-O 2.96Å; R2583-N2625 PolarHBondContact NH2-O 3.16Å; R2583-N2626 PolarHBondContact NH1-O 3.24Å
2584	C	74.2	Confident	63.9	Low	66.5 Å²	66.5	94.2 Å²	94.2	45%	0.449	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	129.8	176.4	-176	0	0	0	0	110.4	R2472 G2582 G2586	R2472-C2584 WeakPolarHBondContact O-CA 3.47Å; G2582-C2584 PolarHBondContact O-N 3.07Å; C2584-G2586 VanDerWaalsContact C-N 3.25Å; C2584-G2586 PolarHBondContact O-N 3.07Å; C2584-G2586 VanDerWaalsContact O-N 3.13Å
2585	L	73.1	Confident	65.7	Low	0 Å²	0	88.1 Å²	88.1	0%	0	47%	0.467	C	S	.	.			trans	-89	46.5	-175.2	-64.9	157.1	0	0	0	113.2	I2468 R2472 I2474 L2611 Y2614 F2622	I2468-L2585 HydrophobicContact CG2-CD1 4.45Å; R2472-L2585 HydrophobicContact CB-CB 4.29Å; R2472-L2585 HydrophobicContact CB-CD1 4.43Å; R2472-L2585 WeakPolarHBondContact O-CD1 3.39Å; R2472-L2585 WeakPolarHBondContact O-CG 3.11Å; R2472-L2585 PolarHBondContact O-N 3.22Å; R2472-L2585 VanDerWaalsContact O-N 3.11Å; I2474-L2585 HydrophobicContact CD1-CD1 3.62Å; I2474-L2585 HydrophobicContact CD1-CD2 3.5Å; I2474-L2585 HydrophobicContact CD1-CG 3.9Å; I2474-L2585 HydrophobicContact CG1-CD1 3.27Å; I2474-L2585 HydrophobicContact CG1-CD2 3.94Å; I2474-L2585 HydrophobicContact CG1-CG 3.76Å; L2585-L2611 HydrophobicContact CB-CD2 4.1Å; L2585-L2611 HydrophobicContact CD1-CD1 3.83Å; L2585-L2611 HydrophobicContact CD1-CD2 3.33Å; L2585-L2611 HydrophobicContact CD1-CG 4.25Å; L2585-L2611 HydrophobicContact CD2-CD1 4.28Å; L2585-L2611 HydrophobicContact CG-CD1 4.44Å; L2585-L2611 HydrophobicContact CG-CD2 4.28Å; L2585-Y2614 PolarHBondContact O-OH 3.37Å; L2585-F2622 HydrophobicContact CB-CE2 4.49Å; L2585-F2622 HydrophobicContact CD2-CB 4.02Å; L2585-F2622 HydrophobicContact CD2-CD1 4.29Å; L2585-F2622 HydrophobicContact CD2-CD2 4.1Å; L2585-F2622 HydrophobicContact CD2-CG 3.89Å; L2585-F2622 WeakPolarHBondContact O-CZ 3.36Å
2586	G	69	Low	67.8	Low	23.5 Å²	23.5	86.3 Å²	86.3	24%	0.242	45%	0.452	C	S	.	.			trans	79	-171.4	176.1	0	0	0	0	0	115.2	R2472 C2584	R2472-G2586 PolarHBondContact NE-O 3.32Å; R2472-G2586 PolarHBondContact NH2-O 3.35Å; C2584-G2586 VanDerWaalsContact C-N 3.25Å; C2584-G2586 PolarHBondContact O-N 3.07Å; C2584-G2586 VanDerWaalsContact O-N 3.13Å
2587	H	70.5	Confident	70.3	Confident	132.5 Å²	132.5	82.2 Å²	82.2	61%	0.613	44%	0.438	S	S	*	.	S	Bend	trans	-119.8	-172.7	-176.4	-57.1	-70.3	0	0	0	109.5	F2589	H2587-F2589 PolarHBondContact O-N 3.43Å
2588	D	80.9	Confident	73.1	Confident	99 Å²	99	76.6 Å²	76.6	53%	0.529	40%	0.403	S	S	.	.			trans	72.2	36.3	173.1	-23.9	-44.8	0	0	0	116.3	Y2615	D2588-Y2615 PolarHBondContact O-N 3.36Å
2589	F	83.9	Confident	75.8	Confident	26.5 Å²	26.5	71.2 Å²	71.2	12%	0.116	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-80.4	148.4	171.6	-105	-92.4	0	0	0	111.1	R2472 H2587 E2591 L2593 I2595 G2613 Y2614	R2472-F2589 HydrophobicContact CB-CZ 4.27Å; R2472-F2589 VanDerWaalsContact CD-CE2 3.49Å; R2472-F2589 HydrophobicContact CG-CE1 4.22Å; R2472-F2589 HydrophobicContact CG-CE2 4.16Å; R2472-F2589 HydrophobicContact CG-CZ 3.81Å; R2472-F2589 VanDerWaalsContact CZ-CB 3.4Å; H2587-F2589 PolarHBondContact O-N 3.43Å; F2589-E2591 PolarHBondContact O-N 3.33Å; F2589-L2593 HydrophobicContact CE1-CB 4.24Å; F2589-L2593 HydrophobicContact CE1-CD2 3.96Å; F2589-L2593 HydrophobicContact CE1-CG 4.24Å; F2589-L2593 HydrophobicContact CZ-CD2 4.27Å; F2589-I2595 HydrophobicContact CD1-CG1 4.35Å; F2589-I2595 HydrophobicContact CE1-CD1 4.46Å; F2589-I2595 HydrophobicContact CE1-CG1 3.83Å; F2589-I2595 HydrophobicContact CZ-CG1 4.22Å; F2589-G2613 WeakPolarHBondContact CA-O 3.45Å; F2589-Y2614 HydrophobicContact CD1-CD1 4.21Å; F2589-Y2614 HydrophobicContact CD1-CE1 4.08Å; F2589-Y2614 HydrophobicContact CD2-CE1 4.48Å; F2589-Y2614 HydrophobicContact CE1-CD1 4.2Å; F2589-Y2614 AromaticContact CE1-CE1 3.62Å; F2589-Y2614 HydrophobicContact CE1-CE1 3.62Å; F2589-Y2614 HydrophobicContact CE1-CE2 4.21Å; F2589-Y2614 AromaticContact CE1-CZ 3.62Å; F2589-Y2614 HydrophobicContact CE2-CE1 4.09Å; F2589-Y2614 AromaticContact CZ-CE1 3.64Å; F2589-Y2614 HydrophobicContact CZ-CE1 3.64Å; F2589-Y2614 AromaticContact CZ-CZ 3.76Å
2590	D	84.9	Confident	78.4	Confident	12.5 Å²	12.5	65.2 Å²	65.2	7%	0.067	34%	0.338	C	S	.	.			trans	-66.8	120.6	172.2	177.5	-117.5	0	0	0	110.7	N2592 L2593 G2613 I2639 R2661	D2590-N2592 VanDerWaalsContact C-N 3.27Å; D2590-N2592 PolarHBondContact O-N 3.13Å; D2590-N2592 WeakPolarHBondContact OD1-CA 3.28Å; D2590-N2592 VanDerWaalsContact OD1-CB 3.31Å; D2590-N2592 WeakPolarHBondContact OD1-CB 3.41Å; D2590-N2592 PolarHBondContact OD1-N 2.87Å; D2590-N2592 VanDerWaalsContact OD1-N 3.14Å; D2590-N2592 PolarHBondContact OD2-N 2.93Å; D2590-N2592 PolarHBondContact OD2-ND2 2.85Å; D2590-L2593 HydrophobicContact CB-CB 4.21Å; D2590-L2593 PolarHBondContact O-N 3.12Å; D2590-L2593 PolarHBondContact OD1-N 2.95Å; D2590-G2613 PolarHBondContact N-O 3.04Å; D2590-I2639 HydrophobicContact CB-CD1 3.79Å; D2590-I2639 HydrophobicContact CB-CG2 4.46Å; D2590-I2639 VanDerWaalsContact CG-CD1 3.48Å; D2590-I2639 WeakPolarHBondContact OD2-CD1 3.26Å; D2590-R2661 IonicContact OD1-CZ 3.44Å; D2590-R2661 IonicContact OD1-NH1 3.63Å; D2590-R2661 PolarHBondContact OD1-NH1 2.9Å; D2590-R2661 IonicContact OD1-NH2 3.57Å; D2590-R2661 PolarHBondContact OD1-NH2 2.77Å; D2590-R2661 IonicContact OD2-NH1 2.99Å; D2590-R2661 PolarHBondContact OD2-NH1 3.18Å
2591	E	82.7	Confident	80.7	Confident	195 Å²	195	63.5 Å²	63.5	91%	0.911	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-21	-177.7	-61.1	-173.3	159.8	0	0	112.7	F2589 L2593	F2589-E2591 PolarHBondContact O-N 3.33Å; E2591-L2593 VanDerWaalsContact C-N 3.32Å
2592	N	84.8	Confident	82.9	Confident	137 Å²	137	56.7 Å²	56.7	73%	0.733	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-11	177.5	-54.9	-65	0	0	0	112.8	D2590 R2594	D2590-N2592 VanDerWaalsContact C-N 3.27Å; D2590-N2592 PolarHBondContact O-N 3.13Å; D2590-N2592 WeakPolarHBondContact OD1-CA 3.28Å; D2590-N2592 VanDerWaalsContact OD1-CB 3.31Å; D2590-N2592 WeakPolarHBondContact OD1-CB 3.41Å; D2590-N2592 PolarHBondContact OD1-N 2.87Å; D2590-N2592 VanDerWaalsContact OD1-N 3.14Å; D2590-N2592 PolarHBondContact OD2-N 2.93Å; D2590-N2592 PolarHBondContact OD2-ND2 2.85Å; N2592-R2594 PolarHBondContact O-N 2.55Å
2593	L	85.1	Confident	84.5	Confident	27 Å²	27	55.4 Å²	55.4	14%	0.141	28%	0.278	C	S	.	.	S	Bend	trans	-94.1	106.7	-178.3	-170.6	66.5	0	0	0	110.6	F2589 D2590 E2591 I2595 Q2599 I2639 T2641	F2589-L2593 HydrophobicContact CE1-CB 4.24Å; F2589-L2593 HydrophobicContact CE1-CD2 3.96Å; F2589-L2593 HydrophobicContact CE1-CG 4.24Å; F2589-L2593 HydrophobicContact CZ-CD2 4.27Å; D2590-L2593 HydrophobicContact CB-CB 4.21Å; D2590-L2593 PolarHBondContact O-N 3.12Å; D2590-L2593 PolarHBondContact OD1-N 2.95Å; E2591-L2593 VanDerWaalsContact C-N 3.32Å; L2593-I2595 PolarHBondContact O-N 2.96Å; L2593-Q2599 VanDerWaalsContact CG-NE2 3.26Å; L2593-I2639 HydrophobicContact CD2-CG2 4.44Å; L2593-T2641 HydrophobicContact CD1-CG2 4.16Å
2594	R	85.6	Confident	85.3	Confident	185.5 Å²	185.5	52 Å²	52	70%	0.7	27%	0.27	S	S	*	.			trans	-56.7	130.7	171.2	-176.1	178.8	179	-174.2	-0	109.8	N2592 Q2599	N2592-R2594 PolarHBondContact O-N 2.55Å; R2594-Q2599 PolarHBondContact O-NE2 3.3Å
2595	I	88.2	Confident	85.9	Confident	25 Å²	25	50.3 Å²	50.3	13%	0.128	26%	0.257	C	S	.	.			trans	-71.2	131.4	178.5	-115.8	170.5	0	0	0	110.6	V2449 E2470 R2472 F2589 L2593 Q2599 F2600	V2449-I2595 HydrophobicContact CB-CG2 4.46Å; V2449-I2595 HydrophobicContact CG1-CG2 4.37Å; V2449-I2595 HydrophobicContact CG2-CD1 4.34Å; V2449-I2595 HydrophobicContact CG2-CG1 4.33Å; V2449-I2595 HydrophobicContact CG2-CG2 3.98Å; E2470-I2595 HydrophobicContact CG-CB 4.18Å; E2470-I2595 HydrophobicContact CG-CD1 4.28Å; E2470-I2595 HydrophobicContact CG-CG2 4.02Å; E2470-I2595 WeakPolarHBondContact O-CD1 3.46Å; R2472-I2595 HydrophobicContact CG-CD1 4.3Å; F2589-I2595 HydrophobicContact CD1-CG1 4.35Å; F2589-I2595 HydrophobicContact CE1-CD1 4.46Å; F2589-I2595 HydrophobicContact CE1-CG1 3.83Å; F2589-I2595 HydrophobicContact CZ-CG1 4.22Å; L2593-I2595 PolarHBondContact O-N 2.96Å; I2595-Q2599 VanDerWaalsContact CA-OE1 3.24Å; I2595-F2600 HydrophobicContact CD1-CE2 4.28Å; I2595-F2600 HydrophobicContact CD1-CZ 3.85Å; I2595-F2600 HydrophobicContact CG1-CE2 3.94Å; I2595-F2600 HydrophobicContact CG1-CZ 3.99Å; I2595-F2600 HydrophobicContact CG2-CE2 3.85Å; I2595-F2600 HydrophobicContact CG2-CZ 4.03Å
2596	T	89.9	Confident	86.6	Confident	44.5 Å²	44.5	50.8 Å²	50.8	27%	0.273	26%	0.261	S	S	.	.			trans	-142.9	162.3	-177.1	62.5	0	0	0	0	111.4	N2598 Q2599 F2600	T2596-N2598 PolarHBondContact O-N 3.12Å; T2596-N2598 VanDerWaalsContact O-N 3.14Å; T2596-Q2599 PolarHBondContact O-N 3.33Å; T2596-Q2599 PolarHBondContact OG1-NE2 2.91Å; T2596-F2600 WeakPolarHBondContact O-CD2 3.4Å; T2596-F2600 VanDerWaalsContact O-CE2 3.26Å; T2596-F2600 WeakPolarHBondContact O-CE2 3.35Å
2597	S	91.5	Very high	87.6	Confident	44.5 Å²	44.5	56.1 Å²	56.1	31%	0.311	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-55.7	-29.5	174.8	53.1	0	0	0	0	113.5	V2449 H2450 Q2599 F2600	V2449-S2597 VanDerWaalsContact O-CA 3.28Å; V2449-S2597 WeakPolarHBondContact O-CA 3.5Å; V2449-S2597 VanDerWaalsContact O-CB 3.32Å; V2449-S2597 WeakPolarHBondContact O-CB 3.32Å; V2449-S2597 PolarHBondContact O-N 3.13Å; H2450-S2597 PolarHBondContact ND1-O 3.16Å; S2597-Q2599 PolarHBondContact O-N 3.16Å; S2597-F2600 PolarHBondContact O-N 3.38Å
2598	N	93.8	Very high	88.6	Confident	21.5 Å²	21.5	49.8 Å²	49.8	12%	0.115	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-68.5	-12.3	-176.8	-60.9	-14.7	0	0	0	113.5	T2596 F2600 C2642 L2643 N2698 C2699 N2763 L2764	T2596-N2598 PolarHBondContact O-N 3.12Å; T2596-N2598 VanDerWaalsContact O-N 3.14Å; N2598-F2600 VanDerWaalsContact C-N 3.35Å; N2598-C2642 HydrophobicContact CB-CB 3.88Å; N2598-C2642 CarbonylContact O-C 3.48Å; N2598-C2642 VanDerWaalsContact O-CA 3.3Å; N2598-C2642 WeakPolarHBondContact O-CA 3.5Å; N2598-L2643 PolarHBondContact O-N 2.97Å; N2598-N2698 PolarHBondContact ND2-O 3.27Å; N2598-C2699 WeakPolarHBondContact ND2-CB 3.39Å; N2598-N2763 PolarHBondContact ND2-O 3.14Å; N2598-L2764 WeakPolarHBondContact OD1-CD1 3.42Å
2599	Q	94.7	Very high	89.1	Confident	6 Å²	6	45.1 Å²	45.1	3%	0.028	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-89	-4.9	-178.8	-70.8	157.6	3.8	0	0	113.6	L2593 R2594 I2595 T2596 S2597 L2611 C2612 T2641	L2593-Q2599 VanDerWaalsContact CG-NE2 3.26Å; R2594-Q2599 PolarHBondContact O-NE2 3.3Å; I2595-Q2599 VanDerWaalsContact CA-OE1 3.24Å; T2596-Q2599 PolarHBondContact O-N 3.33Å; T2596-Q2599 PolarHBondContact OG1-NE2 2.91Å; S2597-Q2599 PolarHBondContact O-N 3.16Å; Q2599-L2611 WeakPolarHBondContact O-CA 3.33Å; Q2599-C2612 PolarHBondContact O-N 3.01Å; Q2599-C2612 VanDerWaalsContact O-N 3.16Å; Q2599-T2641 WeakPolarHBondContact CG-O 3.33Å
2600	F	94.4	Very high	89.7	Confident	5.5 Å²	5.5	43.8 Å²	43.8	2%	0.024	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	136.8	-172	-53.9	-87.7	0	0	0	111.2	V2449 H2450 I2468 I2595 T2596 S2597 N2598 L2611	V2449-F2600 HydrophobicContact CG2-CD2 4.41Å; V2449-F2600 HydrophobicContact CG2-CE2 3.83Å; V2449-F2600 HydrophobicContact CG2-CZ 4.3Å; H2450-F2600 HydrophobicContact CB-CB 4.08Å; H2450-F2600 HydrophobicContact CB-CD2 3.99Å; H2450-F2600 HydrophobicContact CB-CG 4.23Å; H2450-F2600 PolarHBondContact CE1-O 3.12Å; H2450-F2600 PolarHBondContact ND1-O 2.92Å; I2468-F2600 HydrophobicContact CB-CD1 4.41Å; I2468-F2600 HydrophobicContact CD1-CB 3.88Å; I2468-F2600 HydrophobicContact CD1-CD1 3.69Å; I2468-F2600 HydrophobicContact CD1-CE1 4.42Å; I2468-F2600 HydrophobicContact CD1-CG 3.97Å; I2468-F2600 HydrophobicContact CG2-CD1 3.9Å; I2468-F2600 HydrophobicContact CG2-CE1 3.69Å; I2468-F2600 HydrophobicContact CG2-CZ 4.17Å; I2595-F2600 HydrophobicContact CD1-CE2 4.28Å; I2595-F2600 HydrophobicContact CD1-CZ 3.85Å; I2595-F2600 HydrophobicContact CG1-CE2 3.94Å; I2595-F2600 HydrophobicContact CG1-CZ 3.99Å; I2595-F2600 HydrophobicContact CG2-CE2 3.85Å; I2595-F2600 HydrophobicContact CG2-CZ 4.03Å; T2596-F2600 WeakPolarHBondContact O-CD2 3.4Å; T2596-F2600 VanDerWaalsContact O-CE2 3.26Å; T2596-F2600 WeakPolarHBondContact O-CE2 3.35Å; S2597-F2600 PolarHBondContact O-N 3.38Å; N2598-F2600 VanDerWaalsContact C-N 3.35Å; F2600-L2611 HydrophobicContact CD1-CD2 3.33Å; F2600-L2611 HydrophobicContact CD1-CG 3.62Å; F2600-L2611 HydrophobicContact CE1-CD2 3.2Å; F2600-L2611 HydrophobicContact CE1-CG 4.01Å; F2600-L2611 HydrophobicContact CZ-CD2 4.42Å
2601	V	95.1	Very high	90.2	Very high	12 Å²	12	43.2 Å²	43.2	7%	0.073	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	132.1	175.3	162.6	0	0	0	0	108.9	V2609 I2610 L2643 R2645 L2656	V2601-V2609 CarbonylContact O-C 3.48Å; V2601-V2609 WeakPolarHBondContact O-CA 3.25Å; V2601-I2610 HydrophobicContact CB-CB 4.25Å; V2601-I2610 HydrophobicContact CG1-CD1 4.39Å; V2601-I2610 PolarHBondContact N-O 3.27Å; V2601-I2610 PolarHBondContact O-N 2.91Å; V2601-L2643 HydrophobicContact CG2-CB 3.74Å; V2601-R2645 HydrophobicContact CG1-CB 3.59Å; V2601-R2645 HydrophobicContact CG1-CG 4.21Å; V2601-L2656 HydrophobicContact CG1-CD1 4.12Å
2602	V	92.6	Very high	90.8	Very high	3 Å²	3	34 Å²	34	2%	0.018	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	138.3	169.1	-177.2	0	0	0	0	109.3	F2452 F2466 V2609 R2645	F2452-V2602 HydrophobicContact CB-CB 4.06Å; F2452-V2602 HydrophobicContact CB-CG2 3.8Å; F2452-V2602 HydrophobicContact CD1-CB 3.52Å; F2452-V2602 HydrophobicContact CD1-CG1 3.64Å; F2452-V2602 HydrophobicContact CD1-CG2 4.15Å; F2452-V2602 HydrophobicContact CD2-CB 4.45Å; F2452-V2602 HydrophobicContact CE1-CB 4.03Å; F2452-V2602 HydrophobicContact CE1-CG1 3.98Å; F2452-V2602 HydrophobicContact CG-CB 3.75Å; F2452-V2602 HydrophobicContact CG-CG1 4.37Å; F2452-V2602 HydrophobicContact CG-CG2 4.09Å; F2466-V2602 HydrophobicContact CB-CG2 4.15Å; F2466-V2602 HydrophobicContact CD1-CG1 4.36Å; F2466-V2602 HydrophobicContact CD1-CG2 4.34Å; F2466-V2602 HydrophobicContact CD2-CG1 4.06Å; F2466-V2602 HydrophobicContact CE1-CG1 4.41Å; F2466-V2602 HydrophobicContact CE2-CG1 4.12Å; F2466-V2602 HydrophobicContact CG-CG1 4.19Å; F2466-V2602 HydrophobicContact CG-CG2 4.16Å; F2466-V2602 HydrophobicContact CZ-CG1 4.3Å; V2602-V2609 HydrophobicContact CG1-CG2 4.49Å; V2602-V2609 HydrophobicContact CG2-CG1 4.27Å; V2602-V2609 HydrophobicContact CG2-CG2 4.11Å; V2602-R2645 PolarHBondContact O-NE 2.9Å
2603	T	91.5	Very high	91.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.133	C	C	.	.			trans	-70.4	149.2	177.9	59.2	0	0	0	0	111.4	D2605 S2606 R2607 A2608 I2610 F2670	T2603-D2605 VanDerWaalsContact CB-OD1 3.22Å; T2603-D2605 WeakPolarHBondContact CB-OD1 3.15Å; T2603-D2605 PolarHBondContact O-N 3.37Å; T2603-D2605 VanDerWaalsContact O-N 3.09Å; T2603-D2605 PolarHBondContact OG1-OD1 3.01Å; T2603-S2606 PolarHBondContact O-N 3.5Å; T2603-R2607 PolarHBondContact OG1-N 3.48Å; T2603-A2608 HydrophobicContact CG2-CB 3.87Å; T2603-A2608 PolarHBondContact N-O 3.26Å; T2603-A2608 PolarHBondContact OG1-N 3.4Å; T2603-A2608 PolarHBondContact OG1-O 2.87Å; T2603-A2608 VanDerWaalsContact OG1-O 3.14Å; T2603-I2610 HydrophobicContact CG2-CD1 4.29Å; T2603-I2610 HydrophobicContact CG2-CG1 4.5Å; T2603-F2670 HydrophobicContact CG2-CE1 3.83Å; T2603-F2670 HydrophobicContact CG2-CE2 4.13Å; T2603-F2670 HydrophobicContact CG2-CZ 3.53Å
2604	A	85.2	Confident	91.7	Very high	25 Å²	25	26.3 Å²	26.3	21%	0.207	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.6	-176.1	0	0	0	0	0	114.7	N2454 L2460 C2648	N2454-A2604 PolarHBondContact ND2-O 3.43Å; L2460-A2604 WeakPolarHBondContact CD2-O 3.1Å; A2604-C2648 HydrophobicContact CB-CB 3.67Å
2605	D	86.5	Confident	92	Very high	31 Å²	31	25.5 Å²	25.5	17%	0.166	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	2.3	176.7	63.9	-9.6	0	0	0	112.9	T2603 R2607 V2672	T2603-D2605 VanDerWaalsContact CB-OD1 3.22Å; T2603-D2605 WeakPolarHBondContact CB-OD1 3.15Å; T2603-D2605 PolarHBondContact O-N 3.37Å; T2603-D2605 VanDerWaalsContact O-N 3.09Å; T2603-D2605 PolarHBondContact OG1-OD1 3.01Å; D2605-R2607 HydrophobicContact CB-CG 4.26Å; D2605-R2607 PolarHBondContact O-N 3.46Å; D2605-R2607 VanDerWaalsContact O-N 3.15Å; D2605-R2607 PolarHBondContact OD1-N 3.39Å; D2605-R2607 VanDerWaalsContact OD1-N 3.15Å; D2605-R2607 WeakPolarHBondContact OD2-CD 3.22Å; D2605-R2607 WeakPolarHBondContact OD2-CG 3.27Å; D2605-V2672 HydrophobicContact CB-CG1 3.99Å; D2605-V2672 VanDerWaalsContact OD2-CG1 3.3Å; D2605-V2672 WeakPolarHBondContact OD2-CG1 3.48Å
2606	S	88.4	Confident	92.3	Very high	11 Å²	11	26.9 Å²	26.9	8%	0.077	13%	0.133	C	C	.	.	S	Bend	trans	58.8	19.1	-176.5	-60.1	0	0	0	0	114.5	N2454 T2603 S2624	N2454-S2606 WeakPolarHBondContact CB-OG 3.31Å; N2454-S2606 PolarHBondContact ND2-OG 3.1Å; T2603-S2606 PolarHBondContact O-N 3.5Å; S2606-S2624 VanDerWaalsContact O-CB 3.29Å; S2606-S2624 WeakPolarHBondContact O-CB 3.33Å; S2606-S2624 PolarHBondContact O-OG 2.81Å
2607	R	88.8	Confident	92.6	Very high	134 Å²	134	30.7 Å²	30.7	51%	0.506	14%	0.142	S	C	.	.	S	Bend	trans	-90	-22.3	-177.5	-68.3	-178.1	65.7	-154.2	2	114.1	T2603 D2605 S2624	T2603-R2607 PolarHBondContact OG1-N 3.48Å; D2605-R2607 HydrophobicContact CB-CG 4.26Å; D2605-R2607 PolarHBondContact O-N 3.46Å; D2605-R2607 VanDerWaalsContact O-N 3.15Å; D2605-R2607 PolarHBondContact OD1-N 3.39Å; D2605-R2607 VanDerWaalsContact OD1-N 3.15Å; D2605-R2607 WeakPolarHBondContact OD2-CD 3.22Å; D2605-R2607 WeakPolarHBondContact OD2-CG 3.27Å; R2607-S2624 VanDerWaalsContact C-OG 3.23Å; R2607-S2624 WeakPolarHBondContact CA-OG 3.08Å; R2607-S2624 PolarHBondContact O-N 3.24Å; R2607-S2624 PolarHBondContact O-OG 3.48Å; R2607-S2624 VanDerWaalsContact O-OG 3.08Å
2608	A	91.2	Very high	92.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	155.8	-179.5	0	0	0	0	0	112.8	T2603 I2621 F2622 I2630	T2603-A2608 HydrophobicContact CG2-CB 3.87Å; T2603-A2608 PolarHBondContact N-O 3.26Å; T2603-A2608 PolarHBondContact OG1-N 3.4Å; T2603-A2608 PolarHBondContact OG1-O 2.87Å; T2603-A2608 VanDerWaalsContact OG1-O 3.14Å; A2608-I2621 HydrophobicContact CB-CG2 3.88Å; A2608-F2622 CarbonylContact C-O 3.59Å; A2608-F2622 WeakPolarHBondContact CA-O 3.43Å; A2608-F2622 VanDerWaalsContact CB-O 3.31Å; A2608-F2622 WeakPolarHBondContact CB-O 3.27Å; A2608-I2630 HydrophobicContact CB-CD1 4.18Å
2609	V	93	Very high	92.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	131.7	172.1	-173.1	0	0	0	0	108	F2466 I2468 I2474 V2601 V2602 L2611 F2622	F2466-V2609 HydrophobicContact CD1-CG2 4.17Å; F2466-V2609 HydrophobicContact CE1-CG2 4.15Å; I2468-V2609 HydrophobicContact CD1-CG1 3.76Å; I2474-V2609 HydrophobicContact CD1-CB 3.73Å; I2474-V2609 HydrophobicContact CD1-CG1 3.88Å; I2474-V2609 HydrophobicContact CD1-CG2 3.69Å; V2601-V2609 CarbonylContact O-C 3.48Å; V2601-V2609 WeakPolarHBondContact O-CA 3.25Å; V2602-V2609 HydrophobicContact CG1-CG2 4.49Å; V2602-V2609 HydrophobicContact CG2-CG1 4.27Å; V2602-V2609 HydrophobicContact CG2-CG2 4.11Å; V2609-L2611 HydrophobicContact CB-CD1 4.23Å; V2609-L2611 HydrophobicContact CG1-CD1 3.64Å; V2609-F2622 PolarHBondContact N-O 3.13Å; V2609-F2622 PolarHBondContact O-N 3.31Å
2610	I	95.6	Very high	92.9	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.5	-176.2	-47.1	179.6	0	0	0	108.1	V2601 T2603 F2619 R2620 I2621 L2643 L2656 F2670	V2601-I2610 HydrophobicContact CB-CB 4.25Å; V2601-I2610 HydrophobicContact CG1-CD1 4.39Å; V2601-I2610 PolarHBondContact N-O 3.27Å; V2601-I2610 PolarHBondContact O-N 2.91Å; T2603-I2610 HydrophobicContact CG2-CD1 4.29Å; T2603-I2610 HydrophobicContact CG2-CG1 4.5Å; I2610-F2619 HydrophobicContact CG2-CD2 3.75Å; I2610-F2619 HydrophobicContact CG2-CE2 4.32Å; I2610-R2620 CarbonylContact C-O 3.54Å; I2610-R2620 VanDerWaalsContact CA-O 3.29Å; I2610-R2620 WeakPolarHBondContact CA-O 3.43Å; I2610-I2621 HydrophobicContact CD1-CG1 4.45Å; I2610-I2621 HydrophobicContact CG1-CG1 4.17Å; I2610-I2621 HydrophobicContact CG1-CG2 4.25Å; I2610-I2621 HydrophobicContact CG2-CG1 4.17Å; I2610-L2643 HydrophobicContact CB-CD1 4.42Å; I2610-L2643 HydrophobicContact CG2-CD1 3.78Å; I2610-L2656 HydrophobicContact CD1-CD1 4.03Å; I2610-L2656 HydrophobicContact CD1-CD2 4Å; I2610-L2656 HydrophobicContact CG2-CD2 4.33Å; I2610-F2670 HydrophobicContact CD1-CD2 4.02Å; I2610-F2670 HydrophobicContact CD1-CE2 3.95Å
2611	L	95.6	Very high	92.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	144.4	-175.3	-68.9	93	0	0	0	111.6	L2585 Q2599 F2600 V2609 Y2614 F2619 R2620 F2622	L2585-L2611 HydrophobicContact CB-CD2 4.1Å; L2585-L2611 HydrophobicContact CD1-CD1 3.83Å; L2585-L2611 HydrophobicContact CD1-CD2 3.33Å; L2585-L2611 HydrophobicContact CD1-CG 4.25Å; L2585-L2611 HydrophobicContact CD2-CD1 4.28Å; L2585-L2611 HydrophobicContact CG-CD1 4.44Å; L2585-L2611 HydrophobicContact CG-CD2 4.28Å; Q2599-L2611 WeakPolarHBondContact O-CA 3.33Å; F2600-L2611 HydrophobicContact CD1-CD2 3.33Å; F2600-L2611 HydrophobicContact CD1-CG 3.62Å; F2600-L2611 HydrophobicContact CE1-CD2 3.2Å; F2600-L2611 HydrophobicContact CE1-CG 4.01Å; F2600-L2611 HydrophobicContact CZ-CD2 4.42Å; V2609-L2611 HydrophobicContact CB-CD1 4.23Å; V2609-L2611 HydrophobicContact CG1-CD1 3.64Å; L2611-Y2614 HydrophobicContact CB-CE2 4.41Å; L2611-F2619 CarbonylContact O-C 3.56Å; L2611-F2619 VanDerWaalsContact O-CA 3.32Å; L2611-F2619 WeakPolarHBondContact O-CA 3.42Å; L2611-F2619 WeakPolarHBondContact O-CB 3.39Å; L2611-R2620 PolarHBondContact N-O 3.21Å; L2611-R2620 PolarHBondContact O-N 3.28Å; L2611-F2622 HydrophobicContact CD1-CD2 3.87Å; L2611-F2622 HydrophobicContact CD1-CE2 4.33Å
2612	C	95.8	Very high	92.8	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.014	12%	0.124	C	C	.	.			trans	-121.3	-174.8	171.7	71.1	0	0	0	0	112.2	Q2599 F2619 V2640 L2643	Q2599-C2612 PolarHBondContact O-N 3.01Å; Q2599-C2612 VanDerWaalsContact O-N 3.16Å; C2612-F2619 HydrophobicContact CB-CB 3.89Å; C2612-V2640 HydrophobicContact CB-CB 3.8Å; C2612-V2640 HydrophobicContact CB-CG1 3.5Å; C2612-V2640 VanDerWaalsContact CB-CG1 3.5Å; C2612-V2640 WeakPolarHBondContact CB-O 3.41Å; C2612-V2640 PolarHBondContact SG-O 2.99Å; C2612-V2640 VanDerWaalsContact SG-O 3.38Å; C2612-L2643 HydrophobicContact CB-CD1 3.76Å; C2612-L2643 HydrophobicContact CB-CD2 4.37Å; C2612-L2643 HydrophobicContact CB-CG 3.84Å
2613	G	94.2	Very high	92.7	Very high	2 Å²	2	28.6 Å²	28.6	2%	0.021	13%	0.125	C	C	.	.			trans	94.3	16.8	-179.2	0	0	0	0	0	115.1	F2589 D2590 V2640	F2589-G2613 WeakPolarHBondContact CA-O 3.45Å; D2590-G2613 PolarHBondContact N-O 3.04Å; G2613-V2640 WeakPolarHBondContact CA-O 3.46Å; G2613-V2640 PolarHBondContact N-O 2.95Å
2614	Y	94.6	Very high	92.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	13%	0.132	C	C	.	.	B	Isolated β-bridge	trans	-78.3	143.4	175.2	-65.1	-81.8	0	0	0	111.4	L2585 F2589 L2611 D2616 R2617 R2620 F2622	L2585-Y2614 PolarHBondContact O-OH 3.37Å; F2589-Y2614 HydrophobicContact CD1-CD1 4.21Å; F2589-Y2614 HydrophobicContact CD1-CE1 4.08Å; F2589-Y2614 HydrophobicContact CD2-CE1 4.48Å; F2589-Y2614 HydrophobicContact CE1-CD1 4.2Å; F2589-Y2614 AromaticContact CE1-CE1 3.62Å; F2589-Y2614 HydrophobicContact CE1-CE1 3.62Å; F2589-Y2614 HydrophobicContact CE1-CE2 4.21Å; F2589-Y2614 AromaticContact CE1-CZ 3.62Å; F2589-Y2614 HydrophobicContact CE2-CE1 4.09Å; F2589-Y2614 AromaticContact CZ-CE1 3.64Å; F2589-Y2614 HydrophobicContact CZ-CE1 3.64Å; F2589-Y2614 AromaticContact CZ-CZ 3.76Å; L2611-Y2614 HydrophobicContact CB-CE2 4.41Å; Y2614-D2616 WeakPolarHBondContact CB-OD1 3.4Å; Y2614-D2616 PolarHBondContact O-N 3.16Å; Y2614-R2617 PolarHBondContact O-N 3.06Å; Y2614-R2617 VanDerWaalsContact O-N 3.1Å; Y2614-R2620 HydrophobicContact CD2-CB 4.43Å; Y2614-R2620 HydrophobicContact CD2-CG 3.82Å; Y2614-R2620 HydrophobicContact CE2-CB 3.72Å; Y2614-R2620 HydrophobicContact CE2-CG 3.55Å; Y2614-F2622 VanDerWaalsContact OH-CE2 3.28Å; Y2614-F2622 WeakPolarHBondContact OH-CE2 3.24Å; Y2614-F2622 WeakPolarHBondContact OH-CZ 3.46Å
2615	Y	92.2	Very high	92.3	Very high	168 Å²	168	33.9 Å²	33.9	66%	0.659	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-24.2	179.5	-173.5	-96	0	0	0	112.6	D2588 R2617	D2588-Y2615 PolarHBondContact O-N 3.36Å; Y2615-R2617 PolarHBondContact O-N 2.96Å
2616	D	94.3	Very high	92.1	Very high	55 Å²	55	35.6 Å²	35.6	29%	0.294	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	8.4	175.8	73.4	-7.3	0	0	0	114.2	Y2614 S2618 R2620 F2634	Y2614-D2616 WeakPolarHBondContact CB-OD1 3.4Å; Y2614-D2616 PolarHBondContact O-N 3.16Å; D2616-S2618 VanDerWaalsContact CG-OG 3.28Å; D2616-S2618 PolarHBondContact O-N 3.29Å; D2616-S2618 VanDerWaalsContact OD1-CB 3.28Å; D2616-S2618 WeakPolarHBondContact OD1-CB 3.19Å; D2616-S2618 PolarHBondContact OD1-N 2.88Å; D2616-S2618 PolarHBondContact OD1-OG 3.39Å; D2616-S2618 PolarHBondContact OD2-OG 2.75Å; D2616-R2620 IonicContact OD1-NH2 3.87Å; D2616-R2620 IonicContact OD2-CZ 3.71Å; D2616-R2620 IonicContact OD2-NE 3.92Å; D2616-R2620 IonicContact OD2-NH2 2.72Å; D2616-R2620 PolarHBondContact OD2-NH2 3.39Å; D2616-F2634 HydrophobicContact CB-CE1 4.29Å
2617	R	95.6	Very high	91.7	Very high	125 Å²	125	35.9 Å²	35.9	47%	0.472	17%	0.165	S	C	.	.	S	Bend	trans	66.2	13.5	177.2	-46.8	168.1	-172.1	177.4	8.8	114	Y2614 Y2615 S2637	Y2614-R2617 PolarHBondContact O-N 3.06Å; Y2614-R2617 VanDerWaalsContact O-N 3.1Å; Y2615-R2617 PolarHBondContact O-N 2.96Å; R2617-S2637 WeakPolarHBondContact CD-O 3.39Å; R2617-S2637 VanDerWaalsContact CZ-O 3.31Å; R2617-S2637 PolarHBondContact NE-O 3.44Å; R2617-S2637 PolarHBondContact NH1-O 3.19Å
2618	S	95.2	Very high	91.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	17%	0.174	C	C	.	.			trans	-87.2	159.1	175.4	71.7	0	0	0	0	112.5	D2616 R2620 V2633	D2616-S2618 VanDerWaalsContact CG-OG 3.28Å; D2616-S2618 PolarHBondContact O-N 3.29Å; D2616-S2618 VanDerWaalsContact OD1-CB 3.28Å; D2616-S2618 WeakPolarHBondContact OD1-CB 3.19Å; D2616-S2618 PolarHBondContact OD1-N 2.88Å; D2616-S2618 PolarHBondContact OD1-OG 3.39Å; D2616-S2618 PolarHBondContact OD2-OG 2.75Å; S2618-R2620 PolarHBondContact OG-NE 3.33Å; S2618-V2633 VanDerWaalsContact CA-O 3.24Å; S2618-V2633 WeakPolarHBondContact CA-O 3.41Å; S2618-V2633 WeakPolarHBondContact CB-O 3.45Å
