G4LYI7_SCHMA Loading...

Eukaryotic translation initiation factor 3 subunit C

Component of the eukaryotic translation initiation factor 3 (eIF-3) complex, which is involved in protein synthesis of a specialized repertoire of mRNAs and, together with other initiation factors, stimulates binding of mRNA and methionyl-tRNAi to the 40S ribosome. The eIF-3 complex specifically targets and initiates translation of a subset of mRNAs involved in cell proliferation.

AlphaFold DB , UniProt , Accession G4LYI7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 869 aa.

						>G4LYI7_SCHMA|G4LYI7
MYADIFSSSDSDREEEPVRRIESRPLHLSSDEEDIKRIVKSGRNKRCEEMQSIIKNLNNHKKIKDMSNIIIDFQNLVKVYEKSVQMNDFDGVPPFYVRCIAELEDFVNDSWEKKKEMNKGAVKSLATLKQRVKKYTRLFEANIRDFRENSENYVDEEPGISDIEADEQEAAPSPIKVSGTLPTSTVKKSTRKSIASDSEDDDDDMDDSDSDDFSDDDDSSSTSSIDINLDRCKDPSVYFLKSTSDDKKDKTKIKKIAKDRSTKKQLRASSDIEDGTWTTIDSYGRPEIQVQAFEKGQEINFDVVVKKMTEILASRGKKGASTSDQIVLLMQVEEKIKECDLSRGLHVKVLFAFISVLFDYDKKHDCMNSNLFDRTLNAFDRLFDLLNEINIQLIALDSNDDESFEHEPYRIKASILTVVGLLDVECFKVLQNANGHESEYVDRLRDERRVCNIIDRLCVYLEKKEYPPDALCAAYLHKLEHMYYKFDFEWGRKVEASSMEEVGLHPNTLVIQKLCEYIYLNDRTDRLRTRAILCHIYHLALYNQWFKARDLMLMSDLQMSIEHADQSTMILYNRAMVQLGLCAFRQSHIRDAHNALADMIGSNRIRELLAQGLHTQSRYEKTTEEEKREQALQMPYHMYINIDLIECVYLVSAMLLEIPNLAAHETDLRWRPISKPFHLALRVHDRAALVGPPETPRDHVLAAAKAMRYGNWKACTNFIINPKMDAKIWDLLFESNKVKQNLEVKIKEESLRSFLFTFSAIHDSMTLDRLSMCFELPKSVIYSVICRMIINQELAASLEVPSDALIMHKTERSRLQALALQLSDKVNSIVEMNDKLIESRTGGLSGLKGSQSYQGTRRVGTRYTLNKFN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.3	Very low	35.4	Very low	184 Å²	184	150.3 Å²	150.3	91%	0.906	83%	0.834	S	S	*	*				0	66	0	-67.4	-179	-176.8	0	0	114.2	D397	M1-D397 WeakPolarHBondContact CG-OD1 3.47Å; M1-D397 VanDerWaalsContact N-CG 3.26Å; M1-D397 PolarHBondContact N-OD1 2.98Å; M1-D397 PolarHBondContact N-OD2 3.15Å
2	Y	35.9	Very low	35.4	Very low	244 Å²	244	149.2 Å²	149.2	96%	0.957	83%	0.825	S	S	*	*			trans	-141.9	82.9	152	-100.3	-72.5	0	0	0	106.3
3	A	34.9	Very low	35.3	Very low	85 Å²	85	154.7 Å²	154.7	70%	0.702	83%	0.826	S	S	*	*			trans	-157.8	149.9	171.5	0	0	0	0	0	105.2
4	D	37	Very low	35.1	Very low	154 Å²	154	157.4 Å²	157.4	82%	0.824	83%	0.831	S	S	*	*			trans	67.8	85	-174.6	-49.1	-25.9	0	0	0	115.1
5	I	40.4	Very low	35	Very low	154 Å²	154	159.7 Å²	159.7	79%	0.79	84%	0.835	S	S	*	*	S	Bend		-171.3	88.3	126.8	-81.6	141	0	0	0	104.5
6	F	35.6	Very low	35	Very low	217 Å²	217	161.6 Å²	161.6	95%	0.952	84%	0.839	S	S	*	*			trans	171	69.6	155.8	-81.2	-50.3	0	0	0	106.8
7	S	32.3	Very low	34.9	Very low	118 Å²	118	158.6 Å²	158.6	83%	0.825	83%	0.832	S	S	*	*			trans	-132.8	132.1	168.7	-171.9	0	0	0	0	108
8	S	33.1	Very low	34.7	Very low	116 Å²	116	157.9 Å²	157.9	81%	0.811	84%	0.835	S	S	*	*			trans	-72.2	138.4	-171.7	52.2	0	0	0	0	113.1
9	S	34.6	Very low	34.7	Very low	110 Å²	110	161.7 Å²	161.7	77%	0.769	84%	0.837	S	S	*	*			trans	-151.6	126.9	151	-171.8	0	0	0	0	110.6
10	D	31.9	Very low	34.4	Very low	159 Å²	159	165.3 Å²	165.3	85%	0.85	84%	0.839	S	S	*	*			trans	-53.9	141.9	163.9	-76.3	-59.9	0	0	0	111.5
11	S	37.7	Very low	34.5	Very low	112 Å²	112	165.4 Å²	165.4	78%	0.783	84%	0.84	S	S	*	*			trans	-171.6	105.3	144.2	11.9	0	0	0	0	112.4
12	D	35.2	Very low	34.5	Very low	137 Å²	137	164.7 Å²	164.7	73%	0.733	83%	0.834	S	S	*	*			trans	1.8	129.7	150.3	-78.8	-55.7	0	0	0	121.5
13	R	33.3	Very low	34.2	Very low	221 Å²	221	158.9 Å²	158.9	83%	0.834	83%	0.829	S	S	*	*			trans	69.9	142	144.6	-54.4	166.7	-170.8	-163.5	-1.7	117.1
14	E	33.3	Very low	34.2	Very low	192 Å²	192	166 Å²	166	90%	0.897	84%	0.838	S	S	*	*			cis	-146.6	161.5	36.8	-72.8	178.9	155.4	0	0	112.3
15	E	32.8	Very low	34	Very low	192 Å²	192	164.5 Å²	164.5	90%	0.897	84%	0.836	S	S	*	*			trans	-81.5	135.4	177	-58	175.5	139	0	0	112.3
16	E	35.6	Very low	33.8	Very low	190 Å²	190	165.5 Å²	165.5	89%	0.888	84%	0.842	S	S	*	*			trans	-129	145.1	154.1	-90.5	-152.8	155.8	0	0	111.1
17	P	33.4	Very low	33.9	Very low	112 Å²	112	163.1 Å²	163.1	73%	0.727	83%	0.834	S	S	*	*			trans	-87	150.8	-151.6	32.5	-37.7	0	0	0	115.5	R19	P17-R19 PolarHBondContact O-N 2.91Å; P17-R19 VanDerWaalsContact O-N 3.07Å
18	V	31.6	Very low	33.9	Very low	146 Å²	146	165.7 Å²	165.7	89%	0.885	84%	0.838	S	S	*	*			trans	-54.2	109.6	173.1	178.8	0	0	0	0	111.4	R20	V18-R20 PolarHBondContact O-N 3.14Å
19	R	34.3	Very low	34.1	Very low	229 Å²	229	164.2 Å²	164.2	86%	0.864	83%	0.827	S	S	*	*			trans	-82.6	110.5	167.7	-72.5	-172.5	179.3	-178.9	3.1	110.1	P17 I21	P17-R19 PolarHBondContact O-N 2.91Å; P17-R19 VanDerWaalsContact O-N 3.07Å; R19-I21 PolarHBondContact O-N 3.25Å
20	R	28.1	Very low	34.1	Very low	234 Å²	234	163.9 Å²	163.9	88%	0.883	83%	0.825	S	S	*	*			trans	-48.9	120.2	161.8	-81.6	179.8	170.3	168.4	-2	109.7	V18 E22	V18-R20 PolarHBondContact O-N 3.14Å; R20-E22 PolarHBondContact O-N 3.18Å
21	I	38.2	Very low	34.2	Very low	167 Å²	167	163.6 Å²	163.6	86%	0.856	82%	0.823	S	S	*	*			trans	-84.7	104.3	162.8	-62.5	178.1	0	0	0	106.6	R19	R19-I21 PolarHBondContact O-N 3.25Å
22	E	34.3	Very low	34.4	Very low	170 Å²	170	167.8 Å²	167.8	79%	0.794	83%	0.83	S	S	*	*			trans	-62.4	134.6	170.6	-66.1	179.6	152.4	0	0	110.1	R20 R24	R20-E22 PolarHBondContact O-N 3.18Å; E22-R24 PolarHBondContact O-N 3.3Å
23	S	30.2	Very low	34.7	Very low	121 Å²	121	170 Å²	170	85%	0.846	84%	0.837	S	S	*	*			trans	-58.8	108.9	177.4	50.6	0	0	0	0	111.3
24	R	36.4	Very low	34.9	Very low	236 Å²	236	167.3 Å²	167.3	89%	0.891	84%	0.838	S	S	*	*			trans	-83.8	138.8	164.6	-83	-175	169.5	-173.8	-2.9	110.1	E22	E22-R24 PolarHBondContact O-N 3.3Å
25	P	32.6	Very low	35.3	Very low	121 Å²	121	165.8 Å²	165.8	79%	0.786	84%	0.835	S	S	*	*			trans	-69.4	143	-175	-14	28.5	0	0	0	112.2	H27	P25-H27 PolarHBondContact O-N 2.97Å
26	L	35.5	Very low	36.2	Very low	175 Å²	175	162.3 Å²	162.3	92%	0.916	82%	0.817	S	S	*	*			trans	-60.5	114.6	166	-80.2	158.8	0	0	0	109.7
27	H	38	Very low	37	Very low	168 Å²	168	165.1 Å²	165.1	78%	0.778	82%	0.819	S	S	*	*			trans	-98.2	99.3	175.4	-170.4	-80.7	0	0	0	110.5	P25	P25-H27 PolarHBondContact O-N 2.97Å
28	L	32.2	Very low	38.3	Very low	172 Å²	172	164.5 Å²	164.5	90%	0.901	81%	0.809	S	S	*	*			trans	-78.5	113.2	165.3	-78.8	149.2	0	0	0	109.6
29	S	36.4	Very low	40.2	Very low	85 Å²	85	164.4 Å²	164.4	59%	0.594	81%	0.808	S	S	*	*			trans	-157.6	111.3	158.6	-167.2	0	0	0	0	106.1
30	S	34.7	Very low	42.1	Very low	103 Å²	103	157.7 Å²	157.7	72%	0.72	79%	0.785	S	S	*	*				70.2	103.8	61.6	-163.3	0	0	0	0	111.4
31	D	34.4	Very low	44.5	Very low	153 Å²	153	149.5 Å²	149.5	82%	0.818	76%	0.764	S	S	*	*			trans	22	102	159.9	-56.8	-14.5	0	0	0	119.5
32	E	41.6	Very low	46.4	Very low	199 Å²	199	143.8 Å²	143.8	93%	0.93	75%	0.746	S	S	*	*			trans	-129.7	133.6	137.3	-80.2	-165	149.7	0	0	108.8
33	E	42	Very low	48.6	Very low	185 Å²	185	141 Å²	141	86%	0.864	73%	0.728	S	S	*	*			trans	-78.7	161.5	-162	-60.3	173.4	137.4	0	0	115.1	I35	E33-I35 PolarHBondContact O-N 3.15Å
34	D	37.2	Very low	51.1	Low	163 Å²	163	139.6 Å²	139.6	87%	0.872	71%	0.711	S	S	*	*			trans	-60	95.3	-176.4	-75	-62.9	0	0	0	115.5	K36	D34-K36 PolarHBondContact O-N 3.23Å
35	I	41.3	Very low	53.4	Low	160 Å²	160	135 Å²	135	82%	0.821	70%	0.697	S	S	*	*			trans	-90.2	88	163	-56.6	171.7	0	0	0	109.4	E33 R37	E33-I35 PolarHBondContact O-N 3.15Å; I35-R37 PolarHBondContact O-N 3.37Å
36	K	52.3	Low	55.8	Low	120 Å²	120	131.5 Å²	131.5	52%	0.522	67%	0.669	S	S	.	*	P	Polyproline II helix	trans	-52.8	121.9	176.7	-81.2	-175.8	169.8	-170.3	0	112	D34 D281 S282	D34-K36 PolarHBondContact O-N 3.23Å; K36-D281 IonicContact NZ-OD1 3.69Å; K36-D281 PolarHBondContact NZ-OD1 2.77Å; K36-S282 WeakPolarHBondContact CD-OG 3.4Å; K36-S282 PolarHBondContact NZ-OG 3.2Å
37	R	52.7	Low	58.2	Low	248 Å²	248	124.2 Å²	124.2	94%	0.936	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-75.6	121.4	179.6	-67.3	179.4	178.4	175.5	0.9	112	I35	I35-R37 PolarHBondContact O-N 3.37Å
38	I	59.9	Low	60.5	Low	99 Å²	99	120.5 Å²	120.5	51%	0.508	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-86.6	124.5	176	-48.4	172.4	0	0	0	110.6	K40 Y283	I38-K40 HydrophobicContact CG2-CG 4.18Å; I38-Y283 HydrophobicContact CD1-CE1 4.37Å; I38-Y283 WeakPolarHBondContact CD1-OH 3.41Å; I38-Y283 HydrophobicContact CG1-CE2 4.46Å; I38-Y283 WeakPolarHBondContact CG1-OH 3.31Å
39	V	72.5	Confident	63.2	Low	144 Å²	144	116.8 Å²	116.8	87%	0.873	59%	0.593	S	S	*	*			trans	-84.7	112.6	169.2	-177.1	0	0	0	0	109.4
40	K	73.9	Confident	65.7	Low	89 Å²	89	112.8 Å²	112.8	39%	0.387	57%	0.565	S	S	.	*			trans	-98.8	145.7	175.2	-61.5	-177.5	-174.5	177.9	0	110.3	I38 K45 E48	I38-K40 HydrophobicContact CG2-CG 4.18Å; K40-K45 HydrophobicContact CB-CB 4.43Å; K40-E48 VanDerWaalsContact CD-OE2 3.23Å; K40-E48 WeakPolarHBondContact CD-OE2 3.21Å; K40-E48 WeakPolarHBondContact CE-OE2 3.5Å; K40-E48 IonicContact NZ-OE1 2.69Å; K40-E48 PolarHBondContact NZ-OE1 3.09Å; K40-E48 IonicContact NZ-OE2 2.8Å; K40-E48 PolarHBondContact NZ-OE2 3.16Å
41	S	78.6	Confident	68.3	Low	62 Å²	62	111.9 Å²	111.9	43%	0.434	55%	0.55	S	S	.	.			trans	-59.9	155.3	175	70.4	0	0	0	0	111.3	R43 N44 K45	S41-R43 PolarHBondContact O-N 3.33Å; S41-N44 PolarHBondContact O-N 3.11Å; S41-N44 VanDerWaalsContact O-N 3.15Å; S41-N44 VanDerWaalsContact OG-CB 3.31Å; S41-N44 WeakPolarHBondContact OG-CB 3.28Å; S41-N44 PolarHBondContact OG-N 2.93Å; S41-N44 PolarHBondContact OG-OD1 3.23Å; S41-K45 WeakPolarHBondContact O-CB 3.46Å; S41-K45 PolarHBondContact O-N 2.71Å
42	G	77.8	Confident	71	Confident	46 Å²	46	107.5 Å²	107.5	47%	0.474	53%	0.531	S	S	.	.	H	α-helix	trans	-52.7	-51.7	-178.9	0	0	0	0	0	112.6	K45 R46	G42-K45 PolarHBondContact O-N 3.05Å; G42-R46 PolarHBondContact O-N 3.01Å
43	R	80.5	Confident	73.3	Confident	112 Å²	112	99 Å²	99	42%	0.423	49%	0.492	S	S	.	.	H	α-helix	trans	-53.1	-55.7	172.3	178.8	-178.4	170.2	120.7	-11.6	112	S41 K45 R46 C47 D88 F89	S41-R43 PolarHBondContact O-N 3.33Å; R43-K45 VanDerWaalsContact C-N 3.28Å; R43-K45 PolarHBondContact O-N 2.97Å; R43-R46 PolarHBondContact O-N 2.93Å; R43-R46 VanDerWaalsContact O-N 3.1Å; R43-C47 PolarHBondContact O-N 3.01Å; R43-C47 PolarHBondContact O-SG 3.47Å; R43-D88 HydrophobicContact CB-CB 4.37Å; R43-D88 VanDerWaalsContact CD-O 3.29Å; R43-D88 WeakPolarHBondContact CD-O 3.48Å; R43-D88 HydrophobicContact CG-CB 4.49Å; R43-D88 WeakPolarHBondContact CG-O 3.32Å; R43-D88 PolarHBondContact NH1-O 2.81Å; R43-F89 HydrophobicContact CG-CE1 4.47Å
44	N	82.6	Confident	75.6	Confident	92 Å²	92	91.2 Å²	91.2	49%	0.492	46%	0.456	S	S	.	.	H	α-helix	trans	-62.8	-36.6	-175.9	-69.8	4.2	0	0	0	112.1	S41 C47 E48	S41-N44 PolarHBondContact O-N 3.11Å; S41-N44 VanDerWaalsContact O-N 3.15Å; S41-N44 VanDerWaalsContact OG-CB 3.31Å; S41-N44 WeakPolarHBondContact OG-CB 3.28Å; S41-N44 PolarHBondContact OG-N 2.93Å; S41-N44 PolarHBondContact OG-OD1 3.23Å; N44-C47 PolarHBondContact O-N 3.23Å; N44-E48 VanDerWaalsContact O-CB 3.31Å; N44-E48 WeakPolarHBondContact O-CB 3.36Å; N44-E48 PolarHBondContact O-N 3.32Å
45	K	84.7	Confident	78.1	Confident	138 Å²	138	90.1 Å²	90.1	60%	0.6	44%	0.443	S	S	*	.	H	α-helix	trans	-64.3	-40.3	175.6	-170.8	175.8	-179.8	178	0	111.8	K40 S41 G42 R43 E49	K40-K45 HydrophobicContact CB-CB 4.43Å; S41-K45 WeakPolarHBondContact O-CB 3.46Å; S41-K45 PolarHBondContact O-N 2.71Å; G42-K45 PolarHBondContact O-N 3.05Å; R43-K45 VanDerWaalsContact C-N 3.28Å; R43-K45 PolarHBondContact O-N 2.97Å; K45-E49 WeakPolarHBondContact O-CB 3.47Å; K45-E49 PolarHBondContact O-N 2.82Å
46	R	83.3	Confident	80.4	Confident	49 Å²	49	86 Å²	86	19%	0.185	42%	0.423	C	S	.	.	H	α-helix	trans	-74	-37.4	174.7	-64.8	-157.6	-170.8	98	-0.2	112.9	G42 R43 E48 E49 M50 D88	G42-R46 PolarHBondContact O-N 3.01Å; R43-R46 PolarHBondContact O-N 2.93Å; R43-R46 VanDerWaalsContact O-N 3.1Å; R46-E48 VanDerWaalsContact C-N 3.33Å; R46-E48 PolarHBondContact O-N 2.84Å; R46-E49 PolarHBondContact O-N 3.48Å; R46-M50 WeakPolarHBondContact O-CG 3.39Å; R46-M50 PolarHBondContact O-N 3.47Å; R46-D88 VanDerWaalsContact CD-OD2 3.23Å; R46-D88 WeakPolarHBondContact CD-OD2 3.45Å; R46-D88 IonicContact CZ-OD2 3.73Å; R46-D88 IonicContact NE-OD2 3.66Å; R46-D88 IonicContact NH1-OD1 2.86Å; R46-D88 PolarHBondContact NH1-OD1 3.13Å; R46-D88 IonicContact NH1-OD2 2.78Å; R46-D88 PolarHBondContact NH1-OD2 3.39Å
47	C	85.5	Confident	82.3	Confident	22 Å²	22	80.2 Å²	80.2	15%	0.149	40%	0.398	C	S	.	.	H	α-helix	trans	-55.9	-48.3	170.9	-66.1	0	0	0	0	111.2	R43 N44 M50 Q51 F89	R43-C47 PolarHBondContact O-N 3.01Å; R43-C47 PolarHBondContact O-SG 3.47Å; N44-C47 PolarHBondContact O-N 3.23Å; C47-M50 PolarHBondContact O-N 2.89Å; C47-Q51 WeakPolarHBondContact O-CB 3.39Å; C47-Q51 WeakPolarHBondContact O-CG 3.4Å; C47-Q51 PolarHBondContact O-N 3.08Å; C47-F89 WeakPolarHBondContact SG-CE1 3.15Å; C47-F89 WeakPolarHBondContact SG-CZ 3.48Å
48	E	86.9	Confident	84.1	Confident	89 Å²	89	70.7 Å²	70.7	42%	0.416	37%	0.365	S	S	.	.	H	α-helix	trans	-67.7	-38.7	179.6	-175	175.6	-136.4	0	0	112	K40 N44 R46 Q51 S52	K40-E48 VanDerWaalsContact CD-OE2 3.23Å; K40-E48 WeakPolarHBondContact CD-OE2 3.21Å; K40-E48 WeakPolarHBondContact CE-OE2 3.5Å; K40-E48 IonicContact NZ-OE1 2.69Å; K40-E48 PolarHBondContact NZ-OE1 3.09Å; K40-E48 IonicContact NZ-OE2 2.8Å; K40-E48 PolarHBondContact NZ-OE2 3.16Å; N44-E48 VanDerWaalsContact O-CB 3.31Å; N44-E48 WeakPolarHBondContact O-CB 3.36Å; N44-E48 PolarHBondContact O-N 3.32Å; R46-E48 VanDerWaalsContact C-N 3.33Å; R46-E48 PolarHBondContact O-N 2.84Å; E48-Q51 PolarHBondContact O-N 2.91Å; E48-S52 VanDerWaalsContact O-CB 3.23Å; E48-S52 WeakPolarHBondContact O-CB 3.29Å; E48-S52 PolarHBondContact O-N 3.39Å
49	E	89.2	Confident	85.5	Confident	95 Å²	95	69.7 Å²	69.7	44%	0.444	36%	0.361	S	S	.	.	H	α-helix	trans	-60	-45.7	172.1	-170.2	176.9	-178	0	0	111	K45 R46 S52 I53 V79	K45-E49 WeakPolarHBondContact O-CB 3.47Å; K45-E49 PolarHBondContact O-N 2.82Å; R46-E49 PolarHBondContact O-N 3.48Å; E49-S52 PolarHBondContact O-N 3.13Å; E49-I53 HydrophobicContact CG-CD1 4.32Å; E49-I53 VanDerWaalsContact O-CG1 3.29Å; E49-I53 WeakPolarHBondContact O-CG1 3.24Å; E49-I53 PolarHBondContact O-N 3.47Å; E49-V79 HydrophobicContact CB-CG1 4.38Å; E49-V79 HydrophobicContact CG-CG1 4.22Å; E49-V79 HydrophobicContact CG-CG2 4.12Å
50	M	88.6	Confident	86.3	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-62.6	-48.8	173.9	-69.8	-174.8	-163.6	0	0	112.5	R46 C47 S52 I53 I54 L76 V79 Y80 S83 F89 F95	R46-M50 WeakPolarHBondContact O-CG 3.39Å; R46-M50 PolarHBondContact O-N 3.47Å; C47-M50 PolarHBondContact O-N 2.89Å; M50-S52 VanDerWaalsContact C-N 3.27Å; M50-S52 PolarHBondContact O-N 2.98Å; M50-I53 PolarHBondContact O-N 2.84Å; M50-I53 VanDerWaalsContact O-N 3.17Å; M50-I54 VanDerWaalsContact O-CG1 3.27Å; M50-I54 WeakPolarHBondContact O-CG1 3.35Å; M50-I54 PolarHBondContact O-N 3.07Å; M50-L76 HydrophobicContact CB-CD1 4.18Å; M50-L76 HydrophobicContact CG-CD1 4.24Å; M50-V79 HydrophobicContact CE-CG1 4.01Å; M50-V79 HydrophobicContact CG-CB 4.38Å; M50-V79 HydrophobicContact CG-CG1 3.67Å; M50-Y80 HydrophobicContact CE-CD2 4.09Å; M50-Y80 HydrophobicContact SD-CD2 4.49Å; M50-S83 WeakPolarHBondContact CE-OG 3.46Å; M50-F89 HydrophobicContact CE-CE2 3.68Å; M50-F89 HydrophobicContact CE-CZ 4.28Å; M50-F89 HydrophobicContact SD-CE2 4.36Å; M50-F89 HydrophobicContact SD-CZ 4.45Å; M50-F95 HydrophobicContact CB-CE2 4.12Å; M50-F95 HydrophobicContact SD-CE2 4.16Å; M50-F95 HydrophobicContact SD-CZ 4.35Å
51	Q	89.9	Confident	87	Confident	85 Å²	85	61.5 Å²	61.5	40%	0.397	31%	0.314	S	S	.	.	H	α-helix	trans	-62.7	-34.9	179.5	-75.1	-178.1	-5.4	0	0	111.9	C47 E48 I54 K55	C47-Q51 WeakPolarHBondContact O-CB 3.39Å; C47-Q51 WeakPolarHBondContact O-CG 3.4Å; C47-Q51 PolarHBondContact O-N 3.08Å; E48-Q51 PolarHBondContact O-N 2.91Å; Q51-I54 PolarHBondContact O-N 3.25Å; Q51-K55 WeakPolarHBondContact O-CB 3.44Å; Q51-K55 VanDerWaalsContact O-CG 3.31Å; Q51-K55 WeakPolarHBondContact O-CG 3.16Å; Q51-K55 PolarHBondContact O-N 3.33Å
52	S	89.9	Confident	87.4	Confident	61 Å²	61	66.6 Å²	66.6	43%	0.427	33%	0.329	S	S	.	.	H	α-helix	trans	-64.3	-45.9	172.7	-173.5	0	0	0	0	111.6	E48 E49 M50 I54 K55 N56	E48-S52 VanDerWaalsContact O-CB 3.23Å; E48-S52 WeakPolarHBondContact O-CB 3.29Å; E48-S52 PolarHBondContact O-N 3.39Å; E49-S52 PolarHBondContact O-N 3.13Å; M50-S52 VanDerWaalsContact C-N 3.27Å; M50-S52 PolarHBondContact O-N 2.98Å; S52-I54 VanDerWaalsContact C-N 3.34Å; S52-I54 PolarHBondContact O-N 2.83Å; S52-K55 PolarHBondContact O-N 3.44Å; S52-N56 PolarHBondContact O-N 3.01Å
53	I	90.2	Very high	87.8	Confident	20 Å²	20	70.5 Å²	70.5	10%	0.103	34%	0.337	C	S	.	.	H	α-helix	trans	-63.4	-38.9	174.4	-63.4	162.6	0	0	0	111	E49 M50 N56 L57 D72 N75 L76 V79	E49-I53 HydrophobicContact CG-CD1 4.32Å; E49-I53 VanDerWaalsContact O-CG1 3.29Å; E49-I53 WeakPolarHBondContact O-CG1 3.24Å; E49-I53 PolarHBondContact O-N 3.47Å; M50-I53 PolarHBondContact O-N 2.84Å; M50-I53 VanDerWaalsContact O-N 3.17Å; I53-N56 PolarHBondContact O-N 2.99Å; I53-L57 VanDerWaalsContact O-CB 3.23Å; I53-L57 WeakPolarHBondContact O-CB 3.28Å; I53-L57 PolarHBondContact O-N 2.91Å; I53-D72 HydrophobicContact CG2-CB 4.14Å; I53-D72 WeakPolarHBondContact CG2-O 3.27Å; I53-N75 HydrophobicContact CD1-CB 4.3Å; I53-L76 HydrophobicContact CG2-CB 3.82Å; I53-L76 HydrophobicContact CG2-CD1 4.39Å; I53-V79 HydrophobicContact CD1-CB 4.47Å; I53-V79 HydrophobicContact CD1-CG2 3.77Å
54	I	91	Very high	87.9	Confident	22 Å²	22	70.6 Å²	70.6	11%	0.113	34%	0.341	C	S	.	.	H	α-helix	trans	-66.1	-39	176.4	-68	167	0	0	0	111.3	M50 Q51 S52 L57 N58 L76 F95 C99	M50-I54 VanDerWaalsContact O-CG1 3.27Å; M50-I54 WeakPolarHBondContact O-CG1 3.35Å; M50-I54 PolarHBondContact O-N 3.07Å; Q51-I54 PolarHBondContact O-N 3.25Å; S52-I54 VanDerWaalsContact C-N 3.34Å; S52-I54 PolarHBondContact O-N 2.83Å; I54-L57 PolarHBondContact O-N 3.47Å; I54-N58 WeakPolarHBondContact O-CB 3.38Å; I54-N58 PolarHBondContact O-N 2.98Å; I54-L76 HydrophobicContact CD1-CD1 4.27Å; I54-L76 HydrophobicContact CG1-CD1 3.99Å; I54-L76 HydrophobicContact CG1-CD2 4.02Å; I54-F95 HydrophobicContact CD1-CD2 3.63Å; I54-F95 HydrophobicContact CD1-CE2 4.07Å; I54-C99 HydrophobicContact CD1-CB 4.19Å; I54-C99 HydrophobicContact CG1-CB 4.29Å; I54-C99 HydrophobicContact CG2-CB 4.4Å
55	K	89.8	Confident	88.1	Confident	139 Å²	139	68.2 Å²	68.2	60%	0.604	33%	0.328	S	S	*	.	H	α-helix	trans	-61.5	-44.9	172.7	-76.4	171.4	-179.1	176.8	0	111.3	Q51 S52 N58 N59	Q51-K55 WeakPolarHBondContact O-CB 3.44Å; Q51-K55 VanDerWaalsContact O-CG 3.31Å; Q51-K55 WeakPolarHBondContact O-CG 3.16Å; Q51-K55 PolarHBondContact O-N 3.33Å; S52-K55 PolarHBondContact O-N 3.44Å; K55-N58 PolarHBondContact O-N 3.44Å; K55-N59 VanDerWaalsContact O-CG 3.29Å; K55-N59 PolarHBondContact O-N 3.22Å; K55-N59 PolarHBondContact O-ND2 3.42Å
56	N	89.6	Confident	88.1	Confident	73 Å²	73	61.7 Å²	61.7	39%	0.39	30%	0.3	S	S	.	.	H	α-helix	trans	-63.8	-44.8	174.8	-70.9	-16	0	0	0	112.1	S52 I53 N58 N59 H60	S52-N56 PolarHBondContact O-N 3.01Å; I53-N56 PolarHBondContact O-N 2.99Å; N56-N58 VanDerWaalsContact C-N 3.32Å; N56-N58 PolarHBondContact O-N 3.16Å; N56-N59 CarbonylContact O-C 3.38Å; N56-N59 WeakPolarHBondContact O-CA 3.47Å; N56-N59 WeakPolarHBondContact O-CB 3.42Å; N56-N59 PolarHBondContact O-N 3.47Å; N56-N59 VanDerWaalsContact O-N 3.08Å; N56-H60 PolarHBondContact O-N 2.97Å; N56-H60 PolarHBondContact O-ND1 3.07Å
57	L	91.7	Very high	88.3	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.3	-40.1	177.5	-172.3	151.6	0	0	0	111.4	I53 I54 H60 K61 D72 F73 L76 L103	I53-L57 VanDerWaalsContact O-CB 3.23Å; I53-L57 WeakPolarHBondContact O-CB 3.28Å; I53-L57 PolarHBondContact O-N 2.91Å; I54-L57 PolarHBondContact O-N 3.47Å; L57-H60 PolarHBondContact O-N 3.21Å; L57-K61 HydrophobicContact CD2-CD 4.03Å; L57-K61 VanDerWaalsContact CD2-CE 3.47Å; L57-K61 HydrophobicContact CD2-CG 4.24Å; L57-K61 WeakPolarHBondContact O-CG 3.25Å; L57-K61 PolarHBondContact O-N 3.14Å; L57-D72 WeakPolarHBondContact CA-OD2 3.3Å; L57-D72 HydrophobicContact CB-CB 3.99Å; L57-D72 HydrophobicContact CD1-CB 4.1Å; L57-D72 HydrophobicContact CG-CB 4.3Å; L57-D72 PolarHBondContact N-OD2 2.77Å; L57-F73 HydrophobicContact CD1-CB 4.44Å; L57-L76 HydrophobicContact CD1-CD2 4.33Å; L57-L103 HydrophobicContact CD2-CD1 4.48Å
58	N	90.1	Very high	88.4	Confident	48 Å²	48	64 Å²	64	26%	0.257	32%	0.319	S	S	.	.	H	α-helix	trans	-70.6	-32	174.6	-78.1	-12.6	0	0	0	112.7	I54 K55 N56 K61 K62	I54-N58 WeakPolarHBondContact O-CB 3.38Å; I54-N58 PolarHBondContact O-N 2.98Å; K55-N58 PolarHBondContact O-N 3.44Å; N56-N58 VanDerWaalsContact C-N 3.32Å; N56-N58 PolarHBondContact O-N 3.16Å; N58-K61 WeakPolarHBondContact OD1-CD 3.16Å; N58-K61 PolarHBondContact OD1-NZ 3.28Å; N58-K61 VanDerWaalsContact OD1-NZ 3.1Å; N58-K62 WeakPolarHBondContact O-CG 3.33Å; N58-K62 PolarHBondContact O-N 2.91Å; N58-K62 VanDerWaalsContact O-N 3.07Å
59	N	89.2	Confident	88.6	Confident	78 Å²	78	59.8 Å²	59.8	42%	0.417	30%	0.3	S	S	.	.	H	α-helix	trans	-67.4	-42.6	169.6	-71.1	-22.3	0	0	0	111.7	K55 N56 K62 I63	K55-N59 VanDerWaalsContact O-CG 3.29Å; K55-N59 PolarHBondContact O-N 3.22Å; K55-N59 PolarHBondContact O-ND2 3.42Å; N56-N59 CarbonylContact O-C 3.38Å; N56-N59 WeakPolarHBondContact O-CA 3.47Å; N56-N59 WeakPolarHBondContact O-CB 3.42Å; N56-N59 PolarHBondContact O-N 3.47Å; N56-N59 VanDerWaalsContact O-N 3.08Å; N59-K62 WeakPolarHBondContact O-CB 3.24Å; N59-K62 PolarHBondContact O-N 3.1Å; N59-I63 WeakPolarHBondContact O-CG1 3.49Å; N59-I63 PolarHBondContact O-N 3.07Å
60	H	89.3	Confident	88.6	Confident	42 Å²	42	56.1 Å²	56.1	19%	0.194	28%	0.283	C	S	.	.	H	α-helix	trans	-68.4	-33.9	175.6	-63.1	136.8	0	0	0	112.8	N56 L57 I63 K64 D65 N68 I69 D72	N56-H60 PolarHBondContact O-N 2.97Å; N56-H60 PolarHBondContact O-ND1 3.07Å; L57-H60 PolarHBondContact O-N 3.21Å; H60-I63 PolarHBondContact O-N 3.19Å; H60-K64 WeakPolarHBondContact O-CA 3.44Å; H60-K64 PolarHBondContact O-N 2.95Å; H60-D65 HydrophobicContact CB-CB 4.49Å; H60-D65 PolarHBondContact O-N 3.35Å; H60-N68 HydrophobicContact CB-CB 4.46Å; H60-I69 HydrophobicContact CB-CG1 3.65Å; H60-D72 IonicContact CE1-OD2 3.7Å; H60-D72 PolarHBondContact CE1-OD2 3.04Å; H60-D72 IonicContact CG-OD2 3.61Å; H60-D72 IonicContact ND1-OD2 3.01Å; H60-D72 PolarHBondContact ND1-OD2 2.83Å
61	K	87.9	Confident	88.7	Confident	19 Å²	19	60 Å²	60	8%	0.083	30%	0.303	C	S	.	.	H	α-helix	trans	-56.6	-49.3	166.5	-80	177.3	-179.1	163.1	0	111	L57 N58 I63 K64 I69 E102 F106	L57-K61 HydrophobicContact CD2-CD 4.03Å; L57-K61 VanDerWaalsContact CD2-CE 3.47Å; L57-K61 HydrophobicContact CD2-CG 4.24Å; L57-K61 WeakPolarHBondContact O-CG 3.25Å; L57-K61 PolarHBondContact O-N 3.14Å; N58-K61 WeakPolarHBondContact OD1-CD 3.16Å; N58-K61 PolarHBondContact OD1-NZ 3.28Å; N58-K61 VanDerWaalsContact OD1-NZ 3.1Å; K61-I63 PolarHBondContact O-N 3.16Å; K61-K64 PolarHBondContact O-N 3.33Å; K61-K64 VanDerWaalsContact O-N 3.16Å; K61-I69 HydrophobicContact CG-CD1 4.35Å; K61-E102 IonicContact NZ-OE2 3.81Å; K61-F106 HydrophobicContact CB-CD2 4.39Å; K61-F106 HydrophobicContact CB-CE2 4.14Å; K61-F106 HydrophobicContact CB-CZ 4.27Å; K61-F106 HydrophobicContact CD-CG 4.46Å; K61-F106 HydrophobicContact CG-CD1 4.11Å; K61-F106 HydrophobicContact CG-CD2 4.28Å; K61-F106 HydrophobicContact CG-CE1 4.23Å; K61-F106 HydrophobicContact CG-CE2 4.38Å; K61-F106 HydrophobicContact CG-CG 4.14Å; K61-F106 HydrophobicContact CG-CZ 4.36Å; K61-F106 WeakPolarHBondContact O-CE2 3.3Å
62	K	87.9	Confident	88.7	Confident	169 Å²	169	56.8 Å²	56.8	74%	0.735	29%	0.288	S	S	*	.	H	α-helix	trans	-60.9	-41.9	178.3	-72.7	171.9	-176.4	178	0	112.6	N58 N59 K64	N58-K62 WeakPolarHBondContact O-CG 3.33Å; N58-K62 PolarHBondContact O-N 2.91Å; N58-K62 VanDerWaalsContact O-N 3.07Å; N59-K62 WeakPolarHBondContact O-CB 3.24Å; N59-K62 PolarHBondContact O-N 3.1Å; K62-K64 VanDerWaalsContact C-N 3.27Å; K62-K64 PolarHBondContact O-N 3.29Å
63	I	85.6	Confident	88.8	Confident	127 Å²	127	54.5 Å²	54.5	65%	0.651	27%	0.27	S	S	*	.	H	α-helix	trans	-79	-10.7	179.3	-62.3	165.8	0	0	0	112	N59 H60 K61 D65	N59-I63 WeakPolarHBondContact O-CG1 3.49Å; N59-I63 PolarHBondContact O-N 3.07Å; H60-I63 PolarHBondContact O-N 3.19Å; K61-I63 PolarHBondContact O-N 3.16Å; I63-D65 VanDerWaalsContact C-N 3.27Å; I63-D65 HydrophobicContact CG2-CB 4.47Å; I63-D65 PolarHBondContact O-N 2.89Å
64	K	82.6	Confident	88.9	Confident	114 Å²	114	57.1 Å²	57.1	50%	0.496	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	31.3	-172.5	-58.5	-179.2	178.6	177.5	0	113.9	H60 K61 K62 M66	H60-K64 WeakPolarHBondContact O-CA 3.44Å; H60-K64 PolarHBondContact O-N 2.95Å; K61-K64 PolarHBondContact O-N 3.33Å; K61-K64 VanDerWaalsContact O-N 3.16Å; K62-K64 VanDerWaalsContact C-N 3.27Å; K62-K64 PolarHBondContact O-N 3.29Å; K64-M66 HydrophobicContact CB-CE 4.42Å; K64-M66 PolarHBondContact O-N 2.99Å
65	D	86.4	Confident	88.9	Confident	43 Å²	43	59 Å²	59	23%	0.23	29%	0.292	C	S	.	.			trans	-80	83.3	177	-169.1	-22.8	0	0	0	111.3	H60 I63 S67 N68 I69	H60-D65 HydrophobicContact CB-CB 4.49Å; H60-D65 PolarHBondContact O-N 3.35Å; I63-D65 VanDerWaalsContact C-N 3.27Å; I63-D65 HydrophobicContact CG2-CB 4.47Å; I63-D65 PolarHBondContact O-N 2.89Å; D65-S67 PolarHBondContact O-N 3.43Å; D65-S67 VanDerWaalsContact O-N 3.1Å; D65-S67 VanDerWaalsContact OD1-CB 3.3Å; D65-S67 WeakPolarHBondContact OD1-CB 3.4Å; D65-S67 PolarHBondContact OD1-N 2.87Å; D65-S67 VanDerWaalsContact OD1-N 3.09Å; D65-S67 PolarHBondContact OD1-OG 3.15Å; D65-N68 HydrophobicContact CB-CB 4.39Å; D65-N68 PolarHBondContact O-N 3.49Å; D65-N68 PolarHBondContact OD1-N 2.87Å; D65-N68 VanDerWaalsContact OD1-N 3.14Å; D65-N68 PolarHBondContact OD2-ND2 3.07Å; D65-I69 VanDerWaalsContact O-CG1 3.29Å; D65-I69 WeakPolarHBondContact O-CG1 3.34Å; D65-I69 PolarHBondContact O-N 2.86Å
66	M	86.2	Confident	88.9	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-59.2	-22.1	-179	-60.2	-60.7	166.6	0	0	113.7	K64 I69 I70 F106 M117 A121 S124 L125 L128	K64-M66 HydrophobicContact CB-CE 4.42Å; K64-M66 PolarHBondContact O-N 2.99Å; M66-I69 HydrophobicContact SD-CD1 4.14Å; M66-I70 WeakPolarHBondContact O-CD1 3.4Å; M66-I70 WeakPolarHBondContact O-CG1 3.46Å; M66-F106 HydrophobicContact CE-CE1 3.67Å; M66-F106 HydrophobicContact CE-CZ 3.74Å; M66-F106 HydrophobicContact SD-CE1 4.03Å; M66-M117 HydrophobicContact CE-CE 4.3Å; M66-M117 HydrophobicContact CE-SD 3.74Å; M66-M117 HydrophobicContact CG-SD 4.2Å; M66-A121 HydrophobicContact CB-CB 4.43Å; M66-A121 HydrophobicContact CG-CB 4.3Å; M66-S124 VanDerWaalsContact CB-OG 3.23Å; M66-S124 WeakPolarHBondContact CB-OG 3.4Å; M66-S124 WeakPolarHBondContact O-CB 3.27Å; M66-L125 HydrophobicContact CE-CD1 4.02Å; M66-L125 HydrophobicContact CG-CB 4.43Å; M66-L125 HydrophobicContact SD-CD1 3.7Å; M66-L128 HydrophobicContact SD-CD2 4.42Å
67	S	86.5	Confident	88.9	Confident	64 Å²	64	49.8 Å²	49.8	45%	0.448	25%	0.251	S	S	.	.	H	α-helix	trans	-70.6	-53.2	175.3	-1.3	0	0	0	0	110.6	D65 I70 I71	D65-S67 PolarHBondContact O-N 3.43Å; D65-S67 VanDerWaalsContact O-N 3.1Å; D65-S67 VanDerWaalsContact OD1-CB 3.3Å; D65-S67 WeakPolarHBondContact OD1-CB 3.4Å; D65-S67 PolarHBondContact OD1-N 2.87Å; D65-S67 VanDerWaalsContact OD1-N 3.09Å; D65-S67 PolarHBondContact OD1-OG 3.15Å; S67-I70 PolarHBondContact O-N 3.13Å; S67-I71 PolarHBondContact O-N 2.95Å
68	N	88.3	Confident	88.8	Confident	56 Å²	56	55.1 Å²	55.1	30%	0.299	27%	0.274	S	S	.	.	H	α-helix	trans	-73.8	-30.8	-176	-73.9	-37.1	0	0	0	112.5	H60 D65 I70 I71 D72	H60-N68 HydrophobicContact CB-CB 4.46Å; D65-N68 HydrophobicContact CB-CB 4.39Å; D65-N68 PolarHBondContact O-N 3.49Å; D65-N68 PolarHBondContact OD1-N 2.87Å; D65-N68 VanDerWaalsContact OD1-N 3.14Å; D65-N68 PolarHBondContact OD2-ND2 3.07Å; N68-I70 PolarHBondContact O-N 3.2Å; N68-I71 PolarHBondContact O-N 3.14Å; N68-D72 PolarHBondContact O-N 3.04Å
69	I	90.4	Very high	88.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-57.3	-36.4	170.7	-63.7	167.6	0	0	0	111.7	H60 K61 D65 M66 F73 L103 F106 L128	H60-I69 HydrophobicContact CB-CG1 3.65Å; K61-I69 HydrophobicContact CG-CD1 4.35Å; D65-I69 VanDerWaalsContact O-CG1 3.29Å; D65-I69 WeakPolarHBondContact O-CG1 3.34Å; D65-I69 PolarHBondContact O-N 2.86Å; M66-I69 HydrophobicContact SD-CD1 4.14Å; I69-F73 WeakPolarHBondContact O-CB 3.49Å; I69-F73 PolarHBondContact O-N 3.42Å; I69-L103 HydrophobicContact CG2-CD1 3.79Å; I69-F106 HydrophobicContact CD1-CE1 3.63Å; I69-F106 HydrophobicContact CD1-CZ 4.12Å; I69-L128 HydrophobicContact CB-CD2 4.27Å; I69-L128 HydrophobicContact CG2-CD1 3.99Å; I69-L128 HydrophobicContact CG2-CD2 3.6Å; I69-L128 HydrophobicContact CG2-CG 4.47Å
70	I	89	Confident	88.7	Confident	18 Å²	18	50.5 Å²	50.5	9%	0.092	25%	0.248	C	C	.	.	H	α-helix	trans	-67.4	-40.6	176.3	-65.9	166.1	0	0	0	111.3	M66 S67 N68 Q74 S124 T127 L128	M66-I70 WeakPolarHBondContact O-CD1 3.4Å; M66-I70 WeakPolarHBondContact O-CG1 3.46Å; S67-I70 PolarHBondContact O-N 3.13Å; N68-I70 PolarHBondContact O-N 3.2Å; I70-Q74 WeakPolarHBondContact O-CG 3.3Å; I70-Q74 PolarHBondContact O-N 3.01Å; I70-S124 VanDerWaalsContact CD1-CB 3.5Å; I70-S124 WeakPolarHBondContact CD1-O 3.29Å; I70-T127 HydrophobicContact CD1-CG2 4.41Å; I70-L128 HydrophobicContact CD1-CB 4.3Å; I70-L128 HydrophobicContact CG1-CB 3.82Å; I70-L128 HydrophobicContact CG1-CD1 3.94Å; I70-L128 HydrophobicContact CG1-CG 4.37Å
71	I	90.4	Very high	88.5	Confident	82 Å²	82	53.2 Å²	53.2	42%	0.421	26%	0.261	S	S	.	.	H	α-helix	trans	-67.5	-48.5	-178.6	-63.5	172.5	0	0	0	109.5	S67 N68 F73 Q74 N75	S67-I71 PolarHBondContact O-N 2.95Å; N68-I71 PolarHBondContact O-N 3.14Å; I71-F73 PolarHBondContact O-N 2.97Å; I71-Q74 PolarHBondContact O-N 3.08Å; I71-N75 WeakPolarHBondContact O-CB 3.44Å; I71-N75 VanDerWaalsContact O-CG 3.25Å; I71-N75 PolarHBondContact O-N 3.1Å; I71-N75 PolarHBondContact O-ND2 3.14Å
72	D	91.2	Very high	88.5	Confident	16 Å²	16	58 Å²	58	9%	0.086	28%	0.282	C	S	.	.	H	α-helix	trans	-61.9	-43.1	176.3	-72.7	-14.4	0	0	0	111.8	I53 L57 H60 N68 Q74 N75 L76	I53-D72 HydrophobicContact CG2-CB 4.14Å; I53-D72 WeakPolarHBondContact CG2-O 3.27Å; L57-D72 WeakPolarHBondContact CA-OD2 3.3Å; L57-D72 HydrophobicContact CB-CB 3.99Å; L57-D72 HydrophobicContact CD1-CB 4.1Å; L57-D72 HydrophobicContact CG-CB 4.3Å; L57-D72 PolarHBondContact N-OD2 2.77Å; H60-D72 IonicContact CE1-OD2 3.7Å; H60-D72 PolarHBondContact CE1-OD2 3.04Å; H60-D72 IonicContact CG-OD2 3.61Å; H60-D72 IonicContact ND1-OD2 3.01Å; H60-D72 PolarHBondContact ND1-OD2 2.83Å; N68-D72 PolarHBondContact O-N 3.04Å; D72-Q74 VanDerWaalsContact C-N 3.33Å; D72-Q74 PolarHBondContact O-N 2.84Å; D72-N75 PolarHBondContact O-N 3.19Å; D72-N75 VanDerWaalsContact O-N 3.17Å; D72-L76 VanDerWaalsContact O-CB 3.24Å; D72-L76 WeakPolarHBondContact O-CB 3.43Å; D72-L76 PolarHBondContact O-N 2.63Å
73	F	91.9	Very high	88.2	Confident	13 Å²	13	50 Å²	50	6%	0.057	25%	0.247	C	C	.	.	H	α-helix	trans	-61	-41.3	175.3	-178.5	-109.2	0	0	0	111.9	L57 I69 I71 V77 L103 R131 V132 Y135	L57-F73 HydrophobicContact CD1-CB 4.44Å; I69-F73 WeakPolarHBondContact O-CB 3.49Å; I69-F73 PolarHBondContact O-N 3.42Å; I71-F73 PolarHBondContact O-N 2.97Å; F73-V77 HydrophobicContact CE1-CG2 4.38Å; F73-V77 HydrophobicContact CE2-CG2 4.24Å; F73-V77 HydrophobicContact CZ-CG2 4.13Å; F73-V77 VanDerWaalsContact O-CG2 3.31Å; F73-V77 WeakPolarHBondContact O-CG2 3.37Å; F73-V77 PolarHBondContact O-N 3.4Å; F73-V77 VanDerWaalsContact O-N 3.08Å; F73-L103 HydrophobicContact CB-CD2 4.43Å; F73-L103 HydrophobicContact CD2-CD2 3.34Å; F73-L103 HydrophobicContact CE2-CD2 3.76Å; F73-L103 HydrophobicContact CG-CD2 4.01Å; F73-R131 HydrophobicContact CE1-CB 4.3Å; F73-V132 HydrophobicContact CE1-CG2 4.27Å; F73-V132 HydrophobicContact CE2-CG2 4.47Å; F73-V132 HydrophobicContact CZ-CG2 4.23Å; F73-Y135 HydrophobicContact CE2-CD1 4.27Å; F73-Y135 AromaticContact CZ-CD1 3.88Å; F73-Y135 HydrophobicContact CZ-CD1 3.88Å; F73-Y135 AromaticContact CZ-CG 3.89Å; F73-Y135 HydrophobicContact CZ-CG 3.89Å
74	Q	91	Very high	88.1	Confident	76 Å²	76	47.6 Å²	47.6	36%	0.355	24%	0.238	S	C	.	.	H	α-helix	trans	-67.4	-34.8	174.4	-74.7	-164.9	-89.1	0	0	113.2	I70 I71 D72 K78	I70-Q74 WeakPolarHBondContact O-CG 3.3Å; I70-Q74 PolarHBondContact O-N 3.01Å; I71-Q74 PolarHBondContact O-N 3.08Å; D72-Q74 VanDerWaalsContact C-N 3.33Å; D72-Q74 PolarHBondContact O-N 2.84Å; Q74-K78 VanDerWaalsContact O-CG 3.27Å; Q74-K78 WeakPolarHBondContact O-CG 3.23Å; Q74-K78 PolarHBondContact O-N 3.33Å; Q74-K78 VanDerWaalsContact O-N 3.16Å
75	N	90.9	Very high	88	Confident	60 Å²	60	49.4 Å²	49.4	32%	0.321	25%	0.248	S	C	.	.	H	α-helix	trans	-72.3	-41.9	177.5	-69.7	-20.2	0	0	0	111	I53 I71 D72 V77 K78 V79	I53-N75 HydrophobicContact CD1-CB 4.3Å; I71-N75 WeakPolarHBondContact O-CB 3.44Å; I71-N75 VanDerWaalsContact O-CG 3.25Å; I71-N75 PolarHBondContact O-N 3.1Å; I71-N75 PolarHBondContact O-ND2 3.14Å; D72-N75 PolarHBondContact O-N 3.19Å; D72-N75 VanDerWaalsContact O-N 3.17Å; N75-V77 PolarHBondContact O-N 3.18Å; N75-K78 PolarHBondContact O-N 3.09Å; N75-V79 WeakPolarHBondContact O-CG2 3.44Å; N75-V79 PolarHBondContact O-N 3.03Å
76	L	91	Very high	87.5	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.016	27%	0.266	C	S	.	.	H	α-helix	trans	-58	-47.7	175.3	-175.3	57.8	0	0	0	111.2	M50 I53 I54 L57 D72 K78 V79 Y80 Y96	M50-L76 HydrophobicContact CB-CD1 4.18Å; M50-L76 HydrophobicContact CG-CD1 4.24Å; I53-L76 HydrophobicContact CG2-CB 3.82Å; I53-L76 HydrophobicContact CG2-CD1 4.39Å; I54-L76 HydrophobicContact CD1-CD1 4.27Å; I54-L76 HydrophobicContact CG1-CD1 3.99Å; I54-L76 HydrophobicContact CG1-CD2 4.02Å; L57-L76 HydrophobicContact CD1-CD2 4.33Å; D72-L76 VanDerWaalsContact O-CB 3.24Å; D72-L76 WeakPolarHBondContact O-CB 3.43Å; D72-L76 PolarHBondContact O-N 2.63Å; L76-K78 PolarHBondContact O-N 3.1Å; L76-V79 PolarHBondContact O-N 3.46Å; L76-Y80 WeakPolarHBondContact O-CB 3.43Å; L76-Y80 PolarHBondContact O-N 3.08Å; L76-Y96 HydrophobicContact CD1-CD2 4.26Å; L76-Y96 HydrophobicContact CD1-CE2 4.02Å; L76-Y96 HydrophobicContact CD2-CE2 4.31Å; L76-Y96 HydrophobicContact CG-CD2 4.41Å; L76-Y96 HydrophobicContact CG-CE2 3.82Å
77	V	89.1	Confident	86.9	Confident	17 Å²	17	60.1 Å²	60.1	10%	0.103	30%	0.303	C	S	.	.	H	α-helix	trans	-61.1	-42.2	175.1	172.3	0	0	0	0	111.8	F73 N75 V79 Y80 E81 Y135	F73-V77 HydrophobicContact CE1-CG2 4.38Å; F73-V77 HydrophobicContact CE2-CG2 4.24Å; F73-V77 HydrophobicContact CZ-CG2 4.13Å; F73-V77 VanDerWaalsContact O-CG2 3.31Å; F73-V77 WeakPolarHBondContact O-CG2 3.37Å; F73-V77 PolarHBondContact O-N 3.4Å; F73-V77 VanDerWaalsContact O-N 3.08Å; N75-V77 PolarHBondContact O-N 3.18Å; V77-V79 PolarHBondContact O-N 3.1Å; V77-Y80 PolarHBondContact O-N 3.06Å; V77-E81 HydrophobicContact CG1-CG 4.36Å; V77-E81 WeakPolarHBondContact O-CB 3.36Å; V77-E81 WeakPolarHBondContact O-CG 3.35Å; V77-E81 PolarHBondContact O-N 3.21Å; V77-Y135 HydrophobicContact CB-CE2 4.44Å; V77-Y135 HydrophobicContact CG1-CE2 3.71Å; V77-Y135 HydrophobicContact CG2-CD1 4.41Å; V77-Y135 HydrophobicContact CG2-CD2 4.26Å; V77-Y135 HydrophobicContact CG2-CE1 3.96Å; V77-Y135 HydrophobicContact CG2-CE2 3.8Å
78	K	89.7	Confident	86.1	Confident	111 Å²	111	58.1 Å²	58.1	48%	0.483	29%	0.287	S	S	.	.	H	α-helix	trans	-64.9	-37.6	177	-75.5	169.4	-178.6	174.5	0	113.5	Q74 N75 L76 K82	Q74-K78 VanDerWaalsContact O-CG 3.27Å; Q74-K78 WeakPolarHBondContact O-CG 3.23Å; Q74-K78 PolarHBondContact O-N 3.33Å; Q74-K78 VanDerWaalsContact O-N 3.16Å; N75-K78 PolarHBondContact O-N 3.09Å; L76-K78 PolarHBondContact O-N 3.1Å; K78-K82 WeakPolarHBondContact O-CB 3.42Å; K78-K82 VanDerWaalsContact O-CG 3.29Å; K78-K82 WeakPolarHBondContact O-CG 3.48Å; K78-K82 PolarHBondContact O-N 2.73Å; K78-K82 VanDerWaalsContact O-N 3.17Å
79	V	87.9	Confident	85.1	Confident	7 Å²	7	57 Å²	57	4%	0.042	28%	0.279	C	S	.	.	H	α-helix	trans	-70.6	-38.5	176.7	177.3	0	0	0	0	109.8	E49 M50 I53 N75 L76 V77 K82 S83	E49-V79 HydrophobicContact CB-CG1 4.38Å; E49-V79 HydrophobicContact CG-CG1 4.22Å; E49-V79 HydrophobicContact CG-CG2 4.12Å; M50-V79 HydrophobicContact CE-CG1 4.01Å; M50-V79 HydrophobicContact CG-CB 4.38Å; M50-V79 HydrophobicContact CG-CG1 3.67Å; I53-V79 HydrophobicContact CD1-CB 4.47Å; I53-V79 HydrophobicContact CD1-CG2 3.77Å; N75-V79 WeakPolarHBondContact O-CG2 3.44Å; N75-V79 PolarHBondContact O-N 3.03Å; L76-V79 PolarHBondContact O-N 3.46Å; V77-V79 PolarHBondContact O-N 3.1Å; V79-K82 PolarHBondContact O-N 2.88Å; V79-S83 PolarHBondContact O-N 2.8Å; V79-S83 PolarHBondContact O-OG 3.06Å
80	Y	88.6	Confident	84	Confident	22 Å²	22	65 Å²	65	9%	0.086	32%	0.322	C	S	.	.	H	α-helix	trans	-64.6	-45.3	174.5	-174.1	-97.2	0	0	0	113.2	M50 L76 V77 K82 S83 V84 V92 Y96 F139	M50-Y80 HydrophobicContact CE-CD2 4.09Å; M50-Y80 HydrophobicContact SD-CD2 4.49Å; L76-Y80 WeakPolarHBondContact O-CB 3.43Å; L76-Y80 PolarHBondContact O-N 3.08Å; V77-Y80 PolarHBondContact O-N 3.06Å; Y80-K82 VanDerWaalsContact C-N 3.28Å; Y80-K82 PolarHBondContact O-N 3.03Å; Y80-S83 WeakPolarHBondContact CA-OG 3.15Å; Y80-S83 PolarHBondContact O-N 3.09Å; Y80-S83 PolarHBondContact O-OG 2.94Å; Y80-V84 HydrophobicContact CD1-CG2 4.17Å; Y80-V84 HydrophobicContact CE1-CG2 3.72Å; Y80-V84 HydrophobicContact CE2-CG2 4.38Å; Y80-V84 WeakPolarHBondContact O-CG2 3.38Å; Y80-V84 PolarHBondContact O-N 2.69Å; Y80-V92 HydrophobicContact CE2-CG1 4.43Å; Y80-Y96 WeakPolarHBondContact CB-OH 3.23Å; Y80-Y96 AromaticContact CD1-CE1 3.99Å; Y80-Y96 HydrophobicContact CD1-CE1 3.99Å; Y80-Y96 AromaticContact CD1-CZ 3.84Å; Y80-Y96 AromaticContact CD2-CD1 3.96Å; Y80-Y96 HydrophobicContact CD2-CD1 3.96Å; Y80-Y96 AromaticContact CD2-CD2 3.94Å; Y80-Y96 HydrophobicContact CD2-CD2 3.94Å; Y80-Y96 AromaticContact CD2-CE1 3.71Å; Y80-Y96 HydrophobicContact CD2-CE1 3.71Å; Y80-Y96 AromaticContact CD2-CE2 3.69Å; Y80-Y96 HydrophobicContact CD2-CE2 3.69Å; Y80-Y96 HydrophobicContact CD2-CG 4.08Å; Y80-Y96 AromaticContact CD2-CZ 3.6Å; Y80-Y96 HydrophobicContact CE1-CE1 4.09Å; Y80-Y96 AromaticContact CE2-CD1 3.85Å; Y80-Y96 HydrophobicContact CE2-CD1 3.85Å; Y80-Y96 AromaticContact CE2-CE1 3.83Å; Y80-Y96 HydrophobicContact CE2-CE1 3.83Å; Y80-Y96 HydrophobicContact CE2-CG 4.23Å; Y80-Y96 HydrophobicContact CG-CD2 4.46Å; Y80-Y96 AromaticContact CG-CE1 3.81Å; Y80-Y96 HydrophobicContact CG-CE1 3.81Å; Y80-Y96 AromaticContact CG-CE2 3.75Å; Y80-Y96 HydrophobicContact CG-CE2 3.75Å; Y80-Y96 AromaticContact CG-CZ 3.4Å; Y80-F139 HydrophobicContact CE1-CE1 4.42Å; Y80-F139 AromaticContact CE1-CZ 3.97Å; Y80-F139 HydrophobicContact CE1-CZ 3.97Å
81	E	87	Confident	83.2	Confident	100 Å²	100	66.5 Å²	66.5	47%	0.467	34%	0.342	S	S	.	.	H	α-helix	trans	-58.8	-40.2	173.7	-74.9	171.3	176.6	0	0	111.5	V77 V84 Q85	V77-E81 HydrophobicContact CG1-CG 4.36Å; V77-E81 WeakPolarHBondContact O-CB 3.36Å; V77-E81 WeakPolarHBondContact O-CG 3.35Å; V77-E81 PolarHBondContact O-N 3.21Å; E81-V84 PolarHBondContact O-N 2.82Å; E81-Q85 WeakPolarHBondContact O-CB 3.35Å; E81-Q85 VanDerWaalsContact O-CG 3.27Å; E81-Q85 WeakPolarHBondContact O-CG 3.29Å; E81-Q85 PolarHBondContact O-N 3.38Å
82	K	86	Confident	82.7	Confident	120 Å²	120	64.6 Å²	64.6	52%	0.522	34%	0.335	S	S	.	.	H	α-helix	trans	-68.2	-34.5	175.7	-76.4	173.9	177.7	-177.7	0	114.1	K78 V79 Y80 M86	K78-K82 WeakPolarHBondContact O-CB 3.42Å; K78-K82 VanDerWaalsContact O-CG 3.29Å; K78-K82 WeakPolarHBondContact O-CG 3.48Å; K78-K82 PolarHBondContact O-N 2.73Å; K78-K82 VanDerWaalsContact O-N 3.17Å; V79-K82 PolarHBondContact O-N 2.88Å; Y80-K82 VanDerWaalsContact C-N 3.28Å; Y80-K82 PolarHBondContact O-N 3.03Å; K82-M86 WeakPolarHBondContact O-CB 3.39Å; K82-M86 VanDerWaalsContact O-CG 3.22Å; K82-M86 WeakPolarHBondContact O-CG 3.49Å; K82-M86 PolarHBondContact O-N 2.91Å
83	S	83.5	Confident	82	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-74.7	-34.9	176.4	56.1	0	0	0	0	112.1	M50 V79 Y80 M86 N87 D88	M50-S83 WeakPolarHBondContact CE-OG 3.46Å; V79-S83 PolarHBondContact O-N 2.8Å; V79-S83 PolarHBondContact O-OG 3.06Å; Y80-S83 WeakPolarHBondContact CA-OG 3.15Å; Y80-S83 PolarHBondContact O-N 3.09Å; Y80-S83 PolarHBondContact O-OG 2.94Å; S83-M86 PolarHBondContact O-N 3.4Å; S83-N87 PolarHBondContact O-N 2.81Å; S83-D88 PolarHBondContact O-N 3.13Å; S83-D88 VanDerWaalsContact O-N 3.1Å
84	V	82.8	Confident	81.5	Confident	76 Å²	76	66 Å²	66	46%	0.461	35%	0.346	S	S	.	.	H	α-helix	trans	-65.5	-43.4	172.4	173	0	0	0	0	110.6	Y80 E81 M86 N87	Y80-V84 HydrophobicContact CD1-CG2 4.17Å; Y80-V84 HydrophobicContact CE1-CG2 3.72Å; Y80-V84 HydrophobicContact CE2-CG2 4.38Å; Y80-V84 WeakPolarHBondContact O-CG2 3.38Å; Y80-V84 PolarHBondContact O-N 2.69Å; E81-V84 PolarHBondContact O-N 2.82Å; V84-M86 PolarHBondContact O-N 3.08Å; V84-M86 VanDerWaalsContact O-N 3.13Å; V84-N87 PolarHBondContact O-N 3.01Å; V84-N87 PolarHBondContact O-OD1 3.12Å
85	Q	80.9	Confident	81.3	Confident	153 Å²	153	63.9 Å²	63.9	72%	0.715	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-17.9	175.8	-77	172.5	5.4	0	0	114.7	E81	E81-Q85 WeakPolarHBondContact O-CB 3.35Å; E81-Q85 VanDerWaalsContact O-CG 3.27Å; E81-Q85 WeakPolarHBondContact O-CG 3.29Å; E81-Q85 PolarHBondContact O-N 3.38Å
86	M	75.5	Confident	81.1	Confident	122 Å²	122	61 Å²	61	60%	0.601	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	6.3	-175.6	-66.9	-75.5	-128.9	0	0	112.9	K82 S83 V84 D88	K82-M86 WeakPolarHBondContact O-CB 3.39Å; K82-M86 VanDerWaalsContact O-CG 3.22Å; K82-M86 WeakPolarHBondContact O-CG 3.49Å; K82-M86 PolarHBondContact O-N 2.91Å; S83-M86 PolarHBondContact O-N 3.4Å; V84-M86 PolarHBondContact O-N 3.08Å; V84-M86 VanDerWaalsContact O-N 3.13Å; M86-D88 PolarHBondContact O-N 2.96Å
87	N	73.7	Confident	80.8	Confident	146 Å²	146	60.9 Å²	60.9	78%	0.781	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	37.2	-175.8	-66.8	-7.7	0	0	0	114	S83 V84 F89	S83-N87 PolarHBondContact O-N 2.81Å; V84-N87 PolarHBondContact O-N 3.01Å; V84-N87 PolarHBondContact O-OD1 3.12Å; N87-F89 PolarHBondContact O-N 3.38Å
88	D	70	Confident	80.6	Confident	22 Å²	22	65.5 Å²	65.5	12%	0.118	34%	0.335	C	S	.	.			trans	-68.7	-21.9	178.3	-83.8	8.2	0	0	0	113.2	R43 R46 S83 M86	R43-D88 HydrophobicContact CB-CB 4.37Å; R43-D88 VanDerWaalsContact CD-O 3.29Å; R43-D88 WeakPolarHBondContact CD-O 3.48Å; R43-D88 HydrophobicContact CG-CB 4.49Å; R43-D88 WeakPolarHBondContact CG-O 3.32Å; R43-D88 PolarHBondContact NH1-O 2.81Å; R46-D88 VanDerWaalsContact CD-OD2 3.23Å; R46-D88 WeakPolarHBondContact CD-OD2 3.45Å; R46-D88 IonicContact CZ-OD2 3.73Å; R46-D88 IonicContact NE-OD2 3.66Å; R46-D88 IonicContact NH1-OD1 2.86Å; R46-D88 PolarHBondContact NH1-OD1 3.13Å; R46-D88 IonicContact NH1-OD2 2.78Å; R46-D88 PolarHBondContact NH1-OD2 3.39Å; S83-D88 PolarHBondContact O-N 3.13Å; S83-D88 VanDerWaalsContact O-N 3.1Å; M86-D88 PolarHBondContact O-N 2.96Å
89	F	67.7	Low	80.5	Confident	32 Å²	32	60.3 Å²	60.3	14%	0.14	31%	0.313	C	S	.	.			trans	-133.4	121.9	-170.7	-62.3	-73.1	0	0	0	112.9	R43 C47 M50 N87 G91 P93	R43-F89 HydrophobicContact CG-CE1 4.47Å; C47-F89 WeakPolarHBondContact SG-CE1 3.15Å; C47-F89 WeakPolarHBondContact SG-CZ 3.48Å; M50-F89 HydrophobicContact CE-CE2 3.68Å; M50-F89 HydrophobicContact CE-CZ 4.28Å; M50-F89 HydrophobicContact SD-CE2 4.36Å; M50-F89 HydrophobicContact SD-CZ 4.45Å; N87-F89 PolarHBondContact O-N 3.38Å; F89-G91 VanDerWaalsContact C-N 3.27Å; F89-G91 WeakPolarHBondContact CB-O 3.34Å; F89-G91 PolarHBondContact O-N 2.99Å; F89-P93 HydrophobicContact CD1-CG 3.66Å; F89-P93 HydrophobicContact CD2-CG 4.19Å; F89-P93 HydrophobicContact CE1-CG 3.7Å; F89-P93 HydrophobicContact CE2-CG 4.24Å; F89-P93 HydrophobicContact CG-CG 3.9Å; F89-P93 HydrophobicContact CZ-CG 4.01Å
90	D	66.3	Low	80.5	Confident	168 Å²	168	60.2 Å²	60.2	90%	0.898	31%	0.312	S	S	*	.	S	Bend	trans	-74.5	79	163.9	-58	-59.6	0	0	0	109.9
91	G	73.3	Confident	80.4	Confident	50 Å²	50	59.2 Å²	59.2	52%	0.515	31%	0.309	S	S	.	.	S	Bend	trans	101.8	-170.8	-179.6	0	0	0	0	0	114.6	F89	F89-G91 VanDerWaalsContact C-N 3.27Å; F89-G91 WeakPolarHBondContact CB-O 3.34Å; F89-G91 PolarHBondContact O-N 2.99Å
92	V	77.9	Confident	80.4	Confident	43 Å²	43	57.6 Å²	57.6	26%	0.261	30%	0.301	S	S	.	.			trans	-90	121.9	-175.3	-169.9	0	0	0	0	109.7	Y80 Y96 V97 F139 N142	Y80-V92 HydrophobicContact CE2-CG1 4.43Å; V92-Y96 HydrophobicContact CG1-CD1 3.93Å; V92-V97 HydrophobicContact CB-CG2 4.29Å; V92-V97 HydrophobicContact CG1-CG2 3.61Å; V92-F139 HydrophobicContact CG1-CD1 4.27Å; V92-F139 HydrophobicContact CG1-CE1 3.98Å; V92-F139 HydrophobicContact CG2-CD1 4.5Å; V92-F139 HydrophobicContact CG2-CE1 4.13Å; V92-N142 WeakPolarHBondContact CG2-ND2 3.31Å
93	P	78.6	Confident	80.5	Confident	9 Å²	9	51.9 Å²	51.9	6%	0.058	28%	0.276	C	S	.	.			trans	-61.3	137.7	-177.6	-24.3	34.9	0	0	0	113	F89 F95 Y96 V97	F89-P93 HydrophobicContact CD1-CG 3.66Å; F89-P93 HydrophobicContact CD2-CG 4.19Å; F89-P93 HydrophobicContact CE1-CG 3.7Å; F89-P93 HydrophobicContact CE2-CG 4.24Å; F89-P93 HydrophobicContact CG-CG 3.9Å; F89-P93 HydrophobicContact CZ-CG 4.01Å; P93-F95 HydrophobicContact CB-CD1 3.94Å; P93-F95 HydrophobicContact CB-CE1 3.46Å; P93-F95 VanDerWaalsContact CB-CE1 3.46Å; P93-F95 HydrophobicContact CB-CE2 4.22Å; P93-F95 HydrophobicContact CB-CG 4.49Å; P93-F95 HydrophobicContact CB-CZ 3.61Å; P93-F95 HydrophobicContact CG-CE1 4.4Å; P93-F95 HydrophobicContact CG-CZ 4.2Å; P93-F95 PolarHBondContact O-N 3.32Å; P93-Y96 VanDerWaalsContact O-CB 3.26Å; P93-Y96 WeakPolarHBondContact O-CB 3.43Å; P93-Y96 PolarHBondContact O-N 3.42Å; P93-V97 PolarHBondContact O-N 3.13Å
94	P	80.5	Confident	80.8	Confident	50 Å²	50	54 Å²	54	33%	0.325	29%	0.286	S	S	.	.	H	α-helix	trans	-54.2	-48.7	-177.6	-31.4	37.4	0	0	0	114.3	Y96 V97 R98 Y153	P94-Y96 PolarHBondContact O-N 2.86Å; P94-Y96 VanDerWaalsContact O-N 3.13Å; P94-V97 PolarHBondContact O-N 3.17Å; P94-R98 PolarHBondContact O-N 3.12Å; P94-Y153 HydrophobicContact CB-CD1 3.61Å; P94-Y153 HydrophobicContact CB-CE1 4.33Å; P94-Y153 HydrophobicContact CB-CG 4.3Å; P94-Y153 HydrophobicContact CG-CD1 4.44Å
95	F	85.9	Confident	81.1	Confident	30 Å²	30	53.7 Å²	53.7	13%	0.132	28%	0.282	C	S	.	.	H	α-helix	trans	-57.6	-27.4	176.6	65.9	-100.6	0	0	0	113.9	M50 I54 P93 C99	M50-F95 HydrophobicContact CB-CE2 4.12Å; M50-F95 HydrophobicContact SD-CE2 4.16Å; M50-F95 HydrophobicContact SD-CZ 4.35Å; I54-F95 HydrophobicContact CD1-CD2 3.63Å; I54-F95 HydrophobicContact CD1-CE2 4.07Å; P93-F95 HydrophobicContact CB-CD1 3.94Å; P93-F95 HydrophobicContact CB-CE1 3.46Å; P93-F95 VanDerWaalsContact CB-CE1 3.46Å; P93-F95 HydrophobicContact CB-CE2 4.22Å; P93-F95 HydrophobicContact CB-CG 4.49Å; P93-F95 HydrophobicContact CB-CZ 3.61Å; P93-F95 HydrophobicContact CG-CE1 4.4Å; P93-F95 HydrophobicContact CG-CZ 4.2Å; P93-F95 PolarHBondContact O-N 3.32Å; F95-C99 WeakPolarHBondContact O-CB 3.37Å; F95-C99 PolarHBondContact O-N 3.27Å
96	Y	86.8	Confident	81.4	Confident	1 Å²	1	48.3 Å²	48.3	0%	0.004	26%	0.256	C	S	.	.	H	α-helix	trans	-73.8	-45.7	179.2	-170.9	-102	0	0	0	111.1	L76 Y80 V92 P93 P94 C99 I100 Y135 F139	L76-Y96 HydrophobicContact CD1-CD2 4.26Å; L76-Y96 HydrophobicContact CD1-CE2 4.02Å; L76-Y96 HydrophobicContact CD2-CE2 4.31Å; L76-Y96 HydrophobicContact CG-CD2 4.41Å; L76-Y96 HydrophobicContact CG-CE2 3.82Å; Y80-Y96 WeakPolarHBondContact CB-OH 3.23Å; Y80-Y96 AromaticContact CD1-CE1 3.99Å; Y80-Y96 HydrophobicContact CD1-CE1 3.99Å; Y80-Y96 AromaticContact CD1-CZ 3.84Å; Y80-Y96 AromaticContact CD2-CD1 3.96Å; Y80-Y96 HydrophobicContact CD2-CD1 3.96Å; Y80-Y96 AromaticContact CD2-CD2 3.94Å; Y80-Y96 HydrophobicContact CD2-CD2 3.94Å; Y80-Y96 AromaticContact CD2-CE1 3.71Å; Y80-Y96 HydrophobicContact CD2-CE1 3.71Å; Y80-Y96 AromaticContact CD2-CE2 3.69Å; Y80-Y96 HydrophobicContact CD2-CE2 3.69Å; Y80-Y96 HydrophobicContact CD2-CG 4.08Å; Y80-Y96 AromaticContact CD2-CZ 3.6Å; Y80-Y96 HydrophobicContact CE1-CE1 4.09Å; Y80-Y96 AromaticContact CE2-CD1 3.85Å; Y80-Y96 HydrophobicContact CE2-CD1 3.85Å; Y80-Y96 AromaticContact CE2-CE1 3.83Å; Y80-Y96 HydrophobicContact CE2-CE1 3.83Å; Y80-Y96 HydrophobicContact CE2-CG 4.23Å; Y80-Y96 HydrophobicContact CG-CD2 4.46Å; Y80-Y96 AromaticContact CG-CE1 3.81Å; Y80-Y96 HydrophobicContact CG-CE1 3.81Å; Y80-Y96 AromaticContact CG-CE2 3.75Å; Y80-Y96 HydrophobicContact CG-CE2 3.75Å; Y80-Y96 AromaticContact CG-CZ 3.4Å; V92-Y96 HydrophobicContact CG1-CD1 3.93Å; P93-Y96 VanDerWaalsContact O-CB 3.26Å; P93-Y96 WeakPolarHBondContact O-CB 3.43Å; P93-Y96 PolarHBondContact O-N 3.42Å; P94-Y96 PolarHBondContact O-N 2.86Å; P94-Y96 VanDerWaalsContact O-N 3.13Å; Y96-C99 PolarHBondContact O-N 3.04Å; Y96-I100 HydrophobicContact CD1-CD1 3.76Å; Y96-I100 HydrophobicContact CE1-CD1 3.45Å; Y96-I100 VanDerWaalsContact CE1-CD1 3.45Å; Y96-I100 WeakPolarHBondContact O-CG1 3.42Å; Y96-I100 PolarHBondContact O-N 3.32Å; Y96-I100 VanDerWaalsContact O-N 3.13Å; Y96-Y135 HydrophobicContact CE1-CE1 4.37Å; Y96-Y135 WeakPolarHBondContact OH-CE1 3.43Å; Y96-Y135 PolarHBondContact OH-OH 3.27Å; Y96-F139 HydrophobicContact CE1-CE1 4.36Å; Y96-F139 HydrophobicContact CE1-CZ 4.11Å
97	V	85.5	Confident	82.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-45.8	175.5	-177.4	0	0	0	0	110.4	V92 P93 P94 C99 I100 A101 N142 I143 F146 Y153	V92-V97 HydrophobicContact CB-CG2 4.29Å; V92-V97 HydrophobicContact CG1-CG2 3.61Å; P93-V97 PolarHBondContact O-N 3.13Å; P94-V97 PolarHBondContact O-N 3.17Å; V97-C99 PolarHBondContact O-N 2.86Å; V97-I100 PolarHBondContact O-N 3.2Å; V97-A101 PolarHBondContact O-N 3.36Å; V97-N142 HydrophobicContact CG1-CB 4.16Å; V97-N142 HydrophobicContact CG2-CB 4.18Å; V97-I143 HydrophobicContact CG1-CG1 4.21Å; V97-F146 HydrophobicContact CG1-CB 3.93Å; V97-F146 HydrophobicContact CG1-CG 4.34Å; V97-Y153 HydrophobicContact CB-CD1 4.31Å; V97-Y153 HydrophobicContact CB-CE1 3.71Å; V97-Y153 HydrophobicContact CG1-CE1 3.98Å; V97-Y153 HydrophobicContact CG2-CE1 3.87Å
98	R	85.3	Confident	82.8	Confident	113 Å²	113	38.6 Å²	38.6	43%	0.426	21%	0.207	S	C	.	.	H	α-helix	trans	-56	-47.7	174.8	178.2	174.6	177.6	165.9	5.6	112.3	P94 I100 A101 E102 F146	P94-R98 PolarHBondContact O-N 3.12Å; R98-I100 VanDerWaalsContact C-N 3.28Å; R98-I100 PolarHBondContact O-N 3.19Å; R98-A101 PolarHBondContact O-N 2.89Å; R98-E102 HydrophobicContact CG-CG 4.39Å; R98-E102 WeakPolarHBondContact CG-OE1 3.27Å; R98-E102 IonicContact CZ-OE1 3.18Å; R98-E102 IonicContact NE-OE1 3.55Å; R98-E102 PolarHBondContact NE-OE1 2.98Å; R98-E102 IonicContact NH2-OE1 3.97Å; R98-E102 WeakPolarHBondContact O-CB 3.31Å; R98-E102 WeakPolarHBondContact O-CG 3.48Å; R98-E102 PolarHBondContact O-N 3.13Å; R98-F146 HydrophobicContact CB-CE2 3.93Å; R98-F146 HydrophobicContact CB-CZ 3.93Å; R98-F146 HydrophobicContact CG-CE2 4.22Å; R98-F146 HydrophobicContact CG-CZ 3.83Å
99	C	86.3	Confident	83.6	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.02	22%	0.224	C	C	.	.	H	α-helix	trans	-61.3	-35.8	178.9	-176.4	0	0	0	0	112.7	I54 F95 Y96 V97 L103	I54-C99 HydrophobicContact CD1-CB 4.19Å; I54-C99 HydrophobicContact CG1-CB 4.29Å; I54-C99 HydrophobicContact CG2-CB 4.4Å; F95-C99 WeakPolarHBondContact O-CB 3.37Å; F95-C99 PolarHBondContact O-N 3.27Å; Y96-C99 PolarHBondContact O-N 3.04Å; V97-C99 PolarHBondContact O-N 2.86Å; C99-L103 VanDerWaalsContact O-CB 3.25Å; C99-L103 WeakPolarHBondContact O-CB 3.35Å; C99-L103 PolarHBondContact O-N 3.35Å
100	I	88.9	Confident	84.5	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-70.2	-45.1	177	-66.9	168.8	0	0	0	110.9	Y96 V97 R98 L103 E104 Y135 F139 I143	Y96-I100 HydrophobicContact CD1-CD1 3.76Å; Y96-I100 HydrophobicContact CE1-CD1 3.45Å; Y96-I100 VanDerWaalsContact CE1-CD1 3.45Å; Y96-I100 WeakPolarHBondContact O-CG1 3.42Å; Y96-I100 PolarHBondContact O-N 3.32Å; Y96-I100 VanDerWaalsContact O-N 3.13Å; V97-I100 PolarHBondContact O-N 3.2Å; R98-I100 VanDerWaalsContact C-N 3.28Å; R98-I100 PolarHBondContact O-N 3.19Å; I100-L103 PolarHBondContact O-N 2.84Å; I100-L103 VanDerWaalsContact O-N 3.16Å; I100-E104 PolarHBondContact O-N 3.33Å; I100-Y135 HydrophobicContact CD1-CD1 4.15Å; I100-Y135 HydrophobicContact CD1-CE1 3.84Å; I100-F139 HydrophobicContact CD1-CD2 4.25Å; I100-F139 HydrophobicContact CD1-CG 4.48Å; I100-I143 HydrophobicContact CG2-CD1 3.72Å