2619	F	95.9	Very high	91.7	Very high	3 Å²	3	42.3 Å²	42.3	1%	0.013	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	148.9	151.1	68.4	-91.6	0	0	0	109.2	I2610 L2611 C2612 V2633 L2643 L2656 W2668 I2677	I2610-F2619 HydrophobicContact CG2-CD2 3.75Å; I2610-F2619 HydrophobicContact CG2-CE2 4.32Å; L2611-F2619 CarbonylContact O-C 3.56Å; L2611-F2619 VanDerWaalsContact O-CA 3.32Å; L2611-F2619 WeakPolarHBondContact O-CA 3.42Å; L2611-F2619 WeakPolarHBondContact O-CB 3.39Å; C2612-F2619 HydrophobicContact CB-CB 3.89Å; F2619-V2633 HydrophobicContact CD1-CB 4.18Å; F2619-V2633 HydrophobicContact CD1-CG1 4.42Å; F2619-V2633 HydrophobicContact CD2-CB 4.17Å; F2619-V2633 HydrophobicContact CD2-CG2 4.39Å; F2619-V2633 HydrophobicContact CE1-CB 3.75Å; F2619-V2633 HydrophobicContact CE1-CG1 3.59Å; F2619-V2633 HydrophobicContact CE2-CB 3.74Å; F2619-V2633 HydrophobicContact CE2-CG1 4.15Å; F2619-V2633 HydrophobicContact CE2-CG2 3.79Å; F2619-V2633 HydrophobicContact CG-CB 4.38Å; F2619-V2633 HydrophobicContact CZ-CB 3.53Å; F2619-V2633 HydrophobicContact CZ-CG1 3.44Å; F2619-V2633 VanDerWaalsContact CZ-CG1 3.44Å; F2619-V2633 HydrophobicContact CZ-CG2 3.94Å; F2619-V2633 PolarHBondContact N-O 2.96Å; F2619-V2633 VanDerWaalsContact N-O 3.14Å; F2619-V2633 PolarHBondContact O-N 3.33Å; F2619-L2643 HydrophobicContact CB-CD1 4.35Å; F2619-L2643 HydrophobicContact CB-CD2 4.21Å; F2619-L2643 HydrophobicContact CD1-CD2 4.48Å; F2619-L2643 HydrophobicContact CD2-CD2 4.36Å; F2619-L2643 HydrophobicContact CG-CD2 4.11Å; F2619-L2656 HydrophobicContact CD2-CD2 4.32Å; F2619-L2656 HydrophobicContact CE2-CD2 3.59Å; F2619-L2656 HydrophobicContact CZ-CD2 4.04Å; F2619-W2668 HydrophobicContact CE1-CD2 4.17Å; F2619-W2668 AromaticContact CE1-CE2 3.61Å; F2619-W2668 HydrophobicContact CE1-CH2 4.28Å; F2619-W2668 AromaticContact CE1-CZ2 3.7Å; F2619-W2668 HydrophobicContact CE1-CZ2 3.7Å; F2619-W2668 AromaticContact CE1-NE1 3.79Å; F2619-W2668 AromaticContact CZ-CD2 3.96Å; F2619-W2668 HydrophobicContact CZ-CD2 3.96Å; F2619-W2668 AromaticContact CZ-CE2 3.88Å; F2619-W2668 HydrophobicContact CZ-CE3 4.46Å; F2619-W2668 HydrophobicContact CZ-CG 4.19Å; F2619-W2668 HydrophobicContact CZ-CZ2 4.33Å; F2619-W2668 AromaticContact CZ-NE1 4Å; F2619-I2677 HydrophobicContact CE2-CG1 4.18Å; F2619-I2677 HydrophobicContact CZ-CG1 4.33Å
2620	R	95	Very high	91.7	Very high	33 Å²	33	44.3 Å²	44.3	13%	0.125	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	143.7	-166.5	-62	-171.4	-174.1	179	-1.8	111.2	I2610 L2611 Y2614 D2616 S2618 F2622 L2629 Q2631 A2632	I2610-R2620 CarbonylContact C-O 3.54Å; I2610-R2620 VanDerWaalsContact CA-O 3.29Å; I2610-R2620 WeakPolarHBondContact CA-O 3.43Å; L2611-R2620 PolarHBondContact N-O 3.21Å; L2611-R2620 PolarHBondContact O-N 3.28Å; Y2614-R2620 HydrophobicContact CD2-CB 4.43Å; Y2614-R2620 HydrophobicContact CD2-CG 3.82Å; Y2614-R2620 HydrophobicContact CE2-CB 3.72Å; Y2614-R2620 HydrophobicContact CE2-CG 3.55Å; D2616-R2620 IonicContact OD1-NH2 3.87Å; D2616-R2620 IonicContact OD2-CZ 3.71Å; D2616-R2620 IonicContact OD2-NE 3.92Å; D2616-R2620 IonicContact OD2-NH2 2.72Å; D2616-R2620 PolarHBondContact OD2-NH2 3.39Å; S2618-R2620 PolarHBondContact OG-NE 3.33Å; R2620-F2622 HydrophobicContact CB-CD2 4.31Å; R2620-F2622 HydrophobicContact CB-CE2 3.55Å; R2620-F2622 HydrophobicContact CB-CZ 4.06Å; R2620-L2629 HydrophobicContact CB-CD1 3.73Å; R2620-L2629 HydrophobicContact CG-CD1 4.17Å; R2620-Q2631 WeakPolarHBondContact CA-O 3.42Å; R2620-A2632 HydrophobicContact CG-CB 4.01Å
2621	I	95	Very high	91.6	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121.6	-177.7	-52	172.4	0	0	0	107.5	A2608 I2610 I2630 Q2631 V2633 F2670 I2677	A2608-I2621 HydrophobicContact CB-CG2 3.88Å; I2610-I2621 HydrophobicContact CD1-CG1 4.45Å; I2610-I2621 HydrophobicContact CG1-CG1 4.17Å; I2610-I2621 HydrophobicContact CG1-CG2 4.25Å; I2610-I2621 HydrophobicContact CG2-CG1 4.17Å; I2621-I2630 HydrophobicContact CB-CB 4.48Å; I2621-I2630 HydrophobicContact CG2-CB 4.27Å; I2621-I2630 HydrophobicContact CG2-CD1 4.34Å; I2621-I2630 WeakPolarHBondContact O-CA 3.02Å; I2621-I2630 WeakPolarHBondContact O-CB 3.43Å; I2621-I2630 PolarHBondContact O-N 3.2Å; I2621-Q2631 HydrophobicContact CB-CB 4.45Å; I2621-Q2631 HydrophobicContact CD1-CB 4.11Å; I2621-Q2631 PolarHBondContact N-O 2.96Å; I2621-Q2631 PolarHBondContact O-N 2.9Å; I2621-V2633 HydrophobicContact CD1-CG2 4.39Å; I2621-F2670 HydrophobicContact CD1-CD2 4.33Å; I2621-F2670 HydrophobicContact CD1-CE2 4Å; I2621-F2670 HydrophobicContact CG2-CE2 4.18Å; I2621-I2677 HydrophobicContact CD1-CG1 3.9Å
2622	F	92.7	Very high	91.5	Very high	9 Å²	9	47.4 Å²	47.4	4%	0.039	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	145.1	179.7	-65	-92.9	0	0	0	111	L2585 A2608 V2609 L2611 Y2614 R2620 G2627 R2628 L2629	L2585-F2622 HydrophobicContact CB-CE2 4.49Å; L2585-F2622 HydrophobicContact CD2-CB 4.02Å; L2585-F2622 HydrophobicContact CD2-CD1 4.29Å; L2585-F2622 HydrophobicContact CD2-CD2 4.1Å; L2585-F2622 HydrophobicContact CD2-CG 3.89Å; L2585-F2622 WeakPolarHBondContact O-CZ 3.36Å; A2608-F2622 CarbonylContact C-O 3.59Å; A2608-F2622 WeakPolarHBondContact CA-O 3.43Å; A2608-F2622 VanDerWaalsContact CB-O 3.31Å; A2608-F2622 WeakPolarHBondContact CB-O 3.27Å; V2609-F2622 PolarHBondContact N-O 3.13Å; V2609-F2622 PolarHBondContact O-N 3.31Å; L2611-F2622 HydrophobicContact CD1-CD2 3.87Å; L2611-F2622 HydrophobicContact CD1-CE2 4.33Å; Y2614-F2622 VanDerWaalsContact OH-CE2 3.28Å; Y2614-F2622 WeakPolarHBondContact OH-CE2 3.24Å; Y2614-F2622 WeakPolarHBondContact OH-CZ 3.46Å; R2620-F2622 HydrophobicContact CB-CD2 4.31Å; R2620-F2622 HydrophobicContact CB-CE2 3.55Å; R2620-F2622 HydrophobicContact CB-CZ 4.06Å; F2622-G2627 WeakPolarHBondContact CD1-O 3.35Å; F2622-R2628 CarbonylContact C-O 3.56Å; F2622-R2628 VanDerWaalsContact CA-O 3.3Å; F2622-R2628 WeakPolarHBondContact CA-O 3.46Å; F2622-L2629 HydrophobicContact CD1-CB 4.09Å; F2622-L2629 HydrophobicContact CD1-CD1 4.32Å; F2622-L2629 HydrophobicContact CE1-CB 3.84Å; F2622-L2629 HydrophobicContact CE1-CD1 3.92Å; F2622-L2629 HydrophobicContact CE1-CG 4.47Å; F2622-L2629 HydrophobicContact CE2-CD1 4.26Å; F2622-L2629 HydrophobicContact CZ-CD1 3.89Å
2623	G	91.1	Very high	91.5	Very high	3 Å²	3	47.4 Å²	47.4	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	130.2	171.1	0	0	0	0	0	111	N2625 G2627 R2628	G2623-N2625 VanDerWaalsContact C-N 3.29Å; G2623-N2625 PolarHBondContact O-N 3.02Å; G2623-G2627 VanDerWaalsContact O-CA 3.24Å; G2623-G2627 WeakPolarHBondContact O-CA 3.41Å; G2623-G2627 PolarHBondContact O-N 3.18Å; G2623-R2628 PolarHBondContact N-O 3.13Å
2624	S	86.4	Confident	91.6	Very high	20 Å²	20	53.1 Å²	53.1	14%	0.14	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-34.4	-179.3	57.2	0	0	0	0	113	S2606 R2607	S2606-S2624 VanDerWaalsContact O-CB 3.29Å; S2606-S2624 WeakPolarHBondContact O-CB 3.33Å; S2606-S2624 PolarHBondContact O-OG 2.81Å; R2607-S2624 VanDerWaalsContact C-OG 3.23Å; R2607-S2624 WeakPolarHBondContact CA-OG 3.08Å; R2607-S2624 PolarHBondContact O-N 3.24Å; R2607-S2624 PolarHBondContact O-OG 3.48Å; R2607-S2624 VanDerWaalsContact O-OG 3.08Å
2625	N	81.8	Confident	91.5	Very high	116 Å²	116	55.4 Å²	55.4	62%	0.62	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-39.3	-174.8	61.5	-11.4	0	0	0	113.5	R2583 G2623	R2583-N2625 PolarHBondContact NE-O 2.95Å; R2583-N2625 PolarHBondContact NH1-O 2.96Å; R2583-N2625 PolarHBondContact NH2-O 3.16Å; G2623-N2625 VanDerWaalsContact C-N 3.29Å; G2623-N2625 PolarHBondContact O-N 3.02Å
2626	N	81.4	Confident	91.8	Very high	66 Å²	66	48 Å²	48	35%	0.353	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-12.6	-172.6	62.5	14.2	0	0	0	113.3	R2583 R2628	R2583-N2626 PolarHBondContact NH1-O 3.24Å; N2626-R2628 HydrophobicContact CB-CG 4.13Å; N2626-R2628 PolarHBondContact O-N 3.47Å; N2626-R2628 WeakPolarHBondContact OD1-CB 3.02Å; N2626-R2628 PolarHBondContact OD1-N 2.82Å
2627	G	80.9	Confident	91.9	Very high	17 Å²	17	49.3 Å²	49.3	18%	0.175	26%	0.258	C	S	.	.			trans	67	11.3	-174.4	0	0	0	0	0	113.7	F2622 G2623	F2622-G2627 WeakPolarHBondContact CD1-O 3.35Å; G2623-G2627 VanDerWaalsContact O-CA 3.24Å; G2623-G2627 WeakPolarHBondContact O-CA 3.41Å; G2623-G2627 PolarHBondContact O-N 3.18Å
2628	R	89	Confident	92	Very high	183 Å²	183	46.1 Å²	46.1	69%	0.691	25%	0.251	S	S	*	.			trans	-79	139.4	-178.2	-68.4	-173.9	175.6	-177.5	-2.1	110.3	F2622 G2623 N2626 I2630	F2622-R2628 CarbonylContact C-O 3.56Å; F2622-R2628 VanDerWaalsContact CA-O 3.3Å; F2622-R2628 WeakPolarHBondContact CA-O 3.46Å; G2623-R2628 PolarHBondContact N-O 3.13Å; N2626-R2628 HydrophobicContact CB-CG 4.13Å; N2626-R2628 PolarHBondContact O-N 3.47Å; N2626-R2628 WeakPolarHBondContact OD1-CB 3.02Å; N2626-R2628 PolarHBondContact OD1-N 2.82Å; R2628-I2630 PolarHBondContact O-N 3.36Å
2629	L	91.3	Very high	92.1	Very high	87 Å²	87	46.6 Å²	46.6	46%	0.455	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	118.8	170.5	-178.9	65.2	0	0	0	109.6	R2620 F2622 Q2631	R2620-L2629 HydrophobicContact CB-CD1 3.73Å; R2620-L2629 HydrophobicContact CG-CD1 4.17Å; F2622-L2629 HydrophobicContact CD1-CB 4.09Å; F2622-L2629 HydrophobicContact CD1-CD1 4.32Å; F2622-L2629 HydrophobicContact CE1-CB 3.84Å; F2622-L2629 HydrophobicContact CE1-CD1 3.92Å; F2622-L2629 HydrophobicContact CE1-CG 4.47Å; F2622-L2629 HydrophobicContact CE2-CD1 4.26Å; F2622-L2629 HydrophobicContact CZ-CD1 3.89Å; L2629-Q2631 WeakPolarHBondContact CD1-O 3.08Å
2630	I	92.5	Very high	92.2	Very high	42 Å²	42	46.4 Å²	46.4	22%	0.215	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-44.4	174.8	-63.7	172.4	0	0	0	110	A2608 I2621 R2628 S2675 R2676	A2608-I2630 HydrophobicContact CB-CD1 4.18Å; I2621-I2630 HydrophobicContact CB-CB 4.48Å; I2621-I2630 HydrophobicContact CG2-CB 4.27Å; I2621-I2630 HydrophobicContact CG2-CD1 4.34Å; I2621-I2630 WeakPolarHBondContact O-CA 3.02Å; I2621-I2630 WeakPolarHBondContact O-CB 3.43Å; I2621-I2630 PolarHBondContact O-N 3.2Å; R2628-I2630 PolarHBondContact O-N 3.36Å; I2630-S2675 WeakPolarHBondContact CG2-O 3.41Å; I2630-R2676 HydrophobicContact CG2-CG 3.54Å; I2630-R2676 PolarHBondContact O-NE 3.27Å; I2630-R2676 PolarHBondContact O-NH2 3.21Å
2631	Q	93.9	Very high	92.3	Very high	31 Å²	31	45.2 Å²	45.2	15%	0.145	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	138.5	-176.7	-174.1	177.3	18.5	0	0	110.3	R2620 I2621 L2629 V2633 R2676 I2677	R2620-Q2631 WeakPolarHBondContact CA-O 3.42Å; I2621-Q2631 HydrophobicContact CB-CB 4.45Å; I2621-Q2631 HydrophobicContact CD1-CB 4.11Å; I2621-Q2631 PolarHBondContact N-O 2.96Å; I2621-Q2631 PolarHBondContact O-N 2.9Å; L2629-Q2631 WeakPolarHBondContact CD1-O 3.08Å; Q2631-V2633 HydrophobicContact CG-CG2 3.93Å; Q2631-R2676 HydrophobicContact CB-CG 4.29Å; Q2631-R2676 VanDerWaalsContact OE1-CB 3.29Å; Q2631-I2677 PolarHBondContact NE2-O 3.1Å
2632	A	93.7	Very high	92.4	Very high	34 Å²	34	45.2 Å²	45.2	28%	0.281	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	134.2	161.3	0	0	0	0	0	108.4	R2620 F2634	R2620-A2632 HydrophobicContact CG-CB 4.01Å; A2632-F2634 HydrophobicContact CB-CE2 3.91Å; A2632-F2634 HydrophobicContact CB-CZ 4.42Å
2633	V	95.5	Very high	92.7	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.012	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	125.2	-176.1	-176.4	0	0	0	0	108.9	S2618 F2619 I2621 Q2631 W2668 I2677 P2684	S2618-V2633 VanDerWaalsContact CA-O 3.24Å; S2618-V2633 WeakPolarHBondContact CA-O 3.41Å; S2618-V2633 WeakPolarHBondContact CB-O 3.45Å; F2619-V2633 HydrophobicContact CD1-CB 4.18Å; F2619-V2633 HydrophobicContact CD1-CG1 4.42Å; F2619-V2633 HydrophobicContact CD2-CB 4.17Å; F2619-V2633 HydrophobicContact CD2-CG2 4.39Å; F2619-V2633 HydrophobicContact CE1-CB 3.75Å; F2619-V2633 HydrophobicContact CE1-CG1 3.59Å; F2619-V2633 HydrophobicContact CE2-CB 3.74Å; F2619-V2633 HydrophobicContact CE2-CG1 4.15Å; F2619-V2633 HydrophobicContact CE2-CG2 3.79Å; F2619-V2633 HydrophobicContact CG-CB 4.38Å; F2619-V2633 HydrophobicContact CZ-CB 3.53Å; F2619-V2633 HydrophobicContact CZ-CG1 3.44Å; F2619-V2633 VanDerWaalsContact CZ-CG1 3.44Å; F2619-V2633 HydrophobicContact CZ-CG2 3.94Å; F2619-V2633 PolarHBondContact N-O 2.96Å; F2619-V2633 VanDerWaalsContact N-O 3.14Å; F2619-V2633 PolarHBondContact O-N 3.33Å; I2621-V2633 HydrophobicContact CD1-CG2 4.39Å; Q2631-V2633 HydrophobicContact CG-CG2 3.93Å; V2633-W2668 HydrophobicContact CG1-CE3 4.14Å; V2633-W2668 HydrophobicContact CG1-CH2 4.02Å; V2633-W2668 HydrophobicContact CG1-CZ3 3.73Å; V2633-I2677 HydrophobicContact CG2-CB 4.24Å; V2633-I2677 HydrophobicContact CG2-CG1 3.97Å; V2633-P2684 HydrophobicContact CG1-CB 4.49Å
2634	F	95	Very high	93	Very high	122 Å²	122	45.4 Å²	45.4	54%	0.535	25%	0.251	S	S	.	.			trans	-114.2	143.6	178.9	-62.2	-92	0	0	0	109.3	D2616 A2632	D2616-F2634 HydrophobicContact CB-CE1 4.29Å; A2632-F2634 HydrophobicContact CB-CE2 3.91Å; A2632-F2634 HydrophobicContact CB-CZ 4.42Å
2635	G	93.1	Very high	93.4	Very high	47 Å²	47	46.7 Å²	46.7	49%	0.485	25%	0.252	S	S	.	.			trans	176.2	-32.8	176	0	0	0	0	0	114	M2666	G2635-M2666 WeakPolarHBondContact O-CE 3.42Å
2636	H	97.6	Very high	94	Very high	14 Å²	14	41.3 Å²	41.3	7%	0.065	22%	0.223	C	C	.	.			trans	-70.8	150.7	172.7	-80.5	-74.3	0	0	0	112.3	D2638 V2640 S2658 S2660 D2662 T2664 M2666	H2636-D2638 WeakPolarHBondContact CB-O 3.35Å; H2636-V2640 HydrophobicContact CB-CG2 4.05Å; H2636-S2658 PolarHBondContact CD2-OG 2.89Å; H2636-S2658 PolarHBondContact NE2-O 2.91Å; H2636-S2658 PolarHBondContact NE2-OG 2.74Å; H2636-S2660 WeakPolarHBondContact ND1-CB 3.29Å; H2636-D2662 WeakPolarHBondContact CA-OD2 3.4Å; H2636-D2662 WeakPolarHBondContact CB-OD2 3.43Å; H2636-D2662 IonicContact CE1-OD1 3.41Å; H2636-D2662 IonicContact CE1-OD2 3.45Å; H2636-D2662 IonicContact CG-OD2 2.81Å; H2636-D2662 IonicContact ND1-OD1 2.77Å; H2636-D2662 PolarHBondContact ND1-OD1 2.87Å; H2636-D2662 IonicContact ND1-OD2 3.95Å; H2636-D2662 PolarHBondContact ND1-OD2 2.94Å; H2636-T2664 PolarHBondContact CE1-OG1 3.42Å; H2636-T2664 VanDerWaalsContact CE1-OG1 3.29Å; H2636-T2664 PolarHBondContact ND1-OG1 3.49Å; H2636-M2666 VanDerWaalsContact CE1-CG 3.48Å; H2636-M2666 WeakPolarHBondContact CE1-CG 3.21Å
2637	S	97.2	Very high	94.3	Very high	82 Å²	82	40.4 Å²	40.4	57%	0.573	22%	0.217	S	C	*	.	S	Bend	trans	-89.3	-9.2	178.6	59.7	0	0	0	0	113.1	R2617 D2662	R2617-S2637 WeakPolarHBondContact CD-O 3.39Å; R2617-S2637 VanDerWaalsContact CZ-O 3.31Å; R2617-S2637 PolarHBondContact NE-O 3.44Å; R2617-S2637 PolarHBondContact NH1-O 3.19Å; S2637-D2662 PolarHBondContact N-OD2 3.06Å; S2637-D2662 WeakPolarHBondContact OG-CB 3.43Å; S2637-D2662 PolarHBondContact OG-OD2 2.88Å
2638	D	97.3	Very high	94	Very high	58 Å²	58	41.3 Å²	41.3	31%	0.31	22%	0.221	S	C	.	.	S	Bend	trans	-142.8	-179.5	173.5	-155.3	-14.4	0	0	0	110.8	H2636 V2640 S2660 R2661 D2662	H2636-D2638 WeakPolarHBondContact CB-O 3.35Å; D2638-V2640 PolarHBondContact O-N 2.73Å; D2638-S2660 VanDerWaalsContact C-OG 3.23Å; D2638-S2660 PolarHBondContact O-OG 2.91Å; D2638-R2661 HydrophobicContact CB-CB 3.94Å; D2638-R2661 WeakPolarHBondContact OD2-CB 3.41Å; D2638-D2662 HydrophobicContact CB-CB 3.91Å
2639	I	97.5	Very high	92.7	Very high	9 Å²	9	36.2 Å²	36.2	5%	0.046	21%	0.205	C	C	.	.			trans	-60.9	128.6	-173.6	-66.7	157	0	0	0	111.6	D2590 L2593 T2641 S2660 R2661	D2590-I2639 HydrophobicContact CB-CD1 3.79Å; D2590-I2639 HydrophobicContact CB-CG2 4.46Å; D2590-I2639 VanDerWaalsContact CG-CD1 3.48Å; D2590-I2639 WeakPolarHBondContact OD2-CD1 3.26Å; L2593-I2639 HydrophobicContact CD2-CG2 4.44Å; I2639-T2641 PolarHBondContact O-N 2.9Å; I2639-S2660 WeakPolarHBondContact O-CA 3.35Å; I2639-S2660 PolarHBondContact O-OG 2.94Å; I2639-S2660 VanDerWaalsContact O-OG 3.05Å; I2639-R2661 PolarHBondContact O-N 3.38Å
2640	V	98	Very high	90.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	115.3	173.6	-174.4	0	0	0	0	109.7	C2612 G2613 H2636 D2638 L2643 G2659	C2612-V2640 HydrophobicContact CB-CB 3.8Å; C2612-V2640 HydrophobicContact CB-CG1 3.5Å; C2612-V2640 VanDerWaalsContact CB-CG1 3.5Å; C2612-V2640 WeakPolarHBondContact CB-O 3.41Å; C2612-V2640 PolarHBondContact SG-O 2.99Å; C2612-V2640 VanDerWaalsContact SG-O 3.38Å; G2613-V2640 WeakPolarHBondContact CA-O 3.46Å; G2613-V2640 PolarHBondContact N-O 2.95Å; H2636-V2640 HydrophobicContact CB-CG2 4.05Å; D2638-V2640 PolarHBondContact O-N 2.73Å; V2640-L2643 HydrophobicContact CG1-CD2 4.26Å; V2640-G2659 CarbonylContact C-O 3.46Å; V2640-G2659 WeakPolarHBondContact CA-O 3.27Å; V2640-G2659 WeakPolarHBondContact CG1-O 3.39Å
2641	T	97.4	Very high	89.4	Confident	8 Å²	8	41 Å²	41	5%	0.049	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-29.4	-172	54.7	0	0	0	0	113.7	L2593 Q2599 I2639 G2659 R2661 I2697	L2593-T2641 HydrophobicContact CD1-CG2 4.16Å; Q2599-T2641 WeakPolarHBondContact CG-O 3.33Å; I2639-T2641 PolarHBondContact O-N 2.9Å; T2641-G2659 PolarHBondContact N-O 2.95Å; T2641-G2659 PolarHBondContact OG1-O 2.92Å; T2641-R2661 HydrophobicContact CG2-CG 3.57Å; T2641-I2697 WeakPolarHBondContact CB-O 3.22Å; T2641-I2697 PolarHBondContact OG1-O 3.04Å
2642	C	97.9	Very high	88.4	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	157.1	-177	55.4	0	0	0	0	112.7	N2598 S2658 G2659	N2598-C2642 HydrophobicContact CB-CB 3.88Å; N2598-C2642 CarbonylContact O-C 3.48Å; N2598-C2642 VanDerWaalsContact O-CA 3.3Å; N2598-C2642 WeakPolarHBondContact O-CA 3.5Å; C2642-S2658 WeakPolarHBondContact O-CA 3.49Å; C2642-G2659 PolarHBondContact N-O 2.96Å; C2642-G2659 PolarHBondContact O-N 2.91Å
2643	L	98.4	Very high	88.1	Confident	7 Å²	7	47.7 Å²	47.7	4%	0.037	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	147.8	-180	-67.5	171	0	0	0	110.3	N2598 V2601 I2610 C2612 F2619 V2640 A2657	N2598-L2643 PolarHBondContact O-N 2.97Å; V2601-L2643 HydrophobicContact CG2-CB 3.74Å; I2610-L2643 HydrophobicContact CB-CD1 4.42Å; I2610-L2643 HydrophobicContact CG2-CD1 3.78Å; C2612-L2643 HydrophobicContact CB-CD1 3.76Å; C2612-L2643 HydrophobicContact CB-CD2 4.37Å; C2612-L2643 HydrophobicContact CB-CG 3.84Å; F2619-L2643 HydrophobicContact CB-CD1 4.35Å; F2619-L2643 HydrophobicContact CB-CD2 4.21Å; F2619-L2643 HydrophobicContact CD1-CD2 4.48Å; F2619-L2643 HydrophobicContact CD2-CD2 4.36Å; F2619-L2643 HydrophobicContact CG-CD2 4.11Å; V2640-L2643 HydrophobicContact CG1-CD2 4.26Å; L2643-A2657 CarbonylContact C-O 3.32Å; L2643-A2657 WeakPolarHBondContact CA-O 3.24Å
2644	A	97.7	Very high	87.8	Confident	9 Å²	9	48 Å²	48	7%	0.074	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	145.6	171.3	0	0	0	0	0	110.7	L2656 A2657 I2700 L2702	A2644-L2656 CarbonylContact O-C 3.59Å; A2644-L2656 WeakPolarHBondContact O-CA 3.39Å; A2644-L2656 WeakPolarHBondContact O-CD1 3.49Å; A2644-A2657 PolarHBondContact N-O 2.97Å; A2644-A2657 PolarHBondContact O-N 3.46Å; A2644-I2700 HydrophobicContact CB-CB 4.13Å; A2644-I2700 HydrophobicContact CB-CG2 3.77Å; A2644-L2702 HydrophobicContact CB-CB 4.06Å
2645	R	95.2	Very high	87.7	Confident	47 Å²	47	45.1 Å²	45.1	18%	0.177	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	138.7	178	-167	-176.7	67.5	67.3	7.6	109.5	V2601 V2602 H2654 L2656	V2601-R2645 HydrophobicContact CG1-CB 3.59Å; V2601-R2645 HydrophobicContact CG1-CG 4.21Å; V2602-R2645 PolarHBondContact O-NE 2.9Å; R2645-H2654 VanDerWaalsContact CD-NE2 3.27Å; R2645-H2654 WeakPolarHBondContact CD-NE2 3.46Å; R2645-H2654 WeakPolarHBondContact CG-CD2 3.38Å; R2645-H2654 WeakPolarHBondContact CG-NE2 3.44Å; R2645-L2656 HydrophobicContact CB-CD1 4.27Å
2646	S	93.8	Very high	87.8	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.014	22%	0.221	C	C	.	.			trans	-70.3	166.4	170.6	75.4	0	0	0	0	111.7	Y2655 L2702	S2646-Y2655 PolarHBondContact N-O 2.81Å; S2646-Y2655 PolarHBondContact OG-N 2.77Å; S2646-Y2655 PolarHBondContact OG-O 2.85Å; S2646-L2702 WeakPolarHBondContact CA-O 3.42Å
2647	E	88	Confident	87.8	Confident	47 Å²	47	42.2 Å²	42.2	22%	0.22	22%	0.218	C	C	.	.			trans	-56.1	148.2	161.8	-46.5	86.5	166.3	0	0	109.9	S2703 A2704 Y2767	E2647-S2703 PolarHBondContact OE1-OG 3.41Å; E2647-S2703 WeakPolarHBondContact OE2-CA 3.47Å; E2647-S2703 PolarHBondContact OE2-OG 3.04Å; E2647-A2704 PolarHBondContact OE2-N 3.19Å; E2647-Y2767 WeakPolarHBondContact OE1-CE2 3.47Å; E2647-Y2767 PolarHBondContact OE1-OH 3.2Å; E2647-Y2767 PolarHBondContact OE2-OH 3.33Å
2648	C	74.3	Confident	87.9	Confident	37 Å²	37	38.3 Å²	38.3	25%	0.25	19%	0.19	C	C	.	.			trans	-115.2	113	173.5	-166.8	0	0	0	0	107	A2604 H2654	A2604-C2648 HydrophobicContact CB-CB 3.67Å; C2648-H2654 HydrophobicContact CB-CB 4.03Å
2649	H	60.5	Low	87.9	Confident	76 Å²	76	35.5 Å²	35.5	35%	0.352	18%	0.176	S	C	.	.			trans	-80.7	-178.9	163.6	-59.7	-72.3	0	0	0	108.2	D1890 R2089 S2651	D1890-H2649 IonicContact OD2-CE1 3.26Å; D1890-H2649 PolarHBondContact OD2-CE1 2.99Å; D1890-H2649 IonicContact OD2-ND1 2.87Å; D1890-H2649 IonicContact OD2-NE2 3.48Å; D1890-H2649 PolarHBondContact OD2-NE2 3.01Å; R2089-H2649 PolarHBondContact NH2-CD2 2.88Å; R2089-H2649 PolarHBondContact NH2-NE2 2.82Å; R2089-H2649 VanDerWaalsContact NH2-NE2 3.17Å; H2649-S2651 PolarHBondContact O-N 2.9Å; H2649-S2651 PolarHBondContact O-OG 2.89Å
2650	L	54.8	Low	88	Confident	170 Å²	170	35.1 Å²	35.1	89%	0.89	17%	0.173	S	C	*	.	S	Bend	trans	-52.5	3.4	177.9	-67.8	145.8	0	0	0	115.1
2651	S	60.3	Low	88	Confident	60 Å²	60	38.2 Å²	38.2	42%	0.42	19%	0.185	S	C	.	.	S	Bend	trans	-62	141.9	166.1	53.5	0	0	0	0	111.8	H2649 Y2653	H2649-S2651 PolarHBondContact O-N 2.9Å; H2649-S2651 PolarHBondContact O-OG 2.89Å; S2651-Y2653 PolarHBondContact O-N 3.19Å; S2651-Y2653 VanDerWaalsContact O-N 3.1Å; S2651-Y2653 PolarHBondContact OG-O 3.49Å
2652	Q	74	Confident	88	Confident	108 Å²	108	39.1 Å²	39.1	51%	0.505	19%	0.19	S	C	.	.	S	Bend	trans	-69.9	-1.7	173.2	-62.1	174.5	9.2	0	0	112.8	S2671 V2672	Q2652-S2671 CarbonylContact O-C 3.53Å; Q2652-S2671 WeakPolarHBondContact O-CA 3.5Å; Q2652-V2672 PolarHBondContact O-N 2.86Å
2653	Y	86.1	Confident	88	Confident	97 Å²	97	40.5 Å²	40.5	38%	0.38	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	147.3	-173.6	-55.4	-85.2	0	0	0	111.3	S2651 M2669 F2670 V2678	S2651-Y2653 PolarHBondContact O-N 3.19Å; S2651-Y2653 VanDerWaalsContact O-N 3.1Å; S2651-Y2653 PolarHBondContact OG-O 3.49Å; Y2653-M2669 HydrophobicContact CD1-CG 3.96Å; Y2653-M2669 HydrophobicContact CD1-SD 3.95Å; Y2653-M2669 HydrophobicContact CG-CG 4.39Å; Y2653-M2669 HydrophobicContact CG-SD 4.26Å; Y2653-F2670 VanDerWaalsContact CA-O 3.24Å; Y2653-F2670 WeakPolarHBondContact CA-O 3.22Å; Y2653-V2678 HydrophobicContact CD1-CG2 4.25Å; Y2653-V2678 HydrophobicContact CE1-CG2 3.85Å
2654	H	89.1	Confident	88	Confident	7 Å²	7	41.2 Å²	41.2	3%	0.032	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	163.7	166.9	60.8	-100.6	0	0	0	110.1	R2645 C2648 F2670 V2672	R2645-H2654 VanDerWaalsContact CD-NE2 3.27Å; R2645-H2654 WeakPolarHBondContact CD-NE2 3.46Å; R2645-H2654 WeakPolarHBondContact CG-CD2 3.38Å; R2645-H2654 WeakPolarHBondContact CG-NE2 3.44Å; C2648-H2654 HydrophobicContact CB-CB 4.03Å; H2654-F2670 AromaticContact CE1-CD1 3Å; H2654-F2670 WeakPolarHBondContact CE1-CD1 3.37Å; H2654-F2670 AromaticContact CE1-CE1 3.64Å; H2654-F2670 AromaticContact CE1-CG 3.6Å; H2654-F2670 PolarHBondContact N-O 2.9Å; H2654-F2670 VanDerWaalsContact N-O 3.09Å; H2654-F2670 AromaticContact ND1-CD1 3.81Å; H2654-F2670 WeakPolarHBondContact NE2-CB 3.47Å; H2654-F2670 AromaticContact NE2-CD1 3.41Å; H2654-F2670 WeakPolarHBondContact NE2-CD1 3.36Å; H2654-F2670 AromaticContact NE2-CG 3.48Å; H2654-F2670 WeakPolarHBondContact NE2-CG 3.45Å; H2654-F2670 PolarHBondContact O-N 2.79Å; H2654-V2672 WeakPolarHBondContact ND1-CG2 3.49Å
2655	Y	92.8	Very high	88	Confident	62 Å²	62	40.8 Å²	40.8	24%	0.243	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	142.8	176	-63.8	-72.6	0	0	0	111	S2646 L2667 W2668 L2687 A2704	S2646-Y2655 PolarHBondContact N-O 2.81Å; S2646-Y2655 PolarHBondContact OG-N 2.77Å; S2646-Y2655 PolarHBondContact OG-O 2.85Å; Y2655-L2667 HydrophobicContact CD1-CD1 4.45Å; Y2655-L2667 HydrophobicContact CD1-CD2 3.89Å; Y2655-L2667 HydrophobicContact CD1-CG 4.08Å; Y2655-L2667 HydrophobicContact CE1-CD2 4.16Å; Y2655-L2667 HydrophobicContact CG-CD2 4.5Å; Y2655-W2668 WeakPolarHBondContact CA-O 3.42Å; Y2655-L2687 HydrophobicContact CD1-CD1 3.7Å; Y2655-L2687 HydrophobicContact CE1-CD1 3.46Å; Y2655-L2687 VanDerWaalsContact CE1-CD1 3.46Å; Y2655-A2704 HydrophobicContact CD2-CB 4Å; Y2655-A2704 HydrophobicContact CE2-CB 4.45Å
2656	L	96	Very high	88.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	138.6	167.6	-177.3	78.2	0	0	0	107.3	V2601 I2610 F2619 A2644 R2645 L2667 W2668 I2677	V2601-L2656 HydrophobicContact CG1-CD1 4.12Å; I2610-L2656 HydrophobicContact CD1-CD1 4.03Å; I2610-L2656 HydrophobicContact CD1-CD2 4Å; I2610-L2656 HydrophobicContact CG2-CD2 4.33Å; F2619-L2656 HydrophobicContact CD2-CD2 4.32Å; F2619-L2656 HydrophobicContact CE2-CD2 3.59Å; F2619-L2656 HydrophobicContact CZ-CD2 4.04Å; A2644-L2656 CarbonylContact O-C 3.59Å; A2644-L2656 WeakPolarHBondContact O-CA 3.39Å; A2644-L2656 WeakPolarHBondContact O-CD1 3.49Å; R2645-L2656 HydrophobicContact CB-CD1 4.27Å; L2656-L2667 CarbonylContact O-C 3.57Å; L2656-W2668 HydrophobicContact CB-CB 4.3Å; L2656-W2668 PolarHBondContact N-O 2.72Å; L2656-W2668 PolarHBondContact O-N 2.71Å; L2656-I2677 HydrophobicContact CB-CD1 4.41Å; L2656-I2677 HydrophobicContact CD2-CD1 3.86Å
2657	A	98.1	Very high	88.3	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	142.8	171.6	0	0	0	0	0	109.9	L2643 A2644 V2665 M2666 L2667 I2700 L2702 V2709	L2643-A2657 CarbonylContact C-O 3.32Å; L2643-A2657 WeakPolarHBondContact CA-O 3.24Å; A2644-A2657 PolarHBondContact N-O 2.97Å; A2644-A2657 PolarHBondContact O-N 3.46Å; A2657-V2665 HydrophobicContact CB-CG1 4.28Å; A2657-M2666 CarbonylContact C-O 3.59Å; A2657-M2666 VanDerWaalsContact CA-O 3.27Å; A2657-M2666 WeakPolarHBondContact CA-O 3.49Å; A2657-L2667 HydrophobicContact CB-CD1 4.13Å; A2657-I2700 HydrophobicContact CB-CG2 3.91Å; A2657-L2702 HydrophobicContact CB-CB 4.5Å; A2657-L2702 HydrophobicContact CB-CD2 3.92Å; A2657-V2709 HydrophobicContact CB-CG1 4.35Å
2658	S	98.6	Very high	88.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137.7	172.9	62.1	0	0	0	0	110.6	H2636 C2642 V2665 M2666 W2668 I2700	H2636-S2658 PolarHBondContact CD2-OG 2.89Å; H2636-S2658 PolarHBondContact NE2-O 2.91Å; H2636-S2658 PolarHBondContact NE2-OG 2.74Å; C2642-S2658 WeakPolarHBondContact O-CA 3.49Å; S2658-V2665 CarbonylContact O-C 3.47Å; S2658-V2665 VanDerWaalsContact O-CA 3.25Å; S2658-V2665 WeakPolarHBondContact O-CA 3.34Å; S2658-M2666 PolarHBondContact N-O 2.82Å; S2658-M2666 PolarHBondContact O-N 2.83Å; S2658-W2668 PolarHBondContact OG-NE1 3.35Å; S2658-I2700 VanDerWaalsContact C-CD1 3.47Å
2659	G	98.4	Very high	89.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	145.3	175.3	0	0	0	0	0	110	V2640 T2641 C2642	V2640-G2659 CarbonylContact C-O 3.46Å; V2640-G2659 WeakPolarHBondContact CA-O 3.27Å; V2640-G2659 WeakPolarHBondContact CG1-O 3.39Å; T2641-G2659 PolarHBondContact N-O 2.95Å; T2641-G2659 PolarHBondContact OG1-O 2.92Å; C2642-G2659 PolarHBondContact N-O 2.96Å; C2642-G2659 PolarHBondContact O-N 2.91Å
2660	S	98.5	Very high	91	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	165.3	-174	172.5	0	0	0	0	113	H2636 D2638 I2639 D2662 C2663 T2664 I2697	H2636-S2660 WeakPolarHBondContact ND1-CB 3.29Å; D2638-S2660 VanDerWaalsContact C-OG 3.23Å; D2638-S2660 PolarHBondContact O-OG 2.91Å; I2639-S2660 WeakPolarHBondContact O-CA 3.35Å; I2639-S2660 PolarHBondContact O-OG 2.94Å; I2639-S2660 VanDerWaalsContact O-OG 3.05Å; S2660-D2662 VanDerWaalsContact CB-OD1 3.26Å; S2660-D2662 WeakPolarHBondContact CB-OD1 3.41Å; S2660-D2662 PolarHBondContact O-N 2.97Å; S2660-D2662 VanDerWaalsContact OG-CG 3.28Å; S2660-D2662 PolarHBondContact OG-N 3.07Å; S2660-D2662 PolarHBondContact OG-OD1 2.87Å; S2660-D2662 PolarHBondContact OG-OD2 2.71Å; S2660-C2663 PolarHBondContact O-N 3.24Å; S2660-T2664 PolarHBondContact N-O 3.09Å; S2660-I2697 WeakPolarHBondContact O-CG1 3.47Å; S2660-I2697 PolarHBondContact O-N 2.73Å
2661	R	97.7	Very high	92.6	Very high	65 Å²	65	25.7 Å²	25.7	25%	0.245	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-20.1	167.2	-69	-172.5	-178.9	156.7	4.7	112.7	D2590 D2638 I2639 T2641 C2663 S2696	D2590-R2661 IonicContact OD1-CZ 3.44Å; D2590-R2661 IonicContact OD1-NH1 3.63Å; D2590-R2661 PolarHBondContact OD1-NH1 2.9Å; D2590-R2661 IonicContact OD1-NH2 3.57Å; D2590-R2661 PolarHBondContact OD1-NH2 2.77Å; D2590-R2661 IonicContact OD2-NH1 2.99Å; D2590-R2661 PolarHBondContact OD2-NH1 3.18Å; D2638-R2661 HydrophobicContact CB-CB 3.94Å; D2638-R2661 WeakPolarHBondContact OD2-CB 3.41Å; I2639-R2661 PolarHBondContact O-N 3.38Å; T2641-R2661 HydrophobicContact CG2-CG 3.57Å; R2661-C2663 PolarHBondContact O-N 2.84Å; R2661-S2696 WeakPolarHBondContact CA-OG 3.4Å; R2661-S2696 WeakPolarHBondContact CG-OG 3.24Å
2662	D	97.8	Very high	93.9	Very high	27 Å²	27	24 Å²	24	14%	0.144	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	5.4	174.8	69.4	18.8	0	0	0	114.6	H2636 S2637 D2638 S2660 T2664	H2636-D2662 WeakPolarHBondContact CA-OD2 3.4Å; H2636-D2662 WeakPolarHBondContact CB-OD2 3.43Å; H2636-D2662 IonicContact CE1-OD1 3.41Å; H2636-D2662 IonicContact CE1-OD2 3.45Å; H2636-D2662 IonicContact CG-OD2 2.81Å; H2636-D2662 IonicContact ND1-OD1 2.77Å; H2636-D2662 PolarHBondContact ND1-OD1 2.87Å; H2636-D2662 IonicContact ND1-OD2 3.95Å; H2636-D2662 PolarHBondContact ND1-OD2 2.94Å; S2637-D2662 PolarHBondContact N-OD2 3.06Å; S2637-D2662 WeakPolarHBondContact OG-CB 3.43Å; S2637-D2662 PolarHBondContact OG-OD2 2.88Å; D2638-D2662 HydrophobicContact CB-CB 3.91Å; S2660-D2662 VanDerWaalsContact CB-OD1 3.26Å; S2660-D2662 WeakPolarHBondContact CB-OD1 3.41Å; S2660-D2662 PolarHBondContact O-N 2.97Å; S2660-D2662 VanDerWaalsContact OG-CG 3.28Å; S2660-D2662 PolarHBondContact OG-N 3.07Å; S2660-D2662 PolarHBondContact OG-OD1 2.87Å; S2660-D2662 PolarHBondContact OG-OD2 2.71Å; D2662-T2664 VanDerWaalsContact CG-OG1 3.31Å; D2662-T2664 PolarHBondContact O-N 2.55Å; D2662-T2664 WeakPolarHBondContact OD1-CB 3.28Å; D2662-T2664 PolarHBondContact OD1-N 3.45Å; D2662-T2664 PolarHBondContact OD1-OG1 3.37Å; D2662-T2664 PolarHBondContact OD2-OG1 3.49Å
2663	C	97.6	Very high	94.5	Very high	30 Å²	30	25.1 Å²	25.1	20%	0.203	12%	0.117	C	C	.	.	S	Bend	trans	69	10.9	178.9	-46.1	0	0	0	0	114.5	S2660 R2661 H2693 E2694 T2695	S2660-C2663 PolarHBondContact O-N 3.24Å; R2661-C2663 PolarHBondContact O-N 2.84Å; C2663-H2693 HydrophobicContact CB-CB 4.43Å; C2663-H2693 WeakPolarHBondContact CB-O 3.26Å; C2663-H2693 WeakPolarHBondContact O-CB 3.47Å; C2663-E2694 VanDerWaalsContact SG-C 3.51Å; C2663-T2695 WeakPolarHBondContact SG-CA 3.45Å; C2663-T2695 PolarHBondContact SG-N 2.88Å
2664	T	98.1	Very high	94.6	Very high	22 Å²	22	27.9 Å²	27.9	14%	0.135	13%	0.127	C	C	.	.			trans	-107.9	154.7	177.7	72	0	0	0	0	112	H2636 S2660 D2662 I2689	H2636-T2664 PolarHBondContact CE1-OG1 3.42Å; H2636-T2664 VanDerWaalsContact CE1-OG1 3.29Å; H2636-T2664 PolarHBondContact ND1-OG1 3.49Å; S2660-T2664 PolarHBondContact N-O 3.09Å; D2662-T2664 VanDerWaalsContact CG-OG1 3.31Å; D2662-T2664 PolarHBondContact O-N 2.55Å; D2662-T2664 WeakPolarHBondContact OD1-CB 3.28Å; D2662-T2664 PolarHBondContact OD1-N 3.45Å; D2662-T2664 PolarHBondContact OD1-OG1 3.37Å; D2662-T2664 PolarHBondContact OD2-OG1 3.49Å; T2664-I2689 HydrophobicContact CG2-CG2 4.15Å
2665	V	98.5	Very high	94.7	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	126.9	165.4	178.5	0	0	0	0	108.6	A2657 S2658 L2690 I2697 I2700 V2709	A2657-V2665 HydrophobicContact CB-CG1 4.28Å; S2658-V2665 CarbonylContact O-C 3.47Å; S2658-V2665 VanDerWaalsContact O-CA 3.25Å; S2658-V2665 WeakPolarHBondContact O-CA 3.34Å; V2665-L2690 HydrophobicContact CB-CB 4.09Å; V2665-L2690 HydrophobicContact CB-CD1 4.2Å; V2665-L2690 HydrophobicContact CB-CG 4.48Å; V2665-L2690 HydrophobicContact CG1-CD1 3.93Å; V2665-L2690 PolarHBondContact N-O 3.24Å; V2665-L2690 WeakPolarHBondContact O-CA 3.45Å; V2665-L2690 WeakPolarHBondContact O-CB 3.41Å; V2665-L2690 WeakPolarHBondContact O-CG 3.3Å; V2665-L2690 PolarHBondContact O-N 3.3Å; V2665-I2697 HydrophobicContact CG2-CD1 4.06Å; V2665-I2697 HydrophobicContact CG2-CG1 3.93Å; V2665-I2697 HydrophobicContact CG2-CG2 4.21Å; V2665-I2700 HydrophobicContact CB-CD1 4.37Å; V2665-I2700 HydrophobicContact CG1-CD1 3.68Å; V2665-I2700 HydrophobicContact CG1-CG1 4.42Å; V2665-I2700 HydrophobicContact CG2-CD1 3.88Å; V2665-I2700 HydrophobicContact CG2-CG1 4.27Å; V2665-V2709 HydrophobicContact CG1-CG1 4.28Å
2666	M	98.1	Very high	94.6	Very high	12 Å²	12	30.8 Å²	30.8	6%	0.059	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	132.9	176.8	-67.7	-175.8	-175.9	0	0	110.4	G2635 H2636 A2657 S2658 W2668 P2686 F2688 I2689	G2635-M2666 WeakPolarHBondContact O-CE 3.42Å; H2636-M2666 VanDerWaalsContact CE1-CG 3.48Å; H2636-M2666 WeakPolarHBondContact CE1-CG 3.21Å; A2657-M2666 CarbonylContact C-O 3.59Å; A2657-M2666 VanDerWaalsContact CA-O 3.27Å; A2657-M2666 WeakPolarHBondContact CA-O 3.49Å; S2658-M2666 PolarHBondContact N-O 2.82Å; S2658-M2666 PolarHBondContact O-N 2.83Å; M2666-W2668 HydrophobicContact CB-CZ2 3.56Å; M2666-W2668 HydrophobicContact CG-CZ2 4.17Å; M2666-W2668 VanDerWaalsContact O-CD1 3.27Å; M2666-W2668 PolarHBondContact O-NE1 3.48Å; M2666-W2668 HydrophobicContact SD-CH2 3.9Å; M2666-W2668 HydrophobicContact SD-CZ2 3.55Å; M2666-W2668 VanDerWaalsContact SD-CZ2 3.55Å; M2666-P2686 HydrophobicContact CB-CB 4.09Å; M2666-P2686 HydrophobicContact CG-CB 4.39Å; M2666-P2686 HydrophobicContact SD-CB 4.36Å; M2666-P2686 HydrophobicContact SD-CG 4.21Å; M2666-F2688 WeakPolarHBondContact CA-O 3.29Å; M2666-I2689 HydrophobicContact CE-CD1 4.2Å; M2666-I2689 HydrophobicContact CE-CG1 4.3Å; M2666-I2689 HydrophobicContact CE-CG2 4.48Å; M2666-I2689 HydrophobicContact CG-CG1 4.24Å; M2666-I2689 HydrophobicContact CG-CG2 4.48Å
2667	L	96.4	Very high	94.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	133.2	173.5	-165	71	0	0	0	109.5	Y2655 L2656 A2657 P2686 L2687 F2688 L2702 V2709	Y2655-L2667 HydrophobicContact CD1-CD1 4.45Å; Y2655-L2667 HydrophobicContact CD1-CD2 3.89Å; Y2655-L2667 HydrophobicContact CD1-CG 4.08Å; Y2655-L2667 HydrophobicContact CE1-CD2 4.16Å; Y2655-L2667 HydrophobicContact CG-CD2 4.5Å; L2656-L2667 CarbonylContact O-C 3.57Å; A2657-L2667 HydrophobicContact CB-CD1 4.13Å; L2667-P2686 CarbonylContact O-C 3.59Å; L2667-P2686 WeakPolarHBondContact O-CA 3.47Å; L2667-L2687 HydrophobicContact CD2-CD1 4.49Å; L2667-L2687 PolarHBondContact O-N 3.15Å; L2667-F2688 HydrophobicContact CB-CB 4.42Å; L2667-F2688 HydrophobicContact CD2-CD2 4.13Å; L2667-F2688 PolarHBondContact N-O 2.68Å; L2667-L2702 HydrophobicContact CD1-CD1 3.78Å; L2667-L2702 HydrophobicContact CD1-CD2 3.92Å; L2667-V2709 HydrophobicContact CD1-CG2 4.33Å
2668	W	95.2	Very high	94	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	157.6	-175	-45.1	83.9	0	0	0	110.5	F2619 V2633 Y2655 L2656 S2658 M2666 I2677 P2686	F2619-W2668 HydrophobicContact CE1-CD2 4.17Å; F2619-W2668 AromaticContact CE1-CE2 3.61Å; F2619-W2668 HydrophobicContact CE1-CH2 4.28Å; F2619-W2668 AromaticContact CE1-CZ2 3.7Å; F2619-W2668 HydrophobicContact CE1-CZ2 3.7Å; F2619-W2668 AromaticContact CE1-NE1 3.79Å; F2619-W2668 AromaticContact CZ-CD2 3.96Å; F2619-W2668 HydrophobicContact CZ-CD2 3.96Å; F2619-W2668 AromaticContact CZ-CE2 3.88Å; F2619-W2668 HydrophobicContact CZ-CE3 4.46Å; F2619-W2668 HydrophobicContact CZ-CG 4.19Å; F2619-W2668 HydrophobicContact CZ-CZ2 4.33Å; F2619-W2668 AromaticContact CZ-NE1 4Å; V2633-W2668 HydrophobicContact CG1-CE3 4.14Å; V2633-W2668 HydrophobicContact CG1-CH2 4.02Å; V2633-W2668 HydrophobicContact CG1-CZ3 3.73Å; Y2655-W2668 WeakPolarHBondContact CA-O 3.42Å; L2656-W2668 HydrophobicContact CB-CB 4.3Å; L2656-W2668 PolarHBondContact N-O 2.72Å; L2656-W2668 PolarHBondContact O-N 2.71Å; S2658-W2668 PolarHBondContact OG-NE1 3.35Å; M2666-W2668 HydrophobicContact CB-CZ2 3.56Å; M2666-W2668 HydrophobicContact CG-CZ2 4.17Å; M2666-W2668 VanDerWaalsContact O-CD1 3.27Å; M2666-W2668 PolarHBondContact O-NE1 3.48Å; M2666-W2668 HydrophobicContact SD-CH2 3.9Å; M2666-W2668 HydrophobicContact SD-CZ2 3.55Å; M2666-W2668 VanDerWaalsContact SD-CZ2 3.55Å; W2668-I2677 HydrophobicContact CB-CD1 3.95Å; W2668-I2677 HydrophobicContact CB-CG2 4.18Å; W2668-I2677 HydrophobicContact CE3-CG2 4.06Å; W2668-P2686 HydrophobicContact CD2-CB 4.19Å; W2668-P2686 HydrophobicContact CE3-CB 3.95Å; W2668-P2686 HydrophobicContact CH2-CB 4.05Å; W2668-P2686 HydrophobicContact CH2-CG 4.23Å; W2668-P2686 HydrophobicContact CZ2-CB 4.26Å; W2668-P2686 HydrophobicContact CZ3-CB 3.9Å; W2668-P2686 HydrophobicContact CZ3-CG 4.19Å
2669	M	92	Very high	93.1	Very high	48 Å²	48	32.6 Å²	32.6	24%	0.236	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	121	172.7	-168.9	176.1	-66.6	0	0	110.3	Y2653 I2677 V2678 L2687	Y2653-M2669 HydrophobicContact CD1-CG 3.96Å; Y2653-M2669 HydrophobicContact CD1-SD 3.95Å; Y2653-M2669 HydrophobicContact CG-CG 4.39Å; Y2653-M2669 HydrophobicContact CG-SD 4.26Å; M2669-I2677 WeakPolarHBondContact O-CA 3.27Å; M2669-V2678 WeakPolarHBondContact CB-O 3.21Å; M2669-V2678 PolarHBondContact O-N 2.95Å; M2669-V2678 VanDerWaalsContact O-O 3.11Å; M2669-L2687 HydrophobicContact CB-CD1 4.06Å; M2669-L2687 HydrophobicContact CB-CD2 4.22Å; M2669-L2687 HydrophobicContact CB-CG 4.3Å; M2669-L2687 HydrophobicContact CE-CD1 3.98Å; M2669-L2687 HydrophobicContact CE-CD2 3.99Å
2670	F	92.1	Very high	91.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	128.5	176.5	-175.5	-82.2	0	0	0	110.2	T2603 I2610 I2621 Y2653 H2654 S2675 I2677	T2603-F2670 HydrophobicContact CG2-CE1 3.83Å; T2603-F2670 HydrophobicContact CG2-CE2 4.13Å; T2603-F2670 HydrophobicContact CG2-CZ 3.53Å; I2610-F2670 HydrophobicContact CD1-CD2 4.02Å; I2610-F2670 HydrophobicContact CD1-CE2 3.95Å; I2621-F2670 HydrophobicContact CD1-CD2 4.33Å; I2621-F2670 HydrophobicContact CD1-CE2 4Å; I2621-F2670 HydrophobicContact CG2-CE2 4.18Å; Y2653-F2670 VanDerWaalsContact CA-O 3.24Å; Y2653-F2670 WeakPolarHBondContact CA-O 3.22Å; H2654-F2670 AromaticContact CE1-CD1 3Å; H2654-F2670 WeakPolarHBondContact CE1-CD1 3.37Å; H2654-F2670 AromaticContact CE1-CE1 3.64Å; H2654-F2670 AromaticContact CE1-CG 3.6Å; H2654-F2670 PolarHBondContact N-O 2.9Å; H2654-F2670 VanDerWaalsContact N-O 3.09Å; H2654-F2670 AromaticContact ND1-CD1 3.81Å; H2654-F2670 WeakPolarHBondContact NE2-CB 3.47Å; H2654-F2670 AromaticContact NE2-CD1 3.41Å; H2654-F2670 WeakPolarHBondContact NE2-CD1 3.36Å; H2654-F2670 AromaticContact NE2-CG 3.48Å; H2654-F2670 WeakPolarHBondContact NE2-CG 3.45Å; H2654-F2670 PolarHBondContact O-N 2.79Å; F2670-S2675 VanDerWaalsContact CZ-C 3.4Å; F2670-I2677 HydrophobicContact CB-CD1 3.85Å; F2670-I2677 HydrophobicContact CD2-CD1 3.83Å; F2670-I2677 HydrophobicContact CD2-CG1 4.49Å; F2670-I2677 HydrophobicContact CG-CD1 4.33Å
2671	S	90.1	Very high	90.2	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.007	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	116.5	171.9	177.2	0	0	0	0	110.4	Q2652 Q2673 R2674 S2675 R2676	Q2652-S2671 CarbonylContact O-C 3.53Å; Q2652-S2671 WeakPolarHBondContact O-CA 3.5Å; S2671-Q2673 VanDerWaalsContact C-N 3.34Å; S2671-Q2673 PolarHBondContact O-N 3.25Å; S2671-R2674 PolarHBondContact O-N 2.93Å; S2671-R2674 PolarHBondContact OG-N 3Å; S2671-S2675 VanDerWaalsContact O-CA 3.28Å; S2671-S2675 WeakPolarHBondContact O-CA 3.33Å; S2671-S2675 PolarHBondContact O-N 3.04Å; S2671-R2676 PolarHBondContact N-O 2.84Å; S2671-R2676 PolarHBondContact O-N 3.47Å
2672	V	87	Confident	88.9	Confident	26 Å²	26	42.1 Å²	42.1	16%	0.158	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-43.1	176.8	-179.3	0	0	0	0	110.7	D2605 Q2652 H2654 R2674 S2675	D2605-V2672 HydrophobicContact CB-CG1 3.99Å; D2605-V2672 VanDerWaalsContact OD2-CG1 3.3Å; D2605-V2672 WeakPolarHBondContact OD2-CG1 3.48Å; Q2652-V2672 PolarHBondContact O-N 2.86Å; H2654-V2672 WeakPolarHBondContact ND1-CG2 3.49Å; V2672-R2674 PolarHBondContact O-N 2.72Å; V2672-S2675 PolarHBondContact O-N 3.02Å; V2672-S2675 PolarHBondContact O-OG 2.78Å
2673	Q	85.9	Confident	88	Confident	130 Å²	130	45.3 Å²	45.3	61%	0.607	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-46.5	-179.7	-174.4	-179.4	4.5	0	0	112.2	S2671	S2671-Q2673 VanDerWaalsContact C-N 3.34Å; S2671-Q2673 PolarHBondContact O-N 3.25Å
2674	R	88.7	Confident	87.3	Confident	156 Å²	156	46.4 Å²	46.4	59%	0.589	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-10.5	-178.5	-60.7	-177.7	179.7	177.9	0.8	113.3	S2671 V2672 R2676	S2671-R2674 PolarHBondContact O-N 2.93Å; S2671-R2674 PolarHBondContact OG-N 3Å; V2672-R2674 PolarHBondContact O-N 2.72Å; R2674-R2676 HydrophobicContact CB-CB 4.48Å; R2674-R2676 WeakPolarHBondContact O-CG 3.42Å; R2674-R2676 PolarHBondContact O-N 2.95Å
2675	S	90.3	Very high	86.9	Confident	8 Å²	8	51.4 Å²	51.4	6%	0.056	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	39.5	-173.9	-52.5	0	0	0	0	113.4	I2630 F2670 S2671 V2672	I2630-S2675 WeakPolarHBondContact CG2-O 3.41Å; F2670-S2675 VanDerWaalsContact CZ-C 3.4Å; S2671-S2675 VanDerWaalsContact O-CA 3.28Å; S2671-S2675 WeakPolarHBondContact O-CA 3.33Å; S2671-S2675 PolarHBondContact O-N 3.04Å; V2672-S2675 PolarHBondContact O-N 3.02Å; V2672-S2675 PolarHBondContact O-OG 2.78Å
2676	R	92.5	Very high	86.6	Confident	122 Å²	122	53.3 Å²	53.3	46%	0.46	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	156.3	-171.4	-77.7	-176.8	166.3	-178.2	-3.3	112.1	I2630 Q2631 S2671 R2674	I2630-R2676 HydrophobicContact CG2-CG 3.54Å; I2630-R2676 PolarHBondContact O-NE 3.27Å; I2630-R2676 PolarHBondContact O-NH2 3.21Å; Q2631-R2676 HydrophobicContact CB-CG 4.29Å; Q2631-R2676 VanDerWaalsContact OE1-CB 3.29Å; S2671-R2676 PolarHBondContact N-O 2.84Å; S2671-R2676 PolarHBondContact O-N 3.47Å; R2674-R2676 HydrophobicContact CB-CB 4.48Å; R2674-R2676 WeakPolarHBondContact O-CG 3.42Å; R2674-R2676 PolarHBondContact O-N 2.95Å
2677	I	92.7	Very high	86.3	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	131.7	169	-61.4	-62.1	0	0	0	109.3	F2619 I2621 Q2631 V2633 L2656 W2668 M2669 F2670 P2684	F2619-I2677 HydrophobicContact CE2-CG1 4.18Å; F2619-I2677 HydrophobicContact CZ-CG1 4.33Å; I2621-I2677 HydrophobicContact CD1-CG1 3.9Å; Q2631-I2677 PolarHBondContact NE2-O 3.1Å; V2633-I2677 HydrophobicContact CG2-CB 4.24Å; V2633-I2677 HydrophobicContact CG2-CG1 3.97Å; L2656-I2677 HydrophobicContact CB-CD1 4.41Å; L2656-I2677 HydrophobicContact CD2-CD1 3.86Å; W2668-I2677 HydrophobicContact CB-CD1 3.95Å; W2668-I2677 HydrophobicContact CB-CG2 4.18Å; W2668-I2677 HydrophobicContact CE3-CG2 4.06Å; M2669-I2677 WeakPolarHBondContact O-CA 3.27Å; F2670-I2677 HydrophobicContact CB-CD1 3.85Å; F2670-I2677 HydrophobicContact CD2-CD1 3.83Å; F2670-I2677 HydrophobicContact CD2-CG1 4.49Å; F2670-I2677 HydrophobicContact CG-CD1 4.33Å; I2677-P2684 HydrophobicContact CG2-CB 4.25Å
2678	V	87.7	Confident	86.1	Confident	9 Å²	9	54.6 Å²	54.6	6%	0.055	28%	0.276	C	S	.	.			trans	-139.1	157.4	-179	-62.8	0	0	0	0	109.8	Y2653 M2669 L2683	Y2653-V2678 HydrophobicContact CD1-CG2 4.25Å; Y2653-V2678 HydrophobicContact CE1-CG2 3.85Å; M2669-V2678 WeakPolarHBondContact CB-O 3.21Å; M2669-V2678 PolarHBondContact O-N 2.95Å; M2669-V2678 VanDerWaalsContact O-O 3.11Å; V2678-L2683 CarbonylContact C-O 3.59Å
2679	N	79.9	Confident	86.1	Confident	27 Å²	27	57 Å²	57	14%	0.144	29%	0.288	C	S	.	.			trans	-120.7	-171.1	165.3	72.3	-1.5	0	0	0	109.8	Q2681 G2682 L2683	N2679-Q2681 PolarHBondContact O-N 3.23Å; N2679-Q2681 VanDerWaalsContact OD1-C 3.26Å; N2679-Q2681 WeakPolarHBondContact OD1-CA 3.48Å; N2679-Q2681 PolarHBondContact OD1-N 3.07Å; N2679-G2682 PolarHBondContact O-N 2.95Å; N2679-G2682 PolarHBondContact OD1-N 2.91Å; N2679-L2683 VanDerWaalsContact CB-O 3.28Å; N2679-L2683 WeakPolarHBondContact CB-O 3Å; N2679-L2683 PolarHBondContact N-O 2.93Å; N2679-L2683 PolarHBondContact ND2-O 3.47Å; N2679-L2683 PolarHBondContact OD1-N 2.97Å; N2679-L2683 PolarHBondContact OD1-O 3.48Å; N2679-L2683 VanDerWaalsContact OD1-O 3.07Å
2680	S	66.6	Low	86.3	Confident	81 Å²	81	54.8 Å²	54.8	57%	0.566	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-33.6	175.6	52.3	0	0	0	0	113.5
2681	Q	69.2	Low	86.4	Confident	146 Å²	146	58.3 Å²	58.3	68%	0.682	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	4.9	178.6	-57.3	-61.4	-25.6	0	0	113.4	N2679 L2683	N2679-Q2681 PolarHBondContact O-N 3.23Å; N2679-Q2681 VanDerWaalsContact OD1-C 3.26Å; N2679-Q2681 WeakPolarHBondContact OD1-CA 3.48Å; N2679-Q2681 PolarHBondContact OD1-N 3.07Å; Q2681-L2683 VanDerWaalsContact C-N 3.27Å; Q2681-L2683 HydrophobicContact CB-CD1 4.5Å; Q2681-L2683 PolarHBondContact O-N 3.41Å
2682	G	71	Confident	86.5	Confident	38 Å²	38	58.8 Å²	58.8	39%	0.392	30%	0.302	S	S	.	.	S	Bend	trans	73.7	8.6	-176.1	0	0	0	0	0	115.8	N2679	N2679-G2682 PolarHBondContact O-N 2.95Å; N2679-G2682 PolarHBondContact OD1-N 2.91Å
2683	L	79.5	Confident	86.8	Confident	93 Å²	93	58.3 Å²	58.3	49%	0.487	30%	0.297	S	S	.	.	S	Bend	trans	-92.4	150.3	176.2	-65.4	169.9	0	0	0	111.5	V2678 N2679 Q2681 K2685	V2678-L2683 CarbonylContact C-O 3.59Å; N2679-L2683 VanDerWaalsContact CB-O 3.28Å; N2679-L2683 WeakPolarHBondContact CB-O 3Å; N2679-L2683 PolarHBondContact N-O 2.93Å; N2679-L2683 PolarHBondContact ND2-O 3.47Å; N2679-L2683 PolarHBondContact OD1-N 2.97Å; N2679-L2683 PolarHBondContact OD1-O 3.48Å; N2679-L2683 VanDerWaalsContact OD1-O 3.07Å; Q2681-L2683 VanDerWaalsContact C-N 3.27Å; Q2681-L2683 HydrophobicContact CB-CD1 4.5Å; Q2681-L2683 PolarHBondContact O-N 3.41Å; L2683-K2685 VanDerWaalsContact C-N 3.3Å; L2683-K2685 PolarHBondContact O-N 3.31Å
2684	P	81.4	Confident	87.1	Confident	53 Å²	53	56.3 Å²	56.3	34%	0.344	29%	0.288	S	S	.	.			trans	-81.5	72.6	178.3	33.8	-34.8	0	0	0	111.5	V2633 I2677	V2633-P2684 HydrophobicContact CG1-CB 4.49Å; I2677-P2684 HydrophobicContact CG2-CB 4.25Å
2685	K	89.2	Confident	87.4	Confident	127 Å²	127	51 Å²	51	55%	0.552	27%	0.273	S	S	*	.			trans	-107.5	145.9	171.9	-68.4	-172.8	175.6	-176.2	0	110.6	L2683	L2683-K2685 VanDerWaalsContact C-N 3.3Å; L2683-K2685 PolarHBondContact O-N 3.31Å
2686	P	93.7	Very high	87.6	Confident	41 Å²	41	51.4 Å²	51.4	27%	0.266	28%	0.276	S	S	.	.			trans	-65.3	147.1	173.2	29.5	-33.9	0	0	0	110	M2666 L2667 W2668 I2689	M2666-P2686 HydrophobicContact CB-CB 4.09Å; M2666-P2686 HydrophobicContact CG-CB 4.39Å; M2666-P2686 HydrophobicContact SD-CB 4.36Å; M2666-P2686 HydrophobicContact SD-CG 4.21Å; L2667-P2686 CarbonylContact O-C 3.59Å; L2667-P2686 WeakPolarHBondContact O-CA 3.47Å; W2668-P2686 HydrophobicContact CD2-CB 4.19Å; W2668-P2686 HydrophobicContact CE3-CB 3.95Å; W2668-P2686 HydrophobicContact CH2-CB 4.05Å; W2668-P2686 HydrophobicContact CH2-CG 4.23Å; W2668-P2686 HydrophobicContact CZ2-CB 4.26Å; W2668-P2686 HydrophobicContact CZ3-CB 3.9Å; W2668-P2686 HydrophobicContact CZ3-CG 4.19Å; P2686-I2689 HydrophobicContact CG-CG1 4.35Å
2687	L	90.4	Very high	87.9	Confident	20 Å²	20	45.6 Å²	45.6	11%	0.105	25%	0.254	C	S	.	.	S	Bend	trans	-71.8	-45.7	171.7	-60.8	177.8	0	0	0	111	L1994 Y2655 L2667 M2669	L1994-L2687 HydrophobicContact CD1-CD2 3.81Å; L1994-L2687 HydrophobicContact CD2-CB 4.43Å; L1994-L2687 HydrophobicContact CD2-CD2 4.24Å; Y2655-L2687 HydrophobicContact CD1-CD1 3.7Å; Y2655-L2687 HydrophobicContact CE1-CD1 3.46Å; Y2655-L2687 VanDerWaalsContact CE1-CD1 3.46Å; L2667-L2687 HydrophobicContact CD2-CD1 4.49Å; L2667-L2687 PolarHBondContact O-N 3.15Å; M2669-L2687 HydrophobicContact CB-CD1 4.06Å; M2669-L2687 HydrophobicContact CB-CD2 4.22Å; M2669-L2687 HydrophobicContact CB-CG 4.3Å; M2669-L2687 HydrophobicContact CE-CD1 3.98Å; M2669-L2687 HydrophobicContact CE-CD2 3.99Å
2688	F	92.8	Very high	88	Confident	18 Å²	18	47.5 Å²	47.5	8%	0.079	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	145.7	-179.7	-62.4	-69.2	0	0	0	110.1	L1994 M2666 L2667 L2690 T2723	L1994-F2688 HydrophobicContact CB-CZ 4.33Å; L1994-F2688 HydrophobicContact CD2-CE2 3.75Å; L1994-F2688 HydrophobicContact CD2-CZ 3.7Å; M2666-F2688 WeakPolarHBondContact CA-O 3.29Å; L2667-F2688 HydrophobicContact CB-CB 4.42Å; L2667-F2688 HydrophobicContact CD2-CD2 4.13Å; L2667-F2688 PolarHBondContact N-O 2.68Å; F2688-L2690 HydrophobicContact CB-CD2 4.01Å; F2688-T2723 VanDerWaalsContact CE2-O 3.25Å; F2688-T2723 WeakPolarHBondContact CE2-O 3.24Å
2689	I	96	Very high	88.5	Confident	51 Å²	51	47.1 Å²	47.1	26%	0.262	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	114.4	166	-53.8	175.2	0	0	0	106.3	T2664 M2666 P2686	T2664-I2689 HydrophobicContact CG2-CG2 4.15Å; M2666-I2689 HydrophobicContact CE-CD1 4.2Å; M2666-I2689 HydrophobicContact CE-CG1 4.3Å; M2666-I2689 HydrophobicContact CE-CG2 4.48Å; M2666-I2689 HydrophobicContact CG-CG1 4.24Å; M2666-I2689 HydrophobicContact CG-CG2 4.48Å; P2686-I2689 HydrophobicContact CG-CG1 4.35Å
2690	L	96.6	Very high	89.4	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	109.9	-177.7	-47	178	0	0	0	108.3	V2665 F2688 V2709 H2721	V2665-L2690 HydrophobicContact CB-CB 4.09Å; V2665-L2690 HydrophobicContact CB-CD1 4.2Å; V2665-L2690 HydrophobicContact CB-CG 4.48Å; V2665-L2690 HydrophobicContact CG1-CD1 3.93Å; V2665-L2690 PolarHBondContact N-O 3.24Å; V2665-L2690 WeakPolarHBondContact O-CA 3.45Å; V2665-L2690 WeakPolarHBondContact O-CB 3.41Å; V2665-L2690 WeakPolarHBondContact O-CG 3.3Å; V2665-L2690 PolarHBondContact O-N 3.3Å; F2688-L2690 HydrophobicContact CB-CD2 4.01Å; L2690-V2709 HydrophobicContact CD1-CB 3.87Å; L2690-V2709 HydrophobicContact CD1-CG1 3.83Å; L2690-V2709 HydrophobicContact CD1-CG2 3.86Å; L2690-H2721 HydrophobicContact CD1-CB 3.94Å; L2690-H2721 HydrophobicContact CD2-CB 4.21Å; L2690-H2721 HydrophobicContact CG-CB 4.49Å
2691	N	94.2	Very high	90.8	Very high	75 Å²	75	43.1 Å²	43.1	40%	0.401	24%	0.235	S	C	.	.			trans	-98.6	160.6	-178.3	-63.1	-38.6	0	0	0	111.3	L1844 H2721	L1844-N2691 HydrophobicContact CD1-CB 4.34Å; L1844-N2691 HydrophobicContact CD2-CB 3.99Å; N2691-H2721 PolarHBondContact O-NE2 2.83Å
2692	G	91	Very high	92.2	Very high	11 Å²	11	36.2 Å²	36.2	11%	0.113	20%	0.203	C	C	.	.			trans	139.1	-26.5	172.8	0	0	0	0	0	113.6	F1847	F1847-G2692 WeakPolarHBondContact CE1-O 3.28Å
2693	H	94.1	Very high	93.3	Very high	15 Å²	15	34.4 Å²	34.4	7%	0.069	19%	0.185	C	C	.	.			trans	-75.5	147.5	174.5	-68.5	-84.4	0	0	0	111.2	C2663 I2697 S2711 S2713 T2717	C2663-H2693 HydrophobicContact CB-CB 4.43Å; C2663-H2693 WeakPolarHBondContact CB-O 3.26Å; C2663-H2693 WeakPolarHBondContact O-CB 3.47Å; H2693-I2697 HydrophobicContact CB-CD1 3.61Å; H2693-I2697 WeakPolarHBondContact CD2-CD1 3.28Å; H2693-I2697 VanDerWaalsContact CG-CD1 3.41Å; H2693-S2711 PolarHBondContact CE1-O 3.44Å; H2693-S2711 WeakPolarHBondContact NE2-CB 3.25Å; H2693-S2711 PolarHBondContact NE2-O 3.18Å; H2693-S2711 PolarHBondContact NE2-OG 2.63Å; H2693-S2713 VanDerWaalsContact ND1-CB 3.26Å; H2693-S2713 WeakPolarHBondContact ND1-CB 3.11Å; H2693-S2713 PolarHBondContact ND1-OG 3.08Å; H2693-T2717 PolarHBondContact CE1-O 3.43Å
2694	E	91.2	Very high	93.9	Very high	89 Å²	89	30.5 Å²	30.5	42%	0.416	17%	0.166	S	C	.	.	S	Bend	trans	-110	-6.8	178.3	-60.7	178.4	156.9	0	0	112.3	W1852 C2663	W1852-E2694 PolarHBondContact NE1-OE1 2.84Å; C2663-E2694 VanDerWaalsContact SG-C 3.51Å
2695	T	94.9	Very high	94.4	Very high	43 Å²	43	28.4 Å²	28.4	26%	0.264	15%	0.151	S	C	.	.	S	Bend	trans	-134.8	163.7	177.9	59.6	0	0	0	0	110.6	C2663 I2697 S2713 N2715	C2663-T2695 WeakPolarHBondContact SG-CA 3.45Å; C2663-T2695 PolarHBondContact SG-N 2.88Å; T2695-I2697 PolarHBondContact O-N 3Å; T2695-S2713 WeakPolarHBondContact O-CB 3.37Å; T2695-S2713 WeakPolarHBondContact OG1-CB 3.47Å; T2695-N2715 HydrophobicContact CG2-CB 3.85Å; T2695-N2715 WeakPolarHBondContact OG1-CB 3.13Å; T2695-N2715 PolarHBondContact OG1-N 2.99Å; T2695-N2715 PolarHBondContact OG1-OD1 3.33Å; T2695-N2715 VanDerWaalsContact OG1-OD1 3.11Å