101	A	86.6	Confident	85.5	Confident	2 Å²	2	37.2 Å²	37.2	2%	0.017	20%	0.195	C	C	.	.	H	α-helix	trans	-59.8	-50.7	176.4	0	0	0	0	0	111.4	V97 R98 L103 E104 D105 I143 F146	V97-A101 PolarHBondContact O-N 3.36Å; R98-A101 PolarHBondContact O-N 2.89Å; A101-L103 PolarHBondContact O-N 2.87Å; A101-E104 PolarHBondContact O-N 3.48Å; A101-E104 VanDerWaalsContact O-N 3.14Å; A101-D105 PolarHBondContact O-N 3.05Å; A101-I143 HydrophobicContact CB-CG2 4.48Å; A101-F146 HydrophobicContact CB-CD1 3.84Å; A101-F146 HydrophobicContact CB-CE1 3.86Å
102	E	86.8	Confident	86.1	Confident	65 Å²	65	42.5 Å²	42.5	30%	0.304	21%	0.206	S	C	.	.	H	α-helix	trans	-61.5	-25.8	175.8	-70.2	178.1	-171.5	0	0	113.3	K61 R98 F106	K61-E102 IonicContact NZ-OE2 3.81Å; R98-E102 HydrophobicContact CG-CG 4.39Å; R98-E102 WeakPolarHBondContact CG-OE1 3.27Å; R98-E102 IonicContact CZ-OE1 3.18Å; R98-E102 IonicContact NE-OE1 3.55Å; R98-E102 PolarHBondContact NE-OE1 2.98Å; R98-E102 IonicContact NH2-OE1 3.97Å; R98-E102 WeakPolarHBondContact O-CB 3.31Å; R98-E102 WeakPolarHBondContact O-CG 3.48Å; R98-E102 PolarHBondContact O-N 3.13Å; E102-F106 VanDerWaalsContact O-CB 3.24Å; E102-F106 WeakPolarHBondContact O-CB 3.36Å; E102-F106 PolarHBondContact O-N 3.28Å
103	L	88.4	Confident	86.3	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-80.4	-37.4	175.3	-177.7	63.7	0	0	0	112	L57 I69 F73 C99 I100 A101 V107 V132	L57-L103 HydrophobicContact CD2-CD1 4.48Å; I69-L103 HydrophobicContact CG2-CD1 3.79Å; F73-L103 HydrophobicContact CB-CD2 4.43Å; F73-L103 HydrophobicContact CD2-CD2 3.34Å; F73-L103 HydrophobicContact CE2-CD2 3.76Å; F73-L103 HydrophobicContact CG-CD2 4.01Å; C99-L103 VanDerWaalsContact O-CB 3.25Å; C99-L103 WeakPolarHBondContact O-CB 3.35Å; C99-L103 PolarHBondContact O-N 3.35Å; I100-L103 PolarHBondContact O-N 2.84Å; I100-L103 VanDerWaalsContact O-N 3.16Å; A101-L103 PolarHBondContact O-N 2.87Å; L103-V107 HydrophobicContact CD1-CG2 4.24Å; L103-V107 HydrophobicContact CG-CG2 4.47Å; L103-V107 VanDerWaalsContact O-CB 3.28Å; L103-V107 WeakPolarHBondContact O-CB 3.42Å; L103-V107 WeakPolarHBondContact O-CG2 3.36Å; L103-V107 PolarHBondContact O-N 3.25Å; L103-V132 HydrophobicContact CD2-CG2 3.77Å; L103-V132 HydrophobicContact CG-CG2 4.03Å
104	E	89	Confident	86.5	Confident	45 Å²	45	49.7 Å²	49.7	21%	0.21	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-46.9	173.7	177.6	165.1	-151.7	0	0	111.2	I100 A101 V107 N108 V132 T136	I100-E104 PolarHBondContact O-N 3.33Å; A101-E104 PolarHBondContact O-N 3.48Å; A101-E104 VanDerWaalsContact O-N 3.14Å; E104-V107 PolarHBondContact O-N 3.35Å; E104-N108 PolarHBondContact O-N 2.94Å; E104-N108 PolarHBondContact O-ND2 3.17Å; E104-V132 HydrophobicContact CB-CG1 4.33Å; E104-T136 WeakPolarHBondContact OE2-CG2 3.15Å
105	D	88.4	Confident	86.5	Confident	68 Å²	68	56.9 Å²	56.9	36%	0.364	26%	0.259	S	S	.	.	H	α-helix	trans	-65.3	-45.7	-179.8	-65.9	-26.7	0	0	0	110.9	A101 V107 N108 D109 R147	A101-D105 PolarHBondContact O-N 3.05Å; D105-V107 VanDerWaalsContact C-N 3.29Å; D105-V107 PolarHBondContact O-N 3.25Å; D105-N108 PolarHBondContact O-N 3.48Å; D105-N108 VanDerWaalsContact O-N 3.11Å; D105-D109 PolarHBondContact O-N 2.78Å; D105-R147 IonicContact OD1-CZ 2.75Å; D105-R147 IonicContact OD1-NH2 2.87Å; D105-R147 PolarHBondContact OD1-NH2 2.98Å; D105-R147 IonicContact OD2-NH2 2.71Å; D105-R147 PolarHBondContact OD2-NH2 3.35Å
106	F	88.6	Confident	86.1	Confident	40 Å²	40	62.4 Å²	62.4	18%	0.175	29%	0.285	C	S	.	.	H	α-helix	trans	-58.2	-37.4	172.9	178.2	-94.9	0	0	0	113.6	K61 M66 I69 E102 S110	K61-F106 HydrophobicContact CB-CD2 4.39Å; K61-F106 HydrophobicContact CB-CE2 4.14Å; K61-F106 HydrophobicContact CB-CZ 4.27Å; K61-F106 HydrophobicContact CD-CG 4.46Å; K61-F106 HydrophobicContact CG-CD1 4.11Å; K61-F106 HydrophobicContact CG-CD2 4.28Å; K61-F106 HydrophobicContact CG-CE1 4.23Å; K61-F106 HydrophobicContact CG-CE2 4.38Å; K61-F106 HydrophobicContact CG-CG 4.14Å; K61-F106 HydrophobicContact CG-CZ 4.36Å; K61-F106 WeakPolarHBondContact O-CE2 3.3Å; M66-F106 HydrophobicContact CE-CE1 3.67Å; M66-F106 HydrophobicContact CE-CZ 3.74Å; M66-F106 HydrophobicContact SD-CE1 4.03Å; I69-F106 HydrophobicContact CD1-CE1 3.63Å; I69-F106 HydrophobicContact CD1-CZ 4.12Å; E102-F106 VanDerWaalsContact O-CB 3.24Å; E102-F106 WeakPolarHBondContact O-CB 3.36Å; E102-F106 PolarHBondContact O-N 3.28Å; F106-S110 WeakPolarHBondContact O-CB 3.47Å; F106-S110 PolarHBondContact O-N 3.42Å; F106-S110 PolarHBondContact O-OG 3.21Å
107	V	88.8	Confident	85.2	Confident	3 Å²	3	64.2 Å²	64.2	2%	0.018	29%	0.294	C	S	.	.	H	α-helix	trans	-72.8	-31.5	177.9	164.1	0	0	0	0	111.9	L103 E104 D105 W111 L128 K129 V132	L103-V107 HydrophobicContact CD1-CG2 4.24Å; L103-V107 HydrophobicContact CG-CG2 4.47Å; L103-V107 VanDerWaalsContact O-CB 3.28Å; L103-V107 WeakPolarHBondContact O-CB 3.42Å; L103-V107 WeakPolarHBondContact O-CG2 3.36Å; L103-V107 PolarHBondContact O-N 3.25Å; E104-V107 PolarHBondContact O-N 3.35Å; D105-V107 VanDerWaalsContact C-N 3.29Å; D105-V107 PolarHBondContact O-N 3.25Å; V107-W111 VanDerWaalsContact O-CB 3.28Å; V107-W111 WeakPolarHBondContact O-CB 3.18Å; V107-W111 PolarHBondContact O-N 3.08Å; V107-W111 VanDerWaalsContact O-N 3.15Å; V107-L128 HydrophobicContact CG2-CD2 3.64Å; V107-L128 HydrophobicContact CG2-CG 3.81Å; V107-K129 HydrophobicContact CG1-CB 3.7Å; V107-K129 HydrophobicContact CG1-CD 4.26Å; V107-K129 HydrophobicContact CG1-CG 3.86Å; V107-V132 HydrophobicContact CG2-CG2 4.43Å
108	N	88.6	Confident	85	Confident	61 Å²	61	70.2 Å²	70.2	33%	0.326	33%	0.327	S	S	.	.	H	α-helix	trans	-71.8	-50.8	173.7	-72.9	-36.3	0	0	0	111.1	E104 D105 S110 W111 E112 K129	E104-N108 PolarHBondContact O-N 2.94Å; E104-N108 PolarHBondContact O-ND2 3.17Å; D105-N108 PolarHBondContact O-N 3.48Å; D105-N108 VanDerWaalsContact O-N 3.11Å; N108-S110 VanDerWaalsContact C-N 3.32Å; N108-S110 PolarHBondContact O-N 2.89Å; N108-W111 WeakPolarHBondContact O-CA 3.24Å; N108-W111 WeakPolarHBondContact O-CB 3.31Å; N108-W111 PolarHBondContact O-N 3.4Å; N108-E112 PolarHBondContact O-N 3.45Å; N108-K129 PolarHBondContact OD1-NZ 3.2Å
109	D	88.5	Confident	84.9	Confident	92 Å²	92	73.8 Å²	73.8	49%	0.492	35%	0.345	S	S	.	.	H	α-helix	trans	-54.3	-45.7	174.1	-81.2	15.6	0	0	0	112.6	D105 W111 E112 K113	D105-D109 PolarHBondContact O-N 2.78Å; D109-W111 PolarHBondContact O-N 2.82Å; D109-E112 PolarHBondContact O-N 2.81Å; D109-K113 PolarHBondContact O-N 3.02Å; D109-K113 VanDerWaalsContact O-N 3.15Å
110	S	86.1	Confident	84.7	Confident	11 Å²	11	75.8 Å²	75.8	8%	0.077	37%	0.366	C	S	.	.	H	α-helix	trans	-70.6	-21.1	179.2	-61.1	0	0	0	0	112.7	F106 N108 K114 L125	F106-S110 WeakPolarHBondContact O-CB 3.47Å; F106-S110 PolarHBondContact O-N 3.42Å; F106-S110 PolarHBondContact O-OG 3.21Å; N108-S110 VanDerWaalsContact C-N 3.32Å; N108-S110 PolarHBondContact O-N 2.89Å; S110-K114 PolarHBondContact O-N 3.37Å; S110-L125 VanDerWaalsContact CB-CD1 3.49Å; S110-L125 WeakPolarHBondContact O-CD2 3.47Å
111	W	86	Confident	84.4	Confident	90 Å²	90	76.7 Å²	76.7	34%	0.341	37%	0.374	S	S	.	.	H	α-helix	trans	-77.3	-31.3	173.7	-170.4	-96.5	0	0	0	112.9	V107 N108 D109 K114 L125 A126 K129	V107-W111 VanDerWaalsContact O-CB 3.28Å; V107-W111 WeakPolarHBondContact O-CB 3.18Å; V107-W111 PolarHBondContact O-N 3.08Å; V107-W111 VanDerWaalsContact O-N 3.15Å; N108-W111 WeakPolarHBondContact O-CA 3.24Å; N108-W111 WeakPolarHBondContact O-CB 3.31Å; N108-W111 PolarHBondContact O-N 3.4Å; D109-W111 PolarHBondContact O-N 2.82Å; W111-K114 WeakPolarHBondContact O-CB 3.49Å; W111-K114 WeakPolarHBondContact O-CD 3.26Å; W111-K114 VanDerWaalsContact O-CG 3.31Å; W111-K114 WeakPolarHBondContact O-CG 3.23Å; W111-L125 HydrophobicContact CB-CD2 4.48Å; W111-L125 HydrophobicContact CD2-CD2 4.4Å; W111-L125 HydrophobicContact CE3-CD2 3.47Å; W111-L125 VanDerWaalsContact CE3-CD2 3.47Å; W111-L125 HydrophobicContact CE3-CG 4.09Å; W111-L125 HydrophobicContact CZ3-CD2 4.04Å; W111-A126 HydrophobicContact CH2-CB 4.41Å; W111-A126 HydrophobicContact CZ3-CB 4.07Å; W111-K129 HydrophobicContact CB-CD 4.21Å; W111-K129 HydrophobicContact CD2-CD 3.54Å; W111-K129 HydrophobicContact CE3-CB 4.5Å; W111-K129 HydrophobicContact CE3-CD 3.55Å; W111-K129 HydrophobicContact CG-CD 3.82Å; W111-K129 HydrophobicContact CZ3-CD 4.22Å
112	E	86.2	Confident	84.4	Confident	162 Å²	162	78.8 Å²	78.8	76%	0.757	39%	0.387	S	S	*	.	H	α-helix	trans	-67.9	-46.3	169.8	-59	-165.8	159.1	0	0	110.5	N108 D109 K114	N108-E112 PolarHBondContact O-N 3.45Å; D109-E112 PolarHBondContact O-N 2.81Å; E112-K114 PolarHBondContact O-N 3.17Å; E112-K114 VanDerWaalsContact O-N 3.14Å
113	K	82.6	Confident	84.5	Confident	108 Å²	108	83.5 Å²	83.5	47%	0.47	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	14	179.8	-63.2	173.1	-172.6	162.5	0	114.5	D109 K115 E116	D109-K113 PolarHBondContact O-N 3.02Å; D109-K113 VanDerWaalsContact O-N 3.15Å; K113-K115 PolarHBondContact O-N 3.44Å; K113-E116 PolarHBondContact O-N 2.84Å
114	K	82.3	Confident	84.5	Confident	94 Å²	94	84.1 Å²	84.1	41%	0.409	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-55.2	-18.3	-177.3	68.9	-178.5	176.2	-174.5	0	115.8	S110 W111 E112 E116 V122 L125	S110-K114 PolarHBondContact O-N 3.37Å; W111-K114 WeakPolarHBondContact O-CB 3.49Å; W111-K114 WeakPolarHBondContact O-CD 3.26Å; W111-K114 VanDerWaalsContact O-CG 3.31Å; W111-K114 WeakPolarHBondContact O-CG 3.23Å; E112-K114 PolarHBondContact O-N 3.17Å; E112-K114 VanDerWaalsContact O-N 3.14Å; K114-E116 VanDerWaalsContact C-N 3.35Å; K114-V122 WeakPolarHBondContact O-CG2 3.45Å; K114-L125 HydrophobicContact CB-CD2 4.4Å
115	K	80	Confident	84.5	Confident	201 Å²	201	82 Å²	82	87%	0.874	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-75.3	-20.7	177.2	-67.2	-175.2	-179.3	178	0	113.4	K113	K113-K115 PolarHBondContact O-N 3.44Å
116	E	77.7	Confident	84.5	Confident	146 Å²	146	80.8 Å²	80.8	68%	0.682	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-88.1	-4.9	-175.6	-60.7	178.2	170	0	0	113.4	K113 K114	K113-E116 PolarHBondContact O-N 2.84Å; K114-E116 VanDerWaalsContact C-N 3.35Å
117	M	68.5	Low	84.6	Confident	39 Å²	39	81.3 Å²	81.3	19%	0.192	41%	0.407	C	S	.	.	S	Bend	trans	-107.6	148.7	-168.7	-65.5	-161.9	-70.3	0	0	113.6	M66 A121 V122 L125	M66-M117 HydrophobicContact CE-CE 4.3Å; M66-M117 HydrophobicContact CE-SD 3.74Å; M66-M117 HydrophobicContact CG-SD 4.2Å; M117-A121 HydrophobicContact CB-CB 4.13Å; M117-A121 HydrophobicContact SD-CB 4.45Å; M117-V122 HydrophobicContact CB-CG2 3.92Å; M117-L125 HydrophobicContact CE-CB 4.23Å; M117-L125 HydrophobicContact CE-CD1 4.11Å; M117-L125 HydrophobicContact CE-CD2 3.64Å; M117-L125 HydrophobicContact CE-CG 4.18Å
118	N	82.1	Confident	84.6	Confident	127 Å²	127	81.2 Å²	81.2	68%	0.679	41%	0.406	S	S	*	.			trans	-55.6	144.8	172.6	-176.2	-4.5	0	0	0	111	G120 A121 V122	N118-G120 PolarHBondContact O-N 3.4Å; N118-G120 VanDerWaalsContact O-N 3.08Å; N118-G120 PolarHBondContact OD1-N 2.88Å; N118-A121 HydrophobicContact CB-CB 4.4Å; N118-A121 CarbonylContact O-C 3.57Å; N118-A121 WeakPolarHBondContact O-CA 3.38Å; N118-A121 WeakPolarHBondContact O-CB 3.46Å; N118-A121 PolarHBondContact O-N 2.85Å; N118-V122 PolarHBondContact O-N 3.4Å
119	K	83.1	Confident	84.7	Confident	187 Å²	187	80.6 Å²	80.6	81%	0.813	40%	0.401	S	S	*	.	H	α-helix	trans	-49.6	-37.4	177.2	-66.9	-179.2	180	176.8	0	113	K123	K119-K123 PolarHBondContact O-N 3.16Å; K119-K123 VanDerWaalsContact O-N 3.13Å
120	G	81.9	Confident	84.8	Confident	45 Å²	45	82.3 Å²	82.3	46%	0.464	41%	0.406	S	S	.	.	H	α-helix	trans	-61.2	-51.4	173	0	0	0	0	0	112.4	N118 V122 K123 S124	N118-G120 PolarHBondContact O-N 3.4Å; N118-G120 VanDerWaalsContact O-N 3.08Å; N118-G120 PolarHBondContact OD1-N 2.88Å; G120-V122 VanDerWaalsContact C-N 3.32Å; G120-V122 PolarHBondContact O-N 3.49Å; G120-K123 PolarHBondContact O-N 3.47Å; G120-K123 VanDerWaalsContact O-N 3.14Å; G120-S124 PolarHBondContact O-N 2.95Å; G120-S124 PolarHBondContact O-OG 3.32Å; G120-S124 VanDerWaalsContact O-OG 3.1Å
121	A	82.8	Confident	84.8	Confident	23 Å²	23	86.2 Å²	86.2	19%	0.19	42%	0.419	C	S	.	.	H	α-helix	trans	-62	-34.2	177.3	0	0	0	0	0	113.1	M66 M117 N118 S124 L125	M66-A121 HydrophobicContact CB-CB 4.43Å; M66-A121 HydrophobicContact CG-CB 4.3Å; M117-A121 HydrophobicContact CB-CB 4.13Å; M117-A121 HydrophobicContact SD-CB 4.45Å; N118-A121 HydrophobicContact CB-CB 4.4Å; N118-A121 CarbonylContact O-C 3.57Å; N118-A121 WeakPolarHBondContact O-CA 3.38Å; N118-A121 WeakPolarHBondContact O-CB 3.46Å; N118-A121 PolarHBondContact O-N 2.85Å; A121-S124 VanDerWaalsContact CA-OG 3.29Å; A121-S124 WeakPolarHBondContact CA-OG 3.39Å; A121-S124 PolarHBondContact O-OG 3.31Å; A121-S124 VanDerWaalsContact O-OG 3.07Å; A121-L125 VanDerWaalsContact O-CB 3.24Å; A121-L125 WeakPolarHBondContact O-CB 3.49Å; A121-L125 PolarHBondContact O-N 2.92Å
122	V	86.6	Confident	84.8	Confident	47 Å²	47	82.1 Å²	82.1	29%	0.285	40%	0.404	S	S	.	.	H	α-helix	trans	-68.2	-37.8	174.1	177.1	0	0	0	0	111.7	K114 M117 N118 G120 L125 A126	K114-V122 WeakPolarHBondContact O-CG2 3.45Å; M117-V122 HydrophobicContact CB-CG2 3.92Å; N118-V122 PolarHBondContact O-N 3.4Å; G120-V122 VanDerWaalsContact C-N 3.32Å; G120-V122 PolarHBondContact O-N 3.49Å; V122-L125 PolarHBondContact O-N 3.46Å; V122-A126 PolarHBondContact O-N 3.17Å
123	K	88.8	Confident	84.9	Confident	163 Å²	163	80.6 Å²	80.6	71%	0.709	39%	0.394	S	S	*	.	H	α-helix	trans	-68.7	-41.1	176.7	-171.4	-178.5	179.8	-177.3	0	111.7	K119 G120 T127	K119-K123 PolarHBondContact O-N 3.16Å; K119-K123 VanDerWaalsContact O-N 3.13Å; G120-K123 PolarHBondContact O-N 3.47Å; G120-K123 VanDerWaalsContact O-N 3.14Å; K123-T127 PolarHBondContact O-N 2.85Å; K123-T127 PolarHBondContact O-OG1 3.34Å
124	S	87.3	Confident	85.1	Confident	15 Å²	15	82 Å²	82	11%	0.105	40%	0.401	C	S	.	.	H	α-helix	trans	-65.7	-46.2	171.7	40.5	0	0	0	0	111	M66 I70 G120 A121 A126 T127 L128	M66-S124 VanDerWaalsContact CB-OG 3.23Å; M66-S124 WeakPolarHBondContact CB-OG 3.4Å; M66-S124 WeakPolarHBondContact O-CB 3.27Å; I70-S124 VanDerWaalsContact CD1-CB 3.5Å; I70-S124 WeakPolarHBondContact CD1-O 3.29Å; G120-S124 PolarHBondContact O-N 2.95Å; G120-S124 PolarHBondContact O-OG 3.32Å; G120-S124 VanDerWaalsContact O-OG 3.1Å; A121-S124 VanDerWaalsContact CA-OG 3.29Å; A121-S124 WeakPolarHBondContact CA-OG 3.39Å; A121-S124 PolarHBondContact O-OG 3.31Å; A121-S124 VanDerWaalsContact O-OG 3.07Å; S124-A126 VanDerWaalsContact C-N 3.32Å; S124-A126 PolarHBondContact O-N 2.96Å; S124-T127 CarbonylContact O-C 3.59Å; S124-T127 WeakPolarHBondContact O-CA 3.49Å; S124-T127 WeakPolarHBondContact O-CB 3.37Å; S124-T127 PolarHBondContact O-N 3.35Å; S124-L128 WeakPolarHBondContact O-CB 3.4Å; S124-L128 PolarHBondContact O-N 2.97Å
125	L	88.9	Confident	85.2	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-53.1	-45.1	174.9	-175.7	86.6	0	0	0	112.8	M66 S110 W111 K114 M117 A121 V122 T127 L128 K129	M66-L125 HydrophobicContact CE-CD1 4.02Å; M66-L125 HydrophobicContact CG-CB 4.43Å; M66-L125 HydrophobicContact SD-CD1 3.7Å; S110-L125 VanDerWaalsContact CB-CD1 3.49Å; S110-L125 WeakPolarHBondContact O-CD2 3.47Å; W111-L125 HydrophobicContact CB-CD2 4.48Å; W111-L125 HydrophobicContact CD2-CD2 4.4Å; W111-L125 HydrophobicContact CE3-CD2 3.47Å; W111-L125 VanDerWaalsContact CE3-CD2 3.47Å; W111-L125 HydrophobicContact CE3-CG 4.09Å; W111-L125 HydrophobicContact CZ3-CD2 4.04Å; K114-L125 HydrophobicContact CB-CD2 4.4Å; M117-L125 HydrophobicContact CE-CB 4.23Å; M117-L125 HydrophobicContact CE-CD1 4.11Å; M117-L125 HydrophobicContact CE-CD2 3.64Å; M117-L125 HydrophobicContact CE-CG 4.18Å; A121-L125 VanDerWaalsContact O-CB 3.24Å; A121-L125 WeakPolarHBondContact O-CB 3.49Å; A121-L125 PolarHBondContact O-N 2.92Å; V122-L125 PolarHBondContact O-N 3.46Å; L125-T127 VanDerWaalsContact C-N 3.32Å; L125-T127 PolarHBondContact O-N 2.89Å; L125-L128 PolarHBondContact O-N 3Å; L125-K129 WeakPolarHBondContact O-CB 3.36Å; L125-K129 PolarHBondContact O-N 3.34Å
126	A	89.6	Confident	85.2	Confident	42 Å²	42	69.8 Å²	69.8	35%	0.347	35%	0.348	S	S	.	.	H	α-helix	trans	-61.4	-40.2	176.1	0	0	0	0	0	112.5	W111 V122 S124 Q130	W111-A126 HydrophobicContact CH2-CB 4.41Å; W111-A126 HydrophobicContact CZ3-CB 4.07Å; V122-A126 PolarHBondContact O-N 3.17Å; S124-A126 VanDerWaalsContact C-N 3.32Å; S124-A126 PolarHBondContact O-N 2.96Å; A126-Q130 PolarHBondContact O-N 2.67Å; A126-Q130 VanDerWaalsContact O-N 3.08Å
127	T	90	Very high	85.5	Confident	52 Å²	52	70.8 Å²	70.8	32%	0.319	35%	0.345	S	S	.	.	H	α-helix	trans	-67.2	-42.8	176.3	-50.7	0	0	0	0	111.6	I70 K123 S124 L125 Q130 R131	I70-T127 HydrophobicContact CD1-CG2 4.41Å; K123-T127 PolarHBondContact O-N 2.85Å; K123-T127 PolarHBondContact O-OG1 3.34Å; S124-T127 CarbonylContact O-C 3.59Å; S124-T127 WeakPolarHBondContact O-CA 3.49Å; S124-T127 WeakPolarHBondContact O-CB 3.37Å; S124-T127 PolarHBondContact O-N 3.35Å; L125-T127 VanDerWaalsContact C-N 3.32Å; L125-T127 PolarHBondContact O-N 2.89Å; T127-Q130 PolarHBondContact O-N 3.46Å; T127-R131 WeakPolarHBondContact O-CG 3.07Å; T127-R131 PolarHBondContact O-N 2.85Å
128	L	90	Very high	86	Confident	0 Å²	0	75 Å²	75	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-62.1	-49.5	176.2	-176.4	62.8	0	0	0	110.4	M66 I69 I70 V107 S124 L125 Q130 R131 V132	M66-L128 HydrophobicContact SD-CD2 4.42Å; I69-L128 HydrophobicContact CB-CD2 4.27Å; I69-L128 HydrophobicContact CG2-CD1 3.99Å; I69-L128 HydrophobicContact CG2-CD2 3.6Å; I69-L128 HydrophobicContact CG2-CG 4.47Å; I70-L128 HydrophobicContact CD1-CB 4.3Å; I70-L128 HydrophobicContact CG1-CB 3.82Å; I70-L128 HydrophobicContact CG1-CD1 3.94Å; I70-L128 HydrophobicContact CG1-CG 4.37Å; V107-L128 HydrophobicContact CG2-CD2 3.64Å; V107-L128 HydrophobicContact CG2-CG 3.81Å; S124-L128 WeakPolarHBondContact O-CB 3.4Å; S124-L128 PolarHBondContact O-N 2.97Å; L125-L128 PolarHBondContact O-N 3Å; L128-Q130 VanDerWaalsContact C-N 3.31Å; L128-Q130 PolarHBondContact O-N 2.66Å; L128-R131 PolarHBondContact O-N 3.45Å; L128-V132 HydrophobicContact CD1-CG2 3.85Å; L128-V132 HydrophobicContact CG-CG2 4.16Å; L128-V132 WeakPolarHBondContact O-CB 3.5Å; L128-V132 WeakPolarHBondContact O-CG2 3.31Å; L128-V132 PolarHBondContact O-N 3.1Å
129	K	90.1	Very high	85.8	Confident	49 Å²	49	69.9 Å²	69.9	21%	0.213	34%	0.34	C	S	.	.	H	α-helix	trans	-58.7	-40	177.2	-173.6	162.6	-173.6	140.7	0	112.7	V107 N108 W111 L125 K133	V107-K129 HydrophobicContact CG1-CB 3.7Å; V107-K129 HydrophobicContact CG1-CD 4.26Å; V107-K129 HydrophobicContact CG1-CG 3.86Å; N108-K129 PolarHBondContact OD1-NZ 3.2Å; W111-K129 HydrophobicContact CB-CD 4.21Å; W111-K129 HydrophobicContact CD2-CD 3.54Å; W111-K129 HydrophobicContact CE3-CB 4.5Å; W111-K129 HydrophobicContact CE3-CD 3.55Å; W111-K129 HydrophobicContact CG-CD 3.82Å; W111-K129 HydrophobicContact CZ3-CD 4.22Å; L125-K129 WeakPolarHBondContact O-CB 3.36Å; L125-K129 PolarHBondContact O-N 3.34Å; K129-K133 WeakPolarHBondContact O-CB 3.35Å; K129-K133 PolarHBondContact O-N 3.47Å; K129-K133 VanDerWaalsContact O-N 3.1Å
130	Q	89.4	Confident	85.6	Confident	127 Å²	127	65.8 Å²	65.8	59%	0.593	32%	0.324	S	S	*	.	H	α-helix	trans	-68.7	-34.5	175.8	-165.1	-175.9	15.1	0	0	112.6	A126 T127 L128 K134	A126-Q130 PolarHBondContact O-N 2.67Å; A126-Q130 VanDerWaalsContact O-N 3.08Å; T127-Q130 PolarHBondContact O-N 3.46Å; L128-Q130 VanDerWaalsContact C-N 3.31Å; L128-Q130 PolarHBondContact O-N 2.66Å; Q130-K134 WeakPolarHBondContact O-CG 3.42Å; Q130-K134 PolarHBondContact O-N 2.94Å
131	R	87.2	Confident	85.4	Confident	93 Å²	93	66.5 Å²	66.5	35%	0.351	33%	0.325	S	S	.	.	H	α-helix	trans	-76.7	-50.1	178.5	-76	178.9	173.9	179.6	-5.3	112.6	F73 T127 L128 K133 K134 Y135	F73-R131 HydrophobicContact CE1-CB 4.3Å; T127-R131 WeakPolarHBondContact O-CG 3.07Å; T127-R131 PolarHBondContact O-N 2.85Å; L128-R131 PolarHBondContact O-N 3.45Å; R131-K133 PolarHBondContact O-N 3.25Å; R131-K134 WeakPolarHBondContact O-CB 3.36Å; R131-K134 PolarHBondContact O-N 3.21Å; R131-K134 VanDerWaalsContact O-N 3.08Å; R131-Y135 PolarHBondContact O-N 2.82Å
132	V	86.5	Confident	84.9	Confident	4 Å²	4	67.3 Å²	67.3	2%	0.024	33%	0.326	C	S	.	.	H	α-helix	trans	-56.5	-50.8	176.4	174.9	0	0	0	0	109.4	F73 L103 E104 V107 L128 K134 Y135 T136	F73-V132 HydrophobicContact CE1-CG2 4.27Å; F73-V132 HydrophobicContact CE2-CG2 4.47Å; F73-V132 HydrophobicContact CZ-CG2 4.23Å; L103-V132 HydrophobicContact CD2-CG2 3.77Å; L103-V132 HydrophobicContact CG-CG2 4.03Å; E104-V132 HydrophobicContact CB-CG1 4.33Å; V107-V132 HydrophobicContact CG2-CG2 4.43Å; L128-V132 HydrophobicContact CD1-CG2 3.85Å; L128-V132 HydrophobicContact CG-CG2 4.16Å; L128-V132 WeakPolarHBondContact O-CB 3.5Å; L128-V132 WeakPolarHBondContact O-CG2 3.31Å; L128-V132 PolarHBondContact O-N 3.1Å; V132-K134 PolarHBondContact O-N 3.15Å; V132-K134 VanDerWaalsContact O-N 3.09Å; V132-Y135 CarbonylContact O-C 3.57Å; V132-Y135 WeakPolarHBondContact O-CA 3.23Å; V132-Y135 PolarHBondContact O-N 3.29Å; V132-T136 PolarHBondContact O-N 3.35Å; V132-T136 PolarHBondContact O-OG1 2.99Å
133	K	87.3	Confident	84.4	Confident	130 Å²	130	65.4 Å²	65.4	57%	0.565	31%	0.314	S	S	*	.	H	α-helix	trans	-60.6	-24.3	177.6	-173.2	167	-176	168.5	0	114.9	K129 R131	K129-K133 WeakPolarHBondContact O-CB 3.35Å; K129-K133 PolarHBondContact O-N 3.47Å; K129-K133 VanDerWaalsContact O-N 3.1Å; R131-K133 PolarHBondContact O-N 3.25Å
134	K	86.5	Confident	83.9	Confident	138 Å²	138	64.1 Å²	64.1	60%	0.6	31%	0.305	S	S	*	.	H	α-helix	trans	-77.4	-35	171.2	-78.8	-178.3	-179.3	-170	0	112.1	Q130 R131 V132	Q130-K134 WeakPolarHBondContact O-CG 3.42Å; Q130-K134 PolarHBondContact O-N 2.94Å; R131-K134 WeakPolarHBondContact O-CB 3.36Å; R131-K134 PolarHBondContact O-N 3.21Å; R131-K134 VanDerWaalsContact O-N 3.08Å; V132-K134 PolarHBondContact O-N 3.15Å; V132-K134 VanDerWaalsContact O-N 3.09Å
135	Y	84.3	Confident	83.2	Confident	27 Å²	27	66.7 Å²	66.7	11%	0.106	32%	0.318	C	S	.	.	H	α-helix	trans	-82.8	-40.8	-176.5	-157.8	-104	0	0	0	112.6	F73 V77 Y96 I100 R131 V132 R137 L138 F139	F73-Y135 HydrophobicContact CE2-CD1 4.27Å; F73-Y135 AromaticContact CZ-CD1 3.88Å; F73-Y135 HydrophobicContact CZ-CD1 3.88Å; F73-Y135 AromaticContact CZ-CG 3.89Å; F73-Y135 HydrophobicContact CZ-CG 3.89Å; V77-Y135 HydrophobicContact CB-CE2 4.44Å; V77-Y135 HydrophobicContact CG1-CE2 3.71Å; V77-Y135 HydrophobicContact CG2-CD1 4.41Å; V77-Y135 HydrophobicContact CG2-CD2 4.26Å; V77-Y135 HydrophobicContact CG2-CE1 3.96Å; V77-Y135 HydrophobicContact CG2-CE2 3.8Å; Y96-Y135 HydrophobicContact CE1-CE1 4.37Å; Y96-Y135 WeakPolarHBondContact OH-CE1 3.43Å; Y96-Y135 PolarHBondContact OH-OH 3.27Å; I100-Y135 HydrophobicContact CD1-CD1 4.15Å; I100-Y135 HydrophobicContact CD1-CE1 3.84Å; R131-Y135 PolarHBondContact O-N 2.82Å; V132-Y135 CarbonylContact O-C 3.57Å; V132-Y135 WeakPolarHBondContact O-CA 3.23Å; V132-Y135 PolarHBondContact O-N 3.29Å; Y135-R137 PolarHBondContact O-N 3.35Å; Y135-R137 VanDerWaalsContact O-N 3.13Å; Y135-L138 HydrophobicContact CD2-CD1 4.08Å; Y135-L138 HydrophobicContact CE2-CD1 4.2Å; Y135-L138 WeakPolarHBondContact O-CB 3.45Å; Y135-L138 PolarHBondContact O-N 2.78Å; Y135-F139 HydrophobicContact CD1-CD2 4.12Å; Y135-F139 AromaticContact CD1-CE2 3.94Å; Y135-F139 HydrophobicContact CD1-CE2 3.94Å; Y135-F139 AromaticContact CE1-CD2 3.91Å; Y135-F139 HydrophobicContact CE1-CD2 3.91Å; Y135-F139 AromaticContact CE1-CE2 3.32Å; Y135-F139 HydrophobicContact CE1-CE2 3.32Å; Y135-F139 HydrophobicContact CE1-CZ 4.17Å; Y135-F139 HydrophobicContact CE2-CE2 4.28Å; Y135-F139 AromaticContact CZ-CE2 3.51Å
136	T	81.8	Confident	82.2	Confident	11 Å²	11	68.2 Å²	68.2	7%	0.067	32%	0.324	C	S	.	.	H	α-helix	trans	-50	-38.9	174.5	-57.9	0	0	0	0	112.1	E104 V132 L138 F139 E140 I143	E104-T136 WeakPolarHBondContact OE2-CG2 3.15Å; V132-T136 PolarHBondContact O-N 3.35Å; V132-T136 PolarHBondContact O-OG1 2.99Å; T136-L138 PolarHBondContact O-N 2.71Å; T136-L138 VanDerWaalsContact O-N 3.12Å; T136-F139 CarbonylContact O-C 3.57Å; T136-F139 PolarHBondContact O-N 2.97Å; T136-E140 PolarHBondContact O-N 3.17Å; T136-I143 HydrophobicContact CG2-CD1 3.76Å
137	R	82.5	Confident	81.4	Confident	167 Å²	167	72.8 Å²	72.8	63%	0.63	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-23.4	177	-73.5	174.6	170.9	-171.7	-6.1	114.6	Y135	Y135-R137 PolarHBondContact O-N 3.35Å; Y135-R137 VanDerWaalsContact O-N 3.13Å
138	L	79.4	Confident	80.6	Confident	129 Å²	129	76.6 Å²	76.6	68%	0.675	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-19.5	176.8	-56.4	176.7	0	0	0	112.3	Y135 T136	Y135-L138 HydrophobicContact CD2-CD1 4.08Å; Y135-L138 HydrophobicContact CE2-CD1 4.2Å; Y135-L138 WeakPolarHBondContact O-CB 3.45Å; Y135-L138 PolarHBondContact O-N 2.78Å; T136-L138 PolarHBondContact O-N 2.71Å; T136-L138 VanDerWaalsContact O-N 3.12Å
139	F	78.2	Confident	79.4	Confident	18 Å²	18	80.4 Å²	80.4	8%	0.079	37%	0.367	C	S	.	.	S	Bend	trans	-122.2	16.6	-175.5	-61.7	-86.3	0	0	0	112.2	Y80 V92 Y96 I100 Y135 T136 A141 N142 I143	Y80-F139 HydrophobicContact CE1-CE1 4.42Å; Y80-F139 AromaticContact CE1-CZ 3.97Å; Y80-F139 HydrophobicContact CE1-CZ 3.97Å; V92-F139 HydrophobicContact CG1-CD1 4.27Å; V92-F139 HydrophobicContact CG1-CE1 3.98Å; V92-F139 HydrophobicContact CG2-CD1 4.5Å; V92-F139 HydrophobicContact CG2-CE1 4.13Å; Y96-F139 HydrophobicContact CE1-CE1 4.36Å; Y96-F139 HydrophobicContact CE1-CZ 4.11Å; I100-F139 HydrophobicContact CD1-CD2 4.25Å; I100-F139 HydrophobicContact CD1-CG 4.48Å; Y135-F139 HydrophobicContact CD1-CD2 4.12Å; Y135-F139 AromaticContact CD1-CE2 3.94Å; Y135-F139 HydrophobicContact CD1-CE2 3.94Å; Y135-F139 AromaticContact CE1-CD2 3.91Å; Y135-F139 HydrophobicContact CE1-CD2 3.91Å; Y135-F139 AromaticContact CE1-CE2 3.32Å; Y135-F139 HydrophobicContact CE1-CE2 3.32Å; Y135-F139 HydrophobicContact CE1-CZ 4.17Å; Y135-F139 HydrophobicContact CE2-CE2 4.28Å; Y135-F139 AromaticContact CZ-CE2 3.51Å; T136-F139 CarbonylContact O-C 3.57Å; T136-F139 PolarHBondContact O-N 2.97Å; F139-A141 PolarHBondContact O-N 3.33Å; F139-N142 PolarHBondContact O-N 3.5Å; F139-N142 VanDerWaalsContact O-N 3.12Å; F139-I143 HydrophobicContact CB-CD1 3.93Å; F139-I143 HydrophobicContact CB-CG1 4.22Å; F139-I143 WeakPolarHBondContact O-CB 3.48Å; F139-I143 VanDerWaalsContact O-CG1 3.3Å; F139-I143 WeakPolarHBondContact O-CG1 3.29Å; F139-I143 PolarHBondContact O-N 2.99Å
140	E	78	Confident	78.1	Confident	102 Å²	102	82 Å²	82	48%	0.477	39%	0.385	S	S	.	.	H	α-helix	trans	-64.2	-25.6	-171.6	-163.6	172.6	155.9	0	0	113	T136 R144	T136-E140 PolarHBondContact O-N 3.17Å; E140-R144 WeakPolarHBondContact O-CB 3.5Å; E140-R144 PolarHBondContact O-N 3.13Å
141	A	78	Confident	76.6	Confident	59 Å²	59	84 Å²	84	49%	0.488	39%	0.394	S	S	.	.	H	α-helix	trans	-69.5	-60	167.7	0	0	0	0	0	111.1	F139 I143 R144 D145	F139-A141 PolarHBondContact O-N 3.33Å; A141-I143 PolarHBondContact O-N 3.42Å; A141-I143 VanDerWaalsContact O-N 3.15Å; A141-R144 CarbonylContact O-C 3.58Å; A141-R144 WeakPolarHBondContact O-CA 3.29Å; A141-R144 VanDerWaalsContact O-CB 3.27Å; A141-R144 WeakPolarHBondContact O-CB 3.46Å; A141-R144 PolarHBondContact O-N 3.1Å; A141-D145 PolarHBondContact O-N 3.45Å
142	N	73.5	Confident	75.3	Confident	41 Å²	41	85.5 Å²	85.5	22%	0.219	41%	0.409	C	S	.	.	H	α-helix	trans	-58.1	-33.9	-178.2	-55.5	26	0	0	0	113.4	V92 V97 F139 D145 F146	V92-N142 WeakPolarHBondContact CG2-ND2 3.31Å; V97-N142 HydrophobicContact CG1-CB 4.16Å; V97-N142 HydrophobicContact CG2-CB 4.18Å; F139-N142 PolarHBondContact O-N 3.5Å; F139-N142 VanDerWaalsContact O-N 3.12Å; N142-D145 PolarHBondContact O-N 3.31Å; N142-F146 VanDerWaalsContact O-CB 3.3Å; N142-F146 WeakPolarHBondContact O-CB 3.23Å; N142-F146 PolarHBondContact O-N 3.29Å
143	I	76	Confident	74	Confident	7 Å²	7	87 Å²	87	4%	0.036	42%	0.415	C	S	.	.	H	α-helix	trans	-72.4	-31.6	176.3	-66.6	166.7	0	0	0	111.2	V97 I100 A101 T136 F139 A141 R147	V97-I143 HydrophobicContact CG1-CG1 4.21Å; I100-I143 HydrophobicContact CG2-CD1 3.72Å; A101-I143 HydrophobicContact CB-CG2 4.48Å; T136-I143 HydrophobicContact CG2-CD1 3.76Å; F139-I143 HydrophobicContact CB-CD1 3.93Å; F139-I143 HydrophobicContact CB-CG1 4.22Å; F139-I143 WeakPolarHBondContact O-CB 3.48Å; F139-I143 VanDerWaalsContact O-CG1 3.3Å; F139-I143 WeakPolarHBondContact O-CG1 3.29Å; F139-I143 PolarHBondContact O-N 2.99Å; A141-I143 PolarHBondContact O-N 3.42Å; A141-I143 VanDerWaalsContact O-N 3.15Å; I143-R147 WeakPolarHBondContact O-CB 3.22Å; I143-R147 WeakPolarHBondContact O-CG 3.49Å; I143-R147 PolarHBondContact O-N 3.05Å; I143-R147 VanDerWaalsContact O-N 3.13Å
144	R	76.8	Confident	72.4	Confident	135 Å²	135	85.8 Å²	85.8	51%	0.509	42%	0.418	S	S	.	.	H	α-helix	trans	-69.5	-47.2	170.7	-168.9	-179.7	-53.8	165.8	6.4	110.3	E140 A141 F146 R147 E148	E140-R144 WeakPolarHBondContact O-CB 3.5Å; E140-R144 PolarHBondContact O-N 3.13Å; A141-R144 CarbonylContact O-C 3.58Å; A141-R144 WeakPolarHBondContact O-CA 3.29Å; A141-R144 VanDerWaalsContact O-CB 3.27Å; A141-R144 WeakPolarHBondContact O-CB 3.46Å; A141-R144 PolarHBondContact O-N 3.1Å; R144-F146 VanDerWaalsContact C-N 3.28Å; R144-F146 PolarHBondContact O-N 3.27Å; R144-R147 CarbonylContact O-C 3.47Å; R144-R147 PolarHBondContact O-N 2.87Å; R144-E148 HydrophobicContact CG-CG 4.44Å; R144-E148 WeakPolarHBondContact CG-OE1 3.27Å; R144-E148 WeakPolarHBondContact O-CG 3.4Å; R144-E148 PolarHBondContact O-N 2.69Å
145	D	74.1	Confident	70.8	Confident	70 Å²	70	82.8 Å²	82.8	37%	0.374	41%	0.408	S	S	.	.	H	α-helix	trans	-60	-37.1	176.2	-58.6	-16.2	0	0	0	111.9	A141 N142 N149	A141-D145 PolarHBondContact O-N 3.45Å; N142-D145 PolarHBondContact O-N 3.31Å; D145-N149 WeakPolarHBondContact O-CA 3.22Å; D145-N149 WeakPolarHBondContact O-CB 3.21Å; D145-N149 PolarHBondContact O-N 2.87Å
146	F	68.3	Low	68.7	Low	32 Å²	32	90.4 Å²	90.4	14%	0.14	45%	0.445	C	S	.	.	H	α-helix	trans	-65.3	-37.8	172.8	176.7	-105	0	0	0	112.9	V97 R98 A101 N142 R144 S150 Y153	V97-F146 HydrophobicContact CG1-CB 3.93Å; V97-F146 HydrophobicContact CG1-CG 4.34Å; R98-F146 HydrophobicContact CB-CE2 3.93Å; R98-F146 HydrophobicContact CB-CZ 3.93Å; R98-F146 HydrophobicContact CG-CE2 4.22Å; R98-F146 HydrophobicContact CG-CZ 3.83Å; A101-F146 HydrophobicContact CB-CD1 3.84Å; A101-F146 HydrophobicContact CB-CE1 3.86Å; N142-F146 VanDerWaalsContact O-CB 3.3Å; N142-F146 WeakPolarHBondContact O-CB 3.23Å; N142-F146 PolarHBondContact O-N 3.29Å; R144-F146 VanDerWaalsContact C-N 3.28Å; R144-F146 PolarHBondContact O-N 3.27Å; F146-S150 PolarHBondContact O-N 3.36Å; F146-Y153 HydrophobicContact CB-CD2 4.34Å; F146-Y153 HydrophobicContact CB-CE2 4.13Å; F146-Y153 AromaticContact CD2-CD1 3.74Å; F146-Y153 HydrophobicContact CD2-CD1 3.74Å; F146-Y153 AromaticContact CD2-CD2 3.8Å; F146-Y153 HydrophobicContact CD2-CD2 3.8Å; F146-Y153 HydrophobicContact CD2-CE1 4.36Å; F146-Y153 HydrophobicContact CD2-CE2 4.38Å; F146-Y153 AromaticContact CD2-CG 3.46Å; F146-Y153 HydrophobicContact CD2-CG 3.46Å; F146-Y153 VanDerWaalsContact CD2-CG 3.46Å; F146-Y153 HydrophobicContact CE2-CD1 4.4Å; F146-Y153 HydrophobicContact CE2-CG 4.08Å
147	R	72.8	Confident	66.4	Low	137 Å²	137	98.6 Å²	98.6	52%	0.517	48%	0.482	S	S	.	.	H	α-helix	trans	-77.3	-28.9	177.8	-76.9	178.4	169.4	172.7	-1.7	113.2	D105 I143 R144	D105-R147 IonicContact OD1-CZ 2.75Å; D105-R147 IonicContact OD1-NH2 2.87Å; D105-R147 PolarHBondContact OD1-NH2 2.98Å; D105-R147 IonicContact OD2-NH2 2.71Å; D105-R147 PolarHBondContact OD2-NH2 3.35Å; I143-R147 WeakPolarHBondContact O-CB 3.22Å; I143-R147 WeakPolarHBondContact O-CG 3.49Å; I143-R147 PolarHBondContact O-N 3.05Å; I143-R147 VanDerWaalsContact O-N 3.13Å; R144-R147 CarbonylContact O-C 3.47Å; R144-R147 PolarHBondContact O-N 2.87Å
148	E	72.9	Confident	64.2	Low	132 Å²	132	96.3 Å²	96.3	62%	0.617	49%	0.489	S	S	*	.	H	α-helix	trans	-84.1	-37.9	176.7	-70	177.2	-164.4	0	0	111.7	R144	R144-E148 HydrophobicContact CG-CG 4.44Å; R144-E148 WeakPolarHBondContact CG-OE1 3.27Å; R144-E148 WeakPolarHBondContact O-CG 3.4Å; R144-E148 PolarHBondContact O-N 2.69Å
149	N	64.2	Low	61.8	Low	80 Å²	80	93.9 Å²	93.9	43%	0.428	50%	0.495	S	S	.	.			trans	-123.3	66.4	-176.4	-59.7	-56.8	0	0	0	112.3	D145 E151 N152	D145-N149 WeakPolarHBondContact O-CA 3.22Å; D145-N149 WeakPolarHBondContact O-CB 3.21Å; D145-N149 PolarHBondContact O-N 2.87Å; N149-E151 PolarHBondContact O-N 2.99Å; N149-E151 VanDerWaalsContact O-N 3.09Å; N149-N152 HydrophobicContact CB-CB 4.35Å; N149-N152 PolarHBondContact O-N 3.27Å; N149-N152 VanDerWaalsContact O-N 3.16Å
150	S	61.8	Low	59.6	Low	84 Å²	84	100.7 Å²	100.7	59%	0.587	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-57.2	-24.3	180	-177.5	0	0	0	0	114.4	F146	F146-S150 PolarHBondContact O-N 3.36Å
151	E	59.1	Low	57.4	Low	169 Å²	169	101.2 Å²	101.2	79%	0.79	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-75.5	-29.8	-179.2	-65.3	-177.1	156.2	0	0	112.7	N149 Y153 V154	N149-E151 PolarHBondContact O-N 2.99Å; N149-E151 VanDerWaalsContact O-N 3.09Å; E151-Y153 PolarHBondContact O-N 3.37Å; E151-Y153 VanDerWaalsContact O-N 3.13Å; E151-V154 PolarHBondContact O-N 3.36Å
152	N	59.2	Low	55.2	Low	124 Å²	124	105 Å²	105	66%	0.663	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-74.4	-2.2	-177.9	-71.1	-10.4	0	0	0	114	N149	N149-N152 HydrophobicContact CB-CB 4.35Å; N149-N152 PolarHBondContact O-N 3.27Å; N149-N152 VanDerWaalsContact O-N 3.16Å
153	Y	59.1	Low	53.3	Low	36 Å²	36	111.3 Å²	111.3	14%	0.141	59%	0.59	C	S	.	*	G	3₁₀ helix	trans	-121.4	21.2	-176.4	-76.6	-101.8	0	0	0	112.7	P94 V97 F146 E151	P94-Y153 HydrophobicContact CB-CD1 3.61Å; P94-Y153 HydrophobicContact CB-CE1 4.33Å; P94-Y153 HydrophobicContact CB-CG 4.3Å; P94-Y153 HydrophobicContact CG-CD1 4.44Å; V97-Y153 HydrophobicContact CB-CD1 4.31Å; V97-Y153 HydrophobicContact CB-CE1 3.71Å; V97-Y153 HydrophobicContact CG1-CE1 3.98Å; V97-Y153 HydrophobicContact CG2-CE1 3.87Å; F146-Y153 HydrophobicContact CB-CD2 4.34Å; F146-Y153 HydrophobicContact CB-CE2 4.13Å; F146-Y153 AromaticContact CD2-CD1 3.74Å; F146-Y153 HydrophobicContact CD2-CD1 3.74Å; F146-Y153 AromaticContact CD2-CD2 3.8Å; F146-Y153 HydrophobicContact CD2-CD2 3.8Å; F146-Y153 HydrophobicContact CD2-CE1 4.36Å; F146-Y153 HydrophobicContact CD2-CE2 4.38Å; F146-Y153 AromaticContact CD2-CG 3.46Å; F146-Y153 HydrophobicContact CD2-CG 3.46Å; F146-Y153 VanDerWaalsContact CD2-CG 3.46Å; F146-Y153 HydrophobicContact CE2-CD1 4.4Å; F146-Y153 HydrophobicContact CE2-CG 4.08Å; E151-Y153 PolarHBondContact O-N 3.37Å; E151-Y153 VanDerWaalsContact O-N 3.13Å
154	V	54.4	Low	51.3	Low	103 Å²	103	119.1 Å²	119.1	62%	0.624	63%	0.626	S	S	*	*			trans	-76.5	120.3	165.8	-180	0	0	0	0	108	E151 E156	E151-V154 PolarHBondContact O-N 3.36Å; V154-E156 PolarHBondContact O-N 3.41Å
155	D	53	Low	49.3	Very low	75 Å²	75	115.6 Å²	115.6	40%	0.401	63%	0.626	S	S	.	*			trans	-65.1	114.9	168.9	-65.2	-62.2	0	0	0	107.9	E157	D155-E157 PolarHBondContact O-N 3.43Å
156	E	39.7	Very low	47.5	Very low	188 Å²	188	119.1 Å²	119.1	88%	0.879	65%	0.645	S	S	*	*			trans	-63.4	104	170.7	-71.2	-173.7	155.4	0	0	108.9	V154 P158	V154-E156 PolarHBondContact O-N 3.41Å; E156-P158 WeakPolarHBondContact O-CD 3.25Å
157	E	34.2	Very low	45.8	Very low	183 Å²	183	124.8 Å²	124.8	86%	0.855	67%	0.671	S	S	*	*			trans	-65.8	123.5	169.1	-73.3	-156.9	153	0	0	109.1	D155 G159	D155-E157 PolarHBondContact O-N 3.43Å; E157-G159 PolarHBondContact O-N 2.91Å
158	P	34.9	Very low	44	Very low	119 Å²	119	125.5 Å²	125.5	77%	0.773	68%	0.681	S	S	*	*			trans	-68	103	171.8	27.5	-32.3	0	0	0	108.6	E156 I160	E156-P158 WeakPolarHBondContact O-CD 3.25Å; P158-I160 PolarHBondContact O-N 3.45Å
159	G	28.8	Very low	42	Very low	78 Å²	78	128 Å²	128	80%	0.804	69%	0.693	S	S	*	*			trans	-56.4	126.7	-174.9	0	0	0	0	0	113	E157	E157-G159 PolarHBondContact O-N 2.91Å
160	I	32.7	Very low	40.5	Very low	161 Å²	161	129.2 Å²	129.2	83%	0.826	71%	0.714	S	S	*	*			trans	-108.4	118.2	165.6	-62.6	176.8	0	0	0	106.4	P158	P158-I160 PolarHBondContact O-N 3.45Å
161	S	32.8	Very low	39.1	Very low	113 Å²	113	129.9 Å²	129.9	79%	0.79	72%	0.724	S	S	*	*			trans	-53.5	136.9	-172.9	48.2	0	0	0	0	114.7
162	D	30.6	Very low	38	Very low	139 Å²	139	127.6 Å²	127.6	74%	0.743	72%	0.724	S	S	*	*			trans	-65.5	135.4	-179.7	-51.5	-72.1	0	0	0	113
163	I	34.6	Very low	36.7	Very low	173 Å²	173	127.5 Å²	127.5	89%	0.887	73%	0.733	S	S	*	*			trans	-133.2	90	141.5	-57.5	-176.4	0	0	0	107.4
164	E	32.9	Very low	35.5	Very low	171 Å²	171	131.5 Å²	131.5	80%	0.799	76%	0.763	S	S	*	*			trans	-64.3	151.8	166.4	-57.5	-179.6	128.7	0	0	111.2
165	A	36	Very low	34.5	Very low	61 Å²	61	134.5 Å²	134.5	50%	0.504	77%	0.774	S	S	.	*				165.5	124.2	122.4	0	0	0	0	0	111.4
166	D	35.4	Very low	33.5	Very low	144 Å²	144	139.9 Å²	139.9	77%	0.77	79%	0.794	S	S	*	*			trans	65.2	141	147.7	-48.4	-26.2	0	0	0	118.3
167	E	33.7	Very low	33.1	Very low	150 Å²	150	137.3 Å²	137.3	70%	0.701	79%	0.791	S	S	*	*			cis	-159.6	137.3	0.2	-120.6	170.2	176.4	0	0	109.7
168	Q	33.7	Very low	32.9	Very low	153 Å²	153	134.4 Å²	134.4	72%	0.715	79%	0.791	S	S	*	*			trans	55.4	124.6	137.3	-66.3	172.1	21.8	0	0	123.6
169	E	31.3	Very low	32.9	Very low	185 Å²	185	132 Å²	132	86%	0.864	79%	0.788	S	S	*	*			trans	52.6	103.5	133.2	-56.6	-167.4	153.6	0	0	121.5
170	A	32.6	Very low	33.1	Very low	105 Å²	105	134.9 Å²	134.9	87%	0.868	79%	0.79	S	S	*	*				-165.3	119.1	119.4	0	0	0	0	0	111.4
171	A	32.4	Very low	33	Very low	97 Å²	97	133.9 Å²	133.9	80%	0.802	79%	0.785	S	S	*	*			trans	-97.8	-169.4	175.9	0	0	0	0	0	110.8
172	P	37.3	Very low	33.2	Very low	122 Å²	122	134.2 Å²	134.2	79%	0.792	79%	0.785	S	S	*	*				-124.2	178.7	-116.3	34.5	-14.6	0	0	0	114.3
173	S	31.3	Very low	33.1	Very low	121 Å²	121	132.7 Å²	132.7	85%	0.846	78%	0.78	S	S	*	*			trans	-165.8	146.5	149.9	21.4	0	0	0	0	114.4
174	P	32.5	Very low	33.1	Very low	120 Å²	120	129.8 Å²	129.8	78%	0.779	78%	0.776	S	S	*	*			trans	-115.1	154.9	-177	40.5	-31.5	0	0	0	114.9
175	I	34.8	Very low	33.1	Very low	167 Å²	167	128.1 Å²	128.1	86%	0.856	78%	0.777	S	S	*	*			trans	-141.6	120.4	165.9	-53	178.2	0	0	0	107
176	K	31.1	Very low	32.9	Very low	188 Å²	188	131.3 Å²	131.3	82%	0.817	79%	0.79	S	S	*	*			cis	89.8	111.3	46	-99.3	-167.2	177.5	179.4	0	116.3
177	V	30.9	Very low	32.7	Very low	134 Å²	134	134.2 Å²	134.2	81%	0.812	80%	0.796	S	S	*	*			trans	71.7	146.6	146.9	-113.3	0	0	0	0	124
178	S	31.2	Very low	32.5	Very low	122 Å²	122	136 Å²	136	85%	0.853	80%	0.801	S	S	*	*			trans	79	132.8	157.4	-149	0	0	0	0	116.5
179	G	34.7	Very low	32.2	Very low	69 Å²	69	133 Å²	133	71%	0.711	80%	0.798	S	S	*	*			cis	-176	-173	1.3	0	0	0	0	0	108.7
180	T	32.7	Very low	32.3	Very low	138 Å²	138	131.4 Å²	131.4	85%	0.847	80%	0.8	S	S	*	*			cis	-158.9	176.7	-3	-41.2	0	0	0	0	108.3
181	L	31.3	Very low	32	Very low	140 Å²	140	138 Å²	138	73%	0.733	80%	0.803	S	S	*	*			trans	-94	170.1	174.4	-63	99.6	0	0	0	113.7	T183	L181-T183 HydrophobicContact CB-CG2 4.19Å; L181-T183 HydrophobicContact CD2-CG2 4.46Å
182	P	36.3	Very low	32	Very low	120 Å²	120	143.4 Å²	143.4	78%	0.779	81%	0.808	S	S	*	*				-137.6	133	96.9	35.1	-22	0	0	0	113
183	T	29.6	Very low	31.5	Very low	106 Å²	106	142.1 Å²	142.1	65%	0.65	80%	0.802	S	S	*	*				79.1	115	57.1	61.1	0	0	0	0	118	L181	L181-T183 HydrophobicContact CB-CG2 4.19Å; L181-T183 HydrophobicContact CD2-CG2 4.46Å
184	S	32.8	Very low	31.7	Very low	113 Å²	113	143.6 Å²	143.6	79%	0.79	80%	0.799	S	S	*	*			trans	71.9	150.2	155.8	75.9	0	0	0	0	117.5
185	T	33.6	Very low	31.5	Very low	136 Å²	136	141.9 Å²	141.9	83%	0.834	80%	0.795	S	S	*	*			cis	-141	168.6	33.1	47.6	0	0	0	0	116.5
186	V	31.1	Very low	31.3	Very low	127 Å²	127	139.6 Å²	139.6	77%	0.77	79%	0.794	S	S	*	*			trans	-110.8	148.6	-170.6	172.1	0	0	0	0	113
187	K	32.9	Very low	31.2	Very low	205 Å²	205	137.4 Å²	137.4	89%	0.891	79%	0.791	S	S	*	*			trans	161.9	121.8	142.5	-88.4	155.2	-174	-179.1	0	108.5
188	K	28.1	Very low	31.4	Very low	188 Å²	188	136.4 Å²	136.4	82%	0.817	79%	0.79	S	S	*	*			cis	94.9	94.5	34.8	-157.2	-168	-179.2	-177.2	0	114.8
189	S	27.9	Very low	31.4	Very low	91 Å²	91	138.5 Å²	138.5	64%	0.636	79%	0.786	S	S	*	*			trans	51.6	127.1	148.2	69.2	0	0	0	0	122.5
190	T	32.4	Very low	31.6	Very low	150 Å²	150	142.4 Å²	142.4	92%	0.92	79%	0.791	S	S	*	*				-168.5	158.9	111.6	17.5	0	0	0	0	113.3
191	R	27	Very low	31.7	Very low	244 Å²	244	142.4 Å²	142.4	92%	0.921	79%	0.785	S	S	*	*			trans	-90.5	146.9	174.9	-69.6	168.7	162.4	160.8	-8.8	111.8
192	K	32.1	Very low	32.2	Very low	210 Å²	210	142.5 Å²	142.5	91%	0.913	79%	0.787	S	S	*	*				-172.7	169.5	121.8	-111.6	-179.1	176.4	-174.7	0	113.9
193	S	28.2	Very low	32.3	Very low	95 Å²	95	143.6 Å²	143.6	66%	0.664	79%	0.786	S	S	*	*			trans	-100.7	-177.2	-165	51.5	0	0	0	0	114.8
194	I	33.7	Very low	32.7	Very low	153 Å²	153	145.5 Å²	145.5	79%	0.785	79%	0.792	S	S	*	*			trans	94.7	112.6	172.6	-56.1	157.8	0	0	0	110.8
195	A	28.3	Very low	32.9	Very low	84 Å²	84	148.1 Å²	148.1	69%	0.694	79%	0.794	S	S	*	*			cis	95.3	147.1	34.6	0	0	0	0	0	113.8
196	S	31.1	Very low	33	Very low	118 Å²	118	149.2 Å²	149.2	83%	0.825	80%	0.795	S	S	*	*			trans	61.7	155.7	-177.3	55.4	0	0	0	0	117.4
197	D	29.7	Very low	33.3	Very low	143 Å²	143	149.3 Å²	149.3	77%	0.765	79%	0.791	S	S	*	*			cis	-179.2	138.8	-29.7	-159.6	4.2	0	0	0	105.9
198	S	34.9	Very low	33.5	Very low	113 Å²	113	144.7 Å²	144.7	79%	0.79	78%	0.784	S	S	*	*			trans	-178.1	125.7	165.1	55.8	0	0	0	0	111.3
199	E	31.5	Very low	33.9	Very low	166 Å²	166	142.1 Å²	142.1	78%	0.776	78%	0.78	S	S	*	*			trans	-83.6	-155.5	179.4	-62.5	160.7	135.8	0	0	111.2
200	D	38.3	Very low	34.3	Very low	150 Å²	150	141.9 Å²	141.9	80%	0.802	78%	0.778	S	S	*	*			trans	88	130.4	175.4	-46.4	-13	0	0	0	114.8
201	D	36.2	Very low	34.3	Very low	138 Å²	138	142 Å²	142	74%	0.738	77%	0.773	S	S	*	*			cis	172.3	-176.2	-29.1	-110.3	-16.4	0	0	0	103.9
202	D	41.1	Very low	34.7	Very low	143 Å²	143	137.2 Å²	137.2	77%	0.765	77%	0.766	S	S	*	*			trans	72.8	134.5	170.4	-47.4	-19	0	0	0	117.1
203	D	38.9	Very low	34.9	Very low	142 Å²	142	137.4 Å²	137.4	76%	0.759	77%	0.767	S	S	*	*			cis	-165	174.3	-26.1	-120.1	-9.4	0	0	0	108.8
204	D	36.6	Very low	35.3	Very low	146 Å²	146	137.2 Å²	137.2	78%	0.781	77%	0.766	S	S	*	*			trans	-40.3	155.4	174	-63.2	-49.1	0	0	0	116.7
205	M	38.4	Very low	35.3	Very low	169 Å²	169	135.5 Å²	135.5	83%	0.833	76%	0.758	S	S	*	*			trans	-161.3	115.2	130.8	-85	-114.6	171.7	0	0	111.4
206	D	34.5	Very low	35.8	Very low	158 Å²	158	139.1 Å²	139.1	85%	0.845	77%	0.766	S	S	*	*			trans	-97.4	117.8	165.6	176.8	30.7	0	0	0	106.6
207	D	38.3	Very low	36.1	Very low	129 Å²	129	140.8 Å²	140.8	69%	0.69	77%	0.766	S	S	*	*			trans	-135.1	120	-179.5	-102.9	-31.6	0	0	0	112.4
208	S	36.5	Very low	36.3	Very low	108 Å²	108	142.2 Å²	142.2	76%	0.755	77%	0.773	S	S	*	*			trans	-115.4	90.7	179.2	158.5	0	0	0	0	109.2
209	D	37.3	Very low	36.4	Very low	135 Å²	135	141.4 Å²	141.4	72%	0.722	77%	0.768	S	S	*	*			trans	-124.5	125.8	165.3	-88.9	-37.7	0	0	0	109.2
210	S	36.3	Very low	36.4	Very low	86 Å²	86	138.3 Å²	138.3	60%	0.601	76%	0.764	S	S	*	*			cis	77.8	115.4	42.2	108.3	0	0	0	0	113.5
211	D	31.8	Very low	36.1	Very low	152 Å²	152	137 Å²	137	81%	0.813	77%	0.767	S	S	*	*			trans	69.4	132.1	160.5	-63.1	-11.2	0	0	0	123.7
212	D	35.3	Very low	36	Very low	143 Å²	143	137.2 Å²	137.2	77%	0.765	77%	0.773	S	S	*	*			trans	66.7	91.3	137.8	-149.6	31.8	0	0	0	120.3
213	F	36.4	Very low	35.6	Very low	214 Å²	214	135.7 Å²	135.7	94%	0.939	77%	0.774	S	S	*	*			trans	-98.1	105.1	154.2	-75.7	-73.4	0	0	0	110.3
214	S	37.1	Very low	35.3	Very low	92 Å²	92	134.3 Å²	134.3	64%	0.643	78%	0.775	S	S	*	*			trans	-71.9	140	165.4	43.5	0	0	0	0	110.8	D216	S214-D216 PolarHBondContact O-N 3.42Å
215	D	33.8	Very low	35.3	Very low	116 Å²	116	134 Å²	134	62%	0.62	77%	0.772	S	S	*	*			trans	-63.7	121.6	167.7	-78.3	-45.4	0	0	0	108.1	R686	D215-R686 IonicContact OD1-NH1 3.92Å; D215-R686 IonicContact OD2-CZ 3.82Å; D215-R686 VanDerWaalsContact OD2-CZ 3.3Å; D215-R686 IonicContact OD2-NH1 2.83Å; D215-R686 PolarHBondContact OD2-NH1 3.4Å; D215-R686 IonicContact OD2-NH2 2.68Å; D215-R686 PolarHBondContact OD2-NH2 3.21Å
216	D	37.6	Very low	35.2	Very low	161 Å²	161	133.6 Å²	133.6	86%	0.861	77%	0.773	S	S	*	*			trans	-120.2	117.4	158.9	-111	-24.6	0	0	0	108.3	S214	S214-D216 PolarHBondContact O-N 3.42Å
217	D	38.3	Very low	35.2	Very low	153 Å²	153	132.3 Å²	132.3	82%	0.818	77%	0.765	S	S	*	*			trans	-75.3	131.7	-179.3	-80.1	-58.6	0	0	0	111
218	D	33.8	Very low	35	Very low	173 Å²	173	132.9 Å²	132.9	93%	0.925	77%	0.768	S	S	*	*			trans	-122.6	101.4	155.6	-125.5	-23.5	0	0	0	109.8
219	S	35.4	Very low	35.1	Very low	96 Å²	96	136.1 Å²	136.1	67%	0.671	78%	0.776	S	S	*	*			trans	-100.1	133.5	-172.9	-179.4	0	0	0	0	111.8
220	S	32.8	Very low	35.4	Very low	100 Å²	100	136.9 Å²	136.9	70%	0.699	78%	0.78	S	S	*	*			trans	70.1	113.2	162.6	76.2	0	0	0	0	118.1
221	S	32.4	Very low	35.5	Very low	122 Å²	122	144 Å²	144	85%	0.853	79%	0.794	S	S	*	*			trans	-144.3	97.8	141.4	-86.3	0	0	0	0	109.4	S223	S221-S223 PolarHBondContact O-N 3.18Å
222	T	32.8	Very low	35.8	Very low	143 Å²	143	143.1 Å²	143.1	88%	0.877	80%	0.798	S	S	*	*			trans	-64	123	172.8	50.5	0	0	0	0	110.1
223	S	32.8	Very low	36.1	Very low	112 Å²	112	145.1 Å²	145.1	78%	0.783	80%	0.8	S	S	*	*			trans	-126.8	96.9	159.4	49.1	0	0	0	0	109.9	S221 I225	S221-S223 PolarHBondContact O-N 3.18Å; S223-I225 PolarHBondContact O-N 2.94Å
224	S	33.5	Very low	36.4	Very low	113 Å²	113	140.2 Å²	140.2	79%	0.79	78%	0.784	S	S	*	*			trans	-63.8	120.3	164.1	48.8	0	0	0	0	108.8
225	I	35.3	Very low	36.9	Very low	138 Å²	138	141.7 Å²	141.7	71%	0.708	79%	0.791	S	S	*	*			trans	-120.1	94.1	170.8	-151.5	164.6	0	0	0	109.7	S223 I227	S223-I225 PolarHBondContact O-N 2.94Å; I225-I227 HydrophobicContact CD1-CD1 4.23Å; I225-I227 HydrophobicContact CG1-CD1 4.12Å; I225-I227 HydrophobicContact CG1-CG1 3.97Å; I225-I227 HydrophobicContact CG2-CD1 3.96Å; I225-I227 HydrophobicContact CG2-CG1 4.22Å; I225-I227 PolarHBondContact O-N 3.26Å
226	D	36.7	Very low	38.2	Very low	161 Å²	161	140.1 Å²	140.1	86%	0.861	79%	0.789	S	S	*	*			trans	-65.8	97.4	168.3	-73.6	-52	0	0	0	108.8
227	I	35.6	Very low	39.1	Very low	131 Å²	131	137.3 Å²	137.3	67%	0.672	78%	0.778	S	S	*	*			trans	-107.4	110.3	171.3	-60.2	174.2	0	0	0	108.1	I225 L229	I225-I227 HydrophobicContact CD1-CD1 4.23Å; I225-I227 HydrophobicContact CG1-CD1 4.12Å; I225-I227 HydrophobicContact CG1-CG1 3.97Å; I225-I227 HydrophobicContact CG2-CD1 3.96Å; I225-I227 HydrophobicContact CG2-CG1 4.22Å; I225-I227 PolarHBondContact O-N 3.26Å; I227-L229 PolarHBondContact O-N 2.94Å
228	N	34.3	Very low	39.6	Very low	141 Å²	141	140.7 Å²	140.7	75%	0.754	78%	0.78	S	S	*	*			trans	-40.8	108.6	179.8	-79.1	-74.7	0	0	0	113.1	D230	N228-D230 PolarHBondContact O-N 3.02Å
229	L	38.1	Very low	40.2	Very low	176 Å²	176	141.6 Å²	141.6	92%	0.921	78%	0.777	S	S	*	*	S	Bend	trans	-76.9	52.8	174.4	-166.8	69.6	0	0	0	111.4	I227	I227-L229 PolarHBondContact O-N 2.94Å
230	D	43.8	Very low	40.7	Very low	151 Å²	151	144.1 Å²	144.1	81%	0.807	78%	0.782	S	S	*	*			trans	-138.2	21.3	-174	-139.3	2.8	0	0	0	112.3	N228	N228-D230 PolarHBondContact O-N 3.02Å
231	R	37.9	Very low	40.9	Very low	235 Å²	235	149.1 Å²	149.1	89%	0.887	79%	0.791	S	S	*	*			trans	-131.7	-0.6	-176.7	-95.1	-171.8	172.4	-161.1	-2.5	117.4	K233	R231-K233 VanDerWaalsContact C-N 3.34Å; R231-K233 PolarHBondContact O-N 2.8Å; R231-K233 VanDerWaalsContact O-N 3.14Å
232	C	37.9	Very low	41.2	Very low	134 Å²	134	148.5 Å²	148.5	91%	0.905	79%	0.787	S	S	*	*			trans	-87.5	72.6	171.7	-70.6	0	0	0	0	111.4
233	K	41.7	Very low	41.4	Very low	185 Å²	185	148.3 Å²	148.3	80%	0.804	79%	0.786	S	S	*	*			trans	-107.3	127.7	161.2	-78.2	-178	176.5	173.8	0	109.3	R231	R231-K233 VanDerWaalsContact C-N 3.34Å; R231-K233 PolarHBondContact O-N 2.8Å; R231-K233 VanDerWaalsContact O-N 3.14Å
234	D	43.6	Very low	41.5	Very low	111 Å²	111	148 Å²	148	59%	0.594	78%	0.783	S	S	*	*			trans	52.7	102.8	164.4	-61.4	-32.1	0	0	0	118.4	S236 V237	D234-S236 PolarHBondContact O-N 3.5Å; D234-V237 HydrophobicContact CB-CG2 4.17Å; D234-V237 PolarHBondContact O-N 3.38Å
235	P	48	Very low	41.6	Very low	124 Å²	124	150.1 Å²	150.1	81%	0.805	79%	0.786	S	S	*	*	G	3₁₀ helix	trans	-59	-10.7	165.4	-23.5	34.6	0	0	0	114.9	V237	P235-V237 VanDerWaalsContact C-N 3.29Å; P235-V237 PolarHBondContact O-N 3.46Å
236	S	61.2	Low	41.7	Very low	82 Å²	82	148.8 Å²	148.8	57%	0.573	78%	0.78	S	S	*	*	G	3₁₀ helix	trans	-72.5	-15.6	-178.2	61.6	0	0	0	0	114.4	D234	D234-S236 PolarHBondContact O-N 3.5Å
237	V	55.6	Low	41.8	Very low	102 Å²	102	149.5 Å²	149.5	62%	0.618	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-82	-21.2	-172.1	-169.7	0	0	0	0	113.1	D234 P235 F239	D234-V237 HydrophobicContact CB-CG2 4.17Å; D234-V237 PolarHBondContact O-N 3.38Å; P235-V237 VanDerWaalsContact C-N 3.29Å; P235-V237 PolarHBondContact O-N 3.46Å; V237-F239 PolarHBondContact O-N 3.22Å
238	Y	49.5	Very low	41.8	Very low	224 Å²	224	152.7 Å²	152.7	88%	0.878	79%	0.785	S	S	*	*	G	3₁₀ helix	trans	-80.5	-14.3	-173.3	-104.6	-87.8	0	0	0	115.8
239	F	45.3	Very low	41.9	Very low	193 Å²	193	152.4 Å²	152.4	85%	0.846	78%	0.783	S	S	*	*	G	3₁₀ helix	trans	-97.1	-7.2	-177.5	-79.8	-82.5	0	0	0	114.7	V237	V237-F239 PolarHBondContact O-N 3.22Å
240	L	46.2	Very low	41.9	Very low	148 Å²	148	154.3 Å²	154.3	78%	0.775	78%	0.784	S	S	*	*			trans	-98.6	98.3	-179.3	-83.4	161.8	0	0	0	111.9	S242	L240-S242 PolarHBondContact O-N 2.86Å
241	K	37.5	Very low	41.6	Very low	205 Å²	205	152.1 Å²	152.1	89%	0.891	78%	0.776	S	S	*	*			trans	-73	86.7	177.6	-148.6	177.9	-165.1	176.9	0	110.7	T243	K241-T243 PolarHBondContact O-N 3.39Å
242	S	37.6	Very low	41.5	Very low	110 Å²	110	150.6 Å²	150.6	77%	0.769	78%	0.776	S	S	*	*			trans	-65.1	126.9	172.6	71.5	0	0	0	0	110.7	L240	L240-S242 PolarHBondContact O-N 2.86Å
243	T	36.4	Very low	41.6	Very low	139 Å²	139	152.6 Å²	152.6	85%	0.853	78%	0.776	S	S	*	*			trans	-124.1	107.3	152.2	39.2	0	0	0	0	106.3	K241	K241-T243 PolarHBondContact O-N 3.39Å
244	S	35.5	Very low	41.4	Very low	104 Å²	104	153.4 Å²	153.4	73%	0.727	78%	0.779	S	S	*	*			trans	-80.6	125.1	169.5	48.4	0	0	0	0	108.4
245	D	35.9	Very low	41	Very low	159 Å²	159	157.5 Å²	157.5	85%	0.85	79%	0.792	S	S	*	*			trans	-150.2	131.8	144.5	-103.4	-27.2	0	0	0	113
246	D	37.9	Very low	40.4	Very low	110 Å²	110	160.3 Å²	160.3	59%	0.588	80%	0.798	S	S	*	*			trans	22.1	114.5	164	-79.6	-33	0	0	0	124
247	K	38.2	Very low	39.2	Very low	176 Å²	176	160.6 Å²	160.6	77%	0.765	81%	0.805	S	S	*	*				39.5	93.6	113.5	-57.2	-179.7	-165.3	104.2	0	117.4
248	K	36.7	Very low	38.2	Very low	198 Å²	198	165.4 Å²	165.4	86%	0.861	82%	0.818	S	S	*	*				-170.1	164.4	119.9	-103.5	154.4	-173.2	175.6	0	113.3
249	D	35.3	Very low	37.5	Very low	135 Å²	135	162.8 Å²	162.8	72%	0.722	82%	0.819	S	S	*	*			trans	68.8	68.1	161.7	-55.4	-11.8	0	0	0	118.9	T251	D249-T251 PolarHBondContact O-N 3.18Å
250	K	37.6	Very low	36.9	Very low	215 Å²	215	164.8 Å²	164.8	94%	0.935	82%	0.821	S	S	*	*			trans	-60.9	64.4	150.8	-73.5	179.1	170.3	175.7	0	112.7
251	T	38	Very low	36.4	Very low	106 Å²	106	162.6 Å²	162.6	65%	0.65	82%	0.818	S	S	*	*			trans	-151.6	83.6	170.3	41.7	0	0	0	0	112.2	D249	D249-T251 PolarHBondContact O-N 3.18Å
252	K	34.8	Very low	36.3	Very low	202 Å²	202	159.4 Å²	159.4	88%	0.878	82%	0.816	S	S	*	*	S	Bend	trans	-171.9	-18.7	153.3	-105.5	154.2	-171.3	-177.4	0	115.9	K254	K252-K254 PolarHBondContact O-N 3.07Å
253	I	41.4	Very low	36.1	Very low	177 Å²	177	164.2 Å²	164.2	91%	0.908	82%	0.823	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	48.6	-179	-53.3	163.8	0	0	0	112
254	K	36.8	Very low	36	Very low	201 Å²	201	165.8 Å²	165.8	87%	0.874	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.9	26	179.6	-112.5	-173.9	-172.5	-174.3	0	115.7	K252	K252-K254 PolarHBondContact O-N 3.07Å