2696	S	96.2	Very high	94.6	Very high	18 Å²	18	22.7 Å²	22.7	13%	0.126	13%	0.127	C	C	.	.			trans	-45.9	134.2	179.5	175.9	0	0	0	0	112.3	R2661 S2713 M2714	R2661-S2696 WeakPolarHBondContact CA-OG 3.4Å; R2661-S2696 WeakPolarHBondContact CG-OG 3.24Å; S2696-S2713 CarbonylContact O-C 3.5Å; S2696-S2713 VanDerWaalsContact O-CA 3.28Å; S2696-S2713 WeakPolarHBondContact O-CA 3.5Å; S2696-S2713 WeakPolarHBondContact O-CB 3.1Å; S2696-M2714 PolarHBondContact O-N 3.31Å
2697	I	97.8	Very high	94.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	137.8	173.3	-48.8	-55.8	0	0	0	108.6	T2641 S2660 V2665 H2693 T2695 I2700	T2641-I2697 WeakPolarHBondContact CB-O 3.22Å; T2641-I2697 PolarHBondContact OG1-O 3.04Å; S2660-I2697 WeakPolarHBondContact O-CG1 3.47Å; S2660-I2697 PolarHBondContact O-N 2.73Å; V2665-I2697 HydrophobicContact CG2-CD1 4.06Å; V2665-I2697 HydrophobicContact CG2-CG1 3.93Å; V2665-I2697 HydrophobicContact CG2-CG2 4.21Å; H2693-I2697 HydrophobicContact CB-CD1 3.61Å; H2693-I2697 WeakPolarHBondContact CD2-CD1 3.28Å; H2693-I2697 VanDerWaalsContact CG-CD1 3.41Å; T2695-I2697 PolarHBondContact O-N 3Å; I2697-I2700 HydrophobicContact CG2-CD1 4.04Å; I2697-I2700 HydrophobicContact CG2-CG1 3.8Å
2698	N	95.6	Very high	94.9	Very high	42 Å²	42	19.9 Å²	19.9	23%	0.225	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	-36.8	-178.9	-166.7	32.8	0	0	0	112.5	N2598 G2712 P2762	N2598-N2698 PolarHBondContact ND2-O 3.27Å; N2698-G2712 PolarHBondContact N-O 3.29Å; N2698-P2762 PolarHBondContact ND2-O 2.9Å
2699	C	97.1	Very high	95.1	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	149.8	178.8	56.6	0	0	0	0	111.8	N2598 S2711 G2712 P2762	N2598-C2699 WeakPolarHBondContact ND2-CB 3.39Å; C2699-S2711 WeakPolarHBondContact O-CA 3.48Å; C2699-G2712 PolarHBondContact N-O 2.69Å; C2699-G2712 PolarHBondContact O-N 2.87Å; C2699-P2762 PolarHBondContact SG-O 2.83Å
2700	I	98.2	Very high	95.2	Very high	10 Å²	10	16.8 Å²	16.8	5%	0.051	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	147.3	176.2	-63.9	163.9	0	0	0	109.3	A2644 A2657 S2658 V2665 I2697 V2709 I2710	A2644-I2700 HydrophobicContact CB-CB 4.13Å; A2644-I2700 HydrophobicContact CB-CG2 3.77Å; A2657-I2700 HydrophobicContact CB-CG2 3.91Å; S2658-I2700 VanDerWaalsContact C-CD1 3.47Å; V2665-I2700 HydrophobicContact CB-CD1 4.37Å; V2665-I2700 HydrophobicContact CG1-CD1 3.68Å; V2665-I2700 HydrophobicContact CG1-CG1 4.42Å; V2665-I2700 HydrophobicContact CG2-CD1 3.88Å; V2665-I2700 HydrophobicContact CG2-CG1 4.27Å; I2697-I2700 HydrophobicContact CG2-CD1 4.04Å; I2697-I2700 HydrophobicContact CG2-CG1 3.8Å; I2700-V2709 HydrophobicContact CG2-CG1 4.04Å; I2700-I2710 CarbonylContact C-O 3.56Å; I2700-I2710 WeakPolarHBondContact CA-O 3.3Å
2701	S	97.7	Very high	95.3	Very high	14 Å²	14	16.7 Å²	16.7	10%	0.098	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	149.4	163.1	-146.1	0	0	0	0	110.3	I2710 L2765 Y2767	S2701-I2710 PolarHBondContact N-O 3.29Å; S2701-I2710 PolarHBondContact O-N 3.24Å; S2701-L2765 WeakPolarHBondContact CB-O 3.33Å; S2701-L2765 PolarHBondContact OG-O 3.15Å; S2701-Y2767 VanDerWaalsContact OG-CD1 3.24Å; S2701-Y2767 WeakPolarHBondContact OG-CD1 3.38Å; S2701-Y2767 WeakPolarHBondContact OG-CE1 3.37Å
2702	L	96.8	Very high	95.4	Very high	1 Å²	1	13.1 Å²	13.1	1%	0.005	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	122.8	-170.5	172.5	64.6	0	0	0	110.5	A2644 S2646 A2657 L2667 V2709 T2723 Y2767	A2644-L2702 HydrophobicContact CB-CB 4.06Å; S2646-L2702 WeakPolarHBondContact CA-O 3.42Å; A2657-L2702 HydrophobicContact CB-CB 4.5Å; A2657-L2702 HydrophobicContact CB-CD2 3.92Å; L2667-L2702 HydrophobicContact CD1-CD1 3.78Å; L2667-L2702 HydrophobicContact CD1-CD2 3.92Å; L2702-V2709 HydrophobicContact CD1-CB 4.36Å; L2702-V2709 HydrophobicContact CD1-CG1 4.39Å; L2702-V2709 HydrophobicContact CD1-CG2 3.63Å; L2702-T2723 HydrophobicContact CD1-CG2 4.22Å; L2702-Y2767 VanDerWaalsContact C-CE1 3.5Å; L2702-Y2767 WeakPolarHBondContact O-CE1 3.46Å; L2702-Y2767 PolarHBondContact O-OH 2.92Å
2703	S	95.1	Very high	95.5	Very high	1 Å²	1	12.6 Å²	12.6	1%	0.007	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	120.7	174.6	-173	0	0	0	0	111.4	E2647 E2705 L2706 G2707 L2708 Y2767	E2647-S2703 PolarHBondContact OE1-OG 3.41Å; E2647-S2703 WeakPolarHBondContact OE2-CA 3.47Å; E2647-S2703 PolarHBondContact OE2-OG 3.04Å; S2703-E2705 PolarHBondContact OG-N 3.18Å; S2703-L2706 WeakPolarHBondContact OG-CG 3.31Å; S2703-L2706 PolarHBondContact OG-N 3.11Å; S2703-L2706 VanDerWaalsContact OG-N 3.1Å; S2703-G2707 CarbonylContact O-C 3.43Å; S2703-G2707 WeakPolarHBondContact O-CA 3.36Å; S2703-G2707 PolarHBondContact O-N 3.47Å; S2703-L2708 PolarHBondContact N-O 2.61Å; S2703-L2708 PolarHBondContact O-N 3.4Å; S2703-Y2767 WeakPolarHBondContact OG-CE2 3.28Å
2704	A	92.2	Very high	95.4	Very high	11 Å²	11	16.2 Å²	16.2	9%	0.091	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-24.2	171.3	0	0	0	0	0	111.9	W1887 R2089 E2647 Y2655	W1887-A2704 WeakPolarHBondContact CZ2-O 3.45Å; R2089-A2704 PolarHBondContact NE-O 3.03Å; E2647-A2704 PolarHBondContact OE2-N 3.19Å; Y2655-A2704 HydrophobicContact CD2-CB 4Å; Y2655-A2704 HydrophobicContact CE2-CB 4.45Å
2705	E	92.3	Very high	95.3	Very high	9 Å²	9	14 Å²	14	4%	0.042	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-50.6	175.2	-173.2	-173.3	161.9	0	0	110.5	W1887 D1889 D1890 S2703 G2707 R2769	W1887-E2705 PolarHBondContact NE1-O 3.26Å; D1889-E2705 HydrophobicContact CB-CG 4.09Å; D1890-E2705 HydrophobicContact CB-CG 4.32Å; S2703-E2705 PolarHBondContact OG-N 3.18Å; E2705-G2707 VanDerWaalsContact C-N 3.29Å; E2705-G2707 PolarHBondContact O-N 2.65Å; E2705-R2769 WeakPolarHBondContact OE2-CB 3.26Å
2706	L	93.7	Very high	95	Very high	6 Å²	6	12.3 Å²	12.3	3%	0.031	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-12.6	179	-53	177.7	0	0	0	113	R1896 S2703 L2708 Y2767 L2787	R1896-L2706 PolarHBondContact NH1-O 2.67Å; R1896-L2706 VanDerWaalsContact NH1-O 3.1Å; S2703-L2706 WeakPolarHBondContact OG-CG 3.31Å; S2703-L2706 PolarHBondContact OG-N 3.11Å; S2703-L2706 VanDerWaalsContact OG-N 3.1Å; L2706-L2708 VanDerWaalsContact C-N 3.32Å; L2706-L2708 HydrophobicContact CB-CB 4.36Å; L2706-L2708 HydrophobicContact CB-CD1 3.95Å; L2706-L2708 HydrophobicContact CB-CG 4.1Å; L2706-L2708 PolarHBondContact O-N 3.45Å; L2706-Y2767 HydrophobicContact CD1-CD2 3.83Å; L2706-Y2767 HydrophobicContact CD1-CG 4.46Å; L2706-L2787 HydrophobicContact CB-CD1 4.25Å; L2706-L2787 HydrophobicContact CD1-CD1 4.01Å; L2706-L2787 HydrophobicContact CD2-CD1 3.81Å; L2706-L2787 HydrophobicContact CG-CD1 4.24Å
2707	G	93.2	Very high	94.8	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.8	32.1	-176	0	0	0	0	0	113.2	R1896 S2703 E2705 S2722 T2723	R1896-G2707 VanDerWaalsContact NH1-C 3.27Å; R1896-G2707 PolarHBondContact NH1-O 2.91Å; S2703-G2707 CarbonylContact O-C 3.43Å; S2703-G2707 WeakPolarHBondContact O-CA 3.36Å; S2703-G2707 PolarHBondContact O-N 3.47Å; E2705-G2707 VanDerWaalsContact C-N 3.29Å; E2705-G2707 PolarHBondContact O-N 2.65Å; G2707-S2722 CarbonylContact O-C 3.54Å; G2707-S2722 WeakPolarHBondContact O-CA 3.25Å; G2707-T2723 WeakPolarHBondContact CA-OG1 3.49Å; G2707-T2723 PolarHBondContact O-N 2.93Å; G2707-T2723 PolarHBondContact O-OG1 2.94Å
2708	L	95.6	Very high	94.6	Very high	3 Å²	3	12.8 Å²	12.8	2%	0.016	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	143.4	-170.8	-69.9	174.5	0	0	0	112.5	S2703 L2706 H2721 L2728 L2787	S2703-L2708 PolarHBondContact N-O 2.61Å; S2703-L2708 PolarHBondContact O-N 3.4Å; L2706-L2708 VanDerWaalsContact C-N 3.32Å; L2706-L2708 HydrophobicContact CB-CB 4.36Å; L2706-L2708 HydrophobicContact CB-CD1 3.95Å; L2706-L2708 HydrophobicContact CB-CG 4.1Å; L2706-L2708 PolarHBondContact O-N 3.45Å; L2708-H2721 WeakPolarHBondContact CA-O 3.15Å; L2708-L2728 HydrophobicContact CD2-CD1 3.53Å; L2708-L2787 HydrophobicContact CD1-CD1 3.97Å; L2708-L2787 HydrophobicContact CD1-CD2 4.21Å; L2708-L2787 HydrophobicContact CD1-CG 3.72Å
2709	V	98	Very high	94.6	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	127.6	165.6	-162.7	0	0	0	0	107.5	A2657 V2665 L2667 L2690 I2700 L2702 L2720 H2721 T2723	A2657-V2709 HydrophobicContact CB-CG1 4.35Å; V2665-V2709 HydrophobicContact CG1-CG1 4.28Å; L2667-V2709 HydrophobicContact CD1-CG2 4.33Å; L2690-V2709 HydrophobicContact CD1-CB 3.87Å; L2690-V2709 HydrophobicContact CD1-CG1 3.83Å; L2690-V2709 HydrophobicContact CD1-CG2 3.86Å; I2700-V2709 HydrophobicContact CG2-CG1 4.04Å; L2702-V2709 HydrophobicContact CD1-CB 4.36Å; L2702-V2709 HydrophobicContact CD1-CG1 4.39Å; L2702-V2709 HydrophobicContact CD1-CG2 3.63Å; V2709-L2720 WeakPolarHBondContact O-CA 3.49Å; V2709-H2721 HydrophobicContact CB-CB 4.32Å; V2709-H2721 PolarHBondContact N-O 2.92Å; V2709-H2721 PolarHBondContact O-N 2.78Å; V2709-T2723 HydrophobicContact CG2-CG2 4.42Å
2710	I	97.8	Very high	94.6	Very high	3 Å²	3	10.9 Å²	10.9	2%	0.015	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	125.1	179.2	-40.7	-179.3	0	0	0	106.8	I2700 S2701 L2719 L2720 L2731 L2765 L2773	I2700-I2710 CarbonylContact C-O 3.56Å; I2700-I2710 WeakPolarHBondContact CA-O 3.3Å; S2701-I2710 PolarHBondContact N-O 3.29Å; S2701-I2710 PolarHBondContact O-N 3.24Å; I2710-L2719 WeakPolarHBondContact CA-O 3.5Å; I2710-L2720 HydrophobicContact CB-CD2 4.04Å; I2710-L2720 HydrophobicContact CD1-CD2 4.15Å; I2710-L2720 HydrophobicContact CG1-CD2 3.6Å; I2710-L2720 HydrophobicContact CG2-CD2 3.75Å; I2710-L2731 HydrophobicContact CG2-CD1 4.36Å; I2710-L2765 HydrophobicContact CG2-CB 4.3Å; I2710-L2765 HydrophobicContact CG2-CD1 3.98Å; I2710-L2765 HydrophobicContact CG2-CD2 4.41Å; I2710-L2765 HydrophobicContact CG2-CG 4.48Å; I2710-L2773 HydrophobicContact CD1-CB 4.33Å; I2710-L2773 HydrophobicContact CD1-CD1 4.13Å; I2710-L2773 HydrophobicContact CD1-CD2 3.56Å; I2710-L2773 HydrophobicContact CD1-CG 4.22Å
2711	S	98.3	Very high	94.5	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	140.2	-179.1	51.6	0	0	0	0	111.4	H2693 C2699 C2718 L2719	H2693-S2711 PolarHBondContact CE1-O 3.44Å; H2693-S2711 WeakPolarHBondContact NE2-CB 3.25Å; H2693-S2711 PolarHBondContact NE2-O 3.18Å; H2693-S2711 PolarHBondContact NE2-OG 2.63Å; C2699-S2711 WeakPolarHBondContact O-CA 3.48Å; S2711-C2718 CarbonylContact O-C 3.48Å; S2711-C2718 WeakPolarHBondContact O-CA 3.4Å; S2711-L2719 PolarHBondContact N-O 3.28Å; S2711-L2719 PolarHBondContact O-N 2.74Å
2712	G	96	Very high	94.3	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131.6	-180	0	0	0	0	0	110.8	N2698 C2699 T2717 L2765	N2698-G2712 PolarHBondContact N-O 3.29Å; C2699-G2712 PolarHBondContact N-O 2.69Å; C2699-G2712 PolarHBondContact O-N 2.87Å; G2712-T2717 WeakPolarHBondContact CA-O 3.39Å; G2712-L2765 VanDerWaalsContact N-CD1 3.28Å
2713	S	94.8	Very high	94.1	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	165	179.6	53.7	0	0	0	0	113.3	H2693 T2695 S2696 N2715 G2716 T2717 P2762	H2693-S2713 VanDerWaalsContact ND1-CB 3.26Å; H2693-S2713 WeakPolarHBondContact ND1-CB 3.11Å; H2693-S2713 PolarHBondContact ND1-OG 3.08Å; T2695-S2713 WeakPolarHBondContact O-CB 3.37Å; T2695-S2713 WeakPolarHBondContact OG1-CB 3.47Å; S2696-S2713 CarbonylContact O-C 3.5Å; S2696-S2713 VanDerWaalsContact O-CA 3.28Å; S2696-S2713 WeakPolarHBondContact O-CA 3.5Å; S2696-S2713 WeakPolarHBondContact O-CB 3.1Å; S2713-N2715 PolarHBondContact O-N 3.04Å; S2713-N2715 PolarHBondContact OG-OD1 3.03Å; S2713-G2716 PolarHBondContact O-N 3.01Å; S2713-T2717 PolarHBondContact N-O 2.82Å; S2713-T2717 WeakPolarHBondContact OG-CB 3.47Å; S2713-T2717 PolarHBondContact OG-O 3.14Å; S2713-P2762 VanDerWaalsContact O-CD 3.25Å; S2713-P2762 WeakPolarHBondContact O-CD 3.5Å; S2713-P2762 WeakPolarHBondContact O-CG 3.41Å
2714	M	91.8	Very high	93.7	Very high	90 Å²	90	13.2 Å²	13.2	44%	0.443	7%	0.067	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.8	-176.2	-71.3	-177.5	67.5	0	0	114.5	S2696 G2716 Q2761	S2696-M2714 PolarHBondContact O-N 3.31Å; M2714-G2716 VanDerWaalsContact C-N 3.25Å; M2714-G2716 PolarHBondContact O-N 2.99Å; M2714-Q2761 VanDerWaalsContact O-CG 3.27Å; M2714-Q2761 WeakPolarHBondContact O-CG 3.44Å; M2714-Q2761 PolarHBondContact O-NE2 3.34Å
2715	N	88.2	Confident	93.6	Very high	44 Å²	44	13 Å²	13	24%	0.235	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	8.2	175.8	69.9	-13.6	0	0	0	114.4	T2695 S2713 T2717 P2759	T2695-N2715 HydrophobicContact CG2-CB 3.85Å; T2695-N2715 WeakPolarHBondContact OG1-CB 3.13Å; T2695-N2715 PolarHBondContact OG1-N 2.99Å; T2695-N2715 PolarHBondContact OG1-OD1 3.33Å; T2695-N2715 VanDerWaalsContact OG1-OD1 3.11Å; S2713-N2715 PolarHBondContact O-N 3.04Å; S2713-N2715 PolarHBondContact OG-OD1 3.03Å; N2715-T2717 PolarHBondContact ND2-OG1 3.33Å; N2715-T2717 WeakPolarHBondContact OD1-CB 3.39Å; N2715-T2717 PolarHBondContact OD1-N 2.99Å; N2715-T2717 PolarHBondContact OD1-OG1 3.46Å; N2715-P2759 WeakPolarHBondContact O-CB 3.25Å; N2715-P2759 WeakPolarHBondContact O-CG 3.48Å
2716	G	88.7	Confident	93.6	Very high	6 Å²	6	14.2 Å²	14.2	6%	0.062	7%	0.071	C	C	.	.	S	Bend	trans	90.1	-7.9	179.4	0	0	0	0	0	115.7	S2713 M2714 C2718 M2760	S2713-G2716 PolarHBondContact O-N 3.01Å; M2714-G2716 VanDerWaalsContact C-N 3.25Å; M2714-G2716 PolarHBondContact O-N 2.99Å; G2716-C2718 PolarHBondContact O-N 3.03Å; G2716-M2760 WeakPolarHBondContact CA-O 3.47Å
2717	T	91.5	Very high	93.5	Very high	26 Å²	26	14.4 Å²	14.4	16%	0.16	7%	0.073	C	C	.	.			trans	-69.7	129.7	178.2	-59.9	0	0	0	0	110.7	F1847 H2693 G2712 S2713 N2715 L2719	F1847-T2717 HydrophobicContact CZ-CG2 4.33Å; H2693-T2717 PolarHBondContact CE1-O 3.43Å; G2712-T2717 WeakPolarHBondContact CA-O 3.39Å; S2713-T2717 PolarHBondContact N-O 2.82Å; S2713-T2717 WeakPolarHBondContact OG-CB 3.47Å; S2713-T2717 PolarHBondContact OG-O 3.14Å; N2715-T2717 PolarHBondContact ND2-OG1 3.33Å; N2715-T2717 WeakPolarHBondContact OD1-CB 3.39Å; N2715-T2717 PolarHBondContact OD1-N 2.99Å; N2715-T2717 PolarHBondContact OD1-OG1 3.46Å; T2717-L2719 HydrophobicContact CG2-CD2 3.68Å; T2717-L2719 HydrophobicContact CG2-CG 3.96Å
2718	C	94.6	Very high	93.5	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.014	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	120	173.5	-71.8	0	0	0	0	109.7	S2711 G2716 C2730 L2731	S2711-C2718 CarbonylContact O-C 3.48Å; S2711-C2718 WeakPolarHBondContact O-CA 3.4Å; G2716-C2718 PolarHBondContact O-N 3.03Å; C2718-C2730 CarbonylContact O-C 3.58Å; C2718-C2730 WeakPolarHBondContact O-CA 3.32Å; C2718-L2731 HydrophobicContact CB-CB 3.87Å; C2718-L2731 HydrophobicContact CB-CD1 4Å; C2718-L2731 HydrophobicContact CB-CG 4.17Å; C2718-L2731 PolarHBondContact O-N 2.86Å
2719	L	95.5	Very high	93.2	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	148.1	-178.5	-58.8	-175.2	0	0	0	111.6	F1847 I2710 S2711 T2717 L2727 C2730	F1847-L2719 HydrophobicContact CE1-CD1 4.21Å; F1847-L2719 HydrophobicContact CE1-CD2 4.03Å; F1847-L2719 HydrophobicContact CE2-CD2 4Å; F1847-L2719 HydrophobicContact CZ-CD1 4.46Å; F1847-L2719 HydrophobicContact CZ-CD2 3.48Å; F1847-L2719 VanDerWaalsContact CZ-CD2 3.48Å; I2710-L2719 WeakPolarHBondContact CA-O 3.5Å; S2711-L2719 PolarHBondContact N-O 3.28Å; S2711-L2719 PolarHBondContact O-N 2.74Å; T2717-L2719 HydrophobicContact CG2-CD2 3.68Å; T2717-L2719 HydrophobicContact CG2-CG 3.96Å; L2719-L2727 HydrophobicContact CB-CD1 4.13Å; L2719-L2727 HydrophobicContact CD1-CD1 4.1Å; L2719-L2727 HydrophobicContact CD2-CD1 4.24Å; L2719-L2727 HydrophobicContact CG-CD1 4.38Å; L2719-C2730 HydrophobicContact CD2-CB 3.73Å
2720	L	96.3	Very high	92.9	Very high	2 Å²	2	19 Å²	19	1%	0.01	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	120.7	168	-66.7	-178.9	0	0	0	109.1	V2709 I2710 L2728 R2729 L2731 L2773	V2709-L2720 WeakPolarHBondContact O-CA 3.49Å; I2710-L2720 HydrophobicContact CB-CD2 4.04Å; I2710-L2720 HydrophobicContact CD1-CD2 4.15Å; I2710-L2720 HydrophobicContact CG1-CD2 3.6Å; I2710-L2720 HydrophobicContact CG2-CD2 3.75Å; L2720-L2728 HydrophobicContact CB-CB 4.33Å; L2720-L2728 WeakPolarHBondContact O-CA 3.2Å; L2720-L2728 WeakPolarHBondContact O-CB 3.39Å; L2720-L2728 PolarHBondContact O-N 2.93Å; L2720-R2729 HydrophobicContact CB-CB 4.34Å; L2720-R2729 HydrophobicContact CD1-CB 4.27Å; L2720-R2729 PolarHBondContact N-O 2.96Å; L2720-R2729 PolarHBondContact O-N 2.76Å; L2720-L2731 HydrophobicContact CD1-CD2 3.65Å; L2720-L2731 HydrophobicContact CD1-CG 4.48Å; L2720-L2731 HydrophobicContact CD2-CD2 4.49Å; L2720-L2731 HydrophobicContact CG-CD2 3.89Å; L2720-L2731 HydrophobicContact CG-CG 4.2Å; L2720-L2773 HydrophobicContact CD1-CD1 3.84Å; L2720-L2773 HydrophobicContact CD2-CD1 3.72Å; L2720-L2773 HydrophobicContact CG-CD1 4.39Å
2721	H	96.2	Very high	92.6	Very high	2 Å²	2	19.2 Å²	19.2	1%	0.009	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	154.5	170.5	-62.9	83	0	0	0	111.1	L2690 N2691 L2708 V2709 E2726	L2690-H2721 HydrophobicContact CD1-CB 3.94Å; L2690-H2721 HydrophobicContact CD2-CB 4.21Å; L2690-H2721 HydrophobicContact CG-CB 4.49Å; N2691-H2721 PolarHBondContact O-NE2 2.83Å; L2708-H2721 WeakPolarHBondContact CA-O 3.15Å; V2709-H2721 HydrophobicContact CB-CB 4.32Å; V2709-H2721 PolarHBondContact N-O 2.92Å; V2709-H2721 PolarHBondContact O-N 2.78Å; H2721-E2726 CarbonylContact C-O 3.51Å; H2721-E2726 WeakPolarHBondContact CA-O 3.28Å; H2721-E2726 WeakPolarHBondContact CB-O 3.45Å
2722	S	94	Very high	92	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	155.9	167.9	76.7	0	0	0	0	110.5	G2707 R2724 G2725 E2726	G2707-S2722 CarbonylContact O-C 3.54Å; G2707-S2722 WeakPolarHBondContact O-CA 3.25Å; S2722-R2724 PolarHBondContact O-N 3.4Å; S2722-R2724 VanDerWaalsContact O-N 3.09Å; S2722-R2724 PolarHBondContact OG-N 2.78Å; S2722-G2725 PolarHBondContact O-N 3.41Å; S2722-G2725 PolarHBondContact OG-N 3.25Å; S2722-E2726 PolarHBondContact N-O 3.12Å; S2722-E2726 WeakPolarHBondContact OG-CB 3.44Å; S2722-E2726 PolarHBondContact OG-N 3.05Å; S2722-E2726 VanDerWaalsContact OG-N 3.15Å; S2722-E2726 PolarHBondContact OG-OE2 3.07Å
2723	T	91.7	Very high	91.1	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.012	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-5.3	168.5	48.4	0	0	0	0	113.3	W1887 F2688 L2702 G2707 V2709	W1887-T2723 WeakPolarHBondContact CH2-OG1 3.4Å; F2688-T2723 VanDerWaalsContact CE2-O 3.25Å; F2688-T2723 WeakPolarHBondContact CE2-O 3.24Å; L2702-T2723 HydrophobicContact CD1-CG2 4.22Å; G2707-T2723 WeakPolarHBondContact CA-OG1 3.49Å; G2707-T2723 PolarHBondContact O-N 2.93Å; G2707-T2723 PolarHBondContact O-OG1 2.94Å; V2709-T2723 HydrophobicContact CG2-CG2 4.42Å
2724	R	88	Confident	90.1	Very high	71 Å²	71	24.4 Å²	24.4	27%	0.268	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	5.8	170.7	-57.9	-176.6	-179.2	172.7	3.7	112.8	S2088 S2722	S2088-R2724 PolarHBondContact O-NH2 3.45Å; S2722-R2724 PolarHBondContact O-N 3.4Å; S2722-R2724 VanDerWaalsContact O-N 3.09Å; S2722-R2724 PolarHBondContact OG-N 2.78Å
2725	G	90.4	Very high	88.5	Confident	6 Å²	6	24.1 Å²	24.1	6%	0.062	14%	0.139	C	C	.	.	S	Bend	trans	85.6	13.3	173.7	0	0	0	0	0	115.5	K1840 S2722	K1840-G2725 WeakPolarHBondContact CE-O 3.41Å; K1840-G2725 PolarHBondContact NZ-O 3.25Å; S2722-G2725 PolarHBondContact O-N 3.41Å; S2722-G2725 PolarHBondContact OG-N 3.25Å
2726	E	90.7	Very high	86.4	Confident	35 Å²	35	24.8 Å²	24.8	16%	0.164	15%	0.145	C	C	.	.			trans	-89.7	139.8	179.8	-57.8	160.4	115.5	0	0	111	Y1836 H2721 S2722 L2728	Y1836-E2726 HydrophobicContact CE2-CG 4.24Å; Y1836-E2726 WeakPolarHBondContact CE2-OE1 3.36Å; Y1836-E2726 WeakPolarHBondContact OH-CG 3.43Å; Y1836-E2726 PolarHBondContact OH-OE1 2.77Å; H2721-E2726 CarbonylContact C-O 3.51Å; H2721-E2726 WeakPolarHBondContact CA-O 3.28Å; H2721-E2726 WeakPolarHBondContact CB-O 3.45Å; S2722-E2726 PolarHBondContact N-O 3.12Å; S2722-E2726 WeakPolarHBondContact OG-CB 3.44Å; S2722-E2726 PolarHBondContact OG-N 3.05Å; S2722-E2726 VanDerWaalsContact OG-N 3.15Å; S2722-E2726 PolarHBondContact OG-OE2 3.07Å; E2726-L2728 HydrophobicContact CB-CD2 4.17Å; E2726-L2728 PolarHBondContact O-N 2.81Å
2727	L	93.2	Very high	84	Confident	11 Å²	11	30.1 Å²	30.1	6%	0.058	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	111.1	168.1	175.5	63	0	0	0	109.3	R1843 L1844 F1847 L2719	R1843-L2727 WeakPolarHBondContact CG-O 3.44Å; L1844-L2727 HydrophobicContact CD1-CD2 4.16Å; F1847-L2727 HydrophobicContact CB-CD2 3.75Å; F1847-L2727 HydrophobicContact CD1-CD2 3.81Å; F1847-L2727 HydrophobicContact CD2-CD2 4.4Å; F1847-L2727 HydrophobicContact CG-CD2 3.69Å; L2719-L2727 HydrophobicContact CB-CD1 4.13Å; L2719-L2727 HydrophobicContact CD1-CD1 4.1Å; L2719-L2727 HydrophobicContact CD2-CD1 4.24Å; L2719-L2727 HydrophobicContact CG-CD1 4.38Å
2728	L	92.2	Very high	81.2	Confident	5 Å²	5	35.3 Å²	35.3	3%	0.026	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	-58.5	-177.4	-56.1	-178.2	0	0	0	110.6	R1843 R1896 I1898 L2708 L2720 E2726	R1843-L2728 PolarHBondContact NH2-O 3.3Å; R1896-L2728 HydrophobicContact CG-CD1 4.38Å; I1898-L2728 HydrophobicContact CG2-CD2 3.86Å; L2708-L2728 HydrophobicContact CD2-CD1 3.53Å; L2720-L2728 HydrophobicContact CB-CB 4.33Å; L2720-L2728 WeakPolarHBondContact O-CA 3.2Å; L2720-L2728 WeakPolarHBondContact O-CB 3.39Å; L2720-L2728 PolarHBondContact O-N 2.93Å; E2726-L2728 HydrophobicContact CB-CD2 4.17Å; E2726-L2728 PolarHBondContact O-N 2.81Å
2729	R	90.1	Very high	78.1	Confident	42 Å²	42	43.1 Å²	43.1	16%	0.158	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	159	-169	-57.2	-177.8	-174.1	-103.4	-9.9	111.9	F1882 L1897 L2720 N2788	F1882-R2729 VanDerWaalsContact CE1-CZ 3.49Å; L1897-R2729 VanDerWaalsContact CB-NH2 3.26Å; L1897-R2729 PolarHBondContact O-NH2 2.99Å; L2720-R2729 HydrophobicContact CB-CB 4.34Å; L2720-R2729 HydrophobicContact CD1-CB 4.27Å; L2720-R2729 PolarHBondContact N-O 2.96Å; L2720-R2729 PolarHBondContact O-N 2.76Å; R2729-N2788 WeakPolarHBondContact CD-O 3.27Å; R2729-N2788 VanDerWaalsContact CZ-O 3.29Å; R2729-N2788 PolarHBondContact NE-O 3.01Å; R2729-N2788 VanDerWaalsContact NE-O 3.08Å; R2729-N2788 PolarHBondContact NH1-O 3.38Å; R2729-N2788 VanDerWaalsContact NH1-O 3.17Å
2730	C	92	Very high	74.9	Confident	53 Å²	53	49.8 Å²	49.8	36%	0.358	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	123.5	162.4	-178.9	0	0	0	0	108	F1847 C2718 L2719	F1847-C2730 HydrophobicContact CD2-CB 4.31Å; F1847-C2730 HydrophobicContact CE2-CB 3.48Å; F1847-C2730 VanDerWaalsContact CE2-CB 3.48Å; F1847-C2730 HydrophobicContact CZ-CB 4.17Å; C2718-C2730 CarbonylContact O-C 3.58Å; C2718-C2730 WeakPolarHBondContact O-CA 3.32Å; L2719-C2730 HydrophobicContact CD2-CB 3.73Å
2731	L	91.3	Very high	71.8	Confident	6 Å²	6	58.4 Å²	58.4	3%	0.031	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	132.5	177.6	-59.6	-177	0	0	0	108.9	I2710 C2718 L2720 S2733 L2773 Y2785 G2789	I2710-L2731 HydrophobicContact CG2-CD1 4.36Å; C2718-L2731 HydrophobicContact CB-CB 3.87Å; C2718-L2731 HydrophobicContact CB-CD1 4Å; C2718-L2731 HydrophobicContact CB-CG 4.17Å; C2718-L2731 PolarHBondContact O-N 2.86Å; L2720-L2731 HydrophobicContact CD1-CD2 3.65Å; L2720-L2731 HydrophobicContact CD1-CG 4.48Å; L2720-L2731 HydrophobicContact CD2-CD2 4.49Å; L2720-L2731 HydrophobicContact CG-CD2 3.89Å; L2720-L2731 HydrophobicContact CG-CG 4.2Å; L2731-S2733 PolarHBondContact O-N 3.18Å; L2731-L2773 HydrophobicContact CD2-CD1 4.43Å; L2731-Y2785 HydrophobicContact CB-CD1 4.43Å; L2731-Y2785 HydrophobicContact CB-CE1 4.19Å; L2731-Y2785 HydrophobicContact CD1-CD2 4.46Å; L2731-Y2785 HydrophobicContact CD2-CD1 4.35Å; L2731-G2789 VanDerWaalsContact CD2-CA 3.42Å
2732	P	85.5	Confident	68.4	Low	62 Å²	62	66.2 Å²	66.2	40%	0.403	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-63.4	131	178.4	25.6	-31.8	0	0	0	109.7	Y2785 G2789 L2791	P2732-Y2785 HydrophobicContact CG-CD1 4.46Å; P2732-Y2785 HydrophobicContact CG-CE1 4.09Å; P2732-Y2785 WeakPolarHBondContact O-CE1 3.27Å; P2732-Y2785 PolarHBondContact O-OH 3.34Å; P2732-G2789 VanDerWaalsContact CD-O 3.24Å; P2732-G2789 WeakPolarHBondContact CD-O 3.47Å; P2732-L2791 HydrophobicContact CG-CB 4.05Å
2733	S	76.9	Confident	65.1	Low	45 Å²	45	72.6 Å²	72.6	32%	0.315	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-63.4	137.1	176.6	-170.4	0	0	0	0	110	L2731 C2735	L2731-S2733 PolarHBondContact O-N 3.18Å; S2733-C2735 PolarHBondContact O-N 3.07Å
2734	P	72.6	Confident	62	Low	3 Å²	3	77.3 Å²	77.3	2%	0.019	43%	0.429	C	S	.	.			trans	-66.8	103.5	172.8	26.7	-30.3	0	0	0	108.6	M2760 F2777 T2794	P2734-M2760 HydrophobicContact CG-SD 4.22Å; P2734-F2777 HydrophobicContact CG-CB 4.37Å; P2734-F2777 HydrophobicContact CG-CD1 4.13Å; P2734-F2777 HydrophobicContact CG-CD2 3.82Å; P2734-F2777 HydrophobicContact CG-CE1 4.36Å; P2734-F2777 HydrophobicContact CG-CE2 4.09Å; P2734-F2777 HydrophobicContact CG-CG 3.85Å; P2734-F2777 HydrophobicContact CG-CZ 4.34Å; P2734-T2794 HydrophobicContact CB-CG2 4Å
2735	C	59.7	Low	59.1	Low	83 Å²	83	79.9 Å²	79.9	56%	0.561	45%	0.453	S	S	*	.			trans	-74.9	125.7	168.8	-89.1	0	0	0	0	108.9	S2733 T2737	S2733-C2735 PolarHBondContact O-N 3.07Å; C2735-T2737 PolarHBondContact O-N 3.2Å
2736	T	42.4	Very low	56	Low	59 Å²	59	84.4 Å²	84.4	36%	0.362	48%	0.484	S	S	.	.			trans	-74.1	64	163.4	39.6	0	0	0	0	110	I2738 M2760	T2736-I2738 VanDerWaalsContact C-N 3.29Å; T2736-I2738 PolarHBondContact O-N 3.5Å; T2736-M2760 HydrophobicContact CG2-SD 4.11Å
2737	T	38.6	Very low	52.9	Low	117 Å²	117	88.4 Å²	88.4	72%	0.718	52%	0.516	S	S	*	.			trans	-73.3	98.6	158.7	-38.5	0	0	0	0	105.7	C2735 L2739	C2735-T2737 PolarHBondContact O-N 3.2Å; T2737-L2739 PolarHBondContact O-N 3.36Å
2738	I	33.5	Very low	49.8	Very low	135 Å²	135	93 Å²	93	69%	0.692	55%	0.548	S	S	*	.			trans	-43.1	117.3	173.5	-64.4	166.7	0	0	0	107.9	T2736 N2740	T2736-I2738 VanDerWaalsContact C-N 3.29Å; T2736-I2738 PolarHBondContact O-N 3.5Å; I2738-N2740 PolarHBondContact O-N 3.3Å
2739	L	30.5	Very low	46.6	Very low	167 Å²	167	99.8 Å²	99.8	87%	0.874	59%	0.59	S	S	*	*			trans	-66.2	57.8	-179.5	-85.4	160.7	0	0	0	112.2	T2737 H2741	T2737-L2739 PolarHBondContact O-N 3.36Å; L2739-H2741 VanDerWaalsContact C-N 3.27Å; L2739-H2741 PolarHBondContact O-N 3.39Å
2740	N	28.3	Very low	43.7	Very low	140 Å²	140	101.4 Å²	101.4	75%	0.749	61%	0.613	S	S	*	*			trans	-95	45.2	168.1	-74.2	-10.1	0	0	0	110.7	I2738 Q2742	I2738-N2740 PolarHBondContact O-N 3.3Å; N2740-Q2742 VanDerWaalsContact C-N 3.3Å; N2740-Q2742 PolarHBondContact O-N 3.35Å