255	K	35.2	Very low	35.9	Very low	198 Å²	198	168.9 Å²	168.9	86%	0.861	82%	0.821	S	S	*	*	S	Bend	trans	-134.8	12.8	-179.1	-97.4	-164	173.6	-166.9	0	117.4
256	I	36.5	Very low	35.7	Very low	182 Å²	182	169.5 Å²	169.5	93%	0.933	82%	0.824	S	S	*	*	S	Bend	trans	-111.1	3.5	174.5	-62.2	176	0	0	0	112
257	A	34.5	Very low	35.5	Very low	88 Å²	88	175.7 Å²	175.7	73%	0.727	84%	0.839	S	S	*	*	S	Bend	trans	-122.5	131.2	168.9	0	0	0	0	0	109.7
258	K	35.3	Very low	35.2	Very low	204 Å²	204	172.2 Å²	172.2	89%	0.887	84%	0.843	S	S	*	*			trans	84.2	70.1	173.4	-155.2	178.1	-169.2	174.4	0	116.9
259	D	34.4	Very low	35	Very low	169 Å²	169	167.9 Å²	167.9	90%	0.904	84%	0.837	S	S	*	*			trans	-152.7	147.3	136.5	-110.3	-32	0	0	0	112.5
260	R	32.3	Very low	35	Very low	234 Å²	234	166.1 Å²	166.1	88%	0.883	84%	0.836	S	S	*	*			trans	85.1	58.9	-171.1	-62.8	-171.2	171.2	-179.1	0.9	117.9
261	S	36.6	Very low	34.8	Very low	103 Å²	103	163 Å²	163	72%	0.72	83%	0.829	S	S	*	*			trans	-92	158.7	134.1	59.8	0	0	0	0	109.5
262	T	34.4	Very low	34.7	Very low	138 Å²	138	165 Å²	165	85%	0.847	83%	0.834	S	S	*	*			trans	74.2	66.8	171.6	68.8	0	0	0	0	119.8
263	K	34.9	Very low	34.9	Very low	210 Å²	210	164 Å²	164	91%	0.913	83%	0.833	S	S	*	*			trans	-128.5	74.4	138	-154	177	-171.3	179.6	0	107.2
264	K	33.9	Very low	34.5	Very low	173 Å²	173	163.8 Å²	163.8	75%	0.752	83%	0.833	S	S	*	*				69.2	90.2	88.6	-165.2	179.9	-172.1	-179.2	0	111.8
265	Q	32.8	Very low	34.5	Very low	168 Å²	168	157.6 Å²	157.6	79%	0.785	83%	0.827	S	S	*	*			trans	41.5	104.2	145.9	-63.8	169.4	-46.5	0	0	117.8
266	L	32.9	Very low	34.7	Very low	172 Å²	172	154.5 Å²	154.5	90%	0.901	83%	0.825	S	S	*	*				-172.9	148.3	129.4	-100.1	151.7	0	0	0	109.5
267	R	32.6	Very low	35.1	Very low	241 Å²	241	157.9 Å²	157.9	91%	0.909	83%	0.826	S	S	*	*			trans	71.4	68.6	178.4	-55.5	-177.9	178.7	-175.3	-1.4	116.2
268	A	31.5	Very low	36	Very low	103 Å²	103	158 Å²	158	85%	0.851	82%	0.818	S	S	*	*			trans	-105.5	117.6	144.2	0	0	0	0	0	108.1
269	S	34	Very low	37	Very low	106 Å²	106	153.2 Å²	153.2	74%	0.741	81%	0.806	S	S	*	*			trans	-177.2	139.6	164.3	52.4	0	0	0	0	110.2
270	S	34.7	Very low	38.1	Very low	99 Å²	99	150.5 Å²	150.5	69%	0.692	79%	0.79	S	S	*	*			trans	61.5	84.7	173.1	65.6	0	0	0	0	117.8
271	D	32.8	Very low	39.3	Very low	148 Å²	148	142.7 Å²	142.7	79%	0.791	77%	0.766	S	S	*	*				36.8	132.9	114.6	-40.2	-36.3	0	0	0	119.8
272	I	36.4	Very low	40.5	Very low	149 Å²	149	141.2 Å²	141.2	76%	0.764	76%	0.755	S	S	*	*				168.4	126.4	116.8	-86	157.2	0	0	0	111.8
273	E	38.5	Very low	41.5	Very low	181 Å²	181	141 Å²	141	85%	0.846	74%	0.74	S	S	*	*			trans	61	137.5	153.7	-70.5	161.2	-171.9	0	0	123.1	G275	E273-G275 PolarHBondContact O-N 2.9Å
274	D	32.5	Very low	42.3	Very low	172 Å²	172	134 Å²	134	92%	0.92	73%	0.727	S	S	*	*			trans	-68.4	101.4	-177.6	-67.8	-68.5	0	0	0	113
275	G	37.8	Very low	43.2	Very low	71 Å²	71	134.6 Å²	134.6	73%	0.732	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-91.1	116.2	171.8	0	0	0	0	0	113	E273 W277	E273-G275 PolarHBondContact O-N 2.9Å; G275-W277 PolarHBondContact O-N 3.36Å
276	T	38.8	Very low	44.1	Very low	133 Å²	133	131 Å²	131	82%	0.816	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-49.9	130	173.9	-47.1	0	0	0	0	112.2	T278	T276-T278 PolarHBondContact O-N 2.74Å
277	W	44.6	Very low	44.9	Very low	253 Å²	253	128.4 Å²	128.4	96%	0.958	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-56.2	122.3	176.6	-69.4	90.3	0	0	0	111.2	G275	G275-W277 PolarHBondContact O-N 3.36Å
278	T	53.8	Low	45.8	Very low	91 Å²	91	124.6 Å²	124.6	56%	0.558	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-99.4	140.2	172.6	43.8	0	0	0	0	110.2	T276 I280	T276-T278 PolarHBondContact O-N 2.74Å; T278-I280 PolarHBondContact O-N 2.62Å
279	T	57.1	Low	47.1	Very low	104 Å²	104	126.5 Å²	126.5	64%	0.638	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-69.1	124.9	169.1	36.2	0	0	0	0	109.2	E287	T279-E287 PolarHBondContact OG1-OE2 3.02Å
280	I	58	Low	48.5	Very low	112 Å²	112	124.4 Å²	124.4	57%	0.574	67%	0.669	S	S	*	*	B	Isolated β-bridge	trans	-105.1	127.4	-177.8	-61.1	170.3	0	0	0	107.1	T278 G284	T278-I280 PolarHBondContact O-N 2.62Å; I280-G284 VanDerWaalsContact CG2-C 3.41Å
281	D	55.5	Low	49.9	Very low	70 Å²	70	124.3 Å²	124.3	37%	0.374	66%	0.658	S	S	.	*			trans	-65.6	164.4	177	-136.6	-19.9	0	0	0	110.3	K36 Y283 G284 R285	K36-D281 IonicContact NZ-OD1 3.69Å; K36-D281 PolarHBondContact NZ-OD1 2.77Å; D281-Y283 PolarHBondContact O-N 3.14Å; D281-G284 PolarHBondContact O-N 2.73Å; D281-R285 PolarHBondContact N-O 2.79Å
282	S	63.1	Low	51.4	Low	71 Å²	71	117.5 Å²	117.5	50%	0.497	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.3	6.7	-175.5	50	0	0	0	0	115.6	K36	K36-S282 WeakPolarHBondContact CD-OG 3.4Å; K36-S282 PolarHBondContact NZ-OG 3.2Å
283	Y	55.5	Low	53	Low	135 Å²	135	111.5 Å²	111.5	53%	0.529	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-118.2	14.6	176.3	-65.5	-73.4	0	0	0	113.9	I38 D281 R285	I38-Y283 HydrophobicContact CD1-CE1 4.37Å; I38-Y283 WeakPolarHBondContact CD1-OH 3.41Å; I38-Y283 HydrophobicContact CG1-CE2 4.46Å; I38-Y283 WeakPolarHBondContact CG1-OH 3.31Å; D281-Y283 PolarHBondContact O-N 3.14Å; Y283-R285 PolarHBondContact O-N 3.03Å
284	G	50.9	Low	54.4	Low	62 Å²	62	110.5 Å²	110.5	64%	0.639	59%	0.585	S	S	*	*	S	Bend	trans	73	11.3	179.5	0	0	0	0	0	114.1	I280 D281	I280-G284 VanDerWaalsContact CG2-C 3.41Å; D281-G284 PolarHBondContact O-N 2.73Å
285	R	53.8	Low	55.7	Low	185 Å²	185	111.2 Å²	111.2	70%	0.698	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-98.9	139.2	-179.5	-62.3	-177.9	-175.6	-169.3	-1.5	109.6	D281 Y283 E287	D281-R285 PolarHBondContact N-O 2.79Å; Y283-R285 PolarHBondContact O-N 3.03Å; R285-E287 PolarHBondContact O-N 3.29Å
286	P	51.4	Low	56.7	Low	92 Å²	92	111.7 Å²	111.7	60%	0.597	59%	0.585	S	S	*	*	B	Isolated β-bridge	trans	-59.7	137.9	166.4	27.7	-33.5	0	0	0	108.7	I288	P286-I288 PolarHBondContact O-N 3.49Å
287	E	48.9	Very low	58.2	Low	118 Å²	118	109.5 Å²	109.5	55%	0.551	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-52.5	131.7	176.2	-154.4	165.6	-171.2	0	0	109.5	T279 R285 Q289	T279-E287 PolarHBondContact OG1-OE2 3.02Å; R285-E287 PolarHBondContact O-N 3.29Å; E287-Q289 VanDerWaalsContact C-N 3.33Å; E287-Q289 PolarHBondContact O-N 3.44Å
288	I	53.2	Low	59.1	Low	162 Å²	162	104.8 Å²	104.8	83%	0.831	55%	0.554	S	S	*	*			trans	-71.2	92.4	-172.6	-58.3	174	0	0	0	108.8	P286 V290	P286-I288 PolarHBondContact O-N 3.49Å; I288-V290 PolarHBondContact O-N 2.98Å
289	Q	57.8	Low	59.9	Low	142 Å²	142	102.3 Å²	102.3	66%	0.664	54%	0.537	S	S	*	.			trans	-58.4	122.4	170.5	-66.7	-179.2	-4.4	0	0	108.8	E287 Q291	E287-Q289 VanDerWaalsContact C-N 3.33Å; E287-Q289 PolarHBondContact O-N 3.44Å; Q289-Q291 PolarHBondContact O-N 2.96Å
290	V	62.9	Low	60.5	Low	62 Å²	62	101.7 Å²	101.7	38%	0.376	53%	0.53	S	S	.	.			trans	-63.3	117.1	175.9	-178.8	0	0	0	0	108	I288 L328 Q331	I288-V290 PolarHBondContact O-N 2.98Å; V290-L328 HydrophobicContact CG1-CD1 4.11Å; V290-L328 HydrophobicContact CG1-CD2 3.77Å; V290-L328 HydrophobicContact CG1-CG 3.9Å; V290-Q331 PolarHBondContact O-NE2 3.14Å; V290-Q331 PolarHBondContact O-OE1 3.42Å
291	Q	64.9	Low	61.2	Low	98 Å²	98	99 Å²	99	46%	0.458	52%	0.515	S	S	.	.			trans	-108.2	130.2	-179.2	-72.1	-177.5	-6.2	0	0	110.3	Q289 F293	Q289-Q291 PolarHBondContact O-N 2.96Å; Q291-F293 VanDerWaalsContact C-N 3.34Å
292	A	63.2	Low	62.3	Low	4 Å²	4	99.8 Å²	99.8	3%	0.033	52%	0.518	C	S	.	.	S	Bend	trans	-71.7	-27.8	-176.2	0	0	0	0	0	113.7	K307 L328 Q331 V332	A292-K307 VanDerWaalsContact O-CD 3.27Å; A292-K307 WeakPolarHBondContact O-CD 3.39Å; A292-K307 WeakPolarHBondContact O-CE 3.23Å; A292-L328 VanDerWaalsContact CA-CD2 3.41Å; A292-L328 HydrophobicContact CB-CD2 3.61Å; A292-Q331 HydrophobicContact CB-CB 4.1Å; A292-V332 HydrophobicContact CB-CG2 4.05Å
293	F	70.6	Confident	63.2	Low	24 Å²	24	97.8 Å²	97.8	11%	0.105	50%	0.503	C	S	.	.	S	Bend	trans	-124.7	143.7	-179.5	-57	-80.4	0	0	0	109.8	Q291 V303 V304 K307 V332 K335	Q291-F293 VanDerWaalsContact C-N 3.34Å; F293-V303 HydrophobicContact CE1-CG1 4.39Å; F293-V304 HydrophobicContact CE1-CG2 4.27Å; F293-V304 HydrophobicContact CZ-CG2 4.17Å; F293-K307 HydrophobicContact CE1-CB 4.3Å; F293-K307 HydrophobicContact CE1-CG 4.42Å; F293-V332 HydrophobicContact CE2-CG2 4.03Å; F293-V332 HydrophobicContact CZ-CG2 3.99Å; F293-K335 HydrophobicContact CD2-CG 3.89Å; F293-K335 HydrophobicContact CE2-CB 3.88Å; F293-K335 HydrophobicContact CE2-CG 3.71Å
294	E	68.4	Low	64.4	Low	159 Å²	159	91.3 Å²	91.3	74%	0.743	48%	0.478	S	S	*	.			trans	-69.7	142.3	173	-64.1	-175.9	173.3	0	0	110.2	G296 Q297	E294-G296 PolarHBondContact O-N 2.91Å; E294-Q297 PolarHBondContact O-N 3.22Å; E294-Q297 VanDerWaalsContact O-N 3.07Å
295	K	59.2	Low	65.9	Low	187 Å²	187	89.8 Å²	89.8	81%	0.813	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	101.4	-179.3	-68.6	-174.6	179.3	-177.6	0	110.5
296	G	59.3	Low	67.4	Low	81 Å²	81	86.7 Å²	86.7	84%	0.835	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	116.8	0.4	-179.7	0	0	0	0	0	115.2	E294	E294-G296 PolarHBondContact O-N 2.91Å
297	Q	69.3	Low	68.8	Low	88 Å²	88	84.4 Å²	84.4	41%	0.411	43%	0.428	S	S	.	.			trans	-75.2	126.9	174.2	-170.8	173.4	17.4	0	0	111.3	E294 I299 V303	E294-Q297 PolarHBondContact O-N 3.22Å; E294-Q297 VanDerWaalsContact O-N 3.07Å; Q297-I299 PolarHBondContact O-N 3.33Å; Q297-V303 HydrophobicContact CG-CG1 4.47Å
298	E	64.4	Low	70.5	Confident	153 Å²	153	79 Å²	79	72%	0.715	40%	0.403	S	S	*	.			trans	-65.4	123.7	174	-68.4	-179.1	175.6	0	0	110.9	N300	E298-N300 VanDerWaalsContact C-N 3.33Å; E298-N300 PolarHBondContact O-N 2.87Å
299	I	69.8	Low	72	Confident	39 Å²	39	74.6 Å²	74.6	20%	0.2	38%	0.384	C	S	.	.			trans	-83.9	77.5	-172.7	-52.3	-179.6	0	0	0	109.6	Q297 V304 K335	Q297-I299 PolarHBondContact O-N 3.33Å; I299-V304 HydrophobicContact CG2-CG2 3.58Å; I299-K335 HydrophobicContact CD1-CB 4.02Å; I299-K335 HydrophobicContact CD1-CD 3.81Å; I299-K335 HydrophobicContact CD1-CG 3.82Å; I299-K335 HydrophobicContact CG2-CB 4.47Å
300	N	70	Confident	73.4	Confident	91 Å²	91	73.1 Å²	73.1	49%	0.487	38%	0.377	S	S	.	.			trans	-88.4	152.5	175.5	-71.7	-43.6	0	0	0	111.8	E298 D302 V303 V304	E298-N300 VanDerWaalsContact C-N 3.33Å; E298-N300 PolarHBondContact O-N 2.87Å; N300-D302 VanDerWaalsContact C-N 3.34Å; N300-D302 PolarHBondContact O-N 2.92Å; N300-V303 HydrophobicContact CB-CG2 4.16Å; N300-V303 WeakPolarHBondContact O-CA 3.16Å; N300-V303 WeakPolarHBondContact O-CB 3.44Å; N300-V303 PolarHBondContact O-N 2.93Å; N300-V304 PolarHBondContact O-N 2.82Å; N300-V304 VanDerWaalsContact O-N 3.08Å
301	F	72.8	Confident	74.5	Confident	57 Å²	57	70.4 Å²	70.4	25%	0.25	36%	0.36	C	S	.	.	H	α-helix	trans	-49	-48.3	-178.5	172.2	-100.6	0	0	0	113.8	V303 V304 V305 L341 L345 F404 E405	F301-V303 VanDerWaalsContact C-N 3.35Å; F301-V303 PolarHBondContact O-N 2.8Å; F301-V304 PolarHBondContact O-N 3.34Å; F301-V305 WeakPolarHBondContact O-CG2 3.39Å; F301-V305 PolarHBondContact O-N 3.07Å; F301-L341 HydrophobicContact CB-CD2 4.4Å; F301-L345 HydrophobicContact CD2-CD2 3.84Å; F301-L345 HydrophobicContact CE2-CB 4.27Å; F301-L345 HydrophobicContact CE2-CD2 4.13Å; F301-F404 HydrophobicContact CE2-CB 4.05Å; F301-F404 HydrophobicContact CZ-CB 3.71Å; F301-E405 HydrophobicContact CE1-CB 4.07Å; F301-E405 HydrophobicContact CE1-CG 4.25Å; F301-E405 HydrophobicContact CZ-CB 3.76Å; F301-E405 HydrophobicContact CZ-CG 4.21Å
302	D	79.8	Confident	75.3	Confident	85 Å²	85	68.3 Å²	68.3	46%	0.455	35%	0.352	S	S	.	.	H	α-helix	trans	-63.2	-35.5	176.5	172	50	0	0	0	112.9	N300 V305 K306	N300-D302 VanDerWaalsContact C-N 3.34Å; N300-D302 PolarHBondContact O-N 2.92Å; D302-V305 PolarHBondContact O-N 3.48Å; D302-K306 VanDerWaalsContact CG-NZ 3.25Å; D302-K306 VanDerWaalsContact O-CB 3.3Å; D302-K306 WeakPolarHBondContact O-CB 3.27Å; D302-K306 WeakPolarHBondContact O-CD 3.32Å; D302-K306 VanDerWaalsContact O-CG 3.27Å; D302-K306 WeakPolarHBondContact O-CG 3.39Å; D302-K306 PolarHBondContact O-N 3.41Å; D302-K306 WeakPolarHBondContact OD1-CD 3.45Å; D302-K306 WeakPolarHBondContact OD1-CE 3.37Å; D302-K306 IonicContact OD1-NZ 2.66Å; D302-K306 PolarHBondContact OD1-NZ 3.01Å; D302-K306 VanDerWaalsContact OD1-NZ 3.08Å; D302-K306 WeakPolarHBondContact OD2-CE 3.43Å; D302-K306 IonicContact OD2-NZ 2.67Å; D302-K306 PolarHBondContact OD2-NZ 2.89Å
303	V	81.3	Confident	76.4	Confident	29 Å²	29	71 Å²	71	18%	0.176	37%	0.374	C	S	.	.	H	α-helix	trans	-65.1	-41.9	175.2	179.6	0	0	0	0	110.6	F293 Q297 N300 F301 K306 K307	F293-V303 HydrophobicContact CE1-CG1 4.39Å; Q297-V303 HydrophobicContact CG-CG1 4.47Å; N300-V303 HydrophobicContact CB-CG2 4.16Å; N300-V303 WeakPolarHBondContact O-CA 3.16Å; N300-V303 WeakPolarHBondContact O-CB 3.44Å; N300-V303 PolarHBondContact O-N 2.93Å; F301-V303 VanDerWaalsContact C-N 3.35Å; F301-V303 PolarHBondContact O-N 2.8Å; V303-K306 PolarHBondContact O-N 3.2Å; V303-K307 WeakPolarHBondContact O-CB 3.4Å; V303-K307 PolarHBondContact O-N 3.4Å
304	V	81.1	Confident	77.1	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-69.3	-40.9	178.4	-178.7	0	0	0	0	111.6	F293 I299 N300 F301 K307 M308 V332 I336 L341 L345	F293-V304 HydrophobicContact CE1-CG2 4.27Å; F293-V304 HydrophobicContact CZ-CG2 4.17Å; I299-V304 HydrophobicContact CG2-CG2 3.58Å; N300-V304 PolarHBondContact O-N 2.82Å; N300-V304 VanDerWaalsContact O-N 3.08Å; F301-V304 PolarHBondContact O-N 3.34Å; V304-K307 PolarHBondContact O-N 3.03Å; V304-M308 WeakPolarHBondContact O-CB 3.44Å; V304-M308 PolarHBondContact O-N 3.36Å; V304-V332 HydrophobicContact CG1-CG1 3.92Å; V304-I336 HydrophobicContact CG1-CD1 3.8Å; V304-I336 HydrophobicContact CG1-CG1 3.84Å; V304-L341 HydrophobicContact CB-CD2 4.04Å; V304-L341 HydrophobicContact CG1-CD2 4.46Å; V304-L341 HydrophobicContact CG2-CD2 3.72Å; V304-L345 HydrophobicContact CB-CD2 4.05Å; V304-L345 HydrophobicContact CG1-CD2 3.78Å; V304-L345 HydrophobicContact CG1-CG 4.47Å
305	V	82.3	Confident	77.7	Confident	29 Å²	29	68.1 Å²	68.1	18%	0.176	36%	0.361	C	S	.	.	H	α-helix	trans	-61.7	-43.6	173	172.7	0	0	0	0	111.1	F301 D302 M308 T309 L345	F301-V305 WeakPolarHBondContact O-CG2 3.39Å; F301-V305 PolarHBondContact O-N 3.07Å; D302-V305 PolarHBondContact O-N 3.48Å; V305-M308 PolarHBondContact O-N 2.97Å; V305-T309 WeakPolarHBondContact O-CB 3.17Å; V305-T309 WeakPolarHBondContact O-CG2 3.48Å; V305-T309 PolarHBondContact O-N 2.99Å; V305-T309 PolarHBondContact O-OG1 3.35Å; V305-L345 HydrophobicContact CG2-CD1 3.69Å; V305-L345 HydrophobicContact CG2-CD2 4.17Å
306	K	84.7	Confident	78.7	Confident	120 Å²	120	62.6 Å²	62.6	52%	0.522	36%	0.356	S	S	.	.	H	α-helix	trans	-62.1	-44	174.5	-78	166.6	176.1	162.3	0	112.3	D302 V303 T309 E310	D302-K306 VanDerWaalsContact CG-NZ 3.25Å; D302-K306 VanDerWaalsContact O-CB 3.3Å; D302-K306 WeakPolarHBondContact O-CB 3.27Å; D302-K306 WeakPolarHBondContact O-CD 3.32Å; D302-K306 VanDerWaalsContact O-CG 3.27Å; D302-K306 WeakPolarHBondContact O-CG 3.39Å; D302-K306 PolarHBondContact O-N 3.41Å; D302-K306 WeakPolarHBondContact OD1-CD 3.45Å; D302-K306 WeakPolarHBondContact OD1-CE 3.37Å; D302-K306 IonicContact OD1-NZ 2.66Å; D302-K306 PolarHBondContact OD1-NZ 3.01Å; D302-K306 VanDerWaalsContact OD1-NZ 3.08Å; D302-K306 WeakPolarHBondContact OD2-CE 3.43Å; D302-K306 IonicContact OD2-NZ 2.67Å; D302-K306 PolarHBondContact OD2-NZ 2.89Å; V303-K306 PolarHBondContact O-N 3.2Å; K306-T309 WeakPolarHBondContact CA-OG1 3.24Å; K306-T309 PolarHBondContact O-N 3.5Å; K306-T309 PolarHBondContact O-OG1 3.34Å; K306-E310 WeakPolarHBondContact O-CB 3.5Å; K306-E310 PolarHBondContact O-N 2.65Å
307	K	82	Confident	79.9	Confident	44 Å²	44	65 Å²	65	19%	0.191	34%	0.344	C	S	.	.	H	α-helix	trans	-67.4	-41.2	177.7	-158.5	74.4	-154.2	167.3	0	112.3	A292 F293 V303 V304 E310 I311	A292-K307 VanDerWaalsContact O-CD 3.27Å; A292-K307 WeakPolarHBondContact O-CD 3.39Å; A292-K307 WeakPolarHBondContact O-CE 3.23Å; F293-K307 HydrophobicContact CE1-CB 4.3Å; F293-K307 HydrophobicContact CE1-CG 4.42Å; V303-K307 WeakPolarHBondContact O-CB 3.4Å; V303-K307 PolarHBondContact O-N 3.4Å; V304-K307 PolarHBondContact O-N 3.03Å; K307-E310 WeakPolarHBondContact CD-OE2 3.34Å; K307-E310 WeakPolarHBondContact CE-OE2 3.47Å; K307-E310 IonicContact NZ-OE1 3.35Å; K307-E310 PolarHBondContact NZ-OE1 3.28Å; K307-E310 IonicContact NZ-OE2 3.88Å; K307-E310 PolarHBondContact NZ-OE2 2.97Å; K307-E310 PolarHBondContact O-N 3.46Å; K307-I311 HydrophobicContact CG-CD1 4.25Å; K307-I311 WeakPolarHBondContact O-CD1 3.35Å; K307-I311 VanDerWaalsContact O-CG1 3.24Å; K307-I311 WeakPolarHBondContact O-CG1 3.47Å; K307-I311 PolarHBondContact O-N 2.86Å
308	M	83.7	Confident	80.3	Confident	4 Å²	4	71.5 Å²	71.5	2%	0.02	37%	0.371	C	S	.	.	H	α-helix	trans	-59.7	-46.4	173.7	178.5	-172.7	67.7	0	0	111.6	V304 V305 I311 L312 L345 K348 V349	V304-M308 WeakPolarHBondContact O-CB 3.44Å; V304-M308 PolarHBondContact O-N 3.36Å; V305-M308 PolarHBondContact O-N 2.97Å; M308-I311 PolarHBondContact O-N 3.33Å; M308-L312 HydrophobicContact CG-CD1 4.07Å; M308-L312 WeakPolarHBondContact O-CB 3.3Å; M308-L312 WeakPolarHBondContact O-CG 3.24Å; M308-L312 PolarHBondContact O-N 3.42Å; M308-L345 HydrophobicContact CE-CD1 4.12Å; M308-L345 HydrophobicContact SD-CD1 4.21Å; M308-K348 HydrophobicContact CE-CG 3.88Å; M308-K348 HydrophobicContact SD-CB 4.29Å; M308-K348 HydrophobicContact SD-CG 3.77Å; M308-V349 HydrophobicContact CG-CG2 4.11Å; M308-V349 HydrophobicContact SD-CG2 3.56Å; M308-V349 VanDerWaalsContact SD-CG2 3.56Å
309	T	85.4	Confident	80.8	Confident	71 Å²	71	68.1 Å²	68.1	44%	0.436	38%	0.378	S	S	.	.	H	α-helix	trans	-69.8	-34.2	179.3	48.9	0	0	0	0	112.7	V305 K306 L312 A313	V305-T309 WeakPolarHBondContact O-CB 3.17Å; V305-T309 WeakPolarHBondContact O-CG2 3.48Å; V305-T309 PolarHBondContact O-N 2.99Å; V305-T309 PolarHBondContact O-OG1 3.35Å; K306-T309 WeakPolarHBondContact CA-OG1 3.24Å; K306-T309 PolarHBondContact O-N 3.5Å; K306-T309 PolarHBondContact O-OG1 3.34Å; T309-L312 PolarHBondContact O-N 2.66Å; T309-A313 VanDerWaalsContact O-CB 3.23Å; T309-A313 WeakPolarHBondContact O-CB 3.34Å; T309-A313 PolarHBondContact O-N 3.08Å
310	E	87.3	Confident	81.2	Confident	111 Å²	111	67.9 Å²	67.9	52%	0.519	38%	0.381	S	S	.	.	H	α-helix	trans	-61.2	-48.2	169.9	-173.4	-163.2	143.2	0	0	111.8	K306 K307 A313 S314	K306-E310 WeakPolarHBondContact O-CB 3.5Å; K306-E310 PolarHBondContact O-N 2.65Å; K307-E310 WeakPolarHBondContact CD-OE2 3.34Å; K307-E310 WeakPolarHBondContact CE-OE2 3.47Å; K307-E310 IonicContact NZ-OE1 3.35Å; K307-E310 PolarHBondContact NZ-OE1 3.28Å; K307-E310 IonicContact NZ-OE2 3.88Å; K307-E310 PolarHBondContact NZ-OE2 2.97Å; K307-E310 PolarHBondContact O-N 3.46Å; E310-A313 CarbonylContact O-C 3.47Å; E310-A313 PolarHBondContact O-N 2.89Å; E310-S314 PolarHBondContact O-N 3.47Å
311	I	84.4	Confident	81.7	Confident	5 Å²	5	65.7 Å²	65.7	3%	0.026	37%	0.373	C	S	.	.	H	α-helix	trans	-61.9	-46.7	177.7	-65.6	160.8	0	0	0	110.1	K307 M308 A313 S314 R315 Q325 L328 L329 V332	K307-I311 HydrophobicContact CG-CD1 4.25Å; K307-I311 WeakPolarHBondContact O-CD1 3.35Å; K307-I311 VanDerWaalsContact O-CG1 3.24Å; K307-I311 WeakPolarHBondContact O-CG1 3.47Å; K307-I311 PolarHBondContact O-N 2.86Å; M308-I311 PolarHBondContact O-N 3.33Å; I311-A313 VanDerWaalsContact C-N 3.32Å; I311-A313 PolarHBondContact O-N 2.86Å; I311-S314 WeakPolarHBondContact O-CA 3.44Å; I311-S314 WeakPolarHBondContact O-CB 3.45Å; I311-S314 PolarHBondContact O-N 3.48Å; I311-S314 PolarHBondContact O-OG 2.87Å; I311-R315 PolarHBondContact O-N 3.47Å; I311-Q325 HydrophobicContact CG2-CG 4.45Å; I311-L328 HydrophobicContact CD1-CB 3.97Å; I311-L328 HydrophobicContact CG1-CB 4.45Å; I311-L329 HydrophobicContact CB-CD2 4.41Å; I311-L329 HydrophobicContact CD1-CD2 4.05Å; I311-L329 HydrophobicContact CG2-CD1 4.23Å; I311-L329 HydrophobicContact CG2-CD2 3.94Å; I311-L329 HydrophobicContact CG2-CG 3.91Å; I311-V332 HydrophobicContact CD1-CG2 4.07Å
312	L	83.2	Confident	82	Confident	53 Å²	53	64.1 Å²	64.1	28%	0.277	37%	0.368	S	S	.	.	H	α-helix	trans	-61.9	-37.4	175.8	-75.5	171	0	0	0	112.5	M308 T309 S314 R315 A352	M308-L312 HydrophobicContact CG-CD1 4.07Å; M308-L312 WeakPolarHBondContact O-CB 3.3Å; M308-L312 WeakPolarHBondContact O-CG 3.24Å; M308-L312 PolarHBondContact O-N 3.42Å; T309-L312 PolarHBondContact O-N 2.66Å; L312-S314 PolarHBondContact O-N 3.24Å; L312-R315 WeakPolarHBondContact O-CB 3.42Å; L312-R315 PolarHBondContact O-N 3.35Å; L312-A352 HydrophobicContact CD1-CB 4.21Å; L312-A352 HydrophobicContact CD2-CB 3.92Å; L312-A352 HydrophobicContact CG-CB 4.32Å
313	A	86.1	Confident	82	Confident	60 Å²	60	62.6 Å²	62.6	50%	0.496	36%	0.364	S	S	.	.	H	α-helix	trans	-71	-12.5	173.7	0	0	0	0	0	113.3	T309 E310 I311 K317	T309-A313 VanDerWaalsContact O-CB 3.23Å; T309-A313 WeakPolarHBondContact O-CB 3.34Å; T309-A313 PolarHBondContact O-N 3.08Å; E310-A313 CarbonylContact O-C 3.47Å; E310-A313 PolarHBondContact O-N 2.89Å; I311-A313 VanDerWaalsContact C-N 3.32Å; I311-A313 PolarHBondContact O-N 2.86Å; A313-K317 WeakPolarHBondContact O-CE 3.3Å; A313-K317 PolarHBondContact O-NZ 3.23Å
314	S	84.5	Confident	82.2	Confident	33 Å²	33	64.3 Å²	64.3	23%	0.231	37%	0.372	C	S	.	.	H	α-helix	trans	-88.3	-17.4	171.5	81.6	0	0	0	0	113.5	E310 I311 L312 K317 A320 Q325	E310-S314 PolarHBondContact O-N 3.47Å; I311-S314 WeakPolarHBondContact O-CA 3.44Å; I311-S314 WeakPolarHBondContact O-CB 3.45Å; I311-S314 PolarHBondContact O-N 3.48Å; I311-S314 PolarHBondContact O-OG 2.87Å; L312-S314 PolarHBondContact O-N 3.24Å; S314-K317 PolarHBondContact O-N 3.03Å; S314-A320 WeakPolarHBondContact O-CB 3.32Å; S314-Q325 PolarHBondContact O-NE2 3.15Å; S314-Q325 VanDerWaalsContact O-NE2 3.1Å; S314-Q325 PolarHBondContact OG-NE2 3.37Å
315	R	82.2	Confident	82.3	Confident	91 Å²	91	64.6 Å²	64.6	34%	0.343	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	137	179.4	-171	-179.8	171.2	-171.6	0.4	111.3	I311 L312 K317 S355 D359	I311-R315 PolarHBondContact O-N 3.47Å; L312-R315 WeakPolarHBondContact O-CB 3.42Å; L312-R315 PolarHBondContact O-N 3.35Å; R315-K317 PolarHBondContact O-N 3.49Å; R315-K317 VanDerWaalsContact O-N 3.15Å; R315-S355 PolarHBondContact NH2-O 2.92Å; R315-S355 VanDerWaalsContact NH2-O 3.12Å; R315-D359 VanDerWaalsContact CG-OD2 3.24Å; R315-D359 WeakPolarHBondContact CG-OD2 3.32Å; R315-D359 IonicContact CZ-OD1 3.54Å; R315-D359 IonicContact CZ-OD2 2.79Å; R315-D359 VanDerWaalsContact NE-CG 3.28Å; R315-D359 IonicContact NE-OD1 3.19Å; R315-D359 IonicContact NE-OD2 3.64Å; R315-D359 PolarHBondContact NE-OD2 3.49Å; R315-D359 VanDerWaalsContact NH2-CG 3.32Å; R315-D359 IonicContact NH2-OD1 2.89Å; R315-D359 PolarHBondContact NH2-OD1 3.44Å; R315-D359 IonicContact NH2-OD2 3.67Å
316	G	79.6	Confident	82.4	Confident	70 Å²	70	63.4 Å²	63.4	72%	0.722	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	-3.8	176.7	0	0	0	0	0	116.9
317	K	84.2	Confident	82.4	Confident	133 Å²	133	60.8 Å²	60.8	58%	0.578	36%	0.36	S	S	*	.			trans	-72.3	133.3	176	-70.7	178	176.9	158.6	0	110.7	A313 S314 R315 G319 A320	A313-K317 WeakPolarHBondContact O-CE 3.3Å; A313-K317 PolarHBondContact O-NZ 3.23Å; S314-K317 PolarHBondContact O-N 3.03Å; R315-K317 PolarHBondContact O-N 3.49Å; R315-K317 VanDerWaalsContact O-N 3.15Å; K317-G319 PolarHBondContact O-N 3.08Å; K317-A320 HydrophobicContact CB-CB 4.35Å; K317-A320 PolarHBondContact O-N 2.97Å
318	K	76.9	Confident	82.6	Confident	223 Å²	223	60 Å²	60	97%	0.97	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-21.7	-172.9	-170.2	171.4	-178.3	174.2	0	115.9
319	G	76.4	Confident	82.6	Confident	83 Å²	83	59.8 Å²	59.8	86%	0.856	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	1.8	177.6	0	0	0	0	0	115.7	K317	K317-G319 PolarHBondContact O-N 3.08Å
320	A	78.4	Confident	82.6	Confident	34 Å²	34	60 Å²	60	28%	0.281	35%	0.354	S	S	.	.			trans	-89	133	178	0	0	0	0	0	110.4	S314 K317	S314-A320 WeakPolarHBondContact O-CB 3.32Å; K317-A320 HydrophobicContact CB-CB 4.35Å; K317-A320 PolarHBondContact O-N 2.97Å
321	S	78.9	Confident	82.5	Confident	45 Å²	45	56.6 Å²	56.6	32%	0.315	34%	0.338	S	S	.	.			trans	-84	128	175.3	-166.5	0	0	0	0	110.9	S323 D324 Q325	S321-S323 VanDerWaalsContact C-N 3.33Å; S321-S323 PolarHBondContact OG-OG 3.43Å; S321-D324 VanDerWaalsContact CB-CG 3.49Å; S321-D324 WeakPolarHBondContact CB-OD2 3.45Å; S321-D324 PolarHBondContact O-N 3.23Å; S321-Q325 WeakPolarHBondContact O-CG 3.45Å; S321-Q325 PolarHBondContact O-N 3.01Å
322	T	78.7	Confident	82.4	Confident	24 Å²	24	56.4 Å²	56.4	15%	0.147	34%	0.337	C	S	.	.	H	α-helix	trans	-68.1	-32	176.3	44.5	0	0	0	0	111.9	D324 Q325 I326	T322-D324 VanDerWaalsContact C-N 3.29Å; T322-D324 PolarHBondContact O-N 2.92Å; T322-Q325 PolarHBondContact O-N 3.24Å; T322-I326 WeakPolarHBondContact O-CD1 3.03Å; T322-I326 VanDerWaalsContact O-CG1 3.23Å; T322-I326 WeakPolarHBondContact O-CG1 3.5Å; T322-I326 PolarHBondContact O-N 3.23Å; T322-I326 VanDerWaalsContact O-N 3.07Å
323	S	81.6	Confident	82.4	Confident	52 Å²	52	54.2 Å²	54.2	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-58	-43.7	172.9	53.3	0	0	0	0	111.8	S321 I326 V327	S321-S323 VanDerWaalsContact C-N 3.33Å; S321-S323 PolarHBondContact OG-OG 3.43Å; S323-I326 WeakPolarHBondContact O-CB 3.43Å; S323-I326 PolarHBondContact O-N 3.35Å; S323-V327 WeakPolarHBondContact O-CG2 3.27Å; S323-V327 PolarHBondContact O-N 3.44Å
324	D	83.9	Confident	82.3	Confident	66 Å²	66	57 Å²	57	35%	0.353	33%	0.328	S	S	.	.	H	α-helix	trans	-76.2	-36	-171.9	-52	1.5	0	0	0	109.4	S321 T322 I326 V327 L328	S321-D324 VanDerWaalsContact CB-CG 3.49Å; S321-D324 WeakPolarHBondContact CB-OD2 3.45Å; S321-D324 PolarHBondContact O-N 3.23Å; T322-D324 VanDerWaalsContact C-N 3.29Å; T322-D324 PolarHBondContact O-N 2.92Å; D324-I326 VanDerWaalsContact C-N 3.34Å; D324-I326 PolarHBondContact O-N 3.1Å; D324-V327 PolarHBondContact O-N 3.13Å; D324-L328 VanDerWaalsContact O-CB 3.24Å; D324-L328 WeakPolarHBondContact O-CB 3.49Å; D324-L328 WeakPolarHBondContact O-CD1 3.27Å; D324-L328 WeakPolarHBondContact O-CG 3.49Å; D324-L328 PolarHBondContact O-N 3.06Å