2741	H	29.7	Very low	40.6	Very low	183 Å²	183	106.1 Å²	106.1	85%	0.847	63%	0.633	S	S	*	*			trans	-91.9	71	160.2	-91.2	-56.6	0	0	0	109	L2739	L2739-H2741 VanDerWaalsContact C-N 3.27Å; L2739-H2741 PolarHBondContact O-N 3.39Å
2742	Q	24.8	Very low	37.8	Very low	166 Å²	166	111.6 Å²	111.6	78%	0.776	67%	0.666	S	S	*	*			trans	-77.9	124.8	142.6	-79.7	-139.4	-11.9	0	0	107.1	N2740 S2744	N2740-Q2742 VanDerWaalsContact C-N 3.3Å; N2740-Q2742 PolarHBondContact O-N 3.35Å; Q2742-S2744 PolarHBondContact O-N 2.81Å
2743	P	25.7	Very low	35.3	Very low	134 Å²	134	114.7 Å²	114.7	87%	0.87	68%	0.679	S	S	*	*			trans	-74.2	83.6	176.4	30.3	-30.6	0	0	0	108.1
2744	S	26.9	Very low	33.3	Very low	100 Å²	100	119.8 Å²	119.8	70%	0.699	70%	0.703	S	S	*	*			trans	-103.4	122.3	168.4	55.2	0	0	0	0	109.6	Q2742	Q2742-S2744 PolarHBondContact O-N 2.81Å
2745	T	25.3	Very low	31.7	Very low	125 Å²	125	126.1 Å²	126.1	77%	0.767	74%	0.737	S	S	*	*			trans	-30.3	149.7	167.4	48.9	0	0	0	0	116.7
2746	S	27	Very low	30.9	Very low	102 Å²	102	128.6 Å²	128.6	71%	0.713	75%	0.749	S	S	*	*			trans	73.8	107.8	152.6	59.4	0	0	0	0	119.2
2747	S	25.4	Very low	31.4	Very low	119 Å²	119	129 Å²	129	83%	0.832	75%	0.752	S	S	*	*			trans	45.8	87.9	132.9	63.1	0	0	0	0	118.4
2748	S	27.4	Very low	32.3	Very low	106 Å²	106	127.2 Å²	127.2	74%	0.741	75%	0.749	S	S	*	*			trans	-156.9	123.6	135.3	68.6	0	0	0	0	109	A2750	S2748-A2750 PolarHBondContact O-N 2.98Å
2749	T	25.9	Very low	33.9	Very low	148 Å²	148	124.2 Å²	124.2	91%	0.908	74%	0.738	S	S	*	*			trans	-60.8	79.2	169.5	41.6	0	0	0	0	110.1	I2751	T2749-I2751 PolarHBondContact O-N 3.01Å
2750	A	27.8	Very low	36.4	Very low	76 Å²	76	116.8 Å²	116.8	63%	0.628	70%	0.699	S	S	*	*			trans	-84.7	108.3	166.9	0	0	0	0	0	107.1	S2748 V2752	S2748-A2750 PolarHBondContact O-N 2.98Å; A2750-V2752 PolarHBondContact O-N 2.77Å
2751	I	26.7	Very low	39.3	Very low	153 Å²	153	114 Å²	114	79%	0.785	68%	0.681	S	S	*	*			trans	-53.4	105.4	167	-63.4	160.3	0	0	0	105.6	T2749 D2753	T2749-I2751 PolarHBondContact O-N 3.01Å; I2751-D2753 PolarHBondContact O-N 3.01Å
2752	V	33.9	Very low	42.3	Very low	121 Å²	121	105.3 Å²	105.3	73%	0.733	64%	0.641	S	S	*	*			trans	-70.8	100.5	175	178.4	0	0	0	0	105.2	A2750 N2754	A2750-V2752 PolarHBondContact O-N 2.77Å; V2752-N2754 PolarHBondContact O-N 3.14Å
2753	D	32.5	Very low	45.6	Very low	127 Å²	127	99.1 Å²	99.1	68%	0.679	61%	0.613	S	S	*	*			trans	-49.1	112.8	161.3	-78.5	-35.4	0	0	0	106.4	I2751 D2755	I2751-D2753 PolarHBondContact O-N 3.01Å; D2753-D2755 PolarHBondContact O-N 2.9Å
2754	N	34.4	Very low	49	Very low	152 Å²	152	94 Å²	94	81%	0.813	58%	0.579	S	S	*	*			trans	-66.8	71.1	166.7	-87.3	-28.6	0	0	0	106.7	V2752 V2756	V2752-N2754 PolarHBondContact O-N 3.14Å; N2754-V2756 VanDerWaalsContact C-N 3.31Å; N2754-V2756 PolarHBondContact O-N 3.01Å
2755	D	39.9	Very low	52.3	Low	136 Å²	136	89.6 Å²	89.6	73%	0.727	55%	0.547	S	S	*	.			trans	-57.9	105	164.8	-94.4	-20.8	0	0	0	105.5	D2753 T2757	D2753-D2755 PolarHBondContact O-N 2.9Å; D2755-T2757 PolarHBondContact O-N 2.57Å
2756	V	43.4	Very low	55.6	Low	134 Å²	134	85 Å²	85	81%	0.812	52%	0.519	S	S	*	.			trans	-63.4	85.1	170.5	179.7	0	0	0	0	105.3	N2754 A2758	N2754-V2756 VanDerWaalsContact C-N 3.31Å; N2754-V2756 PolarHBondContact O-N 3.01Å; V2756-A2758 PolarHBondContact O-N 3.15Å
2757	T	51.4	Low	58.9	Low	68 Å²	68	82.1 Å²	82.1	42%	0.417	49%	0.493	S	S	.	.			trans	-56.4	115.5	172.2	53.3	0	0	0	0	106.1	D2755	D2755-T2757 PolarHBondContact O-N 2.57Å
2758	A	58	Low	62.3	Low	80 Å²	80	77 Å²	77	66%	0.661	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-49.7	132.1	179.3	0	0	0	0	0	108.9	V2756 M2760	V2756-A2758 PolarHBondContact O-N 3.15Å; A2758-M2760 PolarHBondContact O-N 3.38Å
2759	P	66.8	Low	65.4	Low	72 Å²	72	76.4 Å²	76.4	47%	0.468	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-61.2	131.1	-174.5	26.2	-34.6	0	0	0	109.7	N2715	N2715-P2759 WeakPolarHBondContact O-CB 3.25Å; N2715-P2759 WeakPolarHBondContact O-CG 3.48Å
2760	M	82.6	Confident	68.5	Low	10 Å²	10	71.7 Å²	71.7	5%	0.049	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-72.1	132.3	-174.3	-60.9	-175.2	66.3	0	0	110.6	G2716 P2734 T2736 A2758 P2762 F2777 N2778 Q2781	G2716-M2760 WeakPolarHBondContact CA-O 3.47Å; P2734-M2760 HydrophobicContact CG-SD 4.22Å; T2736-M2760 HydrophobicContact CG2-SD 4.11Å; A2758-M2760 PolarHBondContact O-N 3.38Å; M2760-P2762 WeakPolarHBondContact O-CD 3.25Å; M2760-F2777 HydrophobicContact CB-CB 4.03Å; M2760-F2777 HydrophobicContact CB-CD1 4.38Å; M2760-F2777 HydrophobicContact CE-CB 4.02Å; M2760-N2778 HydrophobicContact CE-CB 3.89Å; M2760-N2778 WeakPolarHBondContact CE-ND2 3.39Å; M2760-N2778 WeakPolarHBondContact CG-ND2 3.35Å; M2760-Q2781 HydrophobicContact CE-CB 3.86Å; M2760-Q2781 HydrophobicContact CE-CG 3.64Å; M2760-Q2781 PolarHBondContact SD-OE1 3.34Å
2761	Q	89.3	Confident	71.4	Confident	82 Å²	82	68.5 Å²	68.5	38%	0.383	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-81.3	126.4	-173.5	-53.8	-168.1	-11	0	0	110.5	M2714 N2763 F2777 N2778	M2714-Q2761 VanDerWaalsContact O-CG 3.27Å; M2714-Q2761 WeakPolarHBondContact O-CG 3.44Å; M2714-Q2761 PolarHBondContact O-NE2 3.34Å; Q2761-N2763 PolarHBondContact O-N 2.92Å; Q2761-N2763 PolarHBondContact O-OD1 2.64Å; Q2761-F2777 VanDerWaalsContact O-CA 3.32Å; Q2761-F2777 WeakPolarHBondContact O-CA 3.39Å; Q2761-N2778 PolarHBondContact N-OD1 2.97Å; Q2761-N2778 PolarHBondContact O-N 2.81Å
2762	P	93.7	Very high	74.6	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	116.3	173	28.6	-36.3	0	0	0	109.9	N2698 C2699 S2713 M2760 L2765 F2777	N2698-P2762 PolarHBondContact ND2-O 2.9Å; C2699-P2762 PolarHBondContact SG-O 2.83Å; S2713-P2762 VanDerWaalsContact O-CD 3.25Å; S2713-P2762 WeakPolarHBondContact O-CD 3.5Å; S2713-P2762 WeakPolarHBondContact O-CG 3.41Å; M2760-P2762 WeakPolarHBondContact O-CD 3.25Å; P2762-L2765 HydrophobicContact CB-CG 4.47Å; P2762-F2777 HydrophobicContact CB-CD1 4.02Å; P2762-F2777 HydrophobicContact CB-CE1 3.8Å
2763	N	94.3	Very high	77.6	Confident	36 Å²	36	57.7 Å²	57.7	19%	0.193	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-34.1	177.6	-63.6	98.9	0	0	0	112.3	N2598 Q2761 L2776 N2778 L2779	N2598-N2763 PolarHBondContact ND2-O 3.14Å; Q2761-N2763 PolarHBondContact O-N 2.92Å; Q2761-N2763 PolarHBondContact O-OD1 2.64Å; N2763-L2776 PolarHBondContact N-O 3.32Å; N2763-N2778 WeakPolarHBondContact OD1-CA 3.28Å; N2763-N2778 PolarHBondContact OD1-N 3.42Å; N2763-L2779 HydrophobicContact CB-CD2 3.73Å; N2763-L2779 VanDerWaalsContact CG-CD2 3.43Å; N2763-L2779 WeakPolarHBondContact ND2-CD2 3.5Å; N2763-L2779 PolarHBondContact OD1-N 3.46Å
2764	L	95.5	Very high	80.6	Confident	28 Å²	28	51.8 Å²	51.8	15%	0.147	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	134.4	179.5	-177.4	73.6	0	0	0	109.2	N2598 G2775 L2776 V2813	N2598-L2764 WeakPolarHBondContact OD1-CD1 3.42Å; L2764-G2775 WeakPolarHBondContact O-CA 3.44Å; L2764-L2776 HydrophobicContact CB-CB 4.05Å; L2764-L2776 HydrophobicContact CB-CD2 4.38Å; L2764-L2776 PolarHBondContact N-O 3.4Å; L2764-L2776 PolarHBondContact O-N 2.95Å; L2764-V2813 HydrophobicContact CD2-CB 3.7Å; L2764-V2813 HydrophobicContact CD2-CG2 3.92Å
2765	L	96.6	Very high	83.5	Confident	6 Å²	6	44.6 Å²	44.6	3%	0.031	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	135.9	171	-68.7	165.7	0	0	0	108.1	S2701 I2710 G2712 P2762 L2774	S2701-L2765 WeakPolarHBondContact CB-O 3.33Å; S2701-L2765 PolarHBondContact OG-O 3.15Å; I2710-L2765 HydrophobicContact CG2-CB 4.3Å; I2710-L2765 HydrophobicContact CG2-CD1 3.98Å; I2710-L2765 HydrophobicContact CG2-CD2 4.41Å; I2710-L2765 HydrophobicContact CG2-CG 4.48Å; G2712-L2765 VanDerWaalsContact N-CD1 3.28Å; P2762-L2765 HydrophobicContact CB-CG 4.47Å; L2765-L2774 WeakPolarHBondContact CA-O 3.22Å
2766	T	96	Very high	86.2	Confident	30 Å²	30	38.3 Å²	38.3	18%	0.184	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	167.4	177	-169.4	0	0	0	0	110.2	L2774 F2815	T2766-L2774 HydrophobicContact CG2-CB 3.84Å; T2766-L2774 HydrophobicContact CG2-CD2 4.05Å; T2766-L2774 HydrophobicContact CG2-CG 4.48Å; T2766-L2774 PolarHBondContact N-O 3.31Å; T2766-L2774 PolarHBondContact O-N 3.06Å; T2766-F2815 HydrophobicContact CG2-CD2 4.24Å; T2766-F2815 HydrophobicContact CG2-CE2 4.02Å
2767	Y	95.8	Very high	88.6	Confident	40 Å²	40	32 Å²	32	16%	0.157	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	164.6	180	67	-87.7	0	0	0	110.3	E2647 S2701 L2702 S2703 L2706 Y2772	E2647-Y2767 WeakPolarHBondContact OE1-CE2 3.47Å; E2647-Y2767 PolarHBondContact OE1-OH 3.2Å; E2647-Y2767 PolarHBondContact OE2-OH 3.33Å; S2701-Y2767 VanDerWaalsContact OG-CD1 3.24Å; S2701-Y2767 WeakPolarHBondContact OG-CD1 3.38Å; S2701-Y2767 WeakPolarHBondContact OG-CE1 3.37Å; L2702-Y2767 VanDerWaalsContact C-CE1 3.5Å; L2702-Y2767 WeakPolarHBondContact O-CE1 3.46Å; L2702-Y2767 PolarHBondContact O-OH 2.92Å; S2703-Y2767 WeakPolarHBondContact OG-CE2 3.28Å; L2706-Y2767 HydrophobicContact CD1-CD2 3.83Å; L2706-Y2767 HydrophobicContact CD1-CG 4.46Å; Y2767-Y2772 CarbonylContact C-O 3.58Å; Y2767-Y2772 VanDerWaalsContact CA-O 3.29Å; Y2767-Y2772 WeakPolarHBondContact CA-O 3.47Å
2768	H	95.7	Very high	90.4	Very high	13 Å²	13	32.5 Å²	32.5	6%	0.06	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	143.5	168.4	-170	-104.4	0	0	0	109.8	E2770 G2771 Y2772 F2815 S2816 N2817 G2819	H2768-E2770 WeakPolarHBondContact CE1-CG 3.29Å; H2768-E2770 WeakPolarHBondContact ND1-CB 3.49Å; H2768-E2770 WeakPolarHBondContact ND1-CG 3.45Å; H2768-E2770 PolarHBondContact ND1-N 2.8Å; H2768-E2770 VanDerWaalsContact ND1-N 3.17Å; H2768-E2770 PolarHBondContact O-N 3.22Å; H2768-G2771 PolarHBondContact O-N 3.12Å; H2768-Y2772 PolarHBondContact N-O 3.03Å; H2768-Y2772 PolarHBondContact O-N 3.37Å; H2768-F2815 HydrophobicContact CB-CB 4.44Å; H2768-F2815 HydrophobicContact CB-CD1 4.05Å; H2768-F2815 HydrophobicContact CB-CD2 3.89Å; H2768-F2815 HydrophobicContact CB-CE1 4.22Å; H2768-F2815 HydrophobicContact CB-CE2 4.07Å; H2768-F2815 HydrophobicContact CB-CG 3.88Å; H2768-F2815 HydrophobicContact CB-CZ 4.23Å; H2768-F2815 AromaticContact CD2-CG 3.94Å; H2768-S2816 PolarHBondContact NE2-O 2.84Å; H2768-S2816 VanDerWaalsContact NE2-O 3.16Å; H2768-N2817 PolarHBondContact NE2-O 2.81Å; H2768-G2819 WeakPolarHBondContact CE1-CA 3.3Å; H2768-G2819 PolarHBondContact CE1-N 3.12Å; H2768-G2819 WeakPolarHBondContact ND1-CA 3.44Å; H2768-G2819 WeakPolarHBondContact NE2-CA 3.46Å; H2768-G2819 PolarHBondContact NE2-N 3.49Å
2769	R	92.4	Very high	91.9	Very high	92 Å²	92	30.2 Å²	30.2	35%	0.347	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.4	179.4	67.5	168.5	-135.4	170	6.5	114	R1895 E2705 G2771	R1895-R2769 VanDerWaalsContact CZ-O 3.23Å; R1895-R2769 PolarHBondContact NH1-O 3.43Å; R1895-R2769 PolarHBondContact NH2-O 2.83Å; E2705-R2769 WeakPolarHBondContact OE2-CB 3.26Å; R2769-G2771 PolarHBondContact O-N 3.16Å
2770	E	91.8	Very high	93.1	Very high	50 Å²	50	27.8 Å²	27.8	23%	0.234	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	2.5	174.4	-60.6	-58.7	135.3	0	0	113.3	R1893 R1895 H2768 Y2772	R1893-E2770 IonicContact CZ-OE2 2.75Å; R1893-E2770 IonicContact NH1-OE1 3.85Å; R1893-E2770 IonicContact NH1-OE2 2.93Å; R1893-E2770 PolarHBondContact NH1-OE2 3.27Å; R1893-E2770 IonicContact NH2-OE1 2.63Å; R1893-E2770 IonicContact NH2-OE2 2.81Å; R1895-E2770 PolarHBondContact NH1-O 2.74Å; H2768-E2770 WeakPolarHBondContact CE1-CG 3.29Å; H2768-E2770 WeakPolarHBondContact ND1-CB 3.49Å; H2768-E2770 WeakPolarHBondContact ND1-CG 3.45Å; H2768-E2770 PolarHBondContact ND1-N 2.8Å; H2768-E2770 VanDerWaalsContact ND1-N 3.17Å; H2768-E2770 PolarHBondContact O-N 3.22Å; E2770-Y2772 HydrophobicContact CB-CD2 4.2Å; E2770-Y2772 HydrophobicContact CB-CE2 4.18Å
2771	G	89.1	Confident	93.5	Very high	9 Å²	9	28 Å²	28	9%	0.093	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.1	27.2	171.2	0	0	0	0	0	113.3	R1895 H2768 R2769 L2787	R1895-G2771 VanDerWaalsContact NH1-N 3.12Å; H2768-G2771 PolarHBondContact O-N 3.12Å; R2769-G2771 PolarHBondContact O-N 3.16Å; G2771-L2787 WeakPolarHBondContact O-CB 2.93Å; G2771-L2787 PolarHBondContact O-N 2.9Å
2772	Y	93.6	Very high	93.8	Very high	45 Å²	45	24.1 Å²	24.1	18%	0.176	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	136.1	172	-64.2	-68.3	0	0	0	109.8	Y2767 H2768 E2770 L2784 L2792	Y2767-Y2772 CarbonylContact C-O 3.58Å; Y2767-Y2772 VanDerWaalsContact CA-O 3.29Å; Y2767-Y2772 WeakPolarHBondContact CA-O 3.47Å; H2768-Y2772 PolarHBondContact N-O 3.03Å; H2768-Y2772 PolarHBondContact O-N 3.37Å; E2770-Y2772 HydrophobicContact CB-CD2 4.2Å; E2770-Y2772 HydrophobicContact CB-CE2 4.18Å; Y2772-L2784 HydrophobicContact CD1-CD1 4.21Å; Y2772-L2784 HydrophobicContact CD1-CD2 4.31Å; Y2772-L2784 HydrophobicContact CD1-CG 4.41Å; Y2772-L2784 HydrophobicContact CG-CD1 4.36Å; Y2772-L2792 HydrophobicContact CD1-CD1 4.25Å; Y2772-L2792 HydrophobicContact CE1-CD1 4.14Å
2773	L	96.3	Very high	93.8	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.01	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	141	171.6	-43.3	-178.7	0	0	0	108.1	I2710 L2720 L2731 L2784 Y2785 T2786	I2710-L2773 HydrophobicContact CD1-CB 4.33Å; I2710-L2773 HydrophobicContact CD1-CD1 4.13Å; I2710-L2773 HydrophobicContact CD1-CD2 3.56Å; I2710-L2773 HydrophobicContact CD1-CG 4.22Å; L2720-L2773 HydrophobicContact CD1-CD1 3.84Å; L2720-L2773 HydrophobicContact CD2-CD1 3.72Å; L2720-L2773 HydrophobicContact CG-CD1 4.39Å; L2731-L2773 HydrophobicContact CD2-CD1 4.43Å; L2773-L2784 CarbonylContact O-C 3.59Å; L2773-L2784 WeakPolarHBondContact O-CA 3.2Å; L2773-Y2785 PolarHBondContact N-O 3.21Å; L2773-Y2785 PolarHBondContact O-N 3.41Å; L2773-T2786 WeakPolarHBondContact CD1-O 3.46Å
2774	L	96	Very high	93.9	Very high	3 Å²	3	22.5 Å²	22.5	2%	0.016	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	129.1	-175.3	-166.3	75.8	0	0	0	109.4	L2765 T2766 L2782 S2783 L2784 V2813 F2815 I2822 L2839	L2765-L2774 WeakPolarHBondContact CA-O 3.22Å; T2766-L2774 HydrophobicContact CG2-CB 3.84Å; T2766-L2774 HydrophobicContact CG2-CD2 4.05Å; T2766-L2774 HydrophobicContact CG2-CG 4.48Å; T2766-L2774 PolarHBondContact N-O 3.31Å; T2766-L2774 PolarHBondContact O-N 3.06Å; L2774-L2782 HydrophobicContact CD1-CD1 3.98Å; L2774-L2782 HydrophobicContact CD1-CD2 4.19Å; L2774-L2782 HydrophobicContact CD1-CG 3.83Å; L2774-L2782 HydrophobicContact CD2-CD1 3.87Å; L2774-L2782 HydrophobicContact CD2-CD2 4.37Å; L2774-L2782 HydrophobicContact CD2-CG 4.39Å; L2774-L2782 HydrophobicContact CG-CD1 3.72Å; L2774-L2782 HydrophobicContact CG-CG 4.16Å; L2774-S2783 WeakPolarHBondContact CA-O 2.91Å; L2774-L2784 HydrophobicContact CD1-CB 4.19Å; L2774-L2784 HydrophobicContact CD1-CD1 3.79Å; L2774-V2813 HydrophobicContact CD2-CG1 3.44Å; L2774-V2813 VanDerWaalsContact CD2-CG1 3.44Å; L2774-F2815 HydrophobicContact CB-CE2 3.72Å; L2774-F2815 HydrophobicContact CB-CZ 3.84Å; L2774-F2815 HydrophobicContact CD1-CZ 4.41Å; L2774-F2815 HydrophobicContact CD2-CE2 3.86Å; L2774-F2815 HydrophobicContact CD2-CZ 3.9Å; L2774-F2815 HydrophobicContact CG-CE2 4.4Å; L2774-F2815 HydrophobicContact CG-CZ 4.3Å; L2774-I2822 HydrophobicContact CD1-CD1 3.96Å; L2774-I2822 HydrophobicContact CD2-CD1 3.86Å; L2774-I2822 HydrophobicContact CD2-CG1 4.46Å; L2774-I2822 HydrophobicContact CD2-CG2 4.17Å; L2774-L2839 HydrophobicContact CD1-CD2 4.3Å
2775	G	95.3	Very high	93.9	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.3	175.7	0	0	0	0	0	111.7	L2764 F2777 S2783	L2764-G2775 WeakPolarHBondContact O-CA 3.44Å; G2775-F2777 WeakPolarHBondContact O-CD2 3.15Å; G2775-F2777 WeakPolarHBondContact O-CE2 3.31Å; G2775-S2783 PolarHBondContact N-O 3.05Å; G2775-S2783 PolarHBondContact O-N 2.91Å
2776	L	95.7	Very high	93.8	Very high	4 Å²	4	21.3 Å²	21.3	2%	0.021	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	120.5	168.1	178.3	66.6	0	0	0	108.8	N2763 L2764 Q2781 L2782 I2810 V2813	N2763-L2776 PolarHBondContact N-O 3.32Å; L2764-L2776 HydrophobicContact CB-CB 4.05Å; L2764-L2776 HydrophobicContact CB-CD2 4.38Å; L2764-L2776 PolarHBondContact N-O 3.4Å; L2764-L2776 PolarHBondContact O-N 2.95Å; L2776-Q2781 CarbonylContact C-O 3.6Å; L2776-Q2781 WeakPolarHBondContact CA-O 3.29Å; L2776-L2782 HydrophobicContact CB-CD1 4.41Å; L2776-L2782 HydrophobicContact CD1-CD1 4.49Å; L2776-I2810 HydrophobicContact CD1-CB 3.99Å; L2776-I2810 HydrophobicContact CD1-CD1 3.81Å; L2776-I2810 HydrophobicContact CD1-CG1 4.43Å; L2776-I2810 HydrophobicContact CD1-CG2 4.32Å; L2776-I2810 HydrophobicContact CD2-CB 3.88Å; L2776-I2810 HydrophobicContact CD2-CG2 3.84Å; L2776-I2810 WeakPolarHBondContact CD2-O 3.44Å; L2776-V2813 HydrophobicContact CD2-CG2 4.35Å
2777	F	93.8	Very high	93.7	Very high	2 Å²	2	20.3 Å²	20.3	1%	0.009	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	138.6	-177	-60.9	-94.4	0	0	0	110.6	P2734 M2760 Q2761 P2762 G2775 L2779 S2780 Q2781 Y2785	P2734-F2777 HydrophobicContact CG-CB 4.37Å; P2734-F2777 HydrophobicContact CG-CD1 4.13Å; P2734-F2777 HydrophobicContact CG-CD2 3.82Å; P2734-F2777 HydrophobicContact CG-CE1 4.36Å; P2734-F2777 HydrophobicContact CG-CE2 4.09Å; P2734-F2777 HydrophobicContact CG-CG 3.85Å; P2734-F2777 HydrophobicContact CG-CZ 4.34Å; M2760-F2777 HydrophobicContact CB-CB 4.03Å; M2760-F2777 HydrophobicContact CB-CD1 4.38Å; M2760-F2777 HydrophobicContact CE-CB 4.02Å; Q2761-F2777 VanDerWaalsContact O-CA 3.32Å; Q2761-F2777 WeakPolarHBondContact O-CA 3.39Å; P2762-F2777 HydrophobicContact CB-CD1 4.02Å; P2762-F2777 HydrophobicContact CB-CE1 3.8Å; G2775-F2777 WeakPolarHBondContact O-CD2 3.15Å; G2775-F2777 WeakPolarHBondContact O-CE2 3.31Å; F2777-L2779 PolarHBondContact O-N 3.36Å; F2777-S2780 PolarHBondContact O-N 3.36Å; F2777-Q2781 HydrophobicContact CB-CB 4.48Å; F2777-Q2781 PolarHBondContact N-O 2.79Å; F2777-Q2781 PolarHBondContact O-N 3.15Å; F2777-Y2785 HydrophobicContact CE2-CE2 4.22Å; F2777-Y2785 HydrophobicContact CZ-CE2 4.47Å
2778	N	89.7	Confident	93.7	Very high	79 Å²	79	18.9 Å²	18.9	42%	0.422	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	30.9	-177.4	-67	-11.5	0	0	0	113.9	M2760 Q2761 N2763 S2780	M2760-N2778 HydrophobicContact CE-CB 3.89Å; M2760-N2778 WeakPolarHBondContact CE-ND2 3.39Å; M2760-N2778 WeakPolarHBondContact CG-ND2 3.35Å; Q2761-N2778 PolarHBondContact N-OD1 2.97Å; Q2761-N2778 PolarHBondContact O-N 2.81Å; N2763-N2778 WeakPolarHBondContact OD1-CA 3.28Å; N2763-N2778 PolarHBondContact OD1-N 3.42Å; N2778-S2780 PolarHBondContact O-N 2.6Å
2779	L	90.7	Very high	93.5	Very high	31 Å²	31	18.8 Å²	18.8	16%	0.162	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	-4.3	-179.8	-54.1	171	0	0	0	117.4	N2763 F2777 Q2809 I2810	N2763-L2779 HydrophobicContact CB-CD2 3.73Å; N2763-L2779 VanDerWaalsContact CG-CD2 3.43Å; N2763-L2779 WeakPolarHBondContact ND2-CD2 3.5Å; N2763-L2779 PolarHBondContact OD1-N 3.46Å; F2777-L2779 PolarHBondContact O-N 3.36Å; L2779-Q2809 HydrophobicContact CB-CB 4.2Å; L2779-Q2809 HydrophobicContact CB-CG 4.18Å; L2779-Q2809 HydrophobicContact CD1-CG 4.25Å; L2779-I2810 WeakPolarHBondContact O-CB 2.96Å; L2779-I2810 PolarHBondContact O-N 3.17Å
2780	S	90.4	Very high	93.5	Very high	21 Å²	21	18.1 Å²	18.1	15%	0.147	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.2	-19.5	179.4	71.4	0	0	0	0	114.8	F2777 N2778 D2796 L2797	F2777-S2780 PolarHBondContact O-N 3.36Å; N2778-S2780 PolarHBondContact O-N 2.6Å; S2780-D2796 PolarHBondContact OG-OD1 2.84Å; S2780-L2797 PolarHBondContact O-N 3.46Å
2781	Q	91.9	Very high	93.6	Very high	15 Å²	15	18.7 Å²	18.7	7%	0.07	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	122.5	-175.5	-64.9	-158.6	-5.2	0	0	111.9	M2760 L2776 F2777 T2795 D2796	M2760-Q2781 HydrophobicContact CE-CB 3.86Å; M2760-Q2781 HydrophobicContact CE-CG 3.64Å; M2760-Q2781 PolarHBondContact SD-OE1 3.34Å; L2776-Q2781 CarbonylContact C-O 3.6Å; L2776-Q2781 WeakPolarHBondContact CA-O 3.29Å; F2777-Q2781 HydrophobicContact CB-CB 4.48Å; F2777-Q2781 PolarHBondContact N-O 2.79Å; F2777-Q2781 PolarHBondContact O-N 3.15Å; Q2781-T2795 WeakPolarHBondContact CA-O 3.4Å; Q2781-D2796 HydrophobicContact CG-CB 4.05Å; Q2781-D2796 PolarHBondContact NE2-OD2 3.35Å; Q2781-D2796 VanDerWaalsContact NE2-OD2 3.16Å
2782	L	94.9	Very high	93.8	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.005	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	122.7	179.5	-164.6	65.9	0	0	0	109.3	L2774 L2776 T2794 T2795 L2797 V2813 I2824 L2834 L2839	L2774-L2782 HydrophobicContact CD1-CD1 3.98Å; L2774-L2782 HydrophobicContact CD1-CD2 4.19Å; L2774-L2782 HydrophobicContact CD1-CG 3.83Å; L2774-L2782 HydrophobicContact CD2-CD1 3.87Å; L2774-L2782 HydrophobicContact CD2-CD2 4.37Å; L2774-L2782 HydrophobicContact CD2-CG 4.39Å; L2774-L2782 HydrophobicContact CG-CD1 3.72Å; L2774-L2782 HydrophobicContact CG-CG 4.16Å; L2776-L2782 HydrophobicContact CB-CD1 4.41Å; L2776-L2782 HydrophobicContact CD1-CD1 4.49Å; L2782-T2794 WeakPolarHBondContact O-CA 3.33Å; L2782-T2795 PolarHBondContact N-O 2.88Å; L2782-T2795 PolarHBondContact O-N 3.16Å; L2782-L2797 HydrophobicContact CB-CD1 3.93Å; L2782-L2797 HydrophobicContact CD2-CD1 4.02Å; L2782-V2813 HydrophobicContact CD1-CG1 4.38Å; L2782-V2813 HydrophobicContact CD1-CG2 4.44Å; L2782-I2824 HydrophobicContact CD2-CG2 4.47Å; L2782-L2834 HydrophobicContact CD2-CD1 4Å; L2782-L2839 HydrophobicContact CB-CD1 4.43Å; L2782-L2839 HydrophobicContact CD2-CD2 4.03Å; L2782-L2839 HydrophobicContact CG-CD1 4.39Å; L2782-L2839 WeakPolarHBondContact O-CD1 3.38Å
2783	S	94.8	Very high	93.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.8	178.2	-58.9	0	0	0	0	111.3	L2774 G2775 R2793 T2794	L2774-S2783 WeakPolarHBondContact CA-O 2.91Å; G2775-S2783 PolarHBondContact N-O 3.05Å; G2775-S2783 PolarHBondContact O-N 2.91Å; S2783-R2793 CarbonylContact C-O 3.48Å; S2783-R2793 VanDerWaalsContact CA-O 3.28Å; S2783-R2793 WeakPolarHBondContact CA-O 3.5Å; S2783-T2794 WeakPolarHBondContact OG-CG2 3.35Å; S2783-T2794 PolarHBondContact OG-OG1 3.21Å
2784	L	95.9	Very high	93.5	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	131	178.5	-174.9	78	0	0	0	109.7	Y2772 L2773 L2774 L2792 R2793 F2815 S2836 L2839	Y2772-L2784 HydrophobicContact CD1-CD1 4.21Å; Y2772-L2784 HydrophobicContact CD1-CD2 4.31Å; Y2772-L2784 HydrophobicContact CD1-CG 4.41Å; Y2772-L2784 HydrophobicContact CG-CD1 4.36Å; L2773-L2784 CarbonylContact O-C 3.59Å; L2773-L2784 WeakPolarHBondContact O-CA 3.2Å; L2774-L2784 HydrophobicContact CD1-CB 4.19Å; L2774-L2784 HydrophobicContact CD1-CD1 3.79Å; L2784-L2792 HydrophobicContact CD2-CB 4.23Å; L2784-L2792 HydrophobicContact CD2-CD1 3.93Å; L2784-L2792 HydrophobicContact CG-CB 4.47Å; L2784-L2792 HydrophobicContact CG-CD1 4.25Å; L2784-L2792 WeakPolarHBondContact O-CB 3.13Å; L2784-L2792 PolarHBondContact O-N 3.37Å; L2784-R2793 PolarHBondContact N-O 3.14Å; L2784-R2793 PolarHBondContact O-N 3.29Å; L2784-F2815 HydrophobicContact CD1-CZ 4.37Å; L2784-S2836 VanDerWaalsContact CD2-O 3.31Å; L2784-S2836 WeakPolarHBondContact CD2-O 3.43Å; L2784-L2839 HydrophobicContact CB-CD1 4.3Å
2785	Y	95.6	Very high	93.4	Very high	1 Å²	1	28.5 Å²	28.5	0%	0.004	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	157.4	177.1	-50.4	-104.7	0	0	0	110.7	L2731 P2732 L2773 F2777 K2790 L2791	L2731-Y2785 HydrophobicContact CB-CD1 4.43Å; L2731-Y2785 HydrophobicContact CB-CE1 4.19Å; L2731-Y2785 HydrophobicContact CD1-CD2 4.46Å; L2731-Y2785 HydrophobicContact CD2-CD1 4.35Å; P2732-Y2785 HydrophobicContact CG-CD1 4.46Å; P2732-Y2785 HydrophobicContact CG-CE1 4.09Å; P2732-Y2785 WeakPolarHBondContact O-CE1 3.27Å; P2732-Y2785 PolarHBondContact O-OH 3.34Å; L2773-Y2785 PolarHBondContact N-O 3.21Å; L2773-Y2785 PolarHBondContact O-N 3.41Å; F2777-Y2785 HydrophobicContact CE2-CE2 4.22Å; F2777-Y2785 HydrophobicContact CZ-CE2 4.47Å; Y2785-K2790 CarbonylContact C-O 3.22Å; Y2785-K2790 WeakPolarHBondContact CA-O 3.32Å; Y2785-L2791 HydrophobicContact CD1-CB 3.83Å; Y2785-L2791 HydrophobicContact CD1-CD1 3.85Å; Y2785-L2791 HydrophobicContact CD1-CG 4.46Å; Y2785-L2791 HydrophobicContact CE1-CB 3.81Å; Y2785-L2791 HydrophobicContact CE1-CD1 3.46Å; Y2785-L2791 VanDerWaalsContact CE1-CD1 3.46Å; Y2785-L2791 HydrophobicContact CE1-CG 4.16Å; Y2785-L2791 HydrophobicContact CE2-CD1 4.17Å; Y2785-L2791 HydrophobicContact CG-CD1 4.34Å
2786	T	95.3	Very high	93.2	Very high	8 Å²	8	31.3 Å²	31.3	5%	0.049	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	163.7	165	70.7	0	0	0	0	110.7	E2330 L2773 N2788 G2789 K2790 L2792	E2330-T2786 HydrophobicContact CG-CG2 4.06Å; L2773-T2786 WeakPolarHBondContact CD1-O 3.46Å; T2786-N2788 PolarHBondContact O-N 3.32Å; T2786-N2788 PolarHBondContact OG1-N 2.92Å; T2786-G2789 PolarHBondContact O-N 3.4Å; T2786-G2789 PolarHBondContact OG1-N 3.18Å; T2786-K2790 HydrophobicContact CG2-CB 3.99Å; T2786-K2790 PolarHBondContact N-O 2.98Å; T2786-K2790 WeakPolarHBondContact OG1-CB 3.45Å; T2786-K2790 PolarHBondContact OG1-N 2.85Å; T2786-K2790 VanDerWaalsContact OG1-N 3.12Å; T2786-L2792 HydrophobicContact CG2-CD1 3.91Å; T2786-L2792 HydrophobicContact CG2-CD2 3.61Å; T2786-L2792 HydrophobicContact CG2-CG 3.81Å
2787	L	94.2	Very high	92.9	Very high	10 Å²	10	31.3 Å²	31.3	5%	0.052	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-31.4	171.4	-174.9	141.3	0	0	0	112.7	R1895 R1896 L2706 L2708 G2771 G2789	R1895-L2787 HydrophobicContact CB-CD1 4.46Å; R1895-L2787 HydrophobicContact CB-CD2 4.41Å; R1896-L2787 HydrophobicContact CB-CD2 3.89Å; R1896-L2787 HydrophobicContact CG-CD2 4.13Å; L2706-L2787 HydrophobicContact CB-CD1 4.25Å; L2706-L2787 HydrophobicContact CD1-CD1 4.01Å; L2706-L2787 HydrophobicContact CD2-CD1 3.81Å; L2706-L2787 HydrophobicContact CG-CD1 4.24Å; L2708-L2787 HydrophobicContact CD1-CD1 3.97Å; L2708-L2787 HydrophobicContact CD1-CD2 4.21Å; L2708-L2787 HydrophobicContact CD1-CG 3.72Å; G2771-L2787 WeakPolarHBondContact O-CB 2.93Å; G2771-L2787 PolarHBondContact O-N 2.9Å; L2787-G2789 VanDerWaalsContact C-N 3.32Å
2788	N	95	Very high	92.6	Very high	10 Å²	10	33.2 Å²	33.2	5%	0.053	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	17.1	178.4	-63.8	-51.7	0	0	0	113.3	R1895 L1897 E2298 R2729 T2786 K2790	R1895-N2788 PolarHBondContact O-ND2 3.45Å; L1897-N2788 PolarHBondContact N-OD1 2.97Å; E2298-N2788 PolarHBondContact OE1-ND2 3.36Å; R2729-N2788 WeakPolarHBondContact CD-O 3.27Å; R2729-N2788 VanDerWaalsContact CZ-O 3.29Å; R2729-N2788 PolarHBondContact NE-O 3.01Å; R2729-N2788 VanDerWaalsContact NE-O 3.08Å; R2729-N2788 PolarHBondContact NH1-O 3.38Å; R2729-N2788 VanDerWaalsContact NH1-O 3.17Å; T2786-N2788 PolarHBondContact O-N 3.32Å; T2786-N2788 PolarHBondContact OG1-N 2.92Å; N2788-K2790 PolarHBondContact O-N 3.14Å
2789	G	91.8	Very high	92.2	Very high	10 Å²	10	35.9 Å²	35.9	10%	0.103	19%	0.186	C	C	.	.	S	Bend	trans	81.7	9.1	167.1	0	0	0	0	0	116.5	L2731 P2732 T2786 L2787	L2731-G2789 VanDerWaalsContact CD2-CA 3.42Å; P2732-G2789 VanDerWaalsContact CD-O 3.24Å; P2732-G2789 WeakPolarHBondContact CD-O 3.47Å; T2786-G2789 PolarHBondContact O-N 3.4Å; T2786-G2789 PolarHBondContact OG1-N 3.18Å; L2787-G2789 VanDerWaalsContact C-N 3.32Å
2790	K	92.5	Very high	91.9	Very high	79 Å²	79	35.6 Å²	35.6	34%	0.343	18%	0.184	S	C	.	.			trans	-75.7	125.6	173.5	-176.7	179.3	177.1	-173.1	0	109.4	E2301 E2330 Y2785 T2786 N2788 L2792	E2301-K2790 IonicContact OE1-NZ 2.74Å; E2301-K2790 PolarHBondContact OE1-NZ 3.39Å; E2301-K2790 IonicContact OE2-NZ 2.68Å; E2330-K2790 WeakPolarHBondContact OE1-CD 3.44Å; E2330-K2790 WeakPolarHBondContact OE1-CE 3.26Å; E2330-K2790 IonicContact OE1-NZ 2.91Å; E2330-K2790 PolarHBondContact OE1-NZ 3.31Å; E2330-K2790 IonicContact OE2-NZ 3.31Å; Y2785-K2790 CarbonylContact C-O 3.22Å; Y2785-K2790 WeakPolarHBondContact CA-O 3.32Å; T2786-K2790 HydrophobicContact CG2-CB 3.99Å; T2786-K2790 PolarHBondContact N-O 2.98Å; T2786-K2790 WeakPolarHBondContact OG1-CB 3.45Å; T2786-K2790 PolarHBondContact OG1-N 2.85Å; T2786-K2790 VanDerWaalsContact OG1-N 3.12Å; N2788-K2790 PolarHBondContact O-N 3.14Å; K2790-L2792 PolarHBondContact O-N 3.23Å
2791	L	93.5	Very high	91.4	Very high	61 Å²	61	35.7 Å²	35.7	32%	0.319	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	121.1	174.9	177.4	66.8	0	0	0	109.7	P2732 Y2785	P2732-L2791 HydrophobicContact CG-CB 4.05Å; Y2785-L2791 HydrophobicContact CD1-CB 3.83Å; Y2785-L2791 HydrophobicContact CD1-CD1 3.85Å; Y2785-L2791 HydrophobicContact CD1-CG 4.46Å; Y2785-L2791 HydrophobicContact CE1-CB 3.81Å; Y2785-L2791 HydrophobicContact CE1-CD1 3.46Å; Y2785-L2791 VanDerWaalsContact CE1-CD1 3.46Å; Y2785-L2791 HydrophobicContact CE1-CG 4.16Å; Y2785-L2791 HydrophobicContact CE2-CD1 4.17Å; Y2785-L2791 HydrophobicContact CG-CD1 4.34Å
2792	L	92.7	Very high	90.3	Very high	50 Å²	50	42.6 Å²	42.6	26%	0.262	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-44.4	179.4	-63.6	179.9	0	0	0	112.1	E2330 Y2772 L2784 T2786 K2790	E2330-L2792 HydrophobicContact CB-CD2 4.4Å; E2330-L2792 HydrophobicContact CG-CD2 3.88Å; Y2772-L2792 HydrophobicContact CD1-CD1 4.25Å; Y2772-L2792 HydrophobicContact CE1-CD1 4.14Å; L2784-L2792 HydrophobicContact CD2-CB 4.23Å; L2784-L2792 HydrophobicContact CD2-CD1 3.93Å; L2784-L2792 HydrophobicContact CG-CB 4.47Å; L2784-L2792 HydrophobicContact CG-CD1 4.25Å; L2784-L2792 WeakPolarHBondContact O-CB 3.13Å; L2784-L2792 PolarHBondContact O-N 3.37Å; T2786-L2792 HydrophobicContact CG2-CD1 3.91Å; T2786-L2792 HydrophobicContact CG2-CD2 3.61Å; T2786-L2792 HydrophobicContact CG2-CG 3.81Å; K2790-L2792 PolarHBondContact O-N 3.23Å
2793	R	92	Very high	88.9	Confident	134 Å²	134	46.4 Å²	46.4	51%	0.506	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	144.4	-175.4	-172.8	64.7	64.3	173.1	2.2	110.6	S2783 L2784 L2839	S2783-R2793 CarbonylContact C-O 3.48Å; S2783-R2793 VanDerWaalsContact CA-O 3.28Å; S2783-R2793 WeakPolarHBondContact CA-O 3.5Å; L2784-R2793 PolarHBondContact N-O 3.14Å; L2784-R2793 PolarHBondContact O-N 3.29Å; R2793-L2839 HydrophobicContact CB-CD1 4.26Å; R2793-L2839 HydrophobicContact CG-CD1 4.04Å; R2793-L2839 HydrophobicContact CG-CG 4.33Å
2794	T	92.8	Very high	87.6	Confident	50 Å²	50	53.4 Å²	53.4	31%	0.307	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135.9	164.6	-61.8	0	0	0	0	108.5	P2734 L2782 S2783	P2734-T2794 HydrophobicContact CB-CG2 4Å; L2782-T2794 WeakPolarHBondContact O-CA 3.33Å; S2783-T2794 WeakPolarHBondContact OG-CG2 3.35Å; S2783-T2794 PolarHBondContact OG-OG1 3.21Å
2795	T	92.3	Very high	86.5	Confident	31 Å²	31	58.8 Å²	58.8	19%	0.19	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	129	177.4	-55.2	0	0	0	0	109.2	Q2781 L2782 L2797	Q2781-T2795 WeakPolarHBondContact CA-O 3.4Å; L2782-T2795 PolarHBondContact N-O 2.88Å; L2782-T2795 PolarHBondContact O-N 3.16Å; T2795-L2797 HydrophobicContact CG2-CD2 3.59Å; T2795-L2797 HydrophobicContact CG2-CG 4.2Å
2796	D	91.2	Very high	85.4	Confident	60 Å²	60	61.2 Å²	61.2	32%	0.321	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	114.5	168	-164.3	-29.9	0	0	0	109.1	S2780 Q2781 S2798	S2780-D2796 PolarHBondContact OG-OD1 2.84Å; Q2781-D2796 HydrophobicContact CG-CB 4.05Å; Q2781-D2796 PolarHBondContact NE2-OD2 3.35Å; Q2781-D2796 VanDerWaalsContact NE2-OD2 3.16Å; D2796-S2798 VanDerWaalsContact C-N 3.33Å; D2796-S2798 WeakPolarHBondContact OD1-CB 3.18Å; D2796-S2798 PolarHBondContact OD1-N 2.8Å; D2796-S2798 PolarHBondContact OD1-OG 3.36Å
2797	L	90.1	Very high	84.8	Confident	3 Å²	3	65.2 Å²	65.2	2%	0.016	37%	0.366	C	S	.	.			trans	-95.3	8.8	-175.2	-63.7	174.7	0	0	0	112.3	S2780 L2782 T2795 I2799 L2800 Y2808 I2810 I2824 L2834	S2780-L2797 PolarHBondContact O-N 3.46Å; L2782-L2797 HydrophobicContact CB-CD1 3.93Å; L2782-L2797 HydrophobicContact CD2-CD1 4.02Å; T2795-L2797 HydrophobicContact CG2-CD2 3.59Å; T2795-L2797 HydrophobicContact CG2-CG 4.2Å; L2797-I2799 PolarHBondContact O-N 2.78Å; L2797-I2799 VanDerWaalsContact O-N 3.12Å; L2797-L2800 HydrophobicContact CB-CD1 4.1Å; L2797-L2800 HydrophobicContact CB-CG 4.46Å; L2797-L2800 HydrophobicContact CD2-CD1 4.07Å; L2797-L2800 HydrophobicContact CD2-CG 4.46Å; L2797-L2800 WeakPolarHBondContact O-CB 3.35Å; L2797-L2800 PolarHBondContact O-N 2.98Å; L2797-Y2808 VanDerWaalsContact O-CD1 3.25Å; L2797-Y2808 WeakPolarHBondContact O-CD1 3.43Å; L2797-I2810 HydrophobicContact CB-CD1 4.1Å; L2797-I2810 HydrophobicContact CD1-CD1 3.97Å; L2797-I2824 HydrophobicContact CD1-CD1 3.69Å; L2797-L2834 HydrophobicContact CD1-CD1 3.67Å
2798	S	86.8	Confident	84.6	Confident	42 Å²	42	64.9 Å²	64.9	29%	0.294	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-53.3	-31.4	174.1	53.4	0	0	0	0	113.5	D2796 L2800 S2801	D2796-S2798 VanDerWaalsContact C-N 3.33Å; D2796-S2798 WeakPolarHBondContact OD1-CB 3.18Å; D2796-S2798 PolarHBondContact OD1-N 2.8Å; D2796-S2798 PolarHBondContact OD1-OG 3.36Å; S2798-L2800 PolarHBondContact O-N 2.87Å; S2798-S2801 PolarHBondContact O-N 2.93Å
2799	I	82.6	Confident	84.4	Confident	135 Å²	135	67.6 Å²	67.6	69%	0.692	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-65.4	-16.7	178.5	62.5	169.8	0	0	0	114.8	L2797 S2801	L2797-I2799 PolarHBondContact O-N 2.78Å; L2797-I2799 VanDerWaalsContact O-N 3.12Å; I2799-S2801 VanDerWaalsContact C-N 3.27Å; I2799-S2801 PolarHBondContact O-N 3.28Å
2800	L	83.9	Confident	84.6	Confident	25 Å²	25	67.1 Å²	67.1	13%	0.131	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-70.9	-25.1	-179.9	-68.1	-179.4	0	0	0	112.3	L2797 S2798 I2824 W2832 L2834 P2841	L2797-L2800 HydrophobicContact CB-CD1 4.1Å; L2797-L2800 HydrophobicContact CB-CG 4.46Å; L2797-L2800 HydrophobicContact CD2-CD1 4.07Å; L2797-L2800 HydrophobicContact CD2-CG 4.46Å; L2797-L2800 WeakPolarHBondContact O-CB 3.35Å; L2797-L2800 PolarHBondContact O-N 2.98Å; S2798-L2800 PolarHBondContact O-N 2.87Å; L2800-I2824 HydrophobicContact CD1-CD1 3.89Å; L2800-W2832 HydrophobicContact CB-CZ2 4.12Å; L2800-W2832 HydrophobicContact CD1-CD2 4.09Å; L2800-W2832 HydrophobicContact CD1-CE3 4.49Å; L2800-W2832 HydrophobicContact CD1-CG 4.09Å; L2800-W2832 HydrophobicContact CD2-CD2 4.5Å; L2800-W2832 HydrophobicContact CD2-CE3 4.24Å; L2800-W2832 HydrophobicContact CD2-CH2 4.37Å; L2800-W2832 HydrophobicContact CD2-CZ3 4.16Å; L2800-W2832 WeakPolarHBondContact O-CZ2 3.46Å; L2800-L2834 HydrophobicContact CD1-CD2 4.5Å; L2800-P2841 HydrophobicContact CD2-CB 4.11Å; L2800-P2841 HydrophobicContact CD2-CG 3.98Å
2801	S	79.8	Confident	84.7	Confident	23 Å²	23	65.3 Å²	65.3	16%	0.161	37%	0.366	C	S	.	.			trans	-99.6	120.3	177.5	-162.6	0	0	0	0	111.1	S2798 I2799 N2803	S2798-S2801 PolarHBondContact O-N 2.93Å; I2799-S2801 VanDerWaalsContact C-N 3.27Å; I2799-S2801 PolarHBondContact O-N 3.28Å; S2801-N2803 PolarHBondContact O-N 2.75Å
2802	N	69	Low	84.8	Confident	161 Å²	161	62.8 Å²	62.8	86%	0.861	35%	0.354	S	S	*	.			trans	-74.5	5	173.4	-72.5	-16	0	0	0	113.6	T2804	N2802-T2804 PolarHBondContact O-N 2.9Å
2803	N	65.4	Low	84.9	Confident	81 Å²	81	61 Å²	61	43%	0.433	35%	0.345	S	S	.	.			trans	-80	104.8	-173.7	-164.4	-8.1	0	0	0	111.2	S2801 S2805 C2806	S2801-N2803 PolarHBondContact O-N 2.75Å; N2803-S2805 VanDerWaalsContact C-N 3.25Å; N2803-S2805 PolarHBondContact O-N 2.8Å; N2803-S2805 PolarHBondContact OD1-N 2.83Å; N2803-C2806 VanDerWaalsContact O-O 3.12Å
2804	T	66.9	Low	85.1	Confident	147 Å²	147	56 Å²	56	90%	0.902	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-23.2	177.2	23	0	0	0	0	113.8	N2802	N2802-T2804 PolarHBondContact O-N 2.9Å
2805	S	73.3	Confident	85.2	Confident	113 Å²	113	54.7 Å²	54.7	79%	0.79	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-25.6	-174.8	-59.8	0	0	0	0	113.9	N2803	N2803-S2805 VanDerWaalsContact C-N 3.25Å; N2803-S2805 PolarHBondContact O-N 2.8Å; N2803-S2805 PolarHBondContact OD1-N 2.83Å
2806	C	73.2	Confident	85.4	Confident	53 Å²	53	53.2 Å²	53.2	36%	0.358	31%	0.309	S	S	.	.	S	Bend	trans	-148.9	126.4	-177.4	-172.5	0	0	0	0	109.7	N2803	N2803-C2806 VanDerWaalsContact O-O 3.12Å
2807	P	82.2	Confident	85.4	Confident	91 Å²	91	55.1 Å²	55.1	59%	0.591	32%	0.319	S	S	*	.			trans	-61.1	145.9	177.8	26.8	-34.3	0	0	0	110.4	Q2809 N2827	P2807-Q2809 PolarHBondContact O-N 2.76Å; P2807-N2827 PolarHBondContact O-ND2 3.23Å
2808	Y	88.7	Confident	85.3	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.016	34%	0.336	C	S	.	.			trans	-61	129.2	176.4	-174.6	-130.3	0	0	0	110.6	L2797 I2810 I2824 N2827 D2828	L2797-Y2808 VanDerWaalsContact O-CD1 3.25Å; L2797-Y2808 WeakPolarHBondContact O-CD1 3.43Å; Y2808-I2810 HydrophobicContact CD1-CG1 4.04Å; Y2808-I2810 HydrophobicContact CE1-CD1 4.06Å; Y2808-I2810 HydrophobicContact CE1-CG1 3.43Å; Y2808-I2810 VanDerWaalsContact CE1-CG1 3.43Å; Y2808-I2824 HydrophobicContact CE1-CD1 4.26Å; Y2808-N2827 WeakPolarHBondContact CA-OD1 3.33Å; Y2808-N2827 VanDerWaalsContact CD2-OD1 3.3Å; Y2808-N2827 WeakPolarHBondContact CD2-OD1 3.26Å; Y2808-D2828 HydrophobicContact CD2-CB 3.98Å; Y2808-D2828 HydrophobicContact CE2-CB 3.95Å; Y2808-D2828 VanDerWaalsContact CE2-OD1 3.26Å; Y2808-D2828 WeakPolarHBondContact CE2-OD1 3.41Å; Y2808-D2828 WeakPolarHBondContact CE2-OD2 3.33Å
2809	Q	92.1	Very high	85.5	Confident	66 Å²	66	55.7 Å²	55.7	31%	0.308	32%	0.324	S	S	.	.			trans	-124.5	118.5	175.3	-68.8	-177.2	-10.3	0	0	108.8	L2779 P2807 G2826 N2827	L2779-Q2809 HydrophobicContact CB-CB 4.2Å; L2779-Q2809 HydrophobicContact CB-CG 4.18Å; L2779-Q2809 HydrophobicContact CD1-CG 4.25Å; P2807-Q2809 PolarHBondContact O-N 2.76Å; Q2809-G2826 CarbonylContact O-C 3.44Å; Q2809-G2826 WeakPolarHBondContact O-CA 3.3Å; Q2809-N2827 PolarHBondContact N-OD1 3.2Å; Q2809-N2827 PolarHBondContact O-N 2.86Å
2810	I	94.8	Very high	86	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	126.6	174.7	-58.8	168.9	0	0	0	107.9	L2776 L2779 L2797 Y2808 V2813 I2824	L2776-I2810 HydrophobicContact CD1-CB 3.99Å; L2776-I2810 HydrophobicContact CD1-CD1 3.81Å; L2776-I2810 HydrophobicContact CD1-CG1 4.43Å; L2776-I2810 HydrophobicContact CD1-CG2 4.32Å; L2776-I2810 HydrophobicContact CD2-CB 3.88Å; L2776-I2810 HydrophobicContact CD2-CG2 3.84Å; L2776-I2810 WeakPolarHBondContact CD2-O 3.44Å; L2779-I2810 WeakPolarHBondContact O-CB 2.96Å; L2779-I2810 PolarHBondContact O-N 3.17Å; L2797-I2810 HydrophobicContact CB-CD1 4.1Å; L2797-I2810 HydrophobicContact CD1-CD1 3.97Å; Y2808-I2810 HydrophobicContact CD1-CG1 4.04Å; Y2808-I2810 HydrophobicContact CE1-CD1 4.06Å; Y2808-I2810 HydrophobicContact CE1-CG1 3.43Å; Y2808-I2810 VanDerWaalsContact CE1-CG1 3.43Å; I2810-V2813 HydrophobicContact CG2-CG2 3.61Å; I2810-I2824 HydrophobicContact CD1-CD1 4.02Å; I2810-I2824 HydrophobicContact CG1-CD1 4.4Å; I2810-I2824 HydrophobicContact CG2-CB 4.22Å
2811	N	94.4	Very high	86.5	Confident	40 Å²	40	51.9 Å²	51.9	21%	0.214	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-26.4	178.8	-63.2	-41.2	0	0	0	112.2	A2825 S2851 I2852	N2811-A2825 PolarHBondContact N-O 3.46Å; N2811-S2851 PolarHBondContact ND2-OG 2.87Å; N2811-I2852 WeakPolarHBondContact CB-O 3.47Å; N2811-I2852 PolarHBondContact ND2-O 3.31Å
2812	A	95.6	Very high	87.3	Confident	9 Å²	9	50.8 Å²	50.8	7%	0.074	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	140.8	-176.9	0	0	0	0	0	111.7	I2824 A2825 L2855	A2812-I2824 WeakPolarHBondContact O-CA 3.36Å; A2812-A2825 PolarHBondContact N-O 2.81Å; A2812-A2825 PolarHBondContact O-N 2.79Å; A2812-A2825 VanDerWaalsContact O-N 3.07Å; A2812-L2855 HydrophobicContact CB-CB 3.87Å; A2812-L2855 HydrophobicContact CB-CD1 4.13Å; A2812-L2855 HydrophobicContact CB-CG 4.05Å
2813	V	96.5	Very high	88.7	Confident	13 Å²	13	43.1 Å²	43.1	8%	0.079	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	131	177.7	-175.2	0	0	0	0	109.5	L2764 L2774 L2776 L2782 I2810 I2822 L2823 I2824	L2764-V2813 HydrophobicContact CD2-CB 3.7Å; L2764-V2813 HydrophobicContact CD2-CG2 3.92Å; L2774-V2813 HydrophobicContact CD2-CG1 3.44Å; L2774-V2813 VanDerWaalsContact CD2-CG1 3.44Å; L2776-V2813 HydrophobicContact CD2-CG2 4.35Å; L2782-V2813 HydrophobicContact CD1-CG1 4.38Å; L2782-V2813 HydrophobicContact CD1-CG2 4.44Å; I2810-V2813 HydrophobicContact CG2-CG2 3.61Å; V2813-I2822 HydrophobicContact CG1-CG2 3.67Å; V2813-L2823 CarbonylContact C-O 3.58Å; V2813-L2823 VanDerWaalsContact CA-O 3.29Å; V2813-L2823 WeakPolarHBondContact CA-O 3.24Å; V2813-I2824 HydrophobicContact CB-CG2 4.45Å; V2813-I2824 HydrophobicContact CG1-CG2 4.07Å; V2813-I2824 HydrophobicContact CG2-CG2 4.02Å
2814	L	95.1	Very high	90.2	Very high	29 Å²	29	39.3 Å²	39.3	15%	0.152	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	149.4	177.6	-6.7	157.1	0	0	0	110.9	I2822 L2823 L2855 L2857	L2814-I2822 CarbonylContact O-C 3.57Å; L2814-I2822 WeakPolarHBondContact O-CA 3.36Å; L2814-L2823 HydrophobicContact CB-CB 4.47Å; L2814-L2823 HydrophobicContact CD1-CB 3.96Å; L2814-L2823 HydrophobicContact CD1-CD2 4.03Å; L2814-L2823 HydrophobicContact CG-CB 4.06Å; L2814-L2823 PolarHBondContact N-O 2.89Å; L2814-L2823 PolarHBondContact O-N 2.84Å; L2814-L2855 HydrophobicContact CD1-CB 4.01Å; L2814-L2855 HydrophobicContact CD2-CB 3.72Å; L2814-L2855 WeakPolarHBondContact CD2-O 3.34Å; L2814-L2855 HydrophobicContact CG-CB 4.15Å; L2814-L2857 HydrophobicContact CD1-CD1 4.3Å; L2814-L2857 HydrophobicContact CD1-CG 3.96Å
2815	F	96	Very high	91.6	Very high	21 Å²	21	32.3 Å²	32.3	9%	0.092	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	145.5	164	-78.6	-81.8	0	0	0	111.5	T2766 H2768 L2774 L2784 I2822	T2766-F2815 HydrophobicContact CG2-CD2 4.24Å; T2766-F2815 HydrophobicContact CG2-CE2 4.02Å; H2768-F2815 HydrophobicContact CB-CB 4.44Å; H2768-F2815 HydrophobicContact CB-CD1 4.05Å; H2768-F2815 HydrophobicContact CB-CD2 3.89Å; H2768-F2815 HydrophobicContact CB-CE1 4.22Å; H2768-F2815 HydrophobicContact CB-CE2 4.07Å; H2768-F2815 HydrophobicContact CB-CG 3.88Å; H2768-F2815 HydrophobicContact CB-CZ 4.23Å; H2768-F2815 AromaticContact CD2-CG 3.94Å; L2774-F2815 HydrophobicContact CB-CE2 3.72Å; L2774-F2815 HydrophobicContact CB-CZ 3.84Å; L2774-F2815 HydrophobicContact CD1-CZ 4.41Å; L2774-F2815 HydrophobicContact CD2-CE2 3.86Å; L2774-F2815 HydrophobicContact CD2-CZ 3.9Å; L2774-F2815 HydrophobicContact CG-CE2 4.4Å; L2774-F2815 HydrophobicContact CG-CZ 4.3Å; L2784-F2815 HydrophobicContact CD1-CZ 4.37Å; F2815-I2822 HydrophobicContact CD1-CD1 4.35Å; F2815-I2822 HydrophobicContact CD1-CG1 3.64Å; F2815-I2822 HydrophobicContact CE1-CD1 3.68Å; F2815-I2822 HydrophobicContact CE1-CG1 3.5Å; F2815-I2822 VanDerWaalsContact CE1-CG1 3.5Å; F2815-I2822 HydrophobicContact CG-CG1 4.45Å; F2815-I2822 HydrophobicContact CZ-CD1 4.06Å; F2815-I2822 HydrophobicContact CZ-CG1 4.2Å
2816	S	95.4	Very high	92.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.149	C	C	.	.			trans	-64.6	154.4	156.9	58.5	0	0	0	0	110.5	H2768 C2818 G2819 Y2821	H2768-S2816 PolarHBondContact NE2-O 2.84Å; H2768-S2816 VanDerWaalsContact NE2-O 3.16Å; S2816-C2818 PolarHBondContact O-N 2.91Å; S2816-G2819 PolarHBondContact O-N 3.39Å; S2816-Y2821 PolarHBondContact N-O 3.09Å; S2816-Y2821 PolarHBondContact OG-N 3.29Å; S2816-Y2821 PolarHBondContact OG-O 2.83Å
2817	N	91.2	Very high	93.6	Very high	100 Å²	100	26.5 Å²	26.5	54%	0.535	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-24.9	-175.9	-83.6	-10.4	0	0	0	112.3	H2768 G2819 Q2861	H2768-N2817 PolarHBondContact NE2-O 2.81Å; N2817-G2819 VanDerWaalsContact C-N 3.3Å; N2817-Q2861 HydrophobicContact CB-CG 4.49Å; N2817-Q2861 VanDerWaalsContact CG-CD 3.44Å; N2817-Q2861 VanDerWaalsContact N-CD 3.3Å; N2817-Q2861 PolarHBondContact ND2-NE2 3.08Å; N2817-Q2861 PolarHBondContact OD1-NE2 3.32Å
2818	C	88.6	Confident	94.1	Very high	53 Å²	53	22.7 Å²	22.7	36%	0.358	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-7.3	175.7	67.6	0	0	0	0	113.1	S2816 R2820	S2816-C2818 PolarHBondContact O-N 2.91Å; C2818-R2820 PolarHBondContact O-N 3Å
2819	G	91.2	Very high	94.3	Very high	4 Å²	4	22.6 Å²	22.6	4%	0.041	12%	0.118	C	C	.	.	S	Bend	trans	70.7	3.2	-180	0	0	0	0	0	115.7	H2768 S2816 N2817 S2836	H2768-G2819 WeakPolarHBondContact CE1-CA 3.3Å; H2768-G2819 PolarHBondContact CE1-N 3.12Å; H2768-G2819 WeakPolarHBondContact ND1-CA 3.44Å; H2768-G2819 WeakPolarHBondContact NE2-CA 3.46Å; H2768-G2819 PolarHBondContact NE2-N 3.49Å; S2816-G2819 PolarHBondContact O-N 3.39Å; N2817-G2819 VanDerWaalsContact C-N 3.3Å; G2819-S2836 WeakPolarHBondContact O-CB 3.45Å; G2819-S2836 PolarHBondContact O-OG 2.81Å
2820	R	91.8	Very high	94.5	Very high	69 Å²	69	20.1 Å²	20.1	26%	0.26	11%	0.108	S	C	.	.	S	Bend	trans	-83.8	-25.3	-178.6	-66.2	-171.1	172.5	99.1	-3	113.5	C2818 S2836	C2818-R2820 PolarHBondContact O-N 3Å; R2820-S2836 WeakPolarHBondContact CA-OG 3.47Å; R2820-S2836 PolarHBondContact O-N 3.49Å; R2820-S2836 PolarHBondContact O-OG 2.98Å; R2820-S2836 VanDerWaalsContact O-OG 3.12Å
2821	Y	95.3	Very high	94.6	Very high	12 Å²	12	20.1 Å²	20.1	5%	0.047	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	149	-177.9	-49.3	-74	0	0	0	111.8	S2816 I2833 L2834 F2880 W2883 H2884	S2816-Y2821 PolarHBondContact N-O 3.09Å; S2816-Y2821 PolarHBondContact OG-N 3.29Å; S2816-Y2821 PolarHBondContact OG-O 2.83Å; Y2821-I2833 HydrophobicContact CD1-CG2 4.14Å; Y2821-I2833 HydrophobicContact CG-CG2 4.34Å; Y2821-L2834 CarbonylContact C-O 3.41Å; Y2821-L2834 VanDerWaalsContact CA-O 3.22Å; Y2821-L2834 WeakPolarHBondContact CA-O 3.41Å; Y2821-F2880 HydrophobicContact CD2-CB 4.08Å; Y2821-F2880 AromaticContact CD2-CD1 3.29Å; Y2821-F2880 HydrophobicContact CD2-CD1 3.29Å; Y2821-F2880 AromaticContact CD2-CE1 3.98Å; Y2821-F2880 HydrophobicContact CD2-CE1 3.98Å; Y2821-F2880 AromaticContact CD2-CG 3.99Å; Y2821-F2880 HydrophobicContact CD2-CG 3.99Å; Y2821-F2880 HydrophobicContact CE2-CB 3.9Å; Y2821-F2880 AromaticContact CE2-CD1 3.91Å; Y2821-F2880 HydrophobicContact CE2-CD1 3.91Å; Y2821-F2880 HydrophobicContact CE2-CG 4.32Å; Y2821-F2880 AromaticContact CG-CD1 3.81Å; Y2821-F2880 HydrophobicContact CG-CD1 3.81Å; Y2821-F2880 HydrophobicContact CG-CE1 4.15Å; Y2821-F2880 PolarHBondContact OH-O 2.58Å; Y2821-W2883 HydrophobicContact CE1-CB 3.85Å; Y2821-W2883 WeakPolarHBondContact OH-CB 3.39Å; Y2821-W2883 PolarHBondContact OH-O 3.26Å; Y2821-H2884 PolarHBondContact OH-N 3.48Å
2822	I	97.2	Very high	94.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	135.8	172.9	-63.7	169.2	0	0	0	107.7	L2774 V2813 L2814 F2815 I2824 L2834 L2839	L2774-I2822 HydrophobicContact CD1-CD1 3.96Å; L2774-I2822 HydrophobicContact CD2-CD1 3.86Å; L2774-I2822 HydrophobicContact CD2-CG1 4.46Å; L2774-I2822 HydrophobicContact CD2-CG2 4.17Å; V2813-I2822 HydrophobicContact CG1-CG2 3.67Å; L2814-I2822 CarbonylContact O-C 3.57Å; L2814-I2822 WeakPolarHBondContact O-CA 3.36Å; F2815-I2822 HydrophobicContact CD1-CD1 4.35Å; F2815-I2822 HydrophobicContact CD1-CG1 3.64Å; F2815-I2822 HydrophobicContact CE1-CD1 3.68Å; F2815-I2822 HydrophobicContact CE1-CG1 3.5Å; F2815-I2822 VanDerWaalsContact CE1-CG1 3.5Å; F2815-I2822 HydrophobicContact CG-CG1 4.45Å; F2815-I2822 HydrophobicContact CZ-CD1 4.06Å; F2815-I2822 HydrophobicContact CZ-CG1 4.2Å; I2822-I2824 HydrophobicContact CG2-CG2 3.97Å; I2822-L2834 HydrophobicContact CB-CB 4.36Å; I2822-L2834 PolarHBondContact N-O 2.61Å; I2822-L2834 PolarHBondContact O-N 3.24Å; I2822-L2839 HydrophobicContact CD1-CD2 3.65Å
2823	L	97.8	Very high	94.7	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	130.9	171.9	-83.9	68.8	0	0	0	108.1	V2813 L2814 I2831 W2832 I2833 L2857 I2864 F2880	V2813-L2823 CarbonylContact C-O 3.58Å; V2813-L2823 VanDerWaalsContact CA-O 3.29Å; V2813-L2823 WeakPolarHBondContact CA-O 3.24Å; L2814-L2823 HydrophobicContact CB-CB 4.47Å; L2814-L2823 HydrophobicContact CD1-CB 3.96Å; L2814-L2823 HydrophobicContact CD1-CD2 4.03Å; L2814-L2823 HydrophobicContact CG-CB 4.06Å; L2814-L2823 PolarHBondContact N-O 2.89Å; L2814-L2823 PolarHBondContact O-N 2.84Å; L2823-I2831 HydrophobicContact CD2-CG2 4.47Å; L2823-W2832 WeakPolarHBondContact CA-O 3.4Å; L2823-I2833 HydrophobicContact CD1-CD1 3.62Å; L2823-I2833 HydrophobicContact CD2-CD1 4.11Å; L2823-I2833 HydrophobicContact CG-CD1 3.43Å; L2823-I2833 VanDerWaalsContact CG-CD1 3.43Å; L2823-L2857 HydrophobicContact CD2-CD1 4.39Å; L2823-L2857 HydrophobicContact CD2-CD2 3.87Å; L2823-L2857 HydrophobicContact CD2-CG 4.3Å; L2823-I2864 HydrophobicContact CD2-CD1 3.93Å; L2823-I2864 HydrophobicContact CD2-CG1 4.04Å; L2823-I2864 HydrophobicContact CD2-CG2 4.19Å; L2823-F2880 HydrophobicContact CD1-CE1 3.73Å; L2823-F2880 HydrophobicContact CD1-CZ 3.64Å
2824	I	97.2	Very high	94.7	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	150.1	170.5	66.8	167.5	0	0	0	110.4	L2782 L2797 L2800 Y2808 I2810 A2812 V2813 I2822 I2831 W2832 L2834	L2782-I2824 HydrophobicContact CD2-CG2 4.47Å; L2797-I2824 HydrophobicContact CD1-CD1 3.69Å; L2800-I2824 HydrophobicContact CD1-CD1 3.89Å; Y2808-I2824 HydrophobicContact CE1-CD1 4.26Å; I2810-I2824 HydrophobicContact CD1-CD1 4.02Å; I2810-I2824 HydrophobicContact CG1-CD1 4.4Å; I2810-I2824 HydrophobicContact CG2-CB 4.22Å; A2812-I2824 WeakPolarHBondContact O-CA 3.36Å; V2813-I2824 HydrophobicContact CB-CG2 4.45Å; V2813-I2824 HydrophobicContact CG1-CG2 4.07Å; V2813-I2824 HydrophobicContact CG2-CG2 4.02Å; I2822-I2824 HydrophobicContact CG2-CG2 3.97Å; I2824-I2831 WeakPolarHBondContact O-CA 3.11Å; I2824-W2832 HydrophobicContact CD1-CB 4.19Å; I2824-W2832 HydrophobicContact CG1-CB 3.66Å; I2824-W2832 HydrophobicContact CG1-CG 4.4Å; I2824-W2832 PolarHBondContact N-O 3.29Å; I2824-W2832 PolarHBondContact O-N 3.18Å; I2824-L2834 HydrophobicContact CD1-CD1 4.01Å; I2824-L2834 HydrophobicContact CD1-CD2 4.45Å; I2824-L2834 HydrophobicContact CD1-CG 4.46Å; I2824-L2834 HydrophobicContact CG1-CD1 4.33Å; I2824-L2834 HydrophobicContact CG1-CG 4.45Å; I2824-L2834 HydrophobicContact CG2-CD1 4.09Å
2825	A	96.1	Very high	94.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	157.2	166.1	0	0	0	0	0	111.5	N2811 A2812 V2830 I2831 I2852 L2855	N2811-A2825 PolarHBondContact N-O 3.46Å; A2812-A2825 PolarHBondContact N-O 2.81Å; A2812-A2825 PolarHBondContact O-N 2.79Å; A2812-A2825 VanDerWaalsContact O-N 3.07Å; A2825-V2830 WeakPolarHBondContact CA-O 3.43Å; A2825-I2831 HydrophobicContact CB-CG1 4.31Å; A2825-I2852 HydrophobicContact CB-CB 3.78Å; A2825-I2852 HydrophobicContact CB-CD1 3.78Å; A2825-I2852 HydrophobicContact CB-CG1 4.39Å; A2825-I2852 HydrophobicContact CB-CG2 3.58Å; A2825-L2855 HydrophobicContact CB-CD1 3.36Å; A2825-L2855 HydrophobicContact CB-CD2 4.32Å; A2825-L2855 HydrophobicContact CB-CG 3.85Å
2826	G	94.3	Very high	94.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	-155.2	-172.2	0	0	0	0	0	114.9	Q2809 D2828 G2829 I2852	Q2809-G2826 CarbonylContact O-C 3.44Å; Q2809-G2826 WeakPolarHBondContact O-CA 3.3Å; G2826-D2828 VanDerWaalsContact C-N 3.26Å; G2826-D2828 PolarHBondContact O-N 3.3Å; G2826-G2829 PolarHBondContact O-N 3.41Å; G2826-I2852 PolarHBondContact O-N 3.28Å
2827	N	93.9	Very high	94.3	Very high	44 Å²	44	24.5 Å²	24.5	24%	0.235	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-11.9	-178.9	66	-16.3	0	0	0	115	P2807 Y2808 Q2809 G2829 S2851	P2807-N2827 PolarHBondContact O-ND2 3.23Å; Y2808-N2827 WeakPolarHBondContact CA-OD1 3.33Å; Y2808-N2827 VanDerWaalsContact CD2-OD1 3.3Å; Y2808-N2827 WeakPolarHBondContact CD2-OD1 3.26Å; Q2809-N2827 PolarHBondContact N-OD1 3.2Å; Q2809-N2827 PolarHBondContact O-N 2.86Å; N2827-G2829 VanDerWaalsContact C-N 3.25Å; N2827-G2829 PolarHBondContact O-N 3.1Å; N2827-S2851 WeakPolarHBondContact CA-OG 3.43Å
2828	D	93.2	Very high	94.3	Very high	12 Å²	12	21.2 Å²	21.2	6%	0.064	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-14.4	173.6	69.3	-14.2	0	0	0	113.5	Y2808 G2826 V2830 W2832 K2847	Y2808-D2828 HydrophobicContact CD2-CB 3.98Å; Y2808-D2828 HydrophobicContact CE2-CB 3.95Å; Y2808-D2828 VanDerWaalsContact CE2-OD1 3.26Å; Y2808-D2828 WeakPolarHBondContact CE2-OD1 3.41Å; Y2808-D2828 WeakPolarHBondContact CE2-OD2 3.33Å; G2826-D2828 VanDerWaalsContact C-N 3.26Å; G2826-D2828 PolarHBondContact O-N 3.3Å; D2828-V2830 VanDerWaalsContact C-N 3.33Å; D2828-V2830 PolarHBondContact OD1-N 3.02Å; D2828-W2832 PolarHBondContact OD2-NE1 3.24Å; D2828-K2847 WeakPolarHBondContact O-CE 3.35Å