325	Q	83.8	Confident	82.1	Confident	6 Å²	6	58.3 Å²	58.3	3%	0.028	33%	0.329	C	S	.	.	H	α-helix	trans	-60.8	-40.7	170.2	-70.5	172.7	-10.1	0	0	112.2	I311 S314 S321 T322 L329 V356	I311-Q325 HydrophobicContact CG2-CG 4.45Å; S314-Q325 PolarHBondContact O-NE2 3.15Å; S314-Q325 VanDerWaalsContact O-NE2 3.1Å; S314-Q325 PolarHBondContact OG-NE2 3.37Å; S321-Q325 WeakPolarHBondContact O-CG 3.45Å; S321-Q325 PolarHBondContact O-N 3.01Å; T322-Q325 PolarHBondContact O-N 3.24Å; Q325-L329 WeakPolarHBondContact O-CB 3.2Å; Q325-L329 VanDerWaalsContact O-CG 3.3Å; Q325-L329 WeakPolarHBondContact O-CG 3.28Å; Q325-L329 PolarHBondContact O-N 3.03Å; Q325-V356 HydrophobicContact CB-CG1 3.84Å
326	I	84.1	Confident	82	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-62.9	-47.9	175.2	-68.1	162.2	0	0	0	110.3	T322 S323 D324 L329 M330 F353 V356 L357 Y360	T322-I326 WeakPolarHBondContact O-CD1 3.03Å; T322-I326 VanDerWaalsContact O-CG1 3.23Å; T322-I326 WeakPolarHBondContact O-CG1 3.5Å; T322-I326 PolarHBondContact O-N 3.23Å; T322-I326 VanDerWaalsContact O-N 3.07Å; S323-I326 WeakPolarHBondContact O-CB 3.43Å; S323-I326 PolarHBondContact O-N 3.35Å; D324-I326 VanDerWaalsContact C-N 3.34Å; D324-I326 PolarHBondContact O-N 3.1Å; I326-L329 PolarHBondContact O-N 3.1Å; I326-M330 HydrophobicContact CG2-SD 4.27Å; I326-M330 WeakPolarHBondContact O-CG 3.47Å; I326-M330 PolarHBondContact O-N 2.84Å; I326-F353 HydrophobicContact CG2-CE2 3.9Å; I326-V356 HydrophobicContact CG1-CG1 3.92Å; I326-L357 HydrophobicContact CD1-CD2 3.83Å; I326-L357 HydrophobicContact CG1-CD2 3.97Å; I326-L357 HydrophobicContact CG2-CD2 4.09Å; I326-Y360 HydrophobicContact CD1-CD2 4.28Å
327	V	85.9	Confident	82	Confident	64 Å²	64	55.4 Å²	55.4	39%	0.388	30%	0.3	S	S	.	.	H	α-helix	trans	-64.6	-43	179.1	173	0	0	0	0	111.8	S323 D324 L329 M330 Q331	S323-V327 WeakPolarHBondContact O-CG2 3.27Å; S323-V327 PolarHBondContact O-N 3.44Å; D324-V327 PolarHBondContact O-N 3.13Å; V327-L329 PolarHBondContact O-N 3.2Å; V327-M330 PolarHBondContact O-N 3.32Å; V327-Q331 WeakPolarHBondContact O-CG 3.46Å; V327-Q331 PolarHBondContact O-N 3.31Å
328	L	84.9	Confident	81.8	Confident	27 Å²	27	54.5 Å²	54.5	14%	0.141	30%	0.297	C	S	.	.	H	α-helix	trans	-59.2	-45.1	175	-77.9	168.2	0	0	0	111.7	V290 A292 I311 D324 Q331 V332	V290-L328 HydrophobicContact CG1-CD1 4.11Å; V290-L328 HydrophobicContact CG1-CD2 3.77Å; V290-L328 HydrophobicContact CG1-CG 3.9Å; A292-L328 VanDerWaalsContact CA-CD2 3.41Å; A292-L328 HydrophobicContact CB-CD2 3.61Å; I311-L328 HydrophobicContact CD1-CB 3.97Å; I311-L328 HydrophobicContact CG1-CB 4.45Å; D324-L328 VanDerWaalsContact O-CB 3.24Å; D324-L328 WeakPolarHBondContact O-CB 3.49Å; D324-L328 WeakPolarHBondContact O-CD1 3.27Å; D324-L328 WeakPolarHBondContact O-CG 3.49Å; D324-L328 PolarHBondContact O-N 3.06Å; L328-Q331 PolarHBondContact O-N 2.98Å; L328-V332 WeakPolarHBondContact O-CG2 3.4Å; L328-V332 PolarHBondContact O-N 3.05Å
329	L	85	Confident	81.6	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-69.1	-33.6	177.8	-71.8	172.9	0	0	0	112.7	I311 Q325 I326 V327 V332 E333 F353 V356	I311-L329 HydrophobicContact CB-CD2 4.41Å; I311-L329 HydrophobicContact CD1-CD2 4.05Å; I311-L329 HydrophobicContact CG2-CD1 4.23Å; I311-L329 HydrophobicContact CG2-CD2 3.94Å; I311-L329 HydrophobicContact CG2-CG 3.91Å; Q325-L329 WeakPolarHBondContact O-CB 3.2Å; Q325-L329 VanDerWaalsContact O-CG 3.3Å; Q325-L329 WeakPolarHBondContact O-CG 3.28Å; Q325-L329 PolarHBondContact O-N 3.03Å; I326-L329 PolarHBondContact O-N 3.1Å; V327-L329 PolarHBondContact O-N 3.2Å; L329-V332 PolarHBondContact O-N 3.41Å; L329-E333 WeakPolarHBondContact O-CB 3.48Å; L329-E333 PolarHBondContact O-N 2.93Å; L329-F353 HydrophobicContact CB-CD2 3.88Å; L329-V356 HydrophobicContact CD1-CB 4Å; L329-V356 HydrophobicContact CD1-CG1 4.36Å; L329-V356 HydrophobicContact CD1-CG2 3.79Å
330	M	85.4	Confident	81.4	Confident	76 Å²	76	50 Å²	50	37%	0.374	27%	0.268	S	S	.	.	H	α-helix	trans	-62.4	-44.4	171.5	-73.3	176.7	62.5	0	0	111.7	I326 V327 V332 E333 E334 F353	I326-M330 HydrophobicContact CG2-SD 4.27Å; I326-M330 WeakPolarHBondContact O-CG 3.47Å; I326-M330 PolarHBondContact O-N 2.84Å; V327-M330 PolarHBondContact O-N 3.32Å; M330-V332 VanDerWaalsContact C-N 3.34Å; M330-V332 PolarHBondContact O-N 3.23Å; M330-E333 WeakPolarHBondContact O-CB 3.45Å; M330-E333 PolarHBondContact O-N 3.4Å; M330-E334 WeakPolarHBondContact O-CB 3.1Å; M330-E334 PolarHBondContact O-N 2.71Å; M330-F353 HydrophobicContact CG-CE2 3.57Å; M330-F353 HydrophobicContact CG-CZ 3.83Å; M330-F353 HydrophobicContact SD-CE2 4.37Å; M330-F353 HydrophobicContact SD-CZ 4.35Å
331	Q	83.4	Confident	81	Confident	40 Å²	40	49.6 Å²	49.6	19%	0.187	26%	0.261	C	S	.	.	H	α-helix	trans	-64.4	-37.6	175.7	-69.2	171.4	8.7	0	0	112.1	V290 A292 V327 L328 E334 K335	V290-Q331 PolarHBondContact O-NE2 3.14Å; V290-Q331 PolarHBondContact O-OE1 3.42Å; A292-Q331 HydrophobicContact CB-CB 4.1Å; V327-Q331 WeakPolarHBondContact O-CG 3.46Å; V327-Q331 PolarHBondContact O-N 3.31Å; L328-Q331 PolarHBondContact O-N 2.98Å; Q331-E334 PolarHBondContact O-N 3.42Å; Q331-K335 WeakPolarHBondContact O-CG 3.47Å; Q331-K335 PolarHBondContact O-N 3.19Å
332	V	83.6	Confident	80.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65	-41.6	173.3	171.3	0	0	0	0	111.2	A292 F293 V304 I311 L328 L329 M330 K335 I336 V349	A292-V332 HydrophobicContact CB-CG2 4.05Å; F293-V332 HydrophobicContact CE2-CG2 4.03Å; F293-V332 HydrophobicContact CZ-CG2 3.99Å; V304-V332 HydrophobicContact CG1-CG1 3.92Å; I311-V332 HydrophobicContact CD1-CG2 4.07Å; L328-V332 WeakPolarHBondContact O-CG2 3.4Å; L328-V332 PolarHBondContact O-N 3.05Å; L329-V332 PolarHBondContact O-N 3.41Å; M330-V332 VanDerWaalsContact C-N 3.34Å; M330-V332 PolarHBondContact O-N 3.23Å; V332-K335 PolarHBondContact O-N 2.84Å; V332-I336 HydrophobicContact CG1-CD1 3.94Å; V332-I336 WeakPolarHBondContact O-CD1 3.26Å; V332-I336 VanDerWaalsContact O-CG1 3.27Å; V332-I336 WeakPolarHBondContact O-CG1 3.23Å; V332-I336 PolarHBondContact O-N 3.5Å; V332-V349 HydrophobicContact CG1-CG1 4.13Å; V332-V349 HydrophobicContact CG1-CG2 4.06Å
333	E	83.3	Confident	80.6	Confident	8 Å²	8	53.9 Å²	53.9	4%	0.037	27%	0.272	C	S	.	.	H	α-helix	trans	-61	-44.5	174.6	-165.4	-158.5	151.3	0	0	111.8	L329 M330 I336 K337 H346 V349 L350 R381	L329-E333 WeakPolarHBondContact O-CB 3.48Å; L329-E333 PolarHBondContact O-N 2.93Å; M330-E333 WeakPolarHBondContact O-CB 3.45Å; M330-E333 PolarHBondContact O-N 3.4Å; E333-I336 PolarHBondContact O-N 2.96Å; E333-K337 PolarHBondContact O-N 3.4Å; E333-K337 WeakPolarHBondContact OE1-CE 3.13Å; E333-K337 IonicContact OE1-NZ 3.86Å; E333-K337 PolarHBondContact OE1-NZ 2.81Å; E333-H346 VanDerWaalsContact CG-CE1 3.48Å; E333-H346 WeakPolarHBondContact CG-CE1 3.49Å; E333-H346 IonicContact OE1-CE1 3.65Å; E333-V349 HydrophobicContact CB-CG1 4.4Å; E333-L350 HydrophobicContact CG-CD2 4.34Å; E333-R381 IonicContact OE1-CZ 3.63Å; E333-R381 IonicContact OE1-NH1 2.87Å; E333-R381 PolarHBondContact OE1-NH1 3.2Å; E333-R381 IonicContact OE2-CZ 3.83Å; E333-R381 IonicContact OE2-NH1 2.69Å; E333-R381 PolarHBondContact OE2-NH1 3.22Å
334	E	84	Confident	80.4	Confident	117 Å²	117	51.4 Å²	51.4	55%	0.547	26%	0.255	S	S	.	.	H	α-helix	trans	-64.1	-44.8	179.4	-166.9	166.5	-132.2	0	0	111.5	M330 Q331 I336 K337 E338	M330-E334 WeakPolarHBondContact O-CB 3.1Å; M330-E334 PolarHBondContact O-N 2.71Å; Q331-E334 PolarHBondContact O-N 3.42Å; E334-I336 VanDerWaalsContact C-N 3.34Å; E334-I336 PolarHBondContact O-N 3.18Å; E334-K337 PolarHBondContact O-N 3.03Å; E334-K337 VanDerWaalsContact O-N 3.14Å; E334-E338 PolarHBondContact O-N 2.87Å
335	K	79.1	Confident	80.2	Confident	61 Å²	61	48.3 Å²	48.3	27%	0.265	24%	0.238	S	C	.	.	H	α-helix	trans	-66.5	-30	175	-68	-43.4	-174.4	-166.3	0	114.4	F293 I299 Q331 V332 K337 E338 C339	F293-K335 HydrophobicContact CD2-CG 3.89Å; F293-K335 HydrophobicContact CE2-CB 3.88Å; F293-K335 HydrophobicContact CE2-CG 3.71Å; I299-K335 HydrophobicContact CD1-CB 4.02Å; I299-K335 HydrophobicContact CD1-CD 3.81Å; I299-K335 HydrophobicContact CD1-CG 3.82Å; I299-K335 HydrophobicContact CG2-CB 4.47Å; Q331-K335 WeakPolarHBondContact O-CG 3.47Å; Q331-K335 PolarHBondContact O-N 3.19Å; V332-K335 PolarHBondContact O-N 2.84Å; K335-K337 VanDerWaalsContact C-N 3.31Å; K335-E338 VanDerWaalsContact CD-OE2 3.25Å; K335-E338 WeakPolarHBondContact CD-OE2 3.47Å; K335-E338 IonicContact NZ-OE1 3.74Å; K335-E338 PolarHBondContact NZ-OE1 3.37Å; K335-E338 IonicContact NZ-OE2 2.69Å; K335-E338 PolarHBondContact NZ-OE2 2.92Å; K335-C339 WeakPolarHBondContact O-CB 3.43Å; K335-C339 PolarHBondContact O-N 3.26Å
336	I	80.5	Confident	80.2	Confident	3 Å²	3	48.8 Å²	48.8	2%	0.015	24%	0.24	C	C	.	.	H	α-helix	trans	-65.4	-37	172.2	-73.7	164.5	0	0	0	111.2	V304 V332 E333 E334 D340 L341 L345 H346 V349	V304-I336 HydrophobicContact CG1-CD1 3.8Å; V304-I336 HydrophobicContact CG1-CG1 3.84Å; V332-I336 HydrophobicContact CG1-CD1 3.94Å; V332-I336 WeakPolarHBondContact O-CD1 3.26Å; V332-I336 VanDerWaalsContact O-CG1 3.27Å; V332-I336 WeakPolarHBondContact O-CG1 3.23Å; V332-I336 PolarHBondContact O-N 3.5Å; E333-I336 PolarHBondContact O-N 2.96Å; E334-I336 VanDerWaalsContact C-N 3.34Å; E334-I336 PolarHBondContact O-N 3.18Å; I336-D340 PolarHBondContact O-N 3.22Å; I336-L341 HydrophobicContact CG1-CB 4.49Å; I336-L341 HydrophobicContact CG2-CB 4.12Å; I336-L341 PolarHBondContact O-N 3.14Å; I336-L341 VanDerWaalsContact O-N 3.1Å; I336-L345 HydrophobicContact CD1-CD2 4.47Å; I336-L345 HydrophobicContact CD1-CG 4.19Å; I336-H346 HydrophobicContact CG2-CB 3.69Å; I336-V349 HydrophobicContact CD1-CB 4.09Å; I336-V349 HydrophobicContact CD1-CG1 4.36Å; I336-V349 HydrophobicContact CD1-CG2 3.61Å
337	K	79.9	Confident	80.2	Confident	98 Å²	98	48.6 Å²	48.6	43%	0.426	24%	0.239	S	C	.	.	H	α-helix	trans	-75.1	-41.4	176.4	-66.9	177.8	-170.6	170.7	0	113	E333 E334 K335 C339 D340 H346	E333-K337 PolarHBondContact O-N 3.4Å; E333-K337 WeakPolarHBondContact OE1-CE 3.13Å; E333-K337 IonicContact OE1-NZ 3.86Å; E333-K337 PolarHBondContact OE1-NZ 2.81Å; E334-K337 PolarHBondContact O-N 3.03Å; E334-K337 VanDerWaalsContact O-N 3.14Å; K335-K337 VanDerWaalsContact C-N 3.31Å; K337-C339 PolarHBondContact O-N 2.93Å; K337-D340 PolarHBondContact O-N 3.3Å; K337-H346 WeakPolarHBondContact CE-CE1 3.4Å; K337-H346 WeakPolarHBondContact CE-NE2 3.4Å
338	E	80.1	Confident	80.2	Confident	114 Å²	114	47 Å²	47	53%	0.533	23%	0.227	S	C	.	.	H	α-helix	trans	-60.7	-33.7	177.2	-76.2	-179.2	-158.2	0	0	112.9	E334 K335	E334-E338 PolarHBondContact O-N 2.87Å; K335-E338 VanDerWaalsContact CD-OE2 3.25Å; K335-E338 WeakPolarHBondContact CD-OE2 3.47Å; K335-E338 IonicContact NZ-OE1 3.74Å; K335-E338 PolarHBondContact NZ-OE1 3.37Å; K335-E338 IonicContact NZ-OE2 2.69Å; K335-E338 PolarHBondContact NZ-OE2 2.92Å
339	C	72	Confident	80.2	Confident	59 Å²	59	45.7 Å²	45.7	40%	0.399	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	7.7	-175.2	-62.6	0	0	0	0	113.9	K335 K337 L341	K335-C339 WeakPolarHBondContact O-CB 3.43Å; K335-C339 PolarHBondContact O-N 3.26Å; K337-C339 PolarHBondContact O-N 2.93Å; C339-L341 HydrophobicContact CB-CD1 3.36Å; C339-L341 PolarHBondContact O-N 2.9Å; C339-L341 VanDerWaalsContact O-N 3.13Å
340	D	72.2	Confident	80.3	Confident	151 Å²	151	45.7 Å²	45.7	81%	0.807	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	44.1	43	-176.3	-80.8	-38.5	0	0	0	113.7	I336 K337	I336-D340 PolarHBondContact O-N 3.22Å; K337-D340 PolarHBondContact O-N 3.3Å
341	L	71.4	Confident	80.4	Confident	27 Å²	27	42.5 Å²	42.5	14%	0.141	20%	0.204	C	C	.	.			trans	-64.9	158.2	178.3	-99.4	75.4	0	0	0	111.4	F301 V304 I336 C339 R343 L345	F301-L341 HydrophobicContact CB-CD2 4.4Å; V304-L341 HydrophobicContact CB-CD2 4.04Å; V304-L341 HydrophobicContact CG1-CD2 4.46Å; V304-L341 HydrophobicContact CG2-CD2 3.72Å; I336-L341 HydrophobicContact CG1-CB 4.49Å; I336-L341 HydrophobicContact CG2-CB 4.12Å; I336-L341 PolarHBondContact O-N 3.14Å; I336-L341 VanDerWaalsContact O-N 3.1Å; C339-L341 HydrophobicContact CB-CD1 3.36Å; C339-L341 PolarHBondContact O-N 2.9Å; C339-L341 VanDerWaalsContact O-N 3.13Å; L341-R343 PolarHBondContact O-N 3.14Å; L341-L345 HydrophobicContact CD2-CD2 3.91Å
342	S	72.7	Confident	80.6	Confident	26 Å²	26	40.9 Å²	40.9	18%	0.182	20%	0.198	C	C	.	.			trans	-40.9	125.6	-178.1	177.3	0	0	0	0	113.2	G344 L345 H346 F404 Y409	S342-G344 PolarHBondContact O-N 3.07Å; S342-G344 VanDerWaalsContact O-N 3.13Å; S342-L345 WeakPolarHBondContact O-CB 3.4Å; S342-L345 PolarHBondContact O-N 3.16Å; S342-H346 PolarHBondContact O-N 3.2Å; S342-F404 WeakPolarHBondContact CB-O 3.46Å; S342-F404 PolarHBondContact OG-O 3.33Å; S342-Y409 VanDerWaalsContact OG-CE1 3.29Å; S342-Y409 WeakPolarHBondContact OG-CE1 3.44Å
343	R	76.1	Confident	80.7	Confident	133 Å²	133	41 Å²	41	50%	0.502	20%	0.198	S	C	.	.	H	α-helix	trans	-59.9	-28.7	-176.6	-54.2	-178.8	177.6	-153.4	-6.9	112.9	L341 L345 H346 V347 E388 I389	L341-R343 PolarHBondContact O-N 3.14Å; R343-L345 VanDerWaalsContact C-N 3.34Å; R343-L345 PolarHBondContact O-N 3.29Å; R343-H346 WeakPolarHBondContact O-CB 3.37Å; R343-H346 PolarHBondContact O-N 3.03Å; R343-V347 PolarHBondContact O-N 2.8Å; R343-V347 VanDerWaalsContact O-N 3.08Å; R343-E388 IonicContact CZ-OE2 2.94Å; R343-E388 IonicContact NH1-OE2 3.32Å; R343-E388 PolarHBondContact NH1-OE2 2.78Å; R343-I389 HydrophobicContact CB-CD1 3.46Å; R343-I389 VanDerWaalsContact CB-CD1 3.46Å; R343-I389 HydrophobicContact CG-CD1 4.21Å
344	G	77.2	Confident	81	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.4	-36.9	173.2	0	0	0	0	0	113.2	S342 K348 I411	S342-G344 PolarHBondContact O-N 3.07Å; S342-G344 VanDerWaalsContact O-N 3.13Å; G344-K348 PolarHBondContact O-N 3.33Å; G344-K348 VanDerWaalsContact O-N 3.13Å; G344-I411 WeakPolarHBondContact O-CD1 3.41Å
345	L	80.5	Confident	81.1	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-68.5	-40.8	173.9	-178.1	60.5	0	0	0	111.2	F301 V304 V305 M308 I336 L341 S342 R343 V347 K348 V349	F301-L345 HydrophobicContact CD2-CD2 3.84Å; F301-L345 HydrophobicContact CE2-CB 4.27Å; F301-L345 HydrophobicContact CE2-CD2 4.13Å; V304-L345 HydrophobicContact CB-CD2 4.05Å; V304-L345 HydrophobicContact CG1-CD2 3.78Å; V304-L345 HydrophobicContact CG1-CG 4.47Å; V305-L345 HydrophobicContact CG2-CD1 3.69Å; V305-L345 HydrophobicContact CG2-CD2 4.17Å; M308-L345 HydrophobicContact CE-CD1 4.12Å; M308-L345 HydrophobicContact SD-CD1 4.21Å; I336-L345 HydrophobicContact CD1-CD2 4.47Å; I336-L345 HydrophobicContact CD1-CG 4.19Å; L341-L345 HydrophobicContact CD2-CD2 3.91Å; S342-L345 WeakPolarHBondContact O-CB 3.4Å; S342-L345 PolarHBondContact O-N 3.16Å; R343-L345 VanDerWaalsContact C-N 3.34Å; R343-L345 PolarHBondContact O-N 3.29Å; L345-V347 VanDerWaalsContact C-N 3.33Å; L345-V347 PolarHBondContact O-N 2.89Å; L345-K348 PolarHBondContact O-N 3.25Å; L345-V349 PolarHBondContact O-N 3.31Å
346	H	83.5	Confident	81.4	Confident	17 Å²	17	33.7 Å²	33.7	8%	0.079	17%	0.169	C	C	.	.	H	α-helix	trans	-57.5	-45.4	176.2	-169.9	35.1	0	0	0	111.8	E333 I336 K337 S342 R343 V349 L350 L385	E333-H346 VanDerWaalsContact CG-CE1 3.48Å; E333-H346 WeakPolarHBondContact CG-CE1 3.49Å; E333-H346 IonicContact OE1-CE1 3.65Å; I336-H346 HydrophobicContact CG2-CB 3.69Å; K337-H346 WeakPolarHBondContact CE-CE1 3.4Å; K337-H346 WeakPolarHBondContact CE-NE2 3.4Å; S342-H346 PolarHBondContact O-N 3.2Å; R343-H346 WeakPolarHBondContact O-CB 3.37Å; R343-H346 PolarHBondContact O-N 3.03Å; H346-V349 PolarHBondContact O-N 2.76Å; H346-L350 WeakPolarHBondContact O-CG 3.36Å; H346-L350 PolarHBondContact O-N 3.26Å; H346-L385 WeakPolarHBondContact CD2-CD1 3.42Å; H346-L385 WeakPolarHBondContact NE2-CD1 3.49Å
347	V	84.6	Confident	81.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.2	-41	176.1	170.4	0	0	0	0	112.2	R343 L345 V349 L350 F351 L382 L385 L386 I391 I411	R343-V347 PolarHBondContact O-N 2.8Å; R343-V347 VanDerWaalsContact O-N 3.08Å; L345-V347 VanDerWaalsContact C-N 3.33Å; L345-V347 PolarHBondContact O-N 2.89Å; V347-V349 PolarHBondContact O-N 3.08Å; V347-L350 PolarHBondContact O-N 2.91Å; V347-F351 HydrophobicContact CG1-CD2 3.82Å; V347-F351 HydrophobicContact CG1-CE2 3.51Å; V347-F351 VanDerWaalsContact O-CD2 3.22Å; V347-F351 WeakPolarHBondContact O-CD2 3.3Å; V347-F351 PolarHBondContact O-N 2.82Å; V347-L382 HydrophobicContact CG1-CD1 4Å; V347-L385 HydrophobicContact CG2-CB 4.07Å; V347-L385 HydrophobicContact CG2-CD1 4.49Å; V347-L386 HydrophobicContact CG1-CD2 4.33Å; V347-I391 HydrophobicContact CB-CD1 3.92Å; V347-I391 HydrophobicContact CG1-CD1 3.89Å; V347-I391 HydrophobicContact CG2-CD1 3.65Å; V347-I411 HydrophobicContact CB-CD1 3.9Å; V347-I411 HydrophobicContact CG1-CD1 3.7Å
348	K	84.1	Confident	81.8	Confident	29 Å²	29	29.9 Å²	29.9	13%	0.126	15%	0.152	C	C	.	.	H	α-helix	trans	-62.9	-40.5	175.1	-172.4	73.8	-178	-162.3	0	112	M308 G344 L345 F351 A352 E402 F404 I411 K412	M308-K348 HydrophobicContact CE-CG 3.88Å; M308-K348 HydrophobicContact SD-CB 4.29Å; M308-K348 HydrophobicContact SD-CG 3.77Å; G344-K348 PolarHBondContact O-N 3.33Å; G344-K348 VanDerWaalsContact O-N 3.13Å; L345-K348 PolarHBondContact O-N 3.25Å; K348-F351 PolarHBondContact O-N 3.37Å; K348-A352 WeakPolarHBondContact O-CB 3.25Å; K348-A352 PolarHBondContact O-N 2.69Å; K348-E402 VanDerWaalsContact NZ-CD 3.33Å; K348-E402 IonicContact NZ-OE1 2.88Å; K348-E402 PolarHBondContact NZ-OE1 2.74Å; K348-E402 IonicContact NZ-OE2 3.31Å; K348-E402 PolarHBondContact NZ-OE2 2.88Å; K348-E402 VanDerWaalsContact NZ-OE2 3.16Å; K348-F404 HydrophobicContact CB-CD1 4.37Å; K348-F404 HydrophobicContact CB-CE1 3.81Å; K348-F404 HydrophobicContact CD-CE1 3.88Å; K348-F404 HydrophobicContact CD-CZ 4.11Å; K348-F404 HydrophobicContact CG-CE1 3.74Å; K348-F404 HydrophobicContact CG-CZ 4.01Å; K348-I411 HydrophobicContact CD-CG2 3.82Å; K348-K412 PolarHBondContact NZ-O 3.17Å
349	V	86.6	Confident	81.9	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.1	-39.2	175.4	169.8	0	0	0	0	111.6	M308 V332 E333 I336 L345 H346 V347 A352 F353	M308-V349 HydrophobicContact CG-CG2 4.11Å; M308-V349 HydrophobicContact SD-CG2 3.56Å; M308-V349 VanDerWaalsContact SD-CG2 3.56Å; V332-V349 HydrophobicContact CG1-CG1 4.13Å; V332-V349 HydrophobicContact CG1-CG2 4.06Å; E333-V349 HydrophobicContact CB-CG1 4.4Å; I336-V349 HydrophobicContact CD1-CB 4.09Å; I336-V349 HydrophobicContact CD1-CG1 4.36Å; I336-V349 HydrophobicContact CD1-CG2 3.61Å; L345-V349 PolarHBondContact O-N 3.31Å; H346-V349 PolarHBondContact O-N 2.76Å; V347-V349 PolarHBondContact O-N 3.08Å; V349-A352 WeakPolarHBondContact O-CB 3.31Å; V349-A352 PolarHBondContact O-N 2.94Å; V349-F353 VanDerWaalsContact O-CB 3.3Å; V349-F353 WeakPolarHBondContact O-CB 3.36Å; V349-F353 PolarHBondContact O-N 2.69Å
350	L	87	Confident	81.9	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64.2	-41.1	174	-72.9	171.9	0	0	0	112.6	E333 H346 V347 A352 F353 I354 L382 L385	E333-L350 HydrophobicContact CG-CD2 4.34Å; H346-L350 WeakPolarHBondContact O-CG 3.36Å; H346-L350 PolarHBondContact O-N 3.26Å; V347-L350 PolarHBondContact O-N 2.91Å; L350-A352 VanDerWaalsContact C-N 3.35Å; L350-A352 PolarHBondContact O-N 3.43Å; L350-F353 PolarHBondContact O-N 2.67Å; L350-I354 VanDerWaalsContact O-CG1 3.32Å; L350-I354 WeakPolarHBondContact O-CG1 3.5Å; L350-I354 PolarHBondContact O-N 3.41Å; L350-L382 HydrophobicContact CB-CD1 4.01Å; L350-L382 HydrophobicContact CD1-CB 4.47Å; L350-L382 HydrophobicContact CD1-CD1 4.43Å; L350-L385 HydrophobicContact CD1-CD1 3.32Å
351	F	87.2	Confident	81.5	Confident	9 Å²	9	18.5 Å²	18.5	4%	0.039	9%	0.088	C	C	.	.	H	α-helix	trans	-62	-40.9	171.7	-78.7	-62.8	0	0	0	112.5	V347 K348 S355 L382 L393 I411 A413 I415 V418	V347-F351 HydrophobicContact CG1-CD2 3.82Å; V347-F351 HydrophobicContact CG1-CE2 3.51Å; V347-F351 VanDerWaalsContact O-CD2 3.22Å; V347-F351 WeakPolarHBondContact O-CD2 3.3Å; V347-F351 PolarHBondContact O-N 2.82Å; K348-F351 PolarHBondContact O-N 3.37Å; F351-S355 VanDerWaalsContact O-CB 3.31Å; F351-S355 WeakPolarHBondContact O-CB 3.39Å; F351-S355 PolarHBondContact O-N 2.92Å; F351-S355 PolarHBondContact O-OG 3.24Å; F351-L382 HydrophobicContact CD1-CD2 4.19Å; F351-L382 HydrophobicContact CD2-CD1 4.36Å; F351-L382 HydrophobicContact CE1-CD1 4.43Å; F351-L382 HydrophobicContact CE1-CD2 3.78Å; F351-L382 HydrophobicContact CE2-CD1 4.11Å; F351-L382 HydrophobicContact CZ-CD1 4.14Å; F351-L382 HydrophobicContact CZ-CD2 4.14Å; F351-L393 HydrophobicContact CE2-CD2 3.77Å; F351-L393 HydrophobicContact CZ-CD2 4.01Å; F351-I411 HydrophobicContact CD2-CG2 4.18Å; F351-I411 HydrophobicContact CE2-CG2 4.32Å; F351-A413 HydrophobicContact CB-CB 4.36Å; F351-A413 HydrophobicContact CD1-CB 3.81Å; F351-A413 HydrophobicContact CD2-CB 3.57Å; F351-A413 HydrophobicContact CE1-CB 3.88Å; F351-A413 HydrophobicContact CE2-CB 3.63Å; F351-A413 HydrophobicContact CG-CB 3.66Å; F351-A413 HydrophobicContact CZ-CB 3.79Å; F351-I415 HydrophobicContact CE1-CG1 3.88Å; F351-I415 HydrophobicContact CZ-CD1 4.46Å; F351-I415 HydrophobicContact CZ-CG1 3.62Å; F351-V418 HydrophobicContact CD1-CG2 4.38Å
352	A	86.2	Confident	81.3	Confident	6 Å²	6	24.9 Å²	24.9	5%	0.05	11%	0.114	C	C	.	.	H	α-helix	trans	-63.4	-43.5	174.9	0	0	0	0	0	111.8	L312 K348 V349 L350 S355 V356	L312-A352 HydrophobicContact CD1-CB 4.21Å; L312-A352 HydrophobicContact CD2-CB 3.92Å; L312-A352 HydrophobicContact CG-CB 4.32Å; K348-A352 WeakPolarHBondContact O-CB 3.25Å; K348-A352 PolarHBondContact O-N 2.69Å; V349-A352 WeakPolarHBondContact O-CB 3.31Å; V349-A352 PolarHBondContact O-N 2.94Å; L350-A352 VanDerWaalsContact C-N 3.35Å; L350-A352 PolarHBondContact O-N 3.43Å; A352-S355 WeakPolarHBondContact O-CB 3.44Å; A352-S355 PolarHBondContact O-N 3.13Å; A352-V356 WeakPolarHBondContact O-CG2 3.41Å; A352-V356 PolarHBondContact O-N 3.42Å
353	F	87.4	Confident	80.8	Confident	4 Å²	4	31 Å²	31	2%	0.018	14%	0.138	C	C	.	.	H	α-helix	trans	-60.2	-52.2	177.4	-179.4	-117.2	0	0	0	111.9	I326 L329 M330 V349 L350 S355 V356 L357 A378	I326-F353 HydrophobicContact CG2-CE2 3.9Å; L329-F353 HydrophobicContact CB-CD2 3.88Å; M330-F353 HydrophobicContact CG-CE2 3.57Å; M330-F353 HydrophobicContact CG-CZ 3.83Å; M330-F353 HydrophobicContact SD-CE2 4.37Å; M330-F353 HydrophobicContact SD-CZ 4.35Å; V349-F353 VanDerWaalsContact O-CB 3.3Å; V349-F353 WeakPolarHBondContact O-CB 3.36Å; V349-F353 PolarHBondContact O-N 2.69Å; L350-F353 PolarHBondContact O-N 2.67Å; F353-S355 VanDerWaalsContact C-N 3.29Å; F353-S355 PolarHBondContact O-N 3.28Å; F353-V356 PolarHBondContact O-N 3.27Å; F353-V356 VanDerWaalsContact O-N 3.14Å; F353-L357 HydrophobicContact CD1-CD1 3.89Å; F353-L357 HydrophobicContact CE1-CD1 3.56Å; F353-L357 HydrophobicContact CE1-CG 4.49Å; F353-L357 HydrophobicContact CE2-CD1 4.32Å; F353-L357 HydrophobicContact CE2-CG 4.44Å; F353-L357 HydrophobicContact CG-CD1 4.41Å; F353-L357 HydrophobicContact CZ-CD1 3.81Å; F353-L357 HydrophobicContact CZ-CD2 4.45Å; F353-L357 HydrophobicContact CZ-CG 4.36Å; F353-L357 WeakPolarHBondContact O-CG 3.46Å; F353-L357 PolarHBondContact O-N 2.99Å; F353-A378 HydrophobicContact CD1-CB 3.86Å; F353-A378 HydrophobicContact CE1-CB 3.87Å
354	I	88	Confident	80.2	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.2	-40.9	176.4	-64.7	164.3	0	0	0	110.8	L350 V356 L357 F358 A378 F379 L382 V418	L350-I354 VanDerWaalsContact O-CG1 3.32Å; L350-I354 WeakPolarHBondContact O-CG1 3.5Å; L350-I354 PolarHBondContact O-N 3.41Å; I354-V356 VanDerWaalsContact C-N 3.32Å; I354-V356 PolarHBondContact O-N 3.17Å; I354-L357 PolarHBondContact O-N 2.75Å; I354-F358 HydrophobicContact CG2-CD2 3.84Å; I354-F358 HydrophobicContact CG2-CE2 3.36Å; I354-F358 HydrophobicContact CG2-CZ 4.17Å; I354-F358 VanDerWaalsContact O-CD2 3.23Å; I354-F358 WeakPolarHBondContact O-CD2 3.22Å; I354-F358 PolarHBondContact O-N 3.25Å; I354-F358 VanDerWaalsContact O-N 3.11Å; I354-A378 HydrophobicContact CD1-CB 4.16Å; I354-A378 HydrophobicContact CG1-CB 3.78Å; I354-F379 HydrophobicContact CD1-CD1 4.33Å; I354-F379 HydrophobicContact CD1-CE1 4.36Å; I354-F379 HydrophobicContact CD1-CG 4.46Å; I354-F379 HydrophobicContact CD1-CZ 4.48Å; I354-F379 HydrophobicContact CG2-CE1 4.46Å; I354-F379 HydrophobicContact CG2-CE2 3.9Å; I354-F379 HydrophobicContact CG2-CZ 3.71Å; I354-L382 HydrophobicContact CD1-CD2 3.85Å; I354-V418 HydrophobicContact CB-CG1 4.33Å; I354-V418 HydrophobicContact CG2-CG1 3.45Å; I354-V418 VanDerWaalsContact CG2-CG1 3.45Å
355	S	86.6	Confident	79.8	Confident	31 Å²	31	35.5 Å²	35.5	22%	0.217	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-33.5	176.8	-59.9	0	0	0	0	113.7	R315 F351 A352 F353 D359	R315-S355 PolarHBondContact NH2-O 2.92Å; R315-S355 VanDerWaalsContact NH2-O 3.12Å; F351-S355 VanDerWaalsContact O-CB 3.31Å; F351-S355 WeakPolarHBondContact O-CB 3.39Å; F351-S355 PolarHBondContact O-N 2.92Å; F351-S355 PolarHBondContact O-OG 3.24Å; A352-S355 WeakPolarHBondContact O-CB 3.44Å; A352-S355 PolarHBondContact O-N 3.13Å; F353-S355 VanDerWaalsContact C-N 3.29Å; F353-S355 PolarHBondContact O-N 3.28Å; S355-D359 PolarHBondContact O-N 2.76Å
356	V	85.5	Confident	79.4	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.006	18%	0.179	C	C	.	.	H	α-helix	trans	-79	-32.5	176.2	169.7	0	0	0	0	111.5	Q325 I326 L329 A352 F353 I354 D359 Y360	Q325-V356 HydrophobicContact CB-CG1 3.84Å; I326-V356 HydrophobicContact CG1-CG1 3.92Å; L329-V356 HydrophobicContact CD1-CB 4Å; L329-V356 HydrophobicContact CD1-CG1 4.36Å; L329-V356 HydrophobicContact CD1-CG2 3.79Å; A352-V356 WeakPolarHBondContact O-CG2 3.41Å; A352-V356 PolarHBondContact O-N 3.42Å; F353-V356 PolarHBondContact O-N 3.27Å; F353-V356 VanDerWaalsContact O-N 3.14Å; I354-V356 VanDerWaalsContact C-N 3.32Å; I354-V356 PolarHBondContact O-N 3.17Å; V356-D359 WeakPolarHBondContact O-CB 3.33Å; V356-D359 PolarHBondContact O-N 3.38Å; V356-Y360 PolarHBondContact O-N 3.19Å