2829	G	93.3	Very high	94.6	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.01	8%	0.082	C	C	.	.	S	Bend	trans	77.1	15.1	-178	0	0	0	0	0	113.9	G2826 N2827 C2848 I2852	G2826-G2829 PolarHBondContact O-N 3.41Å; N2827-G2829 VanDerWaalsContact C-N 3.25Å; N2827-G2829 PolarHBondContact O-N 3.1Å; G2829-C2848 WeakPolarHBondContact O-CB 3.42Å; G2829-C2848 PolarHBondContact O-N 2.94Å; G2829-I2852 VanDerWaalsContact C-CD1 3.48Å; G2829-I2852 WeakPolarHBondContact O-CD1 3.32Å
2830	V	95.2	Very high	94.7	Very high	15 Å²	15	23 Å²	23	9%	0.091	10%	0.104	C	C	.	.			trans	-112	142	-178.2	177.8	0	0	0	0	110.3	A2825 D2828 W2832 A2844 K2847	A2825-V2830 WeakPolarHBondContact CA-O 3.43Å; D2828-V2830 VanDerWaalsContact C-N 3.33Å; D2828-V2830 PolarHBondContact OD1-N 3.02Å; V2830-W2832 HydrophobicContact CG1-CD2 4.12Å; V2830-W2832 HydrophobicContact CG1-CG 4.22Å; V2830-W2832 HydrophobicContact CG1-CZ2 4.15Å; V2830-A2844 HydrophobicContact CG1-CB 4.05Å; V2830-K2847 HydrophobicContact CG2-CB 3.8Å; V2830-K2847 HydrophobicContact CG2-CD 4.33Å; V2830-K2847 HydrophobicContact CG2-CG 3.99Å
2831	I	96.8	Very high	94.8	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	120.5	168.8	-52.4	167.7	0	0	0	107.5	L2823 I2824 A2825 F2845 I2852 L2855 I2864 A2866 F2876	L2823-I2831 HydrophobicContact CD2-CG2 4.47Å; I2824-I2831 WeakPolarHBondContact O-CA 3.11Å; A2825-I2831 HydrophobicContact CB-CG1 4.31Å; I2831-F2845 HydrophobicContact CB-CB 4.08Å; I2831-F2845 HydrophobicContact CB-CD2 4.03Å; I2831-F2845 HydrophobicContact CB-CG 4.29Å; I2831-F2845 HydrophobicContact CG2-CD2 4.16Å; I2831-F2845 PolarHBondContact O-N 3.05Å; I2831-I2852 HydrophobicContact CD1-CD1 4.48Å; I2831-I2852 HydrophobicContact CG1-CD1 3.62Å; I2831-L2855 HydrophobicContact CD1-CD2 3.8Å; I2831-L2855 HydrophobicContact CG1-CD2 3.92Å; I2831-L2855 HydrophobicContact CG2-CD1 4.32Å; I2831-L2855 HydrophobicContact CG2-CD2 4.49Å; I2831-I2864 HydrophobicContact CD1-CG2 3.97Å; I2831-I2864 HydrophobicContact CG2-CD1 4.48Å; I2831-A2866 HydrophobicContact CD1-CB 3.97Å; I2831-F2876 HydrophobicContact CD1-CD2 3.58Å; I2831-F2876 HydrophobicContact CD1-CE2 3.67Å
2832	W	96.2	Very high	94.6	Very high	47 Å²	47	24.2 Å²	24.2	18%	0.178	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	137.8	178.1	-62.8	88.5	0	0	0	110.7	L2800 L2823 I2824 D2828 V2830 L2834 P2841 H2843 A2844	L2800-W2832 HydrophobicContact CB-CZ2 4.12Å; L2800-W2832 HydrophobicContact CD1-CD2 4.09Å; L2800-W2832 HydrophobicContact CD1-CE3 4.49Å; L2800-W2832 HydrophobicContact CD1-CG 4.09Å; L2800-W2832 HydrophobicContact CD2-CD2 4.5Å; L2800-W2832 HydrophobicContact CD2-CE3 4.24Å; L2800-W2832 HydrophobicContact CD2-CH2 4.37Å; L2800-W2832 HydrophobicContact CD2-CZ3 4.16Å; L2800-W2832 WeakPolarHBondContact O-CZ2 3.46Å; L2823-W2832 WeakPolarHBondContact CA-O 3.4Å; I2824-W2832 HydrophobicContact CD1-CB 4.19Å; I2824-W2832 HydrophobicContact CG1-CB 3.66Å; I2824-W2832 HydrophobicContact CG1-CG 4.4Å; I2824-W2832 PolarHBondContact N-O 3.29Å; I2824-W2832 PolarHBondContact O-N 3.18Å; D2828-W2832 PolarHBondContact OD2-NE1 3.24Å; V2830-W2832 HydrophobicContact CG1-CD2 4.12Å; V2830-W2832 HydrophobicContact CG1-CG 4.22Å; V2830-W2832 HydrophobicContact CG1-CZ2 4.15Å; W2832-L2834 HydrophobicContact CB-CD2 4.39Å; W2832-P2841 HydrophobicContact CE3-CB 4.32Å; W2832-H2843 WeakPolarHBondContact CA-O 3.31Å; W2832-A2844 HydrophobicContact CD2-CB 4.1Å; W2832-A2844 HydrophobicContact CE3-CB 3.6Å; W2832-A2844 HydrophobicContact CH2-CB 3.89Å; W2832-A2844 HydrophobicContact CZ2-CB 4.34Å; W2832-A2844 HydrophobicContact CZ3-CB 3.5Å
2833	I	96	Very high	94.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	124.5	169.8	-52.4	-51.7	0	0	0	108.4	Y2821 L2823 V2842 H2843 F2845 I2878 W2883	Y2821-I2833 HydrophobicContact CD1-CG2 4.14Å; Y2821-I2833 HydrophobicContact CG-CG2 4.34Å; L2823-I2833 HydrophobicContact CD1-CD1 3.62Å; L2823-I2833 HydrophobicContact CD2-CD1 4.11Å; L2823-I2833 HydrophobicContact CG-CD1 3.43Å; L2823-I2833 VanDerWaalsContact CG-CD1 3.43Å; I2833-V2842 HydrophobicContact CG2-CB 4.42Å; I2833-V2842 PolarHBondContact O-N 3.44Å; I2833-H2843 HydrophobicContact CB-CB 4.1Å; I2833-H2843 HydrophobicContact CG1-CB 4.1Å; I2833-H2843 PolarHBondContact N-O 2.91Å; I2833-H2843 PolarHBondContact O-N 3.05Å; I2833-F2845 HydrophobicContact CD1-CE2 3.87Å; I2833-F2845 HydrophobicContact CG1-CD2 4.47Å; I2833-F2845 HydrophobicContact CG1-CE2 3.87Å; I2833-I2878 HydrophobicContact CD1-CD1 3.98Å; I2833-W2883 HydrophobicContact CB-CH2 4.5Å; I2833-W2883 HydrophobicContact CB-CZ3 4.47Å; I2833-W2883 HydrophobicContact CG1-CH2 3.78Å; I2833-W2883 HydrophobicContact CG1-CZ2 4.43Å; I2833-W2883 HydrophobicContact CG1-CZ3 4.02Å; I2833-W2883 HydrophobicContact CG2-CE3 4.11Å; I2833-W2883 HydrophobicContact CG2-CH2 4.47Å; I2833-W2883 HydrophobicContact CG2-CZ3 3.97Å
2834	L	96.2	Very high	94.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	151.8	174.8	-44.6	179.7	0	0	0	110.2	L2782 L2797 L2800 Y2821 I2822 I2824 W2832 L2840 P2841	L2782-L2834 HydrophobicContact CD2-CD1 4Å; L2797-L2834 HydrophobicContact CD1-CD1 3.67Å; L2800-L2834 HydrophobicContact CD1-CD2 4.5Å; Y2821-L2834 CarbonylContact C-O 3.41Å; Y2821-L2834 VanDerWaalsContact CA-O 3.22Å; Y2821-L2834 WeakPolarHBondContact CA-O 3.41Å; I2822-L2834 HydrophobicContact CB-CB 4.36Å; I2822-L2834 PolarHBondContact N-O 2.61Å; I2822-L2834 PolarHBondContact O-N 3.24Å; I2824-L2834 HydrophobicContact CD1-CD1 4.01Å; I2824-L2834 HydrophobicContact CD1-CD2 4.45Å; I2824-L2834 HydrophobicContact CD1-CG 4.46Å; I2824-L2834 HydrophobicContact CG1-CD1 4.33Å; I2824-L2834 HydrophobicContact CG1-CG 4.45Å; I2824-L2834 HydrophobicContact CG2-CD1 4.09Å; W2832-L2834 HydrophobicContact CB-CD2 4.39Å; L2834-L2840 CarbonylContact C-O 3.43Å; L2834-L2840 VanDerWaalsContact CA-O 3.27Å; L2834-L2840 WeakPolarHBondContact CA-O 3.36Å; L2834-P2841 HydrophobicContact CD2-CB 3.82Å
2835	R	94.9	Very high	94.1	Very high	73 Å²	73	28.5 Å²	28.5	28%	0.275	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	130.3	163.8	-81.7	169.3	-170.3	-125.7	3.8	109.3	Y2837 N2838 L2839 L2840 V2842	R2835-Y2837 HydrophobicContact CB-CD1 4.32Å; R2835-Y2837 HydrophobicContact CB-CE1 4.05Å; R2835-Y2837 HydrophobicContact CG-CE1 4.15Å; R2835-Y2837 PolarHBondContact NH1-OH 2.86Å; R2835-Y2837 PolarHBondContact O-N 3.35Å; R2835-N2838 WeakPolarHBondContact CB-OD1 3.46Å; R2835-L2839 WeakPolarHBondContact O-CA 3.44Å; R2835-L2839 PolarHBondContact O-N 3.06Å; R2835-L2840 PolarHBondContact N-O 3.32Å; R2835-V2842 HydrophobicContact CB-CG2 4.4Å; R2835-V2842 HydrophobicContact CG-CG2 3.61Å
2836	S	94.1	Very high	94	Very high	6 Å²	6	31.8 Å²	31.8	4%	0.042	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-42.6	-175.3	59.6	0	0	0	0	113.2	L2784 G2819 R2820 N2838 L2839	L2784-S2836 VanDerWaalsContact CD2-O 3.31Å; L2784-S2836 WeakPolarHBondContact CD2-O 3.43Å; G2819-S2836 WeakPolarHBondContact O-CB 3.45Å; G2819-S2836 PolarHBondContact O-OG 2.81Å; R2820-S2836 WeakPolarHBondContact CA-OG 3.47Å; R2820-S2836 PolarHBondContact O-N 3.49Å; R2820-S2836 PolarHBondContact O-OG 2.98Å; R2820-S2836 VanDerWaalsContact O-OG 3.12Å; S2836-N2838 PolarHBondContact O-N 3.36Å; S2836-L2839 WeakPolarHBondContact O-CD2 3.29Å
2837	Y	90.2	Very high	93.9	Very high	78 Å²	78	39 Å²	39	31%	0.306	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-24	-171.5	69.4	-92.5	0	0	0	114.6	R2835	R2835-Y2837 HydrophobicContact CB-CD1 4.32Å; R2835-Y2837 HydrophobicContact CB-CE1 4.05Å; R2835-Y2837 HydrophobicContact CG-CE1 4.15Å; R2835-Y2837 PolarHBondContact NH1-OH 2.86Å; R2835-Y2837 PolarHBondContact O-N 3.35Å
2838	N	91	Very high	93.9	Very high	31 Å²	31	37.6 Å²	37.6	17%	0.166	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.3	-1.8	-179.2	65.3	7.2	0	0	0	114	R2835 S2836 L2840	R2835-N2838 WeakPolarHBondContact CB-OD1 3.46Å; S2836-N2838 PolarHBondContact O-N 3.36Å; N2838-L2840 HydrophobicContact CB-CG 4.34Å; N2838-L2840 PolarHBondContact O-N 3.19Å; N2838-L2840 VanDerWaalsContact O-N 3.16Å; N2838-L2840 PolarHBondContact OD1-N 3.13Å
2839	L	94.2	Very high	93.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.222	C	C	.	.			trans	57	23.7	179.3	-52.3	-179.5	0	0	0	114.2	L2774 L2782 L2784 R2793 I2822 R2835 S2836	L2774-L2839 HydrophobicContact CD1-CD2 4.3Å; L2782-L2839 HydrophobicContact CB-CD1 4.43Å; L2782-L2839 HydrophobicContact CD2-CD2 4.03Å; L2782-L2839 HydrophobicContact CG-CD1 4.39Å; L2782-L2839 WeakPolarHBondContact O-CD1 3.38Å; L2784-L2839 HydrophobicContact CB-CD1 4.3Å; R2793-L2839 HydrophobicContact CB-CD1 4.26Å; R2793-L2839 HydrophobicContact CG-CD1 4.04Å; R2793-L2839 HydrophobicContact CG-CG 4.33Å; I2822-L2839 HydrophobicContact CD1-CD2 3.65Å; R2835-L2839 WeakPolarHBondContact O-CA 3.44Å; R2835-L2839 PolarHBondContact O-N 3.06Å; S2836-L2839 WeakPolarHBondContact O-CD2 3.29Å
2840	L	94.2	Very high	93.8	Very high	95 Å²	95	45 Å²	45	50%	0.497	24%	0.235	S	C	.	.			trans	-85.6	138.9	177.8	-65.9	-179.3	0	0	0	111.2	L2834 R2835 N2838	L2834-L2840 CarbonylContact C-O 3.43Å; L2834-L2840 VanDerWaalsContact CA-O 3.27Å; L2834-L2840 WeakPolarHBondContact CA-O 3.36Å; R2835-L2840 PolarHBondContact N-O 3.32Å; N2838-L2840 HydrophobicContact CB-CG 4.34Å; N2838-L2840 PolarHBondContact O-N 3.19Å; N2838-L2840 VanDerWaalsContact O-N 3.16Å; N2838-L2840 PolarHBondContact OD1-N 3.13Å
2841	P	93.6	Very high	93.8	Very high	62 Å²	62	45.5 Å²	45.5	40%	0.403	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	142.7	175.8	29.8	-36.1	0	0	0	111.6	L2800 W2832 L2834	L2800-P2841 HydrophobicContact CD2-CB 4.11Å; L2800-P2841 HydrophobicContact CD2-CG 3.98Å; W2832-P2841 HydrophobicContact CE3-CB 4.32Å; L2834-P2841 HydrophobicContact CD2-CB 3.82Å
2842	V	91.6	Very high	93.8	Very high	44 Å²	44	45.5 Å²	45.5	27%	0.267	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	-43.6	-179.2	-173.5	0	0	0	0	110.8	I2833 R2835 W2883	I2833-V2842 HydrophobicContact CG2-CB 4.42Å; I2833-V2842 PolarHBondContact O-N 3.44Å; R2835-V2842 HydrophobicContact CB-CG2 4.4Å; R2835-V2842 HydrophobicContact CG-CG2 3.61Å; V2842-W2883 HydrophobicContact CG1-CB 3.98Å; V2842-W2883 VanDerWaalsContact CG1-CD1 3.41Å; V2842-W2883 HydrophobicContact CG1-CD2 4.07Å; V2842-W2883 HydrophobicContact CG1-CG 3.53Å
2843	H	93.2	Very high	93.7	Very high	44 Å²	44	44.3 Å²	44.3	20%	0.204	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	153.8	-174.6	-170.9	59.7	0	0	0	111.7	E2435 W2832 I2833 F2845 W2883	E2435-H2843 IonicContact OE1-CD2 2.7Å; E2435-H2843 IonicContact OE1-CE1 3.6Å; E2435-H2843 PolarHBondContact OE1-CE1 3.34Å; E2435-H2843 VanDerWaalsContact OE1-CE1 3.24Å; E2435-H2843 IonicContact OE1-NE2 3.68Å; E2435-H2843 PolarHBondContact OE1-NE2 2.83Å; E2435-H2843 IonicContact OE2-NE2 3.22Å; W2832-H2843 WeakPolarHBondContact CA-O 3.31Å; I2833-H2843 HydrophobicContact CB-CB 4.1Å; I2833-H2843 HydrophobicContact CG1-CB 4.1Å; I2833-H2843 PolarHBondContact N-O 2.91Å; I2833-H2843 PolarHBondContact O-N 3.05Å; H2843-F2845 AromaticContact CD2-CD2 3.98Å; H2843-F2845 AromaticContact CD2-CE2 3.85Å; H2843-W2883 HydrophobicContact CB-CH2 4.17Å; H2843-W2883 HydrophobicContact CB-CZ2 3.39Å; H2843-W2883 AromaticContact CD2-CZ2 3.61Å; H2843-W2883 AromaticContact CG-CZ2 3.49Å; H2843-W2883 VanDerWaalsContact CG-CZ2 3.49Å
2844	A	94.2	Very high	93.7	Very high	39 Å²	39	44.5 Å²	44.5	32%	0.322	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	121.8	176.8	0	0	0	0	0	109.6	V2830 W2832	V2830-A2844 HydrophobicContact CG1-CB 4.05Å; W2832-A2844 HydrophobicContact CD2-CB 4.1Å; W2832-A2844 HydrophobicContact CE3-CB 3.6Å; W2832-A2844 HydrophobicContact CH2-CB 3.89Å; W2832-A2844 HydrophobicContact CZ2-CB 4.34Å; W2832-A2844 HydrophobicContact CZ3-CB 3.5Å
2845	F	94.8	Very high	93.8	Very high	7 Å²	7	45 Å²	45	3%	0.031	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-73.8	159.3	176.2	-78.9	-95	0	0	0	111.8	E2435 I2831 I2833 H2843 K2847 I2864 F2876 Y2877 I2878	E2435-F2845 HydrophobicContact CB-CD1 4.04Å; E2435-F2845 HydrophobicContact CB-CE1 4.08Å; E2435-F2845 HydrophobicContact CG-CD1 4.47Å; E2435-F2845 HydrophobicContact CG-CE1 4.31Å; E2435-F2845 VanDerWaalsContact OE2-CD1 3.24Å; E2435-F2845 WeakPolarHBondContact OE2-CD1 3.1Å; I2831-F2845 HydrophobicContact CB-CB 4.08Å; I2831-F2845 HydrophobicContact CB-CD2 4.03Å; I2831-F2845 HydrophobicContact CB-CG 4.29Å; I2831-F2845 HydrophobicContact CG2-CD2 4.16Å; I2831-F2845 PolarHBondContact O-N 3.05Å; I2833-F2845 HydrophobicContact CD1-CE2 3.87Å; I2833-F2845 HydrophobicContact CG1-CD2 4.47Å; I2833-F2845 HydrophobicContact CG1-CE2 3.87Å; H2843-F2845 AromaticContact CD2-CD2 3.98Å; H2843-F2845 AromaticContact CD2-CE2 3.85Å; F2845-K2847 PolarHBondContact O-N 2.83Å; F2845-I2864 HydrophobicContact CD2-CD1 4.26Å; F2845-I2864 HydrophobicContact CE1-CD1 4Å; F2845-I2864 HydrophobicContact CE2-CD1 3.62Å; F2845-I2864 HydrophobicContact CZ-CD1 3.47Å; F2845-I2864 VanDerWaalsContact CZ-CD1 3.47Å; F2845-F2876 HydrophobicContact CD1-CB 4.01Å; F2845-F2876 AromaticContact CD1-CD1 3.88Å; F2845-F2876 HydrophobicContact CD1-CD1 3.88Å; F2845-F2876 HydrophobicContact CD1-CG 4Å; F2845-F2876 HydrophobicContact CE1-CB 4Å; F2845-F2876 HydrophobicContact CE1-CG 4.49Å; F2845-Y2877 VanDerWaalsContact CE1-O 3.29Å; F2845-Y2877 WeakPolarHBondContact CE1-O 3.4Å; F2845-I2878 HydrophobicContact CE2-CD1 4.32Å; F2845-I2878 HydrophobicContact CZ-CB 4.23Å; F2845-I2878 HydrophobicContact CZ-CD1 4.13Å; F2845-I2878 HydrophobicContact CZ-CG1 4.29Å
2846	P	92.6	Very high	93.9	Very high	69 Å²	69	42.1 Å²	42.1	45%	0.448	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-49	131.8	173	-29.5	31.4	0	0	0	112.5	E2435 C2848 F2876	E2435-P2846 WeakPolarHBondContact OE2-CD 3.36Å; P2846-C2848 PolarHBondContact O-N 3.19Å; P2846-F2876 HydrophobicContact CB-CE1 4.4Å; P2846-F2876 HydrophobicContact CG-CE1 4.49Å
2847	K	93.1	Very high	94	Very high	151 Å²	151	42.7 Å²	42.7	66%	0.657	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-64	127.2	-178.6	178.5	168.2	173.3	167	0	111.6	D2828 V2830 F2845	D2828-K2847 WeakPolarHBondContact O-CE 3.35Å; V2830-K2847 HydrophobicContact CG2-CB 3.8Å; V2830-K2847 HydrophobicContact CG2-CD 4.33Å; V2830-K2847 HydrophobicContact CG2-CG 3.99Å; F2845-K2847 PolarHBondContact O-N 2.83Å
2848	C	94.1	Very high	94.2	Very high	15 Å²	15	39 Å²	39	10%	0.101	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-73.7	161.5	170.3	-64.8	0	0	0	0	112.1	G2829 P2846 T2850 L2868	G2829-C2848 WeakPolarHBondContact O-CB 3.42Å; G2829-C2848 PolarHBondContact O-N 2.94Å; P2846-C2848 PolarHBondContact O-N 3.19Å; C2848-T2850 VanDerWaalsContact C-N 3.27Å; C2848-T2850 PolarHBondContact O-N 3.32Å; C2848-L2868 HydrophobicContact CB-CD1 3.98Å; C2848-L2868 HydrophobicContact CB-CD2 3.91Å
2849	D	90.1	Very high	94.3	Very high	123 Å²	123	43 Å²	43	66%	0.658	24%	0.242	S	C	*	.	S	Bend	trans	-65.1	-28.3	-179.2	64.9	-14.8	0	0	0	113.8	L2868	D2849-L2868 VanDerWaalsContact OD1-CD1 3.27Å; D2849-L2868 WeakPolarHBondContact OD1-CD1 3.38Å
2850	T	94	Very high	94	Very high	46 Å²	46	46.9 Å²	46.9	28%	0.282	26%	0.262	S	S	.	.	S	Bend	trans	-140.6	166.9	-174.9	55.6	0	0	0	0	111.4	C2848 I2852 S2870	C2848-T2850 VanDerWaalsContact C-N 3.27Å; C2848-T2850 PolarHBondContact O-N 3.32Å; T2850-I2852 PolarHBondContact O-N 3.21Å; T2850-S2870 WeakPolarHBondContact OG1-CB 3.28Å; T2850-S2870 PolarHBondContact OG1-N 2.73Å; T2850-S2870 PolarHBondContact OG1-OG 2.83Å
2851	S	94.6	Very high	93.9	Very high	25 Å²	25	43.4 Å²	43.4	18%	0.175	24%	0.244	C	C	.	.			trans	-49.5	136.4	175.1	176.2	0	0	0	0	111.7	N2811 N2827 L2868 K2869	N2811-S2851 PolarHBondContact ND2-OG 2.87Å; N2827-S2851 WeakPolarHBondContact CA-OG 3.43Å; S2851-L2868 WeakPolarHBondContact O-CA 3.12Å; S2851-K2869 PolarHBondContact O-N 2.99Å
2852	I	96.8	Very high	93.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	119.7	170.5	-62.1	162.3	0	0	0	107.3	N2811 A2825 G2826 G2829 I2831 T2850 S2854 L2855 A2866 G2867 L2868	N2811-I2852 WeakPolarHBondContact CB-O 3.47Å; N2811-I2852 PolarHBondContact ND2-O 3.31Å; A2825-I2852 HydrophobicContact CB-CB 3.78Å; A2825-I2852 HydrophobicContact CB-CD1 3.78Å; A2825-I2852 HydrophobicContact CB-CG1 4.39Å; A2825-I2852 HydrophobicContact CB-CG2 3.58Å; G2826-I2852 PolarHBondContact O-N 3.28Å; G2829-I2852 VanDerWaalsContact C-CD1 3.48Å; G2829-I2852 WeakPolarHBondContact O-CD1 3.32Å; I2831-I2852 HydrophobicContact CD1-CD1 4.48Å; I2831-I2852 HydrophobicContact CG1-CD1 3.62Å; T2850-I2852 PolarHBondContact O-N 3.21Å; I2852-S2854 WeakPolarHBondContact CG2-O 3.44Å; I2852-L2855 HydrophobicContact CG2-CD2 4.08Å; I2852-L2855 HydrophobicContact CG2-CG 4.04Å; I2852-A2866 HydrophobicContact CG2-CB 4.24Å; I2852-G2867 CarbonylContact C-O 3.47Å; I2852-L2868 HydrophobicContact CB-CD2 4.25Å; I2852-L2868 HydrophobicContact CG1-CD2 3.46Å; I2852-L2868 VanDerWaalsContact CG1-CD2 3.46Å
2853	G	93.8	Very high	94.1	Very high	22 Å²	22	41.4 Å²	41.4	23%	0.227	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-26	-179.8	0	0	0	0	0	113.6	G2867	G2853-G2867 PolarHBondContact N-O 2.94Å
2854	S	97	Very high	94.3	Very high	5 Å²	5	39.3 Å²	39.3	4%	0.035	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	153.9	-177.6	48.6	0	0	0	0	111.5	V2448 L2451 I2852 G2867	V2448-S2854 PolarHBondContact O-OG 3.3Å; L2451-S2854 WeakPolarHBondContact CG-OG 3.28Å; I2852-S2854 WeakPolarHBondContact CG2-O 3.44Å; S2854-G2867 PolarHBondContact N-O 3.22Å; S2854-G2867 PolarHBondContact O-N 2.8Å
2855	L	97.2	Very high	94.4	Very high	11 Å²	11	37.4 Å²	37.4	6%	0.058	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	147.2	179.2	-79.4	175.3	0	0	0	110.2	A2812 L2814 A2825 I2831 I2852 I2864 F2865 A2866	A2812-L2855 HydrophobicContact CB-CB 3.87Å; A2812-L2855 HydrophobicContact CB-CD1 4.13Å; A2812-L2855 HydrophobicContact CB-CG 4.05Å; L2814-L2855 HydrophobicContact CD1-CB 4.01Å; L2814-L2855 HydrophobicContact CD2-CB 3.72Å; L2814-L2855 WeakPolarHBondContact CD2-O 3.34Å; L2814-L2855 HydrophobicContact CG-CB 4.15Å; A2825-L2855 HydrophobicContact CB-CD1 3.36Å; A2825-L2855 HydrophobicContact CB-CD2 4.32Å; A2825-L2855 HydrophobicContact CB-CG 3.85Å; I2831-L2855 HydrophobicContact CD1-CD2 3.8Å; I2831-L2855 HydrophobicContact CG1-CD2 3.92Å; I2831-L2855 HydrophobicContact CG2-CD1 4.32Å; I2831-L2855 HydrophobicContact CG2-CD2 4.49Å; I2852-L2855 HydrophobicContact CG2-CD2 4.08Å; I2852-L2855 HydrophobicContact CG2-CG 4.04Å; L2855-I2864 HydrophobicContact CD2-CG2 3.92Å; L2855-F2865 CarbonylContact C-O 3.53Å; L2855-F2865 VanDerWaalsContact CA-O 3.29Å; L2855-F2865 WeakPolarHBondContact CA-O 3.49Å; L2855-A2866 HydrophobicContact CD2-CB 3.75Å
2856	C	96.7	Very high	94.6	Very high	12 Å²	12	37.1 Å²	37.1	8%	0.081	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	167	163	69.7	0	0	0	0	111.4	L2451 S2453 F2865	L2451-C2856 HydrophobicContact CB-CB 4.22Å; S2453-C2856 PolarHBondContact OG-SG 3.12Å; C2856-F2865 PolarHBondContact N-O 3.04Å; C2856-F2865 PolarHBondContact O-N 2.89Å
2857	L	96.9	Very high	94.8	Very high	17 Å²	17	33.8 Å²	33.8	9%	0.089	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	149.1	-179.5	-74.4	170.3	0	0	0	111.1	S2453 L2814 L2823 Q2861 F2863 I2864 I2878 F2880	S2453-L2857 WeakPolarHBondContact CB-O 3.13Å; S2453-L2857 PolarHBondContact OG-O 2.86Å; L2814-L2857 HydrophobicContact CD1-CD1 4.3Å; L2814-L2857 HydrophobicContact CD1-CG 3.96Å; L2823-L2857 HydrophobicContact CD2-CD1 4.39Å; L2823-L2857 HydrophobicContact CD2-CD2 3.87Å; L2823-L2857 HydrophobicContact CD2-CG 4.3Å; L2857-Q2861 HydrophobicContact CD1-CG 4.38Å; L2857-F2863 WeakPolarHBondContact CA-O 3.5Å; L2857-I2864 HydrophobicContact CD2-CB 4.29Å; L2857-I2864 HydrophobicContact CD2-CG1 3.7Å; L2857-I2864 HydrophobicContact CD2-CG2 4.49Å; L2857-I2878 HydrophobicContact CD2-CG2 4.35Å; L2857-F2880 HydrophobicContact CD1-CE2 4.46Å; L2857-F2880 HydrophobicContact CD1-CZ 4.32Å
2858	S	95.2	Very high	95	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.014	15%	0.145	C	C	.	.			trans	-63.2	154.8	165.6	63.7	0	0	0	0	110.9	D2860 Q2861 R2862 F2863	S2858-D2860 WeakPolarHBondContact CB-OD1 3.44Å; S2858-D2860 PolarHBondContact O-N 2.87Å; S2858-D2860 PolarHBondContact OG-OD1 3.23Å; S2858-Q2861 WeakPolarHBondContact O-CA 3.36Å; S2858-Q2861 PolarHBondContact O-N 2.77Å; S2858-Q2861 PolarHBondContact OG-N 3.33Å; S2858-R2862 PolarHBondContact OG-N 3.4Å; S2858-F2863 PolarHBondContact N-O 3.26Å; S2858-F2863 PolarHBondContact OG-N 3.18Å
2859	H	91.3	Very high	95.1	Very high	115 Å²	115	32.3 Å²	32.3	53%	0.532	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-35.5	-178.8	-177.9	77.5	0	0	0	113.3	T2455 Q2861	T2455-H2859 WeakPolarHBondContact OG1-CB 3.32Å; T2455-H2859 PolarHBondContact OG1-N 3.37Å; H2859-Q2861 VanDerWaalsContact C-N 3.3Å
2860	D	89.5	Confident	95.3	Very high	80 Å²	80	27.8 Å²	27.8	43%	0.428	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-1.7	175.1	62.3	-10.8	0	0	0	113.7	S2858 R2862	S2858-D2860 WeakPolarHBondContact CB-OD1 3.44Å; S2858-D2860 PolarHBondContact O-N 2.87Å; S2858-D2860 PolarHBondContact OG-OD1 3.23Å; D2860-R2862 PolarHBondContact O-N 3.21Å; D2860-R2862 PolarHBondContact OD1-N 2.77Å; D2860-R2862 WeakPolarHBondContact OD2-CD 3.39Å
2861	Q	92.1	Very high	95.1	Very high	23 Å²	23	25.6 Å²	25.6	11%	0.107	13%	0.132	C	C	.	.	S	Bend	trans	53.4	35.4	-179.6	-59	-154.6	-22.8	0	0	114.8	N2817 L2857 S2858 H2859 I2878 F2880	N2817-Q2861 HydrophobicContact CB-CG 4.49Å; N2817-Q2861 VanDerWaalsContact CG-CD 3.44Å; N2817-Q2861 VanDerWaalsContact N-CD 3.3Å; N2817-Q2861 PolarHBondContact ND2-NE2 3.08Å; N2817-Q2861 PolarHBondContact OD1-NE2 3.32Å; L2857-Q2861 HydrophobicContact CD1-CG 4.38Å; S2858-Q2861 WeakPolarHBondContact O-CA 3.36Å; S2858-Q2861 PolarHBondContact O-N 2.77Å; S2858-Q2861 PolarHBondContact OG-N 3.33Å; H2859-Q2861 VanDerWaalsContact C-N 3.3Å; Q2861-I2878 WeakPolarHBondContact O-CG2 3.09Å; Q2861-F2880 HydrophobicContact CB-CD2 4.36Å; Q2861-F2880 HydrophobicContact CB-CE2 4.06Å
2862	R	92.2	Very high	95.1	Very high	63 Å²	63	25 Å²	25	24%	0.238	13%	0.127	C	C	.	.	S	Bend	trans	-93.7	-17.6	171.3	-74.6	-177.7	169.7	-177.5	-7.4	113.3	D2485 Y2488 S2858 D2860 Y2877 I2878	D2485-R2862 IonicContact OD1-CZ 2.85Å; D2485-R2862 IonicContact OD1-NH1 3.96Å; D2485-R2862 PolarHBondContact OD1-NH1 3.4Å; Y2488-R2862 HydrophobicContact CD1-CG 4.36Å; Y2488-R2862 HydrophobicContact CD2-CB 3.77Å; Y2488-R2862 HydrophobicContact CD2-CG 4.25Å; Y2488-R2862 HydrophobicContact CE1-CB 4.5Å; Y2488-R2862 HydrophobicContact CE1-CG 3.96Å; Y2488-R2862 HydrophobicContact CE2-CB 3.56Å; Y2488-R2862 HydrophobicContact CE2-CG 3.9Å; Y2488-R2862 VanDerWaalsContact CE2-O 3.28Å; Y2488-R2862 WeakPolarHBondContact CE2-O 3.4Å; Y2488-R2862 HydrophobicContact CG-CB 4.38Å; Y2488-R2862 HydrophobicContact CG-CG 4.49Å; S2858-R2862 PolarHBondContact OG-N 3.4Å; D2860-R2862 PolarHBondContact O-N 3.21Å; D2860-R2862 PolarHBondContact OD1-N 2.77Å; D2860-R2862 WeakPolarHBondContact OD2-CD 3.39Å; R2862-Y2877 WeakPolarHBondContact O-CA 3.31Å; R2862-I2878 PolarHBondContact O-N 3.42Å
2863	F	95.8	Very high	95	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	140	-175.9	-60.8	-95.5	0	0	0	111.8	W2479 A2484 Y2488 L2857 S2858 F2865 V2875 F2876 Y2877	W2479-F2863 HydrophobicContact CH2-CB 4.4Å; W2479-F2863 HydrophobicContact CH2-CD1 4.26Å; W2479-F2863 AromaticContact CH2-CD2 3.72Å; W2479-F2863 HydrophobicContact CH2-CD2 3.72Å; W2479-F2863 HydrophobicContact CH2-CE1 4.44Å; W2479-F2863 AromaticContact CH2-CE2 3.99Å; W2479-F2863 HydrophobicContact CH2-CE2 3.99Å; W2479-F2863 AromaticContact CH2-CG 3.88Å; W2479-F2863 HydrophobicContact CH2-CG 3.88Å; W2479-F2863 HydrophobicContact CH2-CZ 4.34Å; W2479-F2863 AromaticContact CZ2-CD2 3.95Å; W2479-F2863 HydrophobicContact CZ2-CD2 3.95Å; W2479-F2863 HydrophobicContact CZ2-CE2 4.07Å; A2484-F2863 HydrophobicContact CB-CE2 3.89Å; A2484-F2863 HydrophobicContact CB-CZ 3.93Å; A2484-F2863 WeakPolarHBondContact O-CZ 3.39Å; Y2488-F2863 HydrophobicContact CD2-CE2 4.15Å; Y2488-F2863 HydrophobicContact CD2-CZ 4.04Å; Y2488-F2863 HydrophobicContact CG-CZ 4.47Å; L2857-F2863 WeakPolarHBondContact CA-O 3.5Å; S2858-F2863 PolarHBondContact N-O 3.26Å; S2858-F2863 PolarHBondContact OG-N 3.18Å; F2863-F2865 HydrophobicContact CB-CE2 4.46Å; F2863-F2865 HydrophobicContact CB-CZ 4.17Å; F2863-V2875 HydrophobicContact CB-CG1 4.18Å; F2863-V2875 HydrophobicContact CD1-CG1 3.79Å; F2863-V2875 HydrophobicContact CG-CG1 4.45Å; F2863-F2876 CarbonylContact C-O 3.54Å; F2863-F2876 VanDerWaalsContact CA-O 3.26Å; F2863-F2876 WeakPolarHBondContact CA-O 3.37Å; F2863-Y2877 AromaticContact CD1-CD1 3.91Å; F2863-Y2877 HydrophobicContact CD1-CD1 3.91Å; F2863-Y2877 HydrophobicContact CD1-CE1 4.1Å; F2863-Y2877 AromaticContact CE1-CD1 3.52Å; F2863-Y2877 HydrophobicContact CE1-CD1 3.52Å; F2863-Y2877 AromaticContact CE1-CE1 3.32Å; F2863-Y2877 HydrophobicContact CE1-CE1 3.32Å; F2863-Y2877 HydrophobicContact CZ-CD1 4.15Å; F2863-Y2877 AromaticContact CZ-CE1 3.95Å; F2863-Y2877 HydrophobicContact CZ-CE1 3.95Å
2864	I	97.5	Very high	95.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	133.6	168.3	-48.4	167.3	0	0	0	108.2	L2823 I2831 F2845 L2855 L2857 V2875 F2876 I2878	L2823-I2864 HydrophobicContact CD2-CD1 3.93Å; L2823-I2864 HydrophobicContact CD2-CG1 4.04Å; L2823-I2864 HydrophobicContact CD2-CG2 4.19Å; I2831-I2864 HydrophobicContact CD1-CG2 3.97Å; I2831-I2864 HydrophobicContact CG2-CD1 4.48Å; F2845-I2864 HydrophobicContact CD2-CD1 4.26Å; F2845-I2864 HydrophobicContact CE1-CD1 4Å; F2845-I2864 HydrophobicContact CE2-CD1 3.62Å; F2845-I2864 HydrophobicContact CZ-CD1 3.47Å; F2845-I2864 VanDerWaalsContact CZ-CD1 3.47Å; L2855-I2864 HydrophobicContact CD2-CG2 3.92Å; L2857-I2864 HydrophobicContact CD2-CB 4.29Å; L2857-I2864 HydrophobicContact CD2-CG1 3.7Å; L2857-I2864 HydrophobicContact CD2-CG2 4.49Å; I2864-V2875 CarbonylContact O-C 3.6Å; I2864-V2875 VanDerWaalsContact O-CA 3.28Å; I2864-V2875 WeakPolarHBondContact O-CA 3.3Å; I2864-F2876 HydrophobicContact CB-CB 4.33Å; I2864-F2876 HydrophobicContact CD1-CB 4.47Å; I2864-F2876 PolarHBondContact N-O 3.04Å; I2864-F2876 PolarHBondContact O-N 2.72Å; I2864-I2878 HydrophobicContact CD1-CB 3.95Å; I2864-I2878 HydrophobicContact CD1-CD1 3.77Å; I2864-I2878 HydrophobicContact CD1-CG1 4.43Å; I2864-I2878 HydrophobicContact CD1-CG2 4.24Å; I2864-I2878 HydrophobicContact CG1-CB 3.96Å; I2864-I2878 HydrophobicContact CG1-CD1 4.22Å; I2864-I2878 HydrophobicContact CG1-CG2 3.68Å
2865	F	97.7	Very high	95	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125.1	172.4	-55.6	-76.9	0	0	0	109.1	L2451 T2455 V2465 W2479 L2573 L2855 C2856 F2863 L2873 V2875	L2451-F2865 HydrophobicContact CD1-CB 4.16Å; L2451-F2865 WeakPolarHBondContact CD1-O 3.47Å; T2455-F2865 HydrophobicContact CG2-CE2 4.43Å; T2455-F2865 HydrophobicContact CG2-CZ 4.41Å; V2465-F2865 HydrophobicContact CG1-CD1 4.42Å; V2465-F2865 HydrophobicContact CG1-CG 4.39Å; V2465-F2865 HydrophobicContact CG2-CD1 4.42Å; V2465-F2865 HydrophobicContact CG2-CE1 4.01Å; V2465-F2865 HydrophobicContact CG2-CE2 4.1Å; V2465-F2865 HydrophobicContact CG2-CZ 3.83Å; W2479-F2865 HydrophobicContact CE3-CE1 4.31Å; W2479-F2865 HydrophobicContact CE3-CZ 4.01Å; W2479-F2865 HydrophobicContact CH2-CE1 4.36Å; W2479-F2865 AromaticContact CH2-CZ 3.87Å; W2479-F2865 HydrophobicContact CH2-CZ 3.87Å; W2479-F2865 AromaticContact CZ3-CE1 3.69Å; W2479-F2865 HydrophobicContact CZ3-CE1 3.69Å; W2479-F2865 AromaticContact CZ3-CZ 3.49Å; W2479-F2865 HydrophobicContact CZ3-CZ 3.49Å; W2479-F2865 VanDerWaalsContact CZ3-CZ 3.49Å; L2573-F2865 HydrophobicContact CD1-CD1 4.19Å; L2573-F2865 HydrophobicContact CD1-CE1 3.89Å; L2573-F2865 HydrophobicContact CG-CE1 4.48Å; L2855-F2865 CarbonylContact C-O 3.53Å; L2855-F2865 VanDerWaalsContact CA-O 3.29Å; L2855-F2865 WeakPolarHBondContact CA-O 3.49Å; C2856-F2865 PolarHBondContact N-O 3.04Å; C2856-F2865 PolarHBondContact O-N 2.89Å; F2863-F2865 HydrophobicContact CB-CE2 4.46Å; F2863-F2865 HydrophobicContact CB-CZ 4.17Å; F2865-L2873 HydrophobicContact CB-CD1 4.1Å; F2865-V2875 HydrophobicContact CD1-CG1 4.1Å; F2865-V2875 HydrophobicContact CD1-CG2 3.84Å; F2865-V2875 HydrophobicContact CE1-CG1 3.96Å; F2865-V2875 HydrophobicContact CE1-CG2 4.1Å
2866	A	98.2	Very high	95	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	120	-178.9	0	0	0	0	0	110.7	I2831 I2852 L2855 L2873 V2874	I2831-A2866 HydrophobicContact CD1-CB 3.97Å; I2852-A2866 HydrophobicContact CG2-CB 4.24Å; L2855-A2866 HydrophobicContact CD2-CB 3.75Å; A2866-L2873 WeakPolarHBondContact O-CA 3.49Å; A2866-V2874 HydrophobicContact CB-CB 4.49Å; A2866-V2874 PolarHBondContact N-O 3.02Å; A2866-V2874 PolarHBondContact O-N 3.03Å
2867	G	96.9	Very high	94.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	119.7	178.8	0	0	0	0	0	109.9	L2451 I2852 G2853 S2854	L2451-G2867 VanDerWaalsContact CD1-N 3.25Å; I2852-G2867 CarbonylContact C-O 3.47Å; G2853-G2867 PolarHBondContact N-O 2.94Å; S2854-G2867 PolarHBondContact N-O 3.22Å; S2854-G2867 PolarHBondContact O-N 2.8Å
2868	L	97.5	Very high	94.6	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.01	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	156.9	-173	-57.6	-169.4	0	0	0	112.8	V2448 C2848 D2849 S2851 I2852 S2870 G2871 C2872 V2874	V2448-L2868 PolarHBondContact N-O 3.04Å; C2848-L2868 HydrophobicContact CB-CD1 3.98Å; C2848-L2868 HydrophobicContact CB-CD2 3.91Å; D2849-L2868 VanDerWaalsContact OD1-CD1 3.27Å; D2849-L2868 WeakPolarHBondContact OD1-CD1 3.38Å; S2851-L2868 WeakPolarHBondContact O-CA 3.12Å; I2852-L2868 HydrophobicContact CB-CD2 4.25Å; I2852-L2868 HydrophobicContact CG1-CD2 3.46Å; I2852-L2868 VanDerWaalsContact CG1-CD2 3.46Å; L2868-S2870 WeakPolarHBondContact CB-OG 3.27Å; L2868-S2870 PolarHBondContact O-N 3.37Å; L2868-G2871 PolarHBondContact O-N 3.43Å; L2868-G2871 VanDerWaalsContact O-N 3.13Å; L2868-C2872 HydrophobicContact CB-CB 4.31Å; L2868-C2872 WeakPolarHBondContact CB-O 3.47Å; L2868-C2872 HydrophobicContact CD1-CB 4.16Å; L2868-C2872 HydrophobicContact CG-CB 4.45Å; L2868-C2872 PolarHBondContact N-O 3.14Å; L2868-V2874 HydrophobicContact CD1-CG2 3.59Å; L2868-V2874 HydrophobicContact CG-CG2 4.13Å
2869	K	95.4	Very high	94.3	Very high	133 Å²	133	23.6 Å²	23.6	58%	0.578	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-23.1	172.8	-168.2	175.5	-178.8	177.7	0	112.7	P2447 S2851 G2871	P2447-K2869 HydrophobicContact CB-CG 4.07Å; P2447-K2869 HydrophobicContact CG-CG 3.77Å; P2447-K2869 WeakPolarHBondContact CG-O 3.42Å; S2851-K2869 PolarHBondContact O-N 2.99Å; K2869-G2871 PolarHBondContact O-N 3.48Å
2870	S	94.5	Very high	94.1	Very high	28 Å²	28	19.1 Å²	19.1	20%	0.196	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-4.5	173	56.1	0	0	0	0	114.6	T2850 L2868 C2872	T2850-S2870 WeakPolarHBondContact OG1-CB 3.28Å; T2850-S2870 PolarHBondContact OG1-N 2.73Å; T2850-S2870 PolarHBondContact OG1-OG 2.83Å; L2868-S2870 WeakPolarHBondContact CB-OG 3.27Å; L2868-S2870 PolarHBondContact O-N 3.37Å; S2870-C2872 VanDerWaalsContact C-N 3.34Å
2871	G	91	Very high	93.8	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	8%	0.084	C	C	.	.	S	Bend	trans	77	22.7	-172.1	0	0	0	0	0	113.2	F2442 S2446 L2868 K2869	F2442-G2871 WeakPolarHBondContact CB-O 3.45Å; F2442-G2871 WeakPolarHBondContact CD2-O 3.3Å; F2442-G2871 WeakPolarHBondContact CG-O 3.26Å; F2442-G2871 PolarHBondContact N-O 3.43Å; S2446-G2871 WeakPolarHBondContact O-CA 3.48Å; L2868-G2871 PolarHBondContact O-N 3.43Å; L2868-G2871 VanDerWaalsContact O-N 3.13Å; K2869-G2871 PolarHBondContact O-N 3.48Å
2872	C	93.7	Very high	93.2	Very high	11 Å²	11	18.9 Å²	18.9	7%	0.074	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	148.2	174.5	-64.8	0	0	0	0	111.2	L2440 L2868 S2870	L2440-C2872 CarbonylContact O-C 3.48Å; L2440-C2872 VanDerWaalsContact O-CA 3.26Å; L2440-C2872 WeakPolarHBondContact O-CA 3.45Å; L2868-C2872 HydrophobicContact CB-CB 4.31Å; L2868-C2872 WeakPolarHBondContact CB-O 3.47Å; L2868-C2872 HydrophobicContact CD1-CB 4.16Å; L2868-C2872 HydrophobicContact CG-CB 4.45Å; L2868-C2872 PolarHBondContact N-O 3.14Å; S2870-C2872 VanDerWaalsContact C-N 3.34Å
2873	L	94.7	Very high	92.7	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	113.9	167.2	175.6	62.3	0	0	0	108.5	S2439 L2440 F2442 L2451 V2465 L2573 F2865 A2866	S2439-L2873 CarbonylContact C-O 3.55Å; S2439-L2873 WeakPolarHBondContact CA-O 3.24Å; L2440-L2873 HydrophobicContact CB-CB 4.35Å; L2440-L2873 HydrophobicContact CD1-CD2 4.45Å; L2440-L2873 PolarHBondContact N-O 3.18Å; L2440-L2873 PolarHBondContact O-N 3.41Å; F2442-L2873 HydrophobicContact CE1-CB 4.37Å; F2442-L2873 HydrophobicContact CE2-CB 4.32Å; F2442-L2873 HydrophobicContact CZ-CB 3.76Å; F2442-L2873 HydrophobicContact CZ-CD2 4.25Å; L2451-L2873 HydrophobicContact CD1-CD1 3.8Å; L2451-L2873 HydrophobicContact CD2-CD1 3.78Å; L2451-L2873 HydrophobicContact CG-CD1 4.48Å; V2465-L2873 HydrophobicContact CG1-CD2 4.42Å; L2573-L2873 HydrophobicContact CD1-CD2 4.02Å; F2865-L2873 HydrophobicContact CB-CD1 4.1Å; A2866-L2873 WeakPolarHBondContact O-CA 3.49Å
2874	V	95.5	Very high	91.9	Very high	9 Å²	9	18.1 Å²	18.1	6%	0.055	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	142.1	176.2	179.4	0	0	0	0	109.7	F2436 A2866 L2868 F2876	F2436-V2874 HydrophobicContact CD2-CG1 4.14Å; F2436-V2874 HydrophobicContact CE2-CG1 3.88Å; A2866-V2874 HydrophobicContact CB-CB 4.49Å; A2866-V2874 PolarHBondContact N-O 3.02Å; A2866-V2874 PolarHBondContact O-N 3.03Å; L2868-V2874 HydrophobicContact CD1-CG2 3.59Å; L2868-V2874 HydrophobicContact CG-CG2 4.13Å; V2874-F2876 HydrophobicContact CB-CE2 4.26Å; V2874-F2876 HydrophobicContact CG1-CD2 3.97Å; V2874-F2876 HydrophobicContact CG1-CE1 4.42Å; V2874-F2876 HydrophobicContact CG1-CE2 3.41Å; V2874-F2876 VanDerWaalsContact CG1-CE2 3.41Å; V2874-F2876 HydrophobicContact CG1-CZ 3.68Å
2875	V	96	Very high	90.6	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.012	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.4	177.8	-168.8	0	0	0	0	109.5	C2437 M2438 L2573 F2863 I2864 F2865	C2437-V2875 HydrophobicContact CB-CB 4.12Å; C2437-V2875 HydrophobicContact CB-CG1 4.06Å; C2437-V2875 VanDerWaalsContact CB-O 3.31Å; C2437-V2875 WeakPolarHBondContact CB-O 3.37Å; C2437-V2875 PolarHBondContact N-O 3.24Å; M2438-V2875 HydrophobicContact CG-CB 3.82Å; M2438-V2875 HydrophobicContact CG-CG2 3.66Å; M2438-V2875 PolarHBondContact N-O 3.02Å; M2438-V2875 PolarHBondContact O-N 2.94Å; M2438-V2875 HydrophobicContact SD-CG2 4.41Å; L2573-V2875 HydrophobicContact CD1-CG2 3.82Å; F2863-V2875 HydrophobicContact CB-CG1 4.18Å; F2863-V2875 HydrophobicContact CD1-CG1 3.79Å; F2863-V2875 HydrophobicContact CG-CG1 4.45Å; I2864-V2875 CarbonylContact O-C 3.6Å; I2864-V2875 VanDerWaalsContact O-CA 3.28Å; I2864-V2875 WeakPolarHBondContact O-CA 3.3Å; F2865-V2875 HydrophobicContact CD1-CG1 4.1Å; F2865-V2875 HydrophobicContact CD1-CG2 3.84Å; F2865-V2875 HydrophobicContact CE1-CG1 3.96Å; F2865-V2875 HydrophobicContact CE1-CG2 4.1Å
2876	F	96.1	Very high	89.2	Confident	4 Å²	4	23.9 Å²	23.9	2%	0.018	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	150.8	173.5	-64.3	-86.5	0	0	0	110.8	E2435 F2436 I2831 F2845 P2846 F2863 I2864 V2874	E2435-F2876 CarbonylContact O-C 3.57Å; E2435-F2876 WeakPolarHBondContact O-CA 3.32Å; E2435-F2876 WeakPolarHBondContact O-CB 3.46Å; E2435-F2876 WeakPolarHBondContact O-CD1 3.36Å; F2436-F2876 HydrophobicContact CD2-CE1 4.33Å; I2831-F2876 HydrophobicContact CD1-CD2 3.58Å; I2831-F2876 HydrophobicContact CD1-CE2 3.67Å; F2845-F2876 HydrophobicContact CD1-CB 4.01Å; F2845-F2876 AromaticContact CD1-CD1 3.88Å; F2845-F2876 HydrophobicContact CD1-CD1 3.88Å; F2845-F2876 HydrophobicContact CD1-CG 4Å; F2845-F2876 HydrophobicContact CE1-CB 4Å; F2845-F2876 HydrophobicContact CE1-CG 4.49Å; P2846-F2876 HydrophobicContact CB-CE1 4.4Å; P2846-F2876 HydrophobicContact CG-CE1 4.49Å; F2863-F2876 CarbonylContact C-O 3.54Å; F2863-F2876 VanDerWaalsContact CA-O 3.26Å; F2863-F2876 WeakPolarHBondContact CA-O 3.37Å; I2864-F2876 HydrophobicContact CB-CB 4.33Å; I2864-F2876 HydrophobicContact CD1-CB 4.47Å; I2864-F2876 PolarHBondContact N-O 3.04Å; I2864-F2876 PolarHBondContact O-N 2.72Å; V2874-F2876 HydrophobicContact CB-CE2 4.26Å; V2874-F2876 HydrophobicContact CG1-CD2 3.97Å; V2874-F2876 HydrophobicContact CG1-CE1 4.42Å; V2874-F2876 HydrophobicContact CG1-CE2 3.41Å; V2874-F2876 VanDerWaalsContact CG1-CE2 3.41Å; V2874-F2876 HydrophobicContact CG1-CZ 3.68Å
2877	Y	94.2	Very high	87.7	Confident	11 Å²	11	24.8 Å²	24.8	4%	0.043	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	148.7	165.6	-57.3	-65.1	0	0	0	110.4	E2434 E2435 F2436 C2437 V2487 Y2488 A2491 F2845 R2862 F2863	E2434-Y2877 WeakPolarHBondContact O-CD2 3.44Å; E2435-Y2877 PolarHBondContact O-N 3.25Å; F2436-Y2877 WeakPolarHBondContact O-CE2 3.08Å; C2437-Y2877 HydrophobicContact CB-CD1 4.2Å; C2437-Y2877 HydrophobicContact CB-CD2 4.12Å; C2437-Y2877 HydrophobicContact CB-CE1 3.77Å; C2437-Y2877 HydrophobicContact CB-CE2 3.63Å; C2437-Y2877 HydrophobicContact CB-CG 4.38Å; C2437-Y2877 VanDerWaalsContact CB-CZ 3.41Å; C2437-Y2877 VanDerWaalsContact SG-CZ 3.56Å; C2437-Y2877 PolarHBondContact SG-OH 3.2Å; V2487-Y2877 WeakPolarHBondContact CG1-OH 3.5Å; Y2488-Y2877 AromaticContact CD2-CD1 3.6Å; Y2488-Y2877 HydrophobicContact CD2-CD1 3.6Å; Y2488-Y2877 HydrophobicContact CD2-CE1 4.22Å; Y2488-Y2877 HydrophobicContact CD2-CG 4.44Å; Y2488-Y2877 HydrophobicContact CE2-CD1 4.13Å; A2491-Y2877 HydrophobicContact CB-CD2 3.89Å; A2491-Y2877 HydrophobicContact CB-CE1 4.24Å; A2491-Y2877 HydrophobicContact CB-CE2 3.63Å; A2491-Y2877 HydrophobicContact CB-CG 4.33Å; F2845-Y2877 VanDerWaalsContact CE1-O 3.29Å; F2845-Y2877 WeakPolarHBondContact CE1-O 3.4Å; R2862-Y2877 WeakPolarHBondContact O-CA 3.31Å; F2863-Y2877 AromaticContact CD1-CD1 3.91Å; F2863-Y2877 HydrophobicContact CD1-CD1 3.91Å; F2863-Y2877 HydrophobicContact CD1-CE1 4.1Å; F2863-Y2877 AromaticContact CE1-CD1 3.52Å; F2863-Y2877 HydrophobicContact CE1-CD1 3.52Å; F2863-Y2877 AromaticContact CE1-CE1 3.32Å; F2863-Y2877 HydrophobicContact CE1-CE1 3.32Å; F2863-Y2877 HydrophobicContact CZ-CD1 4.15Å; F2863-Y2877 AromaticContact CZ-CE1 3.95Å; F2863-Y2877 HydrophobicContact CZ-CE1 3.95Å
2878	I	92.4	Very high	86.1	Confident	3 Å²	3	27.3 Å²	27.3	2%	0.015	13%	0.13	C	C	.	.			trans	-145	138.9	173.1	-178.1	159.1	0	0	0	111.2	Y2488 I2833 F2845 L2857 Q2861 R2862 I2864 F2880 W2883	Y2488-I2878 PolarHBondContact OH-O 3.49Å; Y2488-I2878 VanDerWaalsContact OH-O 3.07Å; I2833-I2878 HydrophobicContact CD1-CD1 3.98Å; F2845-I2878 HydrophobicContact CE2-CD1 4.32Å; F2845-I2878 HydrophobicContact CZ-CB 4.23Å; F2845-I2878 HydrophobicContact CZ-CD1 4.13Å; F2845-I2878 HydrophobicContact CZ-CG1 4.29Å; L2857-I2878 HydrophobicContact CD2-CG2 4.35Å; Q2861-I2878 WeakPolarHBondContact O-CG2 3.09Å; R2862-I2878 PolarHBondContact O-N 3.42Å; I2864-I2878 HydrophobicContact CD1-CB 3.95Å; I2864-I2878 HydrophobicContact CD1-CD1 3.77Å; I2864-I2878 HydrophobicContact CD1-CG1 4.43Å; I2864-I2878 HydrophobicContact CD1-CG2 4.24Å; I2864-I2878 HydrophobicContact CG1-CB 3.96Å; I2864-I2878 HydrophobicContact CG1-CD1 4.22Å; I2864-I2878 HydrophobicContact CG1-CG2 3.68Å; I2878-F2880 HydrophobicContact CD1-CD1 4.07Å; I2878-F2880 HydrophobicContact CD1-CD2 4.37Å; I2878-F2880 HydrophobicContact CD1-CE1 3.55Å; I2878-F2880 HydrophobicContact CD1-CE2 3.86Å; I2878-F2880 HydrophobicContact CD1-CG 4.47Å; I2878-F2880 HydrophobicContact CD1-CZ 3.44Å; I2878-F2880 VanDerWaalsContact CD1-CZ 3.44Å; I2878-F2880 HydrophobicContact CG1-CD2 4.3Å; I2878-F2880 HydrophobicContact CG1-CE1 4.39Å; I2878-F2880 HydrophobicContact CG1-CE2 4.15Å; I2878-F2880 HydrophobicContact CG1-CG 4.48Å; I2878-F2880 HydrophobicContact CG1-CZ 4.22Å; I2878-F2880 HydrophobicContact CG2-CE2 4.45Å; I2878-W2883 HydrophobicContact CD1-CH2 4.26Å; I2878-W2883 HydrophobicContact CD1-CZ3 4.11Å; I2878-W2883 HydrophobicContact CG1-CH2 4.34Å; I2878-W2883 HydrophobicContact CG1-CZ3 4.28Å
2879	D	88.8	Confident	84.3	Confident	12 Å²	12	35 Å²	35	6%	0.064	17%	0.166	C	C	.	.			trans	-129.7	99.9	169.2	-165.9	-14	0	0	0	110.8	L2432 R2492 N2881 Q2882 Y2891	L2432-D2879 HydrophobicContact CD1-CB 4.24Å; R2492-D2879 IonicContact CZ-OD2 3.99Å; R2492-D2879 IonicContact NH2-OD2 3.36Å; R2492-D2879 PolarHBondContact NH2-OD2 3.13Å; D2879-N2881 PolarHBondContact O-N 3.22Å; D2879-N2881 VanDerWaalsContact O-N 3.12Å; D2879-N2881 VanDerWaalsContact OD1-CB 3.29Å; D2879-N2881 WeakPolarHBondContact OD1-CB 3.27Å; D2879-N2881 PolarHBondContact OD1-N 3.14Å; D2879-N2881 VanDerWaalsContact OD1-N 3.07Å; D2879-N2881 PolarHBondContact OD1-ND2 2.96Å; D2879-Q2882 WeakPolarHBondContact O-CB 3.26Å; D2879-Q2882 PolarHBondContact O-N 2.89Å; D2879-Y2891 PolarHBondContact OD2-OH 3.33Å
2880	F	87.4	Confident	82.6	Confident	20 Å²	20	35.7 Å²	35.7	9%	0.088	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-63.5	-16.2	179.5	-70.8	-73	0	0	0	114.2	Y2821 L2823 L2857 Q2861 I2878 Q2882 W2883	Y2821-F2880 HydrophobicContact CD2-CB 4.08Å; Y2821-F2880 AromaticContact CD2-CD1 3.29Å; Y2821-F2880 HydrophobicContact CD2-CD1 3.29Å; Y2821-F2880 AromaticContact CD2-CE1 3.98Å; Y2821-F2880 HydrophobicContact CD2-CE1 3.98Å; Y2821-F2880 AromaticContact CD2-CG 3.99Å; Y2821-F2880 HydrophobicContact CD2-CG 3.99Å; Y2821-F2880 HydrophobicContact CE2-CB 3.9Å; Y2821-F2880 AromaticContact CE2-CD1 3.91Å; Y2821-F2880 HydrophobicContact CE2-CD1 3.91Å; Y2821-F2880 HydrophobicContact CE2-CG 4.32Å; Y2821-F2880 AromaticContact CG-CD1 3.81Å; Y2821-F2880 HydrophobicContact CG-CD1 3.81Å; Y2821-F2880 HydrophobicContact CG-CE1 4.15Å; Y2821-F2880 PolarHBondContact OH-O 2.58Å; L2823-F2880 HydrophobicContact CD1-CE1 3.73Å; L2823-F2880 HydrophobicContact CD1-CZ 3.64Å; L2857-F2880 HydrophobicContact CD1-CE2 4.46Å; L2857-F2880 HydrophobicContact CD1-CZ 4.32Å; Q2861-F2880 HydrophobicContact CB-CD2 4.36Å; Q2861-F2880 HydrophobicContact CB-CE2 4.06Å; I2878-F2880 HydrophobicContact CD1-CD1 4.07Å; I2878-F2880 HydrophobicContact CD1-CD2 4.37Å; I2878-F2880 HydrophobicContact CD1-CE1 3.55Å; I2878-F2880 HydrophobicContact CD1-CE2 3.86Å; I2878-F2880 HydrophobicContact CD1-CG 4.47Å; I2878-F2880 HydrophobicContact CD1-CZ 3.44Å; I2878-F2880 VanDerWaalsContact CD1-CZ 3.44Å; I2878-F2880 HydrophobicContact CG1-CD2 4.3Å; I2878-F2880 HydrophobicContact CG1-CE1 4.39Å; I2878-F2880 HydrophobicContact CG1-CE2 4.15Å; I2878-F2880 HydrophobicContact CG1-CG 4.48Å; I2878-F2880 HydrophobicContact CG1-CZ 4.22Å; I2878-F2880 HydrophobicContact CG2-CE2 4.45Å; F2880-Q2882 PolarHBondContact O-N 3.11Å; F2880-W2883 HydrophobicContact CD1-CE3 4.19Å; F2880-W2883 AromaticContact CD1-CZ3 3.9Å; F2880-W2883 HydrophobicContact CD1-CZ3 3.9Å; F2880-W2883 HydrophobicContact CE1-CZ3 4.41Å; F2880-W2883 PolarHBondContact O-N 3.48Å
2881	N	82	Confident	80.6	Confident	50 Å²	50	35.4 Å²	35.4	27%	0.267	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-68.2	-24.8	178.9	-62.5	-58.7	0	0	0	112.1	I2428 D2879 W2883 H2884 F2887 Y2891	I2428-N2881 HydrophobicContact CG1-CB 4.33Å; D2879-N2881 PolarHBondContact O-N 3.22Å; D2879-N2881 VanDerWaalsContact O-N 3.12Å; D2879-N2881 VanDerWaalsContact OD1-CB 3.29Å; D2879-N2881 WeakPolarHBondContact OD1-CB 3.27Å; D2879-N2881 PolarHBondContact OD1-N 3.14Å; D2879-N2881 VanDerWaalsContact OD1-N 3.07Å; D2879-N2881 PolarHBondContact OD1-ND2 2.96Å; N2881-W2883 PolarHBondContact O-N 3.16Å; N2881-H2884 WeakPolarHBondContact O-CB 3.43Å; N2881-H2884 PolarHBondContact O-N 3.46Å; N2881-F2887 HydrophobicContact CB-CD2 4.11Å; N2881-Y2891 HydrophobicContact CB-CE2 4.32Å; N2881-Y2891 WeakPolarHBondContact CB-OH 3.48Å; N2881-Y2891 WeakPolarHBondContact O-CE2 3.38Å
2882	Q	79.6	Confident	78.9	Confident	48 Å²	48	45.3 Å²	45.3	22%	0.224	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-55.7	-35.4	177.4	-173.4	179.5	4.7	0	0	112.5	D2879 F2880 Y2891	D2879-Q2882 WeakPolarHBondContact O-CB 3.26Å; D2879-Q2882 PolarHBondContact O-N 2.89Å; F2880-Q2882 PolarHBondContact O-N 3.11Å; Q2882-Y2891 VanDerWaalsContact CA-CE2 3.5Å; Q2882-Y2891 HydrophobicContact CB-CE1 4.36Å; Q2882-Y2891 HydrophobicContact CB-CE2 4.49Å; Q2882-Y2891 HydrophobicContact CG-CG 4.39Å; Q2882-Y2891 HydrophobicContact CG-CD1 4.33Å
2883	W	81.8	Confident	78.1	Confident	23 Å²	23	47 Å²	47	9%	0.087	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-99.8	4.2	-179.1	-49.1	-59.6	0	0	0	113.3	Y2821 I2833 V2842 H2843 I2878 F2880 N2881 H2885 Q2888	Y2821-W2883 HydrophobicContact CE1-CB 3.85Å; Y2821-W2883 WeakPolarHBondContact OH-CB 3.39Å; Y2821-W2883 PolarHBondContact OH-O 3.26Å; I2833-W2883 HydrophobicContact CB-CH2 4.5Å; I2833-W2883 HydrophobicContact CB-CZ3 4.47Å; I2833-W2883 HydrophobicContact CG1-CH2 3.78Å; I2833-W2883 HydrophobicContact CG1-CZ2 4.43Å; I2833-W2883 HydrophobicContact CG1-CZ3 4.02Å; I2833-W2883 HydrophobicContact CG2-CE3 4.11Å; I2833-W2883 HydrophobicContact CG2-CH2 4.47Å; I2833-W2883 HydrophobicContact CG2-CZ3 3.97Å; V2842-W2883 HydrophobicContact CG1-CB 3.98Å; V2842-W2883 VanDerWaalsContact CG1-CD1 3.41Å; V2842-W2883 HydrophobicContact CG1-CD2 4.07Å; V2842-W2883 HydrophobicContact CG1-CG 3.53Å; H2843-W2883 HydrophobicContact CB-CH2 4.17Å; H2843-W2883 HydrophobicContact CB-CZ2 3.39Å; H2843-W2883 AromaticContact CD2-CZ2 3.61Å; H2843-W2883 AromaticContact CG-CZ2 3.49Å; H2843-W2883 VanDerWaalsContact CG-CZ2 3.49Å; I2878-W2883 HydrophobicContact CD1-CH2 4.26Å; I2878-W2883 HydrophobicContact CD1-CZ3 4.11Å; I2878-W2883 HydrophobicContact CG1-CH2 4.34Å; I2878-W2883 HydrophobicContact CG1-CZ3 4.28Å; F2880-W2883 HydrophobicContact CD1-CE3 4.19Å; F2880-W2883 AromaticContact CD1-CZ3 3.9Å; F2880-W2883 HydrophobicContact CD1-CZ3 3.9Å; F2880-W2883 HydrophobicContact CE1-CZ3 4.41Å; F2880-W2883 PolarHBondContact O-N 3.48Å; N2881-W2883 PolarHBondContact O-N 3.16Å; W2883-H2885 PolarHBondContact O-N 3.43Å; W2883-Q2888 PolarHBondContact O-NE2 3.06Å
2884	H	78.6	Confident	77.2	Confident	24 Å²	24	49.5 Å²	49.5	11%	0.111	22%	0.221	C	C	.	.			trans	-72.8	128.1	179.6	-168.8	-91.5	0	0	0	110.6	Y2821 N2881 E2886 F2887 Q2888	Y2821-H2884 PolarHBondContact OH-N 3.48Å; N2881-H2884 WeakPolarHBondContact O-CB 3.43Å; N2881-H2884 PolarHBondContact O-N 3.46Å; H2884-E2886 VanDerWaalsContact C-N 3.28Å; H2884-E2886 IonicContact CE1-OE2 3.82Å; H2884-E2886 PolarHBondContact ND1-N 3.31Å; H2884-E2886 PolarHBondContact O-N 2.83Å; H2884-E2886 VanDerWaalsContact O-N 3.12Å; H2884-F2887 HydrophobicContact CB-CB 4.29Å; H2884-F2887 HydrophobicContact CB-CD2 3.71Å; H2884-F2887 HydrophobicContact CB-CE2 4.43Å; H2884-F2887 HydrophobicContact CB-CG 4.34Å; H2884-F2887 AromaticContact CG-CD2 3.88Å; H2884-F2887 AromaticContact ND1-CD2 3.73Å; H2884-F2887 AromaticContact ND1-CE2 3.86Å; H2884-F2887 PolarHBondContact O-N 2.6Å; H2884-Q2888 PolarHBondContact O-N 3.48Å; H2884-Q2888 WeakPolarHBondContact O-CG 3.35Å
2885	H	70.9	Confident	76.2	Confident	69 Å²	69	51.7 Å²	51.7	32%	0.319	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-38.4	-173	66.3	-73	0	0	0	114.8	W2883 F2887	W2883-H2885 PolarHBondContact O-N 3.43Å; H2885-F2887 VanDerWaalsContact C-N 3.31Å; H2885-F2887 PolarHBondContact O-N 3.33Å
2886	E	67.8	Low	75.1	Confident	52 Å²	52	54.6 Å²	54.6	24%	0.243	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-21.9	177.1	-59.6	-174.2	138.9	0	0	114.1	S2342 E2343 H2884	S2342-E2886 WeakPolarHBondContact CA-OE1 3.49Å; S2342-E2886 VanDerWaalsContact CB-OE1 3.24Å; S2342-E2886 WeakPolarHBondContact CB-OE1 3.14Å; E2343-E2886 PolarHBondContact N-OE1 3.4Å; H2884-E2886 VanDerWaalsContact C-N 3.28Å; H2884-E2886 IonicContact CE1-OE2 3.82Å; H2884-E2886 PolarHBondContact ND1-N 3.31Å; H2884-E2886 PolarHBondContact O-N 2.83Å; H2884-E2886 VanDerWaalsContact O-N 3.12Å
2887	F	66.9	Low	73.7	Confident	19 Å²	19	57.8 Å²	57.8	8%	0.083	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-20.6	-171.8	-59.9	-30.6	0	0	0	112.8	A2421 I2428 F2429 N2881 H2884 H2885 Q2889 R2890 Y2891	A2421-F2887 HydrophobicContact CB-CZ 4.28Å; I2428-F2887 HydrophobicContact CD1-CE2 4.42Å; F2429-F2887 HydrophobicContact CE1-CB 3.74Å; F2429-F2887 AromaticContact CE1-CD1 3.64Å; F2429-F2887 HydrophobicContact CE1-CD1 3.64Å; F2429-F2887 AromaticContact CE1-CG 3.79Å; F2429-F2887 HydrophobicContact CE1-CG 3.79Å; F2429-F2887 AromaticContact CZ-CD1 3.64Å; F2429-F2887 HydrophobicContact CZ-CD1 3.64Å; F2429-F2887 HydrophobicContact CZ-CE1 4.11Å; F2429-F2887 HydrophobicContact CZ-CG 4.21Å; N2881-F2887 HydrophobicContact CB-CD2 4.11Å; H2884-F2887 HydrophobicContact CB-CB 4.29Å; H2884-F2887 HydrophobicContact CB-CD2 3.71Å; H2884-F2887 HydrophobicContact CB-CE2 4.43Å; H2884-F2887 HydrophobicContact CB-CG 4.34Å; H2884-F2887 AromaticContact CG-CD2 3.88Å; H2884-F2887 AromaticContact ND1-CD2 3.73Å; H2884-F2887 AromaticContact ND1-CE2 3.86Å; H2884-F2887 PolarHBondContact O-N 2.6Å; H2885-F2887 VanDerWaalsContact C-N 3.31Å; H2885-F2887 PolarHBondContact O-N 3.33Å; F2887-Q2889 VanDerWaalsContact C-N 3.3Å; F2887-Q2889 PolarHBondContact O-N 3.43Å; F2887-R2890 WeakPolarHBondContact O-CB 3.42Å; F2887-R2890 PolarHBondContact O-N 3.16Å; F2887-Y2891 WeakPolarHBondContact O-CD2 3.41Å; F2887-Y2891 PolarHBondContact O-N 3.24Å; F2887-Y2891 HydrophobicContact CB-CE2 4Å; F2887-Y2891 HydrophobicContact CB-CD2 4.2Å
2888	Q	63.9	Low	72.4	Confident	53 Å²	53	60.9 Å²	60.9	25%	0.248	27%	0.271	C	S	.	.	H	α-helix	trans	-48.1	-49.8	-179	-82.4	175	8.5	0	0	112.2	W2883 H2884 R2890 Y2891 F2892	W2883-Q2888 PolarHBondContact O-NE2 3.06Å; H2884-Q2888 PolarHBondContact O-N 3.48Å; H2884-Q2888 WeakPolarHBondContact O-CG 3.35Å; Q2888-R2890 PolarHBondContact O-N 3.38Å; Q2888-R2890 VanDerWaalsContact O-N 3.08Å; Q2888-Y2891 PolarHBondContact O-N 3.4Å; Q2888-Y2891 VanDerWaalsContact O-N 3.16Å; Q2888-F2892 WeakPolarHBondContact O-CD2 3.48Å; Q2888-F2892 PolarHBondContact O-N 3.14Å
2889	Q	59.8	Low	71	Confident	164 Å²	164	65.1 Å²	65.1	77%	0.766	29%	0.29	S	S	*	.	H	α-helix	trans	-66.2	-8.7	-179.9	-66.7	-176.6	-1.7	0	0	115.1	F2887 F2892	F2887-Q2889 VanDerWaalsContact C-N 3.3Å; F2887-Q2889 PolarHBondContact O-N 3.43Å; Q2889-F2892 VanDerWaalsContact O-OXT 3.06Å
2890	R	58.8	Low	69.6	Low	148 Å²	148	69.2 Å²	69.2	56%	0.558	31%	0.307	S	S	*	.	H	α-helix	trans	-102.4	-17.6	176.6	-67.9	-174.8	178.3	-179.2	1.9	113.1	F2429 F2887 Q2888	F2429-R2890 HydrophobicContact CD1-CB 3.65Å; F2429-R2890 HydrophobicContact CE1-CB 3.67Å; F2429-R2890 HydrophobicContact CE1-CG 4.26Å; F2429-R2890 HydrophobicContact CG-CB 4.36Å; F2429-R2890 HydrophobicContact CZ-CB 4.42Å; F2887-R2890 WeakPolarHBondContact O-CB 3.42Å; F2887-R2890 PolarHBondContact O-N 3.16Å; Q2888-R2890 PolarHBondContact O-N 3.38Å; Q2888-R2890 VanDerWaalsContact O-N 3.08Å
2891	Y	53.3	Low	68.1	Low	21 Å²	21	73.3 Å²	73.3	8%	0.082	33%	0.325	C	S	.	.	H	α-helix	trans	-85.1	-30.9	172.1	-79.8	-86.4	0	0	0	112	I2428 F2429 L2431 D2879 N2881 Q2882 F2887 Q2888	I2428-Y2891 VanDerWaalsContact O-CZ 3.28Å; I2428-Y2891 PolarHBondContact O-OH 3.3Å; F2429-Y2891 HydrophobicContact CD1-CD2 4.09Å; F2429-Y2891 AromaticContact CD1-CE2 3.91Å; F2429-Y2891 HydrophobicContact CD1-CE2 3.91Å; F2429-Y2891 HydrophobicContact CE1-CE2 4.41Å; L2431-Y2891 HydrophobicContact CD1-CD1 3.62Å; L2431-Y2891 HydrophobicContact CD1-CE1 4.47Å; L2431-Y2891 HydrophobicContact CD1-CG 4.48Å; L2431-Y2891 HydrophobicContact CG-CD1 3.95Å; D2879-Y2891 PolarHBondContact OD2-OH 3.33Å; N2881-Y2891 HydrophobicContact CB-CE2 4.32Å; N2881-Y2891 WeakPolarHBondContact CB-OH 3.48Å; N2881-Y2891 WeakPolarHBondContact O-CE2 3.38Å; Q2882-Y2891 VanDerWaalsContact CA-CE2 3.5Å; Q2882-Y2891 HydrophobicContact CB-CE1 4.36Å; Q2882-Y2891 HydrophobicContact CB-CE2 4.49Å; Q2882-Y2891 HydrophobicContact CG-CG 4.39Å; Q2882-Y2891 HydrophobicContact CG-CD1 4.33Å; F2887-Y2891 WeakPolarHBondContact O-CD2 3.41Å; F2887-Y2891 PolarHBondContact O-N 3.24Å; F2887-Y2891 HydrophobicContact CB-CE2 4Å; F2887-Y2891 HydrophobicContact CB-CD2 4.2Å; Q2888-Y2891 PolarHBondContact O-N 3.4Å; Q2888-Y2891 VanDerWaalsContact O-N 3.16Å
2892	F	53.7	Low	66.8	Low	208 Å²	208	75.4 Å²	75.4	91%	0.912	33%	0.33	S	S	*	.			trans	-93.6	0	170.6	-61.5	-68.5	0	0	0	110.1	Q2888 Q2889	Q2888-F2892 WeakPolarHBondContact O-CD2 3.48Å; Q2888-F2892 PolarHBondContact O-N 3.14Å; Q2889-F2892 VanDerWaalsContact O-OXT 3.06Å

Retrieved 2,892 of 2,892 residues in 2771 ms (Link to these results)

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