357	L	85.7	Confident	79.2	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-61.5	-43.1	172.4	-71.9	170.3	0	0	0	111.6	I326 F353 I354 D359 Y360 L371 T375	I326-L357 HydrophobicContact CD1-CD2 3.83Å; I326-L357 HydrophobicContact CG1-CD2 3.97Å; I326-L357 HydrophobicContact CG2-CD2 4.09Å; F353-L357 HydrophobicContact CD1-CD1 3.89Å; F353-L357 HydrophobicContact CE1-CD1 3.56Å; F353-L357 HydrophobicContact CE1-CG 4.49Å; F353-L357 HydrophobicContact CE2-CD1 4.32Å; F353-L357 HydrophobicContact CE2-CG 4.44Å; F353-L357 HydrophobicContact CG-CD1 4.41Å; F353-L357 HydrophobicContact CZ-CD1 3.81Å; F353-L357 HydrophobicContact CZ-CD2 4.45Å; F353-L357 HydrophobicContact CZ-CG 4.36Å; F353-L357 WeakPolarHBondContact O-CG 3.46Å; F353-L357 PolarHBondContact O-N 2.99Å; I354-L357 PolarHBondContact O-N 2.75Å; L357-D359 VanDerWaalsContact C-N 3.31Å; L357-D359 PolarHBondContact O-N 2.94Å; L357-Y360 VanDerWaalsContact O-CB 3.26Å; L357-Y360 WeakPolarHBondContact O-CB 3.35Å; L357-Y360 PolarHBondContact O-N 3.41Å; L357-L371 HydrophobicContact CD2-CD2 4.35Å; L357-T375 HydrophobicContact CB-CG2 3.63Å; L357-T375 HydrophobicContact CD1-CG2 3.59Å; L357-T375 HydrophobicContact CG-CG2 4.15Å
358	F	84.2	Confident	79.1	Confident	19 Å²	19	40.2 Å²	40.2	8%	0.083	20%	0.196	C	C	.	.	H	α-helix	trans	-66.7	-28.3	173.8	-68.3	-52.7	0	0	0	113.6	I354 Y360 D361 M367 F379 V418 L421 L422 E425	I354-F358 HydrophobicContact CG2-CD2 3.84Å; I354-F358 HydrophobicContact CG2-CE2 3.36Å; I354-F358 HydrophobicContact CG2-CZ 4.17Å; I354-F358 VanDerWaalsContact O-CD2 3.23Å; I354-F358 WeakPolarHBondContact O-CD2 3.22Å; I354-F358 PolarHBondContact O-N 3.25Å; I354-F358 VanDerWaalsContact O-N 3.11Å; F358-Y360 PolarHBondContact O-N 3.33Å; F358-D361 WeakPolarHBondContact O-CB 3.44Å; F358-D361 PolarHBondContact O-N 3.32Å; F358-M367 HydrophobicContact CD1-CE 4.03Å; F358-M367 HydrophobicContact CE1-CE 4.45Å; F358-F379 HydrophobicContact CE2-CE2 4.47Å; F358-F379 HydrophobicContact CE2-CZ 4.18Å; F358-F379 HydrophobicContact CZ-CE2 4.06Å; F358-F379 HydrophobicContact CZ-CZ 4.04Å; F358-V418 HydrophobicContact CE2-CG1 4.18Å; F358-L421 HydrophobicContact CD1-CB 4.45Å; F358-L421 HydrophobicContact CD2-CB 4.06Å; F358-L421 HydrophobicContact CD2-CD1 4.17Å; F358-L421 HydrophobicContact CE1-CB 4.22Å; F358-L421 HydrophobicContact CE2-CB 3.77Å; F358-L421 HydrophobicContact CG-CB 4.39Å; F358-L421 HydrophobicContact CZ-CB 3.88Å; F358-L422 HydrophobicContact CZ-CB 4.05Å; F358-E425 HydrophobicContact CD1-CG 3.55Å; F358-E425 HydrophobicContact CE1-CB 4.25Å; F358-E425 HydrophobicContact CE1-CG 3.51Å
359	D	80.8	Confident	78.9	Confident	16 Å²	16	40.7 Å²	40.7	9%	0.086	20%	0.204	C	C	.	.	H	α-helix	trans	-69.6	-17.8	175.8	-102.2	25.6	0	0	0	113.7	R315 S355 V356 L357 D361 K362	R315-D359 VanDerWaalsContact CG-OD2 3.24Å; R315-D359 WeakPolarHBondContact CG-OD2 3.32Å; R315-D359 IonicContact CZ-OD1 3.54Å; R315-D359 IonicContact CZ-OD2 2.79Å; R315-D359 VanDerWaalsContact NE-CG 3.28Å; R315-D359 IonicContact NE-OD1 3.19Å; R315-D359 IonicContact NE-OD2 3.64Å; R315-D359 PolarHBondContact NE-OD2 3.49Å; R315-D359 VanDerWaalsContact NH2-CG 3.32Å; R315-D359 IonicContact NH2-OD1 2.89Å; R315-D359 PolarHBondContact NH2-OD1 3.44Å; R315-D359 IonicContact NH2-OD2 3.67Å; S355-D359 PolarHBondContact O-N 2.76Å; V356-D359 WeakPolarHBondContact O-CB 3.33Å; V356-D359 PolarHBondContact O-N 3.38Å; L357-D359 VanDerWaalsContact C-N 3.31Å; L357-D359 PolarHBondContact O-N 2.94Å; D359-D361 PolarHBondContact O-N 3.27Å; D359-K362 WeakPolarHBondContact OD1-CE 3.44Å; D359-K362 IonicContact OD1-NZ 2.62Å; D359-K362 PolarHBondContact OD1-NZ 2.77Å; D359-K362 IonicContact OD2-NZ 2.74Å
360	Y	73.5	Confident	78.8	Confident	48 Å²	48	46.5 Å²	46.5	19%	0.188	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-62.5	-32	174.3	-172.8	-88.3	0	0	0	112.1	I326 V356 L357 F358 K362 H364 L371	I326-Y360 HydrophobicContact CD1-CD2 4.28Å; V356-Y360 PolarHBondContact O-N 3.19Å; L357-Y360 VanDerWaalsContact O-CB 3.26Å; L357-Y360 WeakPolarHBondContact O-CB 3.35Å; L357-Y360 PolarHBondContact O-N 3.41Å; F358-Y360 PolarHBondContact O-N 3.33Å; Y360-K362 PolarHBondContact O-N 3.38Å; Y360-H364 AromaticContact CE1-CD2 3.6Å; Y360-L371 HydrophobicContact CD1-CD1 3.47Å; Y360-L371 VanDerWaalsContact CD1-CD1 3.47Å; Y360-L371 HydrophobicContact CD2-CD1 4.1Å; Y360-L371 HydrophobicContact CE1-CD1 3.35Å; Y360-L371 HydrophobicContact CE2-CD1 4Å; Y360-L371 HydrophobicContact CG-CD1 3.85Å
361	D	63.3	Low	78.6	Confident	22 Å²	22	47.4 Å²	47.4	12%	0.118	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-65.9	-21.3	-175.4	-167.5	64.9	0	0	0	113.4	F358 D359 K363 H364 C366 M367 K428	F358-D361 WeakPolarHBondContact O-CB 3.44Å; F358-D361 PolarHBondContact O-N 3.32Å; D359-D361 PolarHBondContact O-N 3.27Å; D361-K363 PolarHBondContact O-N 2.81Å; D361-H364 PolarHBondContact O-N 3.12Å; D361-C366 WeakPolarHBondContact OD1-CA 3.24Å; D361-M367 PolarHBondContact OD1-N 3.44Å; D361-K428 IonicContact OD2-NZ 2.89Å; D361-K428 PolarHBondContact OD2-NZ 2.9Å
362	K	66.5	Low	78.6	Confident	161 Å²	161	47.1 Å²	47.1	70%	0.7	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-61.8	-0.3	-178.2	-65.6	175.3	179.4	161.7	0	115.9	D359 Y360	D359-K362 WeakPolarHBondContact OD1-CE 3.44Å; D359-K362 IonicContact OD1-NZ 2.62Å; D359-K362 PolarHBondContact OD1-NZ 2.77Å; D359-K362 IonicContact OD2-NZ 2.74Å; Y360-K362 PolarHBondContact O-N 3.38Å
363	K	63.3	Low	78.7	Confident	155 Å²	155	49.4 Å²	49.4	67%	0.674	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-122	-8	177.1	-65.1	-177.4	-177.2	173.7	0	114.2	D361	D361-K363 PolarHBondContact O-N 2.81Å
364	H	62.6	Low	78.6	Confident	86 Å²	86	54.4 Å²	54.4	40%	0.398	27%	0.268	S	S	.	.	S	Bend	trans	-136.8	144.7	-171.7	-64	-68.9	0	0	0	108.8	Y360 D361 C366	Y360-H364 AromaticContact CE1-CD2 3.6Å; D361-H364 PolarHBondContact O-N 3.12Å; H364-C366 PolarHBondContact O-N 2.73Å
365	D	69.2	Low	78.6	Confident	141 Å²	141	54.4 Å²	54.4	75%	0.754	27%	0.268	S	S	*	.	S	Bend	trans	-72.4	-11.1	-177.1	-53.4	-60.5	0	0	0	113.1	N432	D365-N432 VanDerWaalsContact C-ND2 3.27Å; D365-N432 PolarHBondContact O-ND2 3.35Å
366	C	72	Confident	78.8	Confident	33 Å²	33	53 Å²	53	22%	0.223	26%	0.258	C	S	.	.	S	Bend	trans	-158.3	161	169	58.2	0	0	0	0	113.4	D361 H364 K428 V429 N432	D361-C366 WeakPolarHBondContact OD1-CA 3.24Å; H364-C366 PolarHBondContact O-N 2.73Å; C366-K428 HydrophobicContact CB-CB 4.45Å; C366-V429 HydrophobicContact CB-CG2 4.24Å; C366-N432 HydrophobicContact CB-CB 4.46Å; C366-N432 WeakPolarHBondContact CB-ND2 3.32Å; C366-N432 PolarHBondContact SG-ND2 3.17Å; C366-N432 VanDerWaalsContact SG-ND2 3.44Å
367	M	79.7	Confident	79	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.005	28%	0.276	C	S	.	.			trans	-69	131.2	172.9	-166.8	174.3	-61.2	0	0	113.8	F358 D361 L371 F372 T375 E425 V429	F358-M367 HydrophobicContact CD1-CE 4.03Å; F358-M367 HydrophobicContact CE1-CE 4.45Å; D361-M367 PolarHBondContact OD1-N 3.44Å; M367-L371 HydrophobicContact CG-CB 3.59Å; M367-L371 HydrophobicContact SD-CB 3.94Å; M367-F372 HydrophobicContact CG-CB 4.42Å; M367-F372 HydrophobicContact SD-CB 4.22Å; M367-F372 HydrophobicContact SD-CD2 4.16Å; M367-T375 HydrophobicContact CE-CG2 4.05Å; M367-T375 HydrophobicContact SD-CG2 3.74Å; M367-E425 HydrophobicContact CE-CG 4.33Å; M367-V429 HydrophobicContact CB-CG2 4.49Å
368	N	81	Confident	79.1	Confident	81 Å²	81	56.3 Å²	56.3	43%	0.433	28%	0.276	S	S	.	.			trans	-59.6	144.1	172.9	-72.6	-36.9	0	0	0	111.8	N370 L371 F372	N368-N370 VanDerWaalsContact C-N 3.31Å; N368-N370 PolarHBondContact O-N 3Å; N368-L371 HydrophobicContact CB-CD1 4.29Å; N368-L371 HydrophobicContact CB-CG 4.44Å; N368-L371 WeakPolarHBondContact O-CA 3.46Å; N368-L371 WeakPolarHBondContact O-CB 3.39Å; N368-L371 PolarHBondContact O-N 2.98Å; N368-F372 PolarHBondContact O-N 3.32Å
369	S	81.6	Confident	79.4	Confident	40 Å²	40	55.4 Å²	55.4	28%	0.28	27%	0.272	S	S	.	.	H	α-helix	trans	-49.8	-48.3	-177.4	-145.1	0	0	0	0	113.1	L371 F372 D373 R443	S369-L371 PolarHBondContact O-N 3.11Å; S369-L371 VanDerWaalsContact O-N 3.16Å; S369-F372 PolarHBondContact O-N 3.38Å; S369-D373 PolarHBondContact O-N 2.95Å; S369-R443 PolarHBondContact OG-NE 3.42Å
370	N	83.3	Confident	79.8	Confident	122 Å²	122	56.5 Å²	56.5	65%	0.652	28%	0.278	S	S	*	.	H	α-helix	trans	-62.4	-23.5	179.3	-64.9	-24.5	0	0	0	114.3	N368 R374	N368-N370 VanDerWaalsContact C-N 3.31Å; N368-N370 PolarHBondContact O-N 3Å; N370-R374 VanDerWaalsContact O-CD 3.28Å; N370-R374 WeakPolarHBondContact O-CD 3.32Å; N370-R374 WeakPolarHBondContact O-CG 3.47Å; N370-R374 PolarHBondContact O-NE 3.27Å
371	L	83.6	Confident	80.4	Confident	19 Å²	19	57.7 Å²	57.7	10%	0.099	28%	0.282	C	S	.	.	H	α-helix	trans	-86.6	-35.7	174.8	-68	174.3	0	0	0	110.9	L357 Y360 M367 N368 S369 R374 T375	L357-L371 HydrophobicContact CD2-CD2 4.35Å; Y360-L371 HydrophobicContact CD1-CD1 3.47Å; Y360-L371 VanDerWaalsContact CD1-CD1 3.47Å; Y360-L371 HydrophobicContact CD2-CD1 4.1Å; Y360-L371 HydrophobicContact CE1-CD1 3.35Å; Y360-L371 HydrophobicContact CE2-CD1 4Å; Y360-L371 HydrophobicContact CG-CD1 3.85Å; M367-L371 HydrophobicContact CG-CB 3.59Å; M367-L371 HydrophobicContact SD-CB 3.94Å; N368-L371 HydrophobicContact CB-CD1 4.29Å; N368-L371 HydrophobicContact CB-CG 4.44Å; N368-L371 WeakPolarHBondContact O-CA 3.46Å; N368-L371 WeakPolarHBondContact O-CB 3.39Å; N368-L371 PolarHBondContact O-N 2.98Å; S369-L371 PolarHBondContact O-N 3.11Å; S369-L371 VanDerWaalsContact O-N 3.16Å; L371-R374 CarbonylContact O-C 3.58Å; L371-R374 WeakPolarHBondContact O-CA 3.47Å; L371-R374 WeakPolarHBondContact O-CB 3.48Å; L371-R374 PolarHBondContact O-N 2.91Å; L371-R374 VanDerWaalsContact O-N 3.14Å; L371-T375 PolarHBondContact O-N 2.71Å
372	F	86.7	Confident	81.5	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.009	28%	0.276	C	S	.	.	H	α-helix	trans	-66.6	-41.1	175.2	-162.7	-108.8	0	0	0	111.9	M367 N368 S369 R374 T375 L376 L422 E425 C426 D446 V450	M367-F372 HydrophobicContact CG-CB 4.42Å; M367-F372 HydrophobicContact SD-CB 4.22Å; M367-F372 HydrophobicContact SD-CD2 4.16Å; N368-F372 PolarHBondContact O-N 3.32Å; S369-F372 PolarHBondContact O-N 3.38Å; F372-R374 PolarHBondContact O-N 3.46Å; F372-T375 WeakPolarHBondContact CA-OG1 3.38Å; F372-T375 PolarHBondContact O-N 3.43Å; F372-T375 PolarHBondContact O-OG1 2.97Å; F372-L376 HydrophobicContact CD1-CD1 3.84Å; F372-L376 HydrophobicContact CD1-CG 4.32Å; F372-L376 HydrophobicContact CE1-CD1 3.78Å; F372-L376 HydrophobicContact CE1-CD2 4.44Å; F372-L376 HydrophobicContact CE1-CG 4.23Å; F372-L376 WeakPolarHBondContact O-CG 3.31Å; F372-L376 PolarHBondContact O-N 3.31Å; F372-L422 HydrophobicContact CE2-CD1 3.91Å; F372-L422 HydrophobicContact CZ-CD1 4.18Å; F372-E425 HydrophobicContact CE2-CB 4.29Å; F372-C426 HydrophobicContact CE2-CB 4.45Å; F372-C426 HydrophobicContact CZ-CB 3.92Å; F372-D446 HydrophobicContact CD1-CB 4.27Å; F372-D446 HydrophobicContact CE1-CB 3.82Å; F372-V450 HydrophobicContact CZ-CG2 4.26Å
373	D	87.4	Confident	82.4	Confident	54 Å²	54	49 Å²	49	29%	0.289	24%	0.243	S	C	.	.	H	α-helix	trans	-59.1	-36.8	169.6	-89.9	-52.9	0	0	0	112.4	S369 N377 R449	S369-D373 PolarHBondContact O-N 2.95Å; D373-N377 VanDerWaalsContact O-CB 3.25Å; D373-N377 WeakPolarHBondContact O-CB 3.23Å; D373-N377 PolarHBondContact O-N 2.99Å; D373-N377 PolarHBondContact O-ND2 2.95Å; D373-N377 VanDerWaalsContact O-ND2 3.08Å; D373-R449 IonicContact OD1-NH1 2.63Å; D373-R449 PolarHBondContact OD1-NH1 3.17Å
374	R	86.9	Confident	83.6	Confident	110 Å²	110	45.2 Å²	45.2	42%	0.415	23%	0.23	S	C	.	.	H	α-helix	trans	-71.1	-36.4	176.6	-71.9	170.8	-172	-160.9	2.2	112.5	N370 L371 F372 A378	N370-R374 VanDerWaalsContact O-CD 3.28Å; N370-R374 WeakPolarHBondContact O-CD 3.32Å; N370-R374 WeakPolarHBondContact O-CG 3.47Å; N370-R374 PolarHBondContact O-NE 3.27Å; L371-R374 CarbonylContact O-C 3.58Å; L371-R374 WeakPolarHBondContact O-CA 3.47Å; L371-R374 WeakPolarHBondContact O-CB 3.48Å; L371-R374 PolarHBondContact O-N 2.91Å; L371-R374 VanDerWaalsContact O-N 3.14Å; F372-R374 PolarHBondContact O-N 3.46Å; R374-A378 WeakPolarHBondContact O-CB 3.5Å; R374-A378 PolarHBondContact O-N 3.25Å
375	T	87.7	Confident	84.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.5	-50.5	172.7	55	0	0	0	0	110	L357 M367 L371 F372 N377 A378 F379	L357-T375 HydrophobicContact CB-CG2 3.63Å; L357-T375 HydrophobicContact CD1-CG2 3.59Å; L357-T375 HydrophobicContact CG-CG2 4.15Å; M367-T375 HydrophobicContact CE-CG2 4.05Å; M367-T375 HydrophobicContact SD-CG2 3.74Å; L371-T375 PolarHBondContact O-N 2.71Å; F372-T375 WeakPolarHBondContact CA-OG1 3.38Å; F372-T375 PolarHBondContact O-N 3.43Å; F372-T375 PolarHBondContact O-OG1 2.97Å; T375-N377 PolarHBondContact O-N 3.05Å; T375-A378 CarbonylContact O-C 3.54Å; T375-A378 WeakPolarHBondContact O-CA 3.43Å; T375-A378 VanDerWaalsContact O-CB 3.31Å; T375-A378 WeakPolarHBondContact O-CB 3.49Å; T375-A378 PolarHBondContact O-N 2.95Å; T375-F379 WeakPolarHBondContact O-CD2 3.33Å; T375-F379 PolarHBondContact O-N 3.29Å
376	L	89.4	Confident	85	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-55.5	-48.2	177.7	-66.4	173.8	0	0	0	111.8	F372 A378 F379 D380 L422 D446 R449 V450 I453	F372-L376 HydrophobicContact CD1-CD1 3.84Å; F372-L376 HydrophobicContact CD1-CG 4.32Å; F372-L376 HydrophobicContact CE1-CD1 3.78Å; F372-L376 HydrophobicContact CE1-CD2 4.44Å; F372-L376 HydrophobicContact CE1-CG 4.23Å; F372-L376 WeakPolarHBondContact O-CG 3.31Å; F372-L376 PolarHBondContact O-N 3.31Å; L376-A378 PolarHBondContact O-N 3.36Å; L376-F379 PolarHBondContact O-N 2.98Å; L376-F379 VanDerWaalsContact O-N 3.12Å; L376-D380 PolarHBondContact O-N 3.22Å; L376-L422 HydrophobicContact CD2-CD1 4.02Å; L376-L422 HydrophobicContact CD2-CD2 4.21Å; L376-D446 HydrophobicContact CD1-CB 4.05Å; L376-R449 HydrophobicContact CD1-CB 4.28Å; L376-R449 HydrophobicContact CD2-CB 4.39Å; L376-V450 HydrophobicContact CD2-CG2 3.83Å; L376-I453 HydrophobicContact CD2-CD1 3.65Å
377	N	90.8	Very high	85.3	Confident	73 Å²	73	37.9 Å²	37.9	39%	0.39	19%	0.191	S	C	.	.	H	α-helix	trans	-63.6	-25.4	175.2	-69.4	-22.7	0	0	0	113.1	D373 T375 R381 R449	D373-N377 VanDerWaalsContact O-CB 3.25Å; D373-N377 WeakPolarHBondContact O-CB 3.23Å; D373-N377 PolarHBondContact O-N 2.99Å; D373-N377 PolarHBondContact O-ND2 2.95Å; D373-N377 VanDerWaalsContact O-ND2 3.08Å; T375-N377 PolarHBondContact O-N 3.05Å; N377-R381 WeakPolarHBondContact O-CG 3.29Å; N377-R381 PolarHBondContact O-N 2.79Å; N377-R381 PolarHBondContact O-NE 2.94Å; N377-R449 PolarHBondContact OD1-NH2 3.49Å
378	A	88.2	Confident	85.1	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-77.2	-37.2	172.5	0	0	0	0	0	112.3	F353 I354 R374 T375 L376 L382	F353-A378 HydrophobicContact CD1-CB 3.86Å; F353-A378 HydrophobicContact CE1-CB 3.87Å; I354-A378 HydrophobicContact CD1-CB 4.16Å; I354-A378 HydrophobicContact CG1-CB 3.78Å; R374-A378 WeakPolarHBondContact O-CB 3.5Å; R374-A378 PolarHBondContact O-N 3.25Å; T375-A378 CarbonylContact O-C 3.54Å; T375-A378 WeakPolarHBondContact O-CA 3.43Å; T375-A378 VanDerWaalsContact O-CB 3.31Å; T375-A378 WeakPolarHBondContact O-CB 3.49Å; T375-A378 PolarHBondContact O-N 2.95Å; L376-A378 PolarHBondContact O-N 3.36Å; A378-L382 VanDerWaalsContact O-CB 3.25Å; A378-L382 WeakPolarHBondContact O-CB 3.3Å; A378-L382 PolarHBondContact O-N 3.02Å
379	F	89.3	Confident	84.3	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.4	-45.7	172.5	-80.5	-76.9	0	0	0	112	I354 F358 T375 L376 R381 L382 F383 V418 V419 L422 I453	I354-F379 HydrophobicContact CD1-CD1 4.33Å; I354-F379 HydrophobicContact CD1-CE1 4.36Å; I354-F379 HydrophobicContact CD1-CG 4.46Å; I354-F379 HydrophobicContact CD1-CZ 4.48Å; I354-F379 HydrophobicContact CG2-CE1 4.46Å; I354-F379 HydrophobicContact CG2-CE2 3.9Å; I354-F379 HydrophobicContact CG2-CZ 3.71Å; F358-F379 HydrophobicContact CE2-CE2 4.47Å; F358-F379 HydrophobicContact CE2-CZ 4.18Å; F358-F379 HydrophobicContact CZ-CE2 4.06Å; F358-F379 HydrophobicContact CZ-CZ 4.04Å; T375-F379 WeakPolarHBondContact O-CD2 3.33Å; T375-F379 PolarHBondContact O-N 3.29Å; L376-F379 PolarHBondContact O-N 2.98Å; L376-F379 VanDerWaalsContact O-N 3.12Å; F379-R381 PolarHBondContact O-N 2.94Å; F379-L382 PolarHBondContact O-N 3.48Å; F379-F383 HydrophobicContact CD1-CE2 4.24Å; F379-F383 WeakPolarHBondContact O-CD2 3.46Å; F379-F383 PolarHBondContact O-N 3.31Å; F379-V418 HydrophobicContact CE1-CG1 3.75Å; F379-V418 HydrophobicContact CZ-CG1 3.71Å; F379-V418 WeakPolarHBondContact CZ-O 3.38Å; F379-V419 HydrophobicContact CD1-CG2 4.32Å; F379-V419 HydrophobicContact CE1-CG2 3.86Å; F379-L422 HydrophobicContact CD2-CD1 4.18Å; F379-L422 HydrophobicContact CD2-CD2 3.76Å; F379-L422 HydrophobicContact CD2-CG 4.41Å; F379-L422 HydrophobicContact CE1-CD2 4.5Å; F379-L422 HydrophobicContact CE2-CB 3.82Å; F379-L422 HydrophobicContact CE2-CD1 3.84Å; F379-L422 HydrophobicContact CE2-CD2 3.77Å; F379-L422 HydrophobicContact CE2-CG 4.01Å; F379-L422 HydrophobicContact CG-CD2 4.17Å; F379-L422 HydrophobicContact CZ-CB 3.79Å; F379-L422 HydrophobicContact CZ-CD2 4.14Å; F379-L422 HydrophobicContact CZ-CG 4.41Å; F379-I453 HydrophobicContact CB-CD1 3.76Å; F379-I453 HydrophobicContact CB-CG1 4.25Å; F379-I453 HydrophobicContact CB-CG2 4.2Å; F379-I453 HydrophobicContact CD1-CG2 4.23Å; F379-I453 HydrophobicContact CG-CD1 4.44Å; F379-I453 HydrophobicContact CG-CG2 4.35Å
380	D	89.4	Confident	83.4	Confident	38 Å²	38	45.3 Å²	45.3	20%	0.203	22%	0.224	C	C	.	.	H	α-helix	trans	-55.5	-52	176.8	-74.2	-39.2	0	0	0	110.5	L376 L382 F383 D384 R449	L376-D380 PolarHBondContact O-N 3.22Å; D380-L382 PolarHBondContact O-N 3.08Å; D380-F383 PolarHBondContact O-N 3.46Å; D380-D384 VanDerWaalsContact O-CG 3.24Å; D380-D384 PolarHBondContact O-N 2.88Å; D380-R449 IonicContact OD2-CZ 2.73Å; D380-R449 IonicContact OD2-NE 2.66Å; D380-R449 IonicContact OD2-NH2 2.79Å; D380-R449 PolarHBondContact OD2-NH2 2.78Å
381	R	86.6	Confident	82.6	Confident	73 Å²	73	39.6 Å²	39.6	28%	0.275	19%	0.194	S	C	.	.	H	α-helix	trans	-57.5	-44.5	174.4	-75	178	-72.9	164.3	-1.7	113.3	E333 N377 F379 D384 L385	E333-R381 IonicContact OE1-CZ 3.63Å; E333-R381 IonicContact OE1-NH1 2.87Å; E333-R381 PolarHBondContact OE1-NH1 3.2Å; E333-R381 IonicContact OE2-CZ 3.83Å; E333-R381 IonicContact OE2-NH1 2.69Å; E333-R381 PolarHBondContact OE2-NH1 3.22Å; N377-R381 WeakPolarHBondContact O-CG 3.29Å; N377-R381 PolarHBondContact O-N 2.79Å; N377-R381 PolarHBondContact O-NE 2.94Å; F379-R381 PolarHBondContact O-N 2.94Å; R381-D384 PolarHBondContact O-N 3.19Å; R381-L385 WeakPolarHBondContact O-CD1 3.39Å; R381-L385 WeakPolarHBondContact O-CG 3.32Å; R381-L385 PolarHBondContact O-N 3.13Å; R381-L385 VanDerWaalsContact O-N 3.16Å
382	L	87	Confident	81.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-45.4	178.6	178.8	70.3	0	0	0	111.1	V347 L350 F351 I354 A378 F379 D380 L385 L386	V347-L382 HydrophobicContact CG1-CD1 4Å; L350-L382 HydrophobicContact CB-CD1 4.01Å; L350-L382 HydrophobicContact CD1-CB 4.47Å; L350-L382 HydrophobicContact CD1-CD1 4.43Å; F351-L382 HydrophobicContact CD1-CD2 4.19Å; F351-L382 HydrophobicContact CD2-CD1 4.36Å; F351-L382 HydrophobicContact CE1-CD1 4.43Å; F351-L382 HydrophobicContact CE1-CD2 3.78Å; F351-L382 HydrophobicContact CE2-CD1 4.11Å; F351-L382 HydrophobicContact CZ-CD1 4.14Å; F351-L382 HydrophobicContact CZ-CD2 4.14Å; I354-L382 HydrophobicContact CD1-CD2 3.85Å; A378-L382 VanDerWaalsContact O-CB 3.25Å; A378-L382 WeakPolarHBondContact O-CB 3.3Å; A378-L382 PolarHBondContact O-N 3.02Å; F379-L382 PolarHBondContact O-N 3.48Å; D380-L382 PolarHBondContact O-N 3.08Å; L382-L385 PolarHBondContact O-N 3.36Å; L382-L386 HydrophobicContact CD1-CD1 4.18Å; L382-L386 HydrophobicContact CD1-CG 4.39Å; L382-L386 HydrophobicContact CD2-CD1 4.37Å; L382-L386 HydrophobicContact CG-CD1 3.79Å; L382-L386 HydrophobicContact CG-CG 4.4Å; L382-L386 WeakPolarHBondContact O-CB 3.19Å; L382-L386 WeakPolarHBondContact O-CD1 3.2Å; L382-L386 WeakPolarHBondContact O-CG 3.37Å; L382-L386 PolarHBondContact O-N 3.09Å
383	F	85.5	Confident	80.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-69.7	-34.3	179.6	-86.1	-72.2	0	0	0	113.2	F379 D380 L386 N387 I415 V419 I453 R456 L457	F379-F383 HydrophobicContact CD1-CE2 4.24Å; F379-F383 WeakPolarHBondContact O-CD2 3.46Å; F379-F383 PolarHBondContact O-N 3.31Å; D380-F383 PolarHBondContact O-N 3.46Å; F383-L386 HydrophobicContact CD1-CD1 4.45Å; F383-L386 PolarHBondContact O-N 3.12Å; F383-N387 PolarHBondContact O-N 2.89Å; F383-N387 VanDerWaalsContact O-N 3.08Å; F383-N387 PolarHBondContact O-ND2 2.93Å; F383-I415 HydrophobicContact CE1-CG2 4.42Å; F383-I415 HydrophobicContact CZ-CG2 3.8Å; F383-V419 HydrophobicContact CE2-CG2 4.26Å; F383-V419 HydrophobicContact CZ-CG2 4.24Å; F383-I453 HydrophobicContact CD2-CG2 4.13Å; F383-I453 HydrophobicContact CE2-CG2 3.64Å; F383-R456 HydrophobicContact CD1-CB 3.94Å; F383-R456 HydrophobicContact CE1-CB 4.3Å; F383-R456 HydrophobicContact CG-CB 4.1Å; F383-L457 HydrophobicContact CE1-CB 4.27Å; F383-L457 HydrophobicContact CZ-CB 3.94Å; F383-L457 HydrophobicContact CZ-CD1 4.29Å
384	D	86.7	Confident	79	Confident	77 Å²	77	42.5 Å²	42.5	41%	0.412	21%	0.206	S	C	.	.	H	α-helix	trans	-62.8	-47.7	174.7	-65.3	-21	0	0	0	110.2	D380 R381 L386 N387 E388 R456	D380-D384 VanDerWaalsContact O-CG 3.24Å; D380-D384 PolarHBondContact O-N 2.88Å; R381-D384 PolarHBondContact O-N 3.19Å; D384-L386 PolarHBondContact O-N 3.29Å; D384-N387 PolarHBondContact O-N 3.44Å; D384-E388 PolarHBondContact O-N 2.9Å; D384-R456 IonicContact OD1-CZ 2.76Å; D384-R456 IonicContact OD1-NH1 3.73Å; D384-R456 PolarHBondContact OD1-NH1 3.15Å; D384-R456 IonicContact OD1-NH2 3.08Å; D384-R456 PolarHBondContact OD1-NH2 3.48Å
385	L	81.9	Confident	77.7	Confident	27 Å²	27	40.5 Å²	40.5	14%	0.141	21%	0.213	C	C	.	.	H	α-helix	trans	-64	-38.7	176	-67.4	161.5	0	0	0	113.6	H346 V347 L350 R381 L382 N387 E388 I389	H346-L385 WeakPolarHBondContact CD2-CD1 3.42Å; H346-L385 WeakPolarHBondContact NE2-CD1 3.49Å; V347-L385 HydrophobicContact CG2-CB 4.07Å; V347-L385 HydrophobicContact CG2-CD1 4.49Å; L350-L385 HydrophobicContact CD1-CD1 3.32Å; R381-L385 WeakPolarHBondContact O-CD1 3.39Å; R381-L385 WeakPolarHBondContact O-CG 3.32Å; R381-L385 PolarHBondContact O-N 3.13Å; R381-L385 VanDerWaalsContact O-N 3.16Å; L382-L385 PolarHBondContact O-N 3.36Å; L385-N387 VanDerWaalsContact C-N 3.28Å; L385-N387 PolarHBondContact O-N 3.08Å; L385-E388 PolarHBondContact O-N 3.49Å; L385-I389 WeakPolarHBondContact O-CD1 3.33Å; L385-I389 WeakPolarHBondContact O-CG1 3.25Å; L385-I389 PolarHBondContact O-N 2.61Å
386	L	80.4	Confident	76.4	Confident	3 Å²	3	45 Å²	45	2%	0.016	24%	0.236	C	C	.	.	H	α-helix	trans	-68.1	-25.7	177.3	-76.6	169.8	0	0	0	113.1	V347 L382 F383 D384 I391 L393 I415 Y460	V347-L386 HydrophobicContact CG1-CD2 4.33Å; L382-L386 HydrophobicContact CD1-CD1 4.18Å; L382-L386 HydrophobicContact CD1-CG 4.39Å; L382-L386 HydrophobicContact CD2-CD1 4.37Å; L382-L386 HydrophobicContact CG-CD1 3.79Å; L382-L386 HydrophobicContact CG-CG 4.4Å; L382-L386 WeakPolarHBondContact O-CB 3.19Å; L382-L386 WeakPolarHBondContact O-CD1 3.2Å; L382-L386 WeakPolarHBondContact O-CG 3.37Å; L382-L386 PolarHBondContact O-N 3.09Å; F383-L386 HydrophobicContact CD1-CD1 4.45Å; F383-L386 PolarHBondContact O-N 3.12Å; D384-L386 PolarHBondContact O-N 3.29Å; L386-I391 HydrophobicContact CD2-CD1 4.3Å; L386-L393 HydrophobicContact CD2-CD1 4.35Å; L386-I415 HydrophobicContact CD1-CD1 3.51Å; L386-I415 HydrophobicContact CD1-CG1 4.25Å; L386-I415 HydrophobicContact CD2-CD1 4.41Å; L386-Y460 HydrophobicContact CB-CD2 4.28Å; L386-Y460 HydrophobicContact CB-CE2 3.81Å; L386-Y460 HydrophobicContact CD2-CE2 4.32Å
387	N	78.3	Confident	74.7	Confident	75 Å²	75	50.2 Å²	50.2	40%	0.401	26%	0.264	S	S	.	.	H	α-helix	trans	-79.8	-29.7	174.7	-81.9	-63.8	0	0	0	112.6	F383 D384 L385	F383-N387 PolarHBondContact O-N 2.89Å; F383-N387 VanDerWaalsContact O-N 3.08Å; F383-N387 PolarHBondContact O-ND2 2.93Å; D384-N387 PolarHBondContact O-N 3.44Å; L385-N387 VanDerWaalsContact C-N 3.28Å; L385-N387 PolarHBondContact O-N 3.08Å
388	E	75.7	Confident	73.1	Confident	130 Å²	130	48.7 Å²	48.7	61%	0.607	26%	0.259	S	S	*	.	H	α-helix	trans	-74.2	-24.5	175.4	-73.8	-171.6	-165.7	0	0	113.6	R343 D384 L385	R343-E388 IonicContact CZ-OE2 2.94Å; R343-E388 IonicContact NH1-OE2 3.32Å; R343-E388 PolarHBondContact NH1-OE2 2.78Å; D384-E388 PolarHBondContact O-N 2.9Å; L385-E388 PolarHBondContact O-N 3.49Å
389	I	64.8	Low	71.5	Confident	7 Å²	7	56.2 Å²	56.2	4%	0.036	30%	0.3	C	S	.	.	S	Bend	trans	-127.8	131.1	-163.3	-47.5	161.7	0	0	0	112.5	R343 L385 I391 Y409 K464	R343-I389 HydrophobicContact CB-CD1 3.46Å; R343-I389 VanDerWaalsContact CB-CD1 3.46Å; R343-I389 HydrophobicContact CG-CD1 4.21Å; L385-I389 WeakPolarHBondContact O-CD1 3.33Å; L385-I389 WeakPolarHBondContact O-CG1 3.25Å; L385-I389 PolarHBondContact O-N 2.61Å; I389-I391 HydrophobicContact CB-CD1 4.27Å; I389-I391 HydrophobicContact CB-CG1 3.86Å; I389-I391 HydrophobicContact CD1-CD1 4.38Å; I389-I391 HydrophobicContact CG2-CD1 4.17Å; I389-I391 HydrophobicContact CG2-CG1 3.5Å; I389-I391 VanDerWaalsContact CG2-CG1 3.5Å; I389-I391 PolarHBondContact O-N 2.99Å; I389-Y409 HydrophobicContact CG2-CD2 3.62Å; I389-Y409 HydrophobicContact CG2-CE2 3.8Å; I389-K464 PolarHBondContact O-NZ 3.45Å
390	N	62.1	Low	70	Confident	141 Å²	141	59.5 Å²	59.5	75%	0.754	32%	0.317	S	S	*	.			trans	-75.6	62.2	171.5	-77.5	-29.6	0	0	0	112.6
391	I	65.4	Low	68.7	Low	3 Å²	3	64.4 Å²	64.4	2%	0.015	34%	0.343	C	S	.	.			trans	-73	131	171.8	-54.7	-173	0	0	0	109.7	V347 L386 I389 L393 Y409 I411 K464	V347-I391 HydrophobicContact CB-CD1 3.92Å; V347-I391 HydrophobicContact CG1-CD1 3.89Å; V347-I391 HydrophobicContact CG2-CD1 3.65Å; L386-I391 HydrophobicContact CD2-CD1 4.3Å; I389-I391 HydrophobicContact CB-CD1 4.27Å; I389-I391 HydrophobicContact CB-CG1 3.86Å; I389-I391 HydrophobicContact CD1-CD1 4.38Å; I389-I391 HydrophobicContact CG2-CD1 4.17Å; I389-I391 HydrophobicContact CG2-CG1 3.5Å; I389-I391 VanDerWaalsContact CG2-CG1 3.5Å; I389-I391 PolarHBondContact O-N 2.99Å; I391-L393 HydrophobicContact CG2-CD2 4.02Å; I391-L393 HydrophobicContact CG2-CG 4.19Å; I391-Y409 HydrophobicContact CG1-CD2 4.32Å; I391-Y409 WeakPolarHBondContact CG2-O 3.45Å; I391-I411 HydrophobicContact CD1-CD1 4.15Å; I391-I411 HydrophobicContact CG2-CB 4.32Å; I391-I411 HydrophobicContact CG2-CD1 3.87Å; I391-I411 HydrophobicContact CG2-CG1 4.13Å; I391-K464 PolarHBondContact O-NZ 3.49Å
392	Q	61.3	Low	67.7	Low	98 Å²	98	64.1 Å²	64.1	46%	0.458	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	102	166.2	-71.6	-177.1	-15.7	0	0	108.1	I394 P408 Y409 R410 I411	Q392-I394 PolarHBondContact O-N 2.94Å; Q392-P408 HydrophobicContact CG-CB 4.16Å; Q392-Y409 PolarHBondContact N-O 3.25Å; Q392-R410 HydrophobicContact CB-CG 4.43Å; Q392-R410 WeakPolarHBondContact O-CA 3.34Å; Q392-I411 PolarHBondContact O-N 2.69Å
393	L	61.3	Low	66.5	Low	18 Å²	18	66 Å²	66	9%	0.094	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	116.5	174.9	-60.4	157.6	0	0	0	108.3	F351 L386 I391 I411 A413 I415 Y460 Y466	F351-L393 HydrophobicContact CE2-CD2 3.77Å; F351-L393 HydrophobicContact CZ-CD2 4.01Å; L386-L393 HydrophobicContact CD2-CD1 4.35Å; I391-L393 HydrophobicContact CG2-CD2 4.02Å; I391-L393 HydrophobicContact CG2-CG 4.19Å; L393-I411 CarbonylContact C-O 3.4Å; L393-I411 WeakPolarHBondContact CA-O 3.46Å; L393-I411 HydrophobicContact CD2-CB 4.14Å; L393-I411 HydrophobicContact CD2-CG2 4.2Å; L393-A413 HydrophobicContact CD2-CB 4.48Å; L393-I415 HydrophobicContact CD1-CD1 3.25Å; L393-I415 HydrophobicContact CD1-CG1 3.77Å; L393-Y460 HydrophobicContact CD1-CE1 4.07Å; L393-Y460 WeakPolarHBondContact CD1-OH 3.4Å; L393-Y466 WeakPolarHBondContact CB-OH 3.29Å; L393-Y466 PolarHBondContact O-OH 3.27Å
394	I	59.6	Low	65.5	Low	20 Å²	20	67.1 Å²	67.1	10%	0.103	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	136	-179.3	-59	-163.6	0	0	0	108.4	Q392 L396 S398 D400 R410 I411 K412 A413	Q392-I394 PolarHBondContact O-N 2.94Å; I394-L396 PolarHBondContact O-N 3.16Å; I394-S398 VanDerWaalsContact CG2-CB 3.47Å; I394-D400 HydrophobicContact CD1-CB 3.57Å; I394-D400 HydrophobicContact CG2-CB 4.36Å; I394-R410 HydrophobicContact CD1-CB 3.66Å; I394-R410 HydrophobicContact CD1-CG 3.8Å; I394-R410 HydrophobicContact CG1-CB 4.18Å; I394-R410 HydrophobicContact CG1-CG 4.41Å; I394-I411 PolarHBondContact N-O 2.64Å; I394-K412 HydrophobicContact CB-CG 4.35Å; I394-K412 HydrophobicContact CG2-CG 4.44Å; I394-K412 WeakPolarHBondContact O-CA 3.47Å; I394-A413 PolarHBondContact O-N 3.19Å
395	A	60.3	Low	64.2	Low	68 Å²	68	69.3 Å²	69.3	56%	0.562	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-56.7	139.3	173.3	0	0	0	0	0	110.1	D397 S398	A395-D397 PolarHBondContact O-N 3.47Å; A395-S398 PolarHBondContact O-N 3.42Å
396	L	60.3	Low	63.2	Low	95 Å²	95	74.4 Å²	74.4	50%	0.497	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-29	-175.4	-70.1	166.8	0	0	0	113.5	I394 K412	I394-L396 PolarHBondContact O-N 3.16Å; L396-K412 HydrophobicContact CD2-CB 4.45Å
397	D	54.2	Low	62.3	Low	108 Å²	108	81.3 Å²	81.3	58%	0.578	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	2.5	-174.9	-54.2	-32.3	0	0	0	113.5	M1 A395	M1-D397 WeakPolarHBondContact CG-OD1 3.47Å; M1-D397 VanDerWaalsContact N-CG 3.26Å; M1-D397 PolarHBondContact N-OD1 2.98Å; M1-D397 PolarHBondContact N-OD2 3.15Å; A395-D397 PolarHBondContact O-N 3.47Å
398	S	57.5	Low	61.6	Low	42 Å²	42	80.6 Å²	80.6	29%	0.294	43%	0.425	S	S	.	.			trans	-84.2	144.9	175.2	-163.6	0	0	0	0	113.1	I394 A395 D400 K412	I394-S398 VanDerWaalsContact CG2-CB 3.47Å; A395-S398 PolarHBondContact O-N 3.42Å; S398-D400 VanDerWaalsContact C-N 3.29Å; S398-D400 PolarHBondContact O-N 3.35Å; S398-D400 PolarHBondContact OG-OD2 3.43Å; S398-K412 WeakPolarHBondContact O-CE 3.33Å; S398-K412 PolarHBondContact O-NZ 3.23Å
399	N	54.4	Low	61.2	Low	158 Å²	158	75.6 Å²	75.6	85%	0.845	40%	0.401	S	S	*	.			trans	-78.2	-6.1	176.9	-72.8	-31.6	0	0	0	114.2
400	D	58.3	Low	61.3	Low	69 Å²	69	79.5 Å²	79.5	37%	0.369	42%	0.415	S	S	.	.			trans	-58.2	143.2	-179.9	-62.1	-66.6	0	0	0	112.8	I394 S398 K412	I394-D400 HydrophobicContact CD1-CB 3.57Å; I394-D400 HydrophobicContact CG2-CB 4.36Å; S398-D400 VanDerWaalsContact C-N 3.29Å; S398-D400 PolarHBondContact O-N 3.35Å; S398-D400 PolarHBondContact OG-OD2 3.43Å; D400-K412 WeakPolarHBondContact O-CE 3.31Å; D400-K412 PolarHBondContact O-NZ 3Å
401	D	61.5	Low	61.7	Low	141 Å²	141	72.8 Å²	72.8	75%	0.754	38%	0.379	S	S	*	.			trans	-73.1	148.3	176.4	-67.7	-51.6	0	0	0	112.8	S403	D401-S403 PolarHBondContact O-N 3.33Å
402	E	66.1	Low	62	Low	67 Å²	67	75.1 Å²	75.1	31%	0.313	39%	0.389	S	S	.	.			trans	-81.2	111.2	176.2	-58.6	-159.8	97.8	0	0	110.9	K348 F404 R410 K412	K348-E402 VanDerWaalsContact NZ-CD 3.33Å; K348-E402 IonicContact NZ-OE1 2.88Å; K348-E402 PolarHBondContact NZ-OE1 2.74Å; K348-E402 IonicContact NZ-OE2 3.31Å; K348-E402 PolarHBondContact NZ-OE2 2.88Å; K348-E402 VanDerWaalsContact NZ-OE2 3.16Å; E402-F404 HydrophobicContact CB-CD2 4.4Å; E402-F404 HydrophobicContact CB-CE1 4.05Å; E402-F404 HydrophobicContact CB-CE2 3.71Å; E402-F404 HydrophobicContact CB-CZ 3.51Å; E402-F404 HydrophobicContact CG-CZ 4.12Å; E402-F404 WeakPolarHBondContact OE2-CZ 3.18Å; E402-R410 CarbonylContact C-O 3.54Å; E402-R410 VanDerWaalsContact CA-O 3.29Å; E402-R410 WeakPolarHBondContact CA-O 3.27Å; E402-K412 HydrophobicContact CG-CB 4.44Å; E402-K412 HydrophobicContact CG-CD 4.16Å; E402-K412 HydrophobicContact CG-CG 3.95Å; E402-K412 WeakPolarHBondContact OE1-CB 3.38Å; E402-K412 PolarHBondContact OE1-N 3.37Å
403	S	62	Low	62.5	Low	38 Å²	38	71 Å²	71	27%	0.266	37%	0.371	S	S	.	.			trans	-94	101.4	173.4	53.8	0	0	0	0	110.5	D401 P408 Y409 R410	D401-S403 PolarHBondContact O-N 3.33Å; S403-P408 PolarHBondContact OG-O 2.86Å; S403-Y409 WeakPolarHBondContact O-CA 3.4Å; S403-R410 PolarHBondContact N-O 3.4Å; S403-R410 PolarHBondContact O-N 3.23Å; S403-R410 VanDerWaalsContact OG-CB 3.24Å; S403-R410 WeakPolarHBondContact OG-CB 3.35Å; S403-R410 WeakPolarHBondContact OG-CG 3.37Å; S403-R410 PolarHBondContact OG-N 3.44Å; S403-R410 VanDerWaalsContact OG-N 3.16Å
404	F	63.1	Low	63.3	Low	24 Å²	24	71.9 Å²	71.9	11%	0.105	38%	0.379	C	S	.	.			trans	-93.8	-16.9	176.6	-55.6	-63	0	0	0	113.8	F301 S342 K348 E402 Y409 I411	F301-F404 HydrophobicContact CE2-CB 4.05Å; F301-F404 HydrophobicContact CZ-CB 3.71Å; S342-F404 WeakPolarHBondContact CB-O 3.46Å; S342-F404 PolarHBondContact OG-O 3.33Å; K348-F404 HydrophobicContact CB-CD1 4.37Å; K348-F404 HydrophobicContact CB-CE1 3.81Å; K348-F404 HydrophobicContact CD-CE1 3.88Å; K348-F404 HydrophobicContact CD-CZ 4.11Å; K348-F404 HydrophobicContact CG-CE1 3.74Å; K348-F404 HydrophobicContact CG-CZ 4.01Å; E402-F404 HydrophobicContact CB-CD2 4.4Å; E402-F404 HydrophobicContact CB-CE1 4.05Å; E402-F404 HydrophobicContact CB-CE2 3.71Å; E402-F404 HydrophobicContact CB-CZ 3.51Å; E402-F404 HydrophobicContact CG-CZ 4.12Å; E402-F404 WeakPolarHBondContact OE2-CZ 3.18Å; F404-Y409 WeakPolarHBondContact O-CE1 3.33Å; F404-I411 HydrophobicContact CD1-CG1 4.34Å; F404-I411 HydrophobicContact CE1-CG1 4.23Å
405	E	59.3	Low	64.5	Low	124 Å²	124	71.3 Å²	71.3	58%	0.579	38%	0.376	S	S	*	.	S	Bend	trans	-98.6	-29.2	-168.4	-163.6	172.3	175.9	0	0	114	F301	F301-E405 HydrophobicContact CE1-CB 4.07Å; F301-E405 HydrophobicContact CE1-CG 4.25Å; F301-E405 HydrophobicContact CZ-CB 3.76Å; F301-E405 HydrophobicContact CZ-CG 4.21Å
406	H	61.1	Low	65.6	Low	134 Å²	134	69.8 Å²	69.8	62%	0.62	36%	0.359	S	S	*	.	S	Bend	trans	-131.6	147.5	-176	-61.7	-21.6	0	0	0	111.4	P408	H406-P408 CarbonylContact O-C 3.59Å
407	E	61.9	Low	66.8	Low	148 Å²	148	68.5 Å²	68.5	69%	0.692	36%	0.355	S	S	*	.	S	Bend	trans	-71	141	171.9	-68.4	-174.8	169.9	0	0	111.1	Y409	E407-Y409 HydrophobicContact CG-CD2 3.95Å; E407-Y409 HydrophobicContact CG-CE2 3.48Å; E407-Y409 VanDerWaalsContact CG-CE2 3.48Å
408	P	63.2	Low	68.4	Low	59 Å²	59	64 Å²	64	38%	0.383	33%	0.331	S	S	.	.	S	Bend	cis	-73.2	133	-2.1	30.7	-34.3	0	0	0	111.7	Q392 S403 H406 R410	Q392-P408 HydrophobicContact CG-CB 4.16Å; S403-P408 PolarHBondContact OG-O 2.86Å; H406-P408 CarbonylContact O-C 3.59Å; P408-R410 PolarHBondContact O-N 3.07Å
409	Y	67.1	Low	69.9	Low	26 Å²	26	62 Å²	62	10%	0.102	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-66.2	120.5	174	-61.2	-68.5	0	0	0	109.6	S342 I389 I391 Q392 S403 F404 E407	S342-Y409 VanDerWaalsContact OG-CE1 3.29Å; S342-Y409 WeakPolarHBondContact OG-CE1 3.44Å; I389-Y409 HydrophobicContact CG2-CD2 3.62Å; I389-Y409 HydrophobicContact CG2-CE2 3.8Å; I391-Y409 HydrophobicContact CG1-CD2 4.32Å; I391-Y409 WeakPolarHBondContact CG2-O 3.45Å; Q392-Y409 PolarHBondContact N-O 3.25Å; S403-Y409 WeakPolarHBondContact O-CA 3.4Å; F404-Y409 WeakPolarHBondContact O-CE1 3.33Å; E407-Y409 HydrophobicContact CG-CD2 3.95Å; E407-Y409 HydrophobicContact CG-CE2 3.48Å; E407-Y409 VanDerWaalsContact CG-CE2 3.48Å
410	R	67.2	Low	71.5	Confident	89 Å²	89	55.1 Å²	55.1	34%	0.336	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	111.3	179.2	-69.2	173	168.6	-156.3	-1.5	109.6	Q392 I394 E402 S403 P408	Q392-R410 HydrophobicContact CB-CG 4.43Å; Q392-R410 WeakPolarHBondContact O-CA 3.34Å; I394-R410 HydrophobicContact CD1-CB 3.66Å; I394-R410 HydrophobicContact CD1-CG 3.8Å; I394-R410 HydrophobicContact CG1-CB 4.18Å; I394-R410 HydrophobicContact CG1-CG 4.41Å; E402-R410 CarbonylContact C-O 3.54Å; E402-R410 VanDerWaalsContact CA-O 3.29Å; E402-R410 WeakPolarHBondContact CA-O 3.27Å; S403-R410 PolarHBondContact N-O 3.4Å; S403-R410 PolarHBondContact O-N 3.23Å; S403-R410 VanDerWaalsContact OG-CB 3.24Å; S403-R410 WeakPolarHBondContact OG-CB 3.35Å; S403-R410 WeakPolarHBondContact OG-CG 3.37Å; S403-R410 PolarHBondContact OG-N 3.44Å; S403-R410 VanDerWaalsContact OG-N 3.16Å; P408-R410 PolarHBondContact O-N 3.07Å
411	I	70.5	Confident	72.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	122.8	-174.2	-64.2	179.6	0	0	0	108.6	G344 V347 K348 F351 I391 Q392 L393 I394 F404 A413	G344-I411 WeakPolarHBondContact O-CD1 3.41Å; V347-I411 HydrophobicContact CB-CD1 3.9Å; V347-I411 HydrophobicContact CG1-CD1 3.7Å; K348-I411 HydrophobicContact CD-CG2 3.82Å; F351-I411 HydrophobicContact CD2-CG2 4.18Å; F351-I411 HydrophobicContact CE2-CG2 4.32Å; I391-I411 HydrophobicContact CD1-CD1 4.15Å; I391-I411 HydrophobicContact CG2-CB 4.32Å; I391-I411 HydrophobicContact CG2-CD1 3.87Å; I391-I411 HydrophobicContact CG2-CG1 4.13Å; Q392-I411 PolarHBondContact O-N 2.69Å; L393-I411 CarbonylContact C-O 3.4Å; L393-I411 WeakPolarHBondContact CA-O 3.46Å; L393-I411 HydrophobicContact CD2-CB 4.14Å; L393-I411 HydrophobicContact CD2-CG2 4.2Å; I394-I411 PolarHBondContact N-O 2.64Å; F404-I411 HydrophobicContact CD1-CG1 4.34Å; F404-I411 HydrophobicContact CE1-CG1 4.23Å; I411-A413 HydrophobicContact CG2-CB 4.07Å; I411-A413 PolarHBondContact O-N 2.82Å; I411-A413 VanDerWaalsContact O-N 3.15Å
412	K	72	Confident	74.2	Confident	52 Å²	52	48.8 Å²	48.8	23%	0.226	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	97.3	169.6	-64.9	-176.9	-168.5	-166.3	0	109.2	K348 I394 L396 S398 D400 E402	K348-K412 PolarHBondContact NZ-O 3.17Å; I394-K412 HydrophobicContact CB-CG 4.35Å; I394-K412 HydrophobicContact CG2-CG 4.44Å; I394-K412 WeakPolarHBondContact O-CA 3.47Å; L396-K412 HydrophobicContact CD2-CB 4.45Å; S398-K412 WeakPolarHBondContact O-CE 3.33Å; S398-K412 PolarHBondContact O-NZ 3.23Å; D400-K412 WeakPolarHBondContact O-CE 3.31Å; D400-K412 PolarHBondContact O-NZ 3Å; E402-K412 HydrophobicContact CG-CB 4.44Å; E402-K412 HydrophobicContact CG-CD 4.16Å; E402-K412 HydrophobicContact CG-CG 3.95Å; E402-K412 WeakPolarHBondContact OE1-CB 3.38Å; E402-K412 PolarHBondContact OE1-N 3.37Å
413	A	71.9	Confident	75.3	Confident	10 Å²	10	45.9 Å²	45.9	8%	0.083	24%	0.236	C	C	.	.			trans	-161.4	141	172.2	0	0	0	0	0	109.5	F351 L393 I394 I411	F351-A413 HydrophobicContact CB-CB 4.36Å; F351-A413 HydrophobicContact CD1-CB 3.81Å; F351-A413 HydrophobicContact CD2-CB 3.57Å; F351-A413 HydrophobicContact CE1-CB 3.88Å; F351-A413 HydrophobicContact CE2-CB 3.63Å; F351-A413 HydrophobicContact CG-CB 3.66Å; F351-A413 HydrophobicContact CZ-CB 3.79Å; L393-A413 HydrophobicContact CD2-CB 4.48Å; I394-A413 PolarHBondContact O-N 3.19Å; I411-A413 HydrophobicContact CG2-CB 4.07Å; I411-A413 PolarHBondContact O-N 2.82Å; I411-A413 VanDerWaalsContact O-N 3.15Å
414	S	78.8	Confident	76.5	Confident	37 Å²	37	47.6 Å²	47.6	26%	0.259	25%	0.245	S	C	.	.			trans	-106.4	109.7	171.1	177	0	0	0	0	109.4	L416 T417 V418	S414-L416 PolarHBondContact O-N 3.34Å; S414-T417 WeakPolarHBondContact CB-OG1 3.4Å; S414-T417 PolarHBondContact O-N 3.14Å; S414-T417 PolarHBondContact O-OG1 2.95Å; S414-T417 PolarHBondContact OG-N 3.06Å; S414-V418 WeakPolarHBondContact O-CG2 3.48Å; S414-V418 PolarHBondContact O-N 3.41Å
415	I	83.3	Confident	77.6	Confident	8 Å²	8	46.8 Å²	46.8	4%	0.041	24%	0.241	C	C	.	.	H	α-helix	trans	-60.4	-40.3	176.5	-61.1	163.8	0	0	0	110	F351 F383 L386 L393 T417 V418 V419 L457 Y460	F351-I415 HydrophobicContact CE1-CG1 3.88Å; F351-I415 HydrophobicContact CZ-CD1 4.46Å; F351-I415 HydrophobicContact CZ-CG1 3.62Å; F383-I415 HydrophobicContact CE1-CG2 4.42Å; F383-I415 HydrophobicContact CZ-CG2 3.8Å; L386-I415 HydrophobicContact CD1-CD1 3.51Å; L386-I415 HydrophobicContact CD1-CG1 4.25Å; L386-I415 HydrophobicContact CD2-CD1 4.41Å; L393-I415 HydrophobicContact CD1-CD1 3.25Å; L393-I415 HydrophobicContact CD1-CG1 3.77Å; I415-T417 VanDerWaalsContact C-N 3.32Å; I415-T417 PolarHBondContact O-N 3.43Å; I415-V418 PolarHBondContact O-N 3.34Å; I415-V419 HydrophobicContact CG2-CG2 3.78Å; I415-V419 PolarHBondContact O-N 3.49Å; I415-L457 HydrophobicContact CB-CD1 4.25Å; I415-L457 HydrophobicContact CG2-CD1 3.61Å; I415-Y460 HydrophobicContact CD1-CD1 4Å; I415-Y460 HydrophobicContact CD1-CE1 3.47Å; I415-Y460 VanDerWaalsContact CD1-CE1 3.47Å
416	L	84.2	Confident	79	Confident	36 Å²	36	41.1 Å²	41.1	19%	0.188	22%	0.215	C	C	.	.	H	α-helix	trans	-55.6	-45.2	-179.2	179.3	65.1	0	0	0	111.8	S414 V418 G420 L457 A470 A473 A474	S414-L416 PolarHBondContact O-N 3.34Å; L416-V418 VanDerWaalsContact C-N 3.34Å; L416-V418 PolarHBondContact O-N 3Å; L416-G420 PolarHBondContact O-N 3.37Å; L416-L457 HydrophobicContact CD1-CD2 4.4Å; L416-A470 HydrophobicContact CD2-CB 4.29Å; L416-A473 HydrophobicContact CD1-CB 4.06Å; L416-A473 HydrophobicContact CD2-CB 3.74Å; L416-A473 HydrophobicContact CG-CB 4.46Å; L416-A474 HydrophobicContact CD1-CB 4.24Å
417	T	85.5	Confident	80.2	Confident	69 Å²	69	36.8 Å²	36.8	42%	0.423	19%	0.194	S	C	.	.	H	α-helix	trans	-68.7	-34.1	177.4	56.7	0	0	0	0	112.3	S414 I415 L421	S414-T417 WeakPolarHBondContact CB-OG1 3.4Å; S414-T417 PolarHBondContact O-N 3.14Å; S414-T417 PolarHBondContact O-OG1 2.95Å; S414-T417 PolarHBondContact OG-N 3.06Å; I415-T417 VanDerWaalsContact C-N 3.32Å; I415-T417 PolarHBondContact O-N 3.43Å; T417-L421 VanDerWaalsContact O-CG 3.29Å; T417-L421 WeakPolarHBondContact O-CG 3.45Å; T417-L421 PolarHBondContact O-N 2.92Å
418	V	87	Confident	81.4	Confident	13 Å²	13	32.3 Å²	32.3	8%	0.079	17%	0.173	C	C	.	.	H	α-helix	trans	-74.2	-35.6	-178.7	179.6	0	0	0	0	111.2	F351 I354 F358 F379 S414 I415 L416 L422	F351-V418 HydrophobicContact CD1-CG2 4.38Å; I354-V418 HydrophobicContact CB-CG1 4.33Å; I354-V418 HydrophobicContact CG2-CG1 3.45Å; I354-V418 VanDerWaalsContact CG2-CG1 3.45Å; F358-V418 HydrophobicContact CE2-CG1 4.18Å; F379-V418 HydrophobicContact CE1-CG1 3.75Å; F379-V418 HydrophobicContact CZ-CG1 3.71Å; F379-V418 WeakPolarHBondContact CZ-O 3.38Å; S414-V418 WeakPolarHBondContact O-CG2 3.48Å; S414-V418 PolarHBondContact O-N 3.41Å; I415-V418 PolarHBondContact O-N 3.34Å; L416-V418 VanDerWaalsContact C-N 3.34Å; L416-V418 PolarHBondContact O-N 3Å; V418-L422 PolarHBondContact O-N 3.38Å
419	V	89.2	Confident	82.5	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.006	16%	0.156	C	C	.	.	H	α-helix	trans	-75.4	-37.1	172.4	175.9	0	0	0	0	111.5	F379 F383 I415 L421 L422 D423 I453 I454 L457	F379-V419 HydrophobicContact CD1-CG2 4.32Å; F379-V419 HydrophobicContact CE1-CG2 3.86Å; F383-V419 HydrophobicContact CE2-CG2 4.26Å; F383-V419 HydrophobicContact CZ-CG2 4.24Å; I415-V419 HydrophobicContact CG2-CG2 3.78Å; I415-V419 PolarHBondContact O-N 3.49Å; V419-L421 PolarHBondContact O-N 2.96Å; V419-L422 WeakPolarHBondContact O-CB 3.42Å; V419-L422 PolarHBondContact O-N 3.44Å; V419-D423 PolarHBondContact O-N 2.97Å; V419-I453 HydrophobicContact CG2-CG2 4.5Å; V419-I454 HydrophobicContact CG1-CG1 3.97Å; V419-L457 HydrophobicContact CB-CD2 3.95Å; V419-L457 HydrophobicContact CG1-CD2 3.86Å; V419-L457 HydrophobicContact CG2-CD2 4.15Å
420	G	87.5	Confident	83.4	Confident	12 Å²	12	28.9 Å²	28.9	12%	0.124	15%	0.153	C	C	.	.	H	α-helix	trans	-61.6	-32.5	171.8	0	0	0	0	0	113	L416 V424	L416-G420 PolarHBondContact O-N 3.37Å; G420-V424 WeakPolarHBondContact O-CG2 3.32Å; G420-V424 PolarHBondContact O-N 3.2Å; G420-V424 VanDerWaalsContact O-N 3.15Å
421	L	87.8	Confident	84.3	Confident	77 Å²	77	27.1 Å²	27.1	40%	0.403	15%	0.149	S	C	.	.	H	α-helix	trans	-69.2	-38.9	169.6	-73.3	169.3	0	0	0	112.5	F358 T417 V419 D423 V424 E425	F358-L421 HydrophobicContact CD1-CB 4.45Å; F358-L421 HydrophobicContact CD2-CB 4.06Å; F358-L421 HydrophobicContact CD2-CD1 4.17Å; F358-L421 HydrophobicContact CE1-CB 4.22Å; F358-L421 HydrophobicContact CE2-CB 3.77Å; F358-L421 HydrophobicContact CG-CB 4.39Å; F358-L421 HydrophobicContact CZ-CB 3.88Å; T417-L421 VanDerWaalsContact O-CG 3.29Å; T417-L421 WeakPolarHBondContact O-CG 3.45Å; T417-L421 PolarHBondContact O-N 2.92Å; V419-L421 PolarHBondContact O-N 2.96Å; L421-D423 VanDerWaalsContact C-N 3.3Å; L421-D423 PolarHBondContact O-N 3.3Å; L421-V424 PolarHBondContact O-N 3.43Å; L421-E425 WeakPolarHBondContact O-CG 3.27Å; L421-E425 PolarHBondContact O-N 2.88Å
422	L	90.4	Very high	85	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.7	-42.3	174.4	176.3	66	0	0	0	111.7	F358 F372 L376 F379 V418 V419 E425 C426 V450 I453	F358-L422 HydrophobicContact CZ-CB 4.05Å; F372-L422 HydrophobicContact CE2-CD1 3.91Å; F372-L422 HydrophobicContact CZ-CD1 4.18Å; L376-L422 HydrophobicContact CD2-CD1 4.02Å; L376-L422 HydrophobicContact CD2-CD2 4.21Å; F379-L422 HydrophobicContact CD2-CD1 4.18Å; F379-L422 HydrophobicContact CD2-CD2 3.76Å; F379-L422 HydrophobicContact CD2-CG 4.41Å; F379-L422 HydrophobicContact CE1-CD2 4.5Å; F379-L422 HydrophobicContact CE2-CB 3.82Å; F379-L422 HydrophobicContact CE2-CD1 3.84Å; F379-L422 HydrophobicContact CE2-CD2 3.77Å; F379-L422 HydrophobicContact CE2-CG 4.01Å; F379-L422 HydrophobicContact CG-CD2 4.17Å; F379-L422 HydrophobicContact CZ-CB 3.79Å; F379-L422 HydrophobicContact CZ-CD2 4.14Å; F379-L422 HydrophobicContact CZ-CG 4.41Å; V418-L422 PolarHBondContact O-N 3.38Å; V419-L422 WeakPolarHBondContact O-CB 3.42Å; V419-L422 PolarHBondContact O-N 3.44Å; L422-E425 PolarHBondContact O-N 3.04Å; L422-C426 WeakPolarHBondContact O-CB 3.48Å; L422-C426 PolarHBondContact O-N 3.2Å; L422-V450 HydrophobicContact CD2-CG1 4.49Å; L422-V450 HydrophobicContact CD2-CG2 4.4Å; L422-V450 HydrophobicContact CG-CG2 4.42Å; L422-I453 HydrophobicContact CD2-CD1 4.03Å; L422-I453 HydrophobicContact CD2-CG2 4.08Å
423	D	88.7	Confident	85.6	Confident	6 Å²	6	29.9 Å²	29.9	3%	0.032	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-52.1	176.7	-173.3	9	0	0	0	110.9	V419 L421 E425 C426 F427 H477 H481	V419-D423 PolarHBondContact O-N 2.97Å; L421-D423 VanDerWaalsContact C-N 3.3Å; L421-D423 PolarHBondContact O-N 3.3Å; D423-E425 VanDerWaalsContact C-N 3.33Å; D423-E425 PolarHBondContact O-N 2.92Å; D423-C426 WeakPolarHBondContact O-CA 3.39Å; D423-C426 VanDerWaalsContact O-CB 3.27Å; D423-C426 WeakPolarHBondContact O-CB 3.35Å; D423-C426 PolarHBondContact O-N 3.05Å; D423-F427 WeakPolarHBondContact O-CD2 3.33Å; D423-F427 PolarHBondContact O-N 2.74Å; D423-F427 VanDerWaalsContact OD1-CD2 3.24Å; D423-F427 WeakPolarHBondContact OD1-CD2 3.22Å; D423-F427 VanDerWaalsContact OD1-CE2 3.22Å; D423-F427 WeakPolarHBondContact OD1-CE2 3.47Å; D423-H477 IonicContact OD2-CE1 3.34Å; D423-H477 IonicContact OD2-CG 3.25Å; D423-H477 IonicContact OD2-ND1 2.78Å; D423-H477 PolarHBondContact OD2-ND1 3.16Å; D423-H481 IonicContact OD1-CE1 2.7Å; D423-H481 IonicContact OD1-NE2 3.85Å; D423-H481 PolarHBondContact OD1-NE2 2.68Å
424	V	87.8	Confident	86.2	Confident	75 Å²	75	32.9 Å²	32.9	46%	0.455	18%	0.183	S	C	.	.	H	α-helix	trans	-56.9	-41.9	175.5	170.9	0	0	0	0	112.6	G420 L421 F427 K428	G420-V424 WeakPolarHBondContact O-CG2 3.32Å; G420-V424 PolarHBondContact O-N 3.2Å; G420-V424 VanDerWaalsContact O-N 3.15Å; L421-V424 PolarHBondContact O-N 3.43Å; V424-F427 PolarHBondContact O-N 3.27Å; V424-K428 WeakPolarHBondContact O-CG 3.29Å; V424-K428 PolarHBondContact O-N 3.38Å
425	E	86.2	Confident	86.4	Confident	7 Å²	7	32 Å²	32	3%	0.033	18%	0.181	C	C	.	.	H	α-helix	trans	-66.5	-38.1	174.8	-69.8	-48.1	126.2	0	0	113	F358 M367 F372 L421 L422 D423 F427 K428 V429	F358-E425 HydrophobicContact CD1-CG 3.55Å; F358-E425 HydrophobicContact CE1-CB 4.25Å; F358-E425 HydrophobicContact CE1-CG 3.51Å; M367-E425 HydrophobicContact CE-CG 4.33Å; F372-E425 HydrophobicContact CE2-CB 4.29Å; L421-E425 WeakPolarHBondContact O-CG 3.27Å; L421-E425 PolarHBondContact O-N 2.88Å; L422-E425 PolarHBondContact O-N 3.04Å; D423-E425 VanDerWaalsContact C-N 3.33Å; D423-E425 PolarHBondContact O-N 2.92Å; E425-F427 VanDerWaalsContact C-N 3.32Å; E425-F427 PolarHBondContact O-N 3.21Å; E425-K428 PolarHBondContact O-N 3.14Å; E425-K428 IonicContact OE1-NZ 3.7Å; E425-K428 PolarHBondContact OE1-NZ 3.41Å; E425-K428 IonicContact OE2-NZ 2.74Å; E425-V429 WeakPolarHBondContact O-CB 3.32Å; E425-V429 WeakPolarHBondContact O-CG2 3.47Å; E425-V429 PolarHBondContact O-N 3.39Å
426	C	87.1	Confident	86.5	Confident	4 Å²	4	38.9 Å²	38.9	3%	0.027	21%	0.212	C	C	.	.	H	α-helix	trans	-59.6	-45.2	173.8	-168.6	0	0	0	0	110.6	F372 L422 D423 V429 L430 V450	F372-C426 HydrophobicContact CE2-CB 4.45Å; F372-C426 HydrophobicContact CZ-CB 3.92Å; L422-C426 WeakPolarHBondContact O-CB 3.48Å; L422-C426 PolarHBondContact O-N 3.2Å; D423-C426 WeakPolarHBondContact O-CA 3.39Å; D423-C426 VanDerWaalsContact O-CB 3.27Å; D423-C426 WeakPolarHBondContact O-CB 3.35Å; D423-C426 PolarHBondContact O-N 3.05Å; C426-V429 PolarHBondContact O-N 2.85Å; C426-L430 WeakPolarHBondContact O-CG 3.31Å; C426-L430 PolarHBondContact O-N 3.18Å; C426-V450 HydrophobicContact CB-CG2 4.39Å
427	F	87	Confident	86.7	Confident	44 Å²	44	41.8 Å²	41.8	19%	0.193	23%	0.225	C	C	.	.	H	α-helix	trans	-59.9	-48.5	174.3	-90.7	-86.7	0	0	0	112.3	D423 V424 E425 V429 L430 Q431 M634 P635 M638	D423-F427 WeakPolarHBondContact O-CD2 3.33Å; D423-F427 PolarHBondContact O-N 2.74Å; D423-F427 VanDerWaalsContact OD1-CD2 3.24Å; D423-F427 WeakPolarHBondContact OD1-CD2 3.22Å; D423-F427 VanDerWaalsContact OD1-CE2 3.22Å; D423-F427 WeakPolarHBondContact OD1-CE2 3.47Å; V424-F427 PolarHBondContact O-N 3.27Å; E425-F427 VanDerWaalsContact C-N 3.32Å; E425-F427 PolarHBondContact O-N 3.21Å; F427-V429 PolarHBondContact O-N 3.44Å; F427-L430 CarbonylContact O-C 3.58Å; F427-L430 PolarHBondContact O-N 2.98Å; F427-L430 VanDerWaalsContact O-N 3.14Å; F427-Q431 VanDerWaalsContact O-CG 3.31Å; F427-Q431 WeakPolarHBondContact O-CG 3.42Å; F427-Q431 PolarHBondContact O-N 3.24Å; F427-M634 HydrophobicContact CE1-CE 4.22Å; F427-P635 HydrophobicContact CD1-CG 3.52Å; F427-P635 HydrophobicContact CE1-CG 3.8Å; F427-M638 HydrophobicContact CE1-SD 3.77Å; F427-M638 HydrophobicContact CZ-SD 4.15Å
428	K	86.2	Confident	86.8	Confident	53 Å²	53	42.9 Å²	42.9	23%	0.23	24%	0.235	C	C	.	.	H	α-helix	trans	-58.1	-45.3	176.1	-71.1	175.8	-174.6	167.9	0	113	D361 C366 V424 E425 L430 Q431 N432	D361-K428 IonicContact OD2-NZ 2.89Å; D361-K428 PolarHBondContact OD2-NZ 2.9Å; C366-K428 HydrophobicContact CB-CB 4.45Å; V424-K428 WeakPolarHBondContact O-CG 3.29Å; V424-K428 PolarHBondContact O-N 3.38Å; E425-K428 PolarHBondContact O-N 3.14Å; E425-K428 IonicContact OE1-NZ 3.7Å; E425-K428 PolarHBondContact OE1-NZ 3.41Å; E425-K428 IonicContact OE2-NZ 2.74Å; K428-L430 PolarHBondContact O-N 3.04Å; K428-Q431 PolarHBondContact O-N 3.16Å; K428-N432 PolarHBondContact O-N 2.87Å
429	V	86.9	Confident	86.8	Confident	7 Å²	7	48.1 Å²	48.1	4%	0.042	26%	0.259	C	S	.	.	H	α-helix	trans	-59.4	-38.1	177.5	165.6	0	0	0	0	111	C366 M367 E425 C426 F427 A433 R443	C366-V429 HydrophobicContact CB-CG2 4.24Å; M367-V429 HydrophobicContact CB-CG2 4.49Å; E425-V429 WeakPolarHBondContact O-CB 3.32Å; E425-V429 WeakPolarHBondContact O-CG2 3.47Å; E425-V429 PolarHBondContact O-N 3.39Å; C426-V429 PolarHBondContact O-N 2.85Å; F427-V429 PolarHBondContact O-N 3.44Å; V429-A433 WeakPolarHBondContact O-CB 3.47Å; V429-A433 PolarHBondContact O-N 2.98Å; V429-R443 HydrophobicContact CG1-CB 4.36Å; V429-R443 HydrophobicContact CG1-CG 4.18Å; V429-R443 VanDerWaalsContact CG1-NH1 3.29Å
430	L	87	Confident	86.9	Confident	6 Å²	6	48.4 Å²	48.4	3%	0.031	26%	0.26	C	S	.	.	H	α-helix	trans	-86.7	-11.5	178.7	-62.8	171.8	0	0	0	114.3	C426 F427 K428 Y440 R443 P635	C426-L430 WeakPolarHBondContact O-CG 3.31Å; C426-L430 PolarHBondContact O-N 3.18Å; F427-L430 CarbonylContact O-C 3.58Å; F427-L430 PolarHBondContact O-N 2.98Å; F427-L430 VanDerWaalsContact O-N 3.14Å; K428-L430 PolarHBondContact O-N 3.04Å; L430-Y440 WeakPolarHBondContact O-CE2 3.38Å; L430-R443 HydrophobicContact CD2-CB 3.89Å; L430-P635 HydrophobicContact CB-CB 3.93Å; L430-P635 HydrophobicContact CB-CG 4.11Å
431	Q	86	Confident	87	Confident	53 Å²	53	52 Å²	52	25%	0.248	28%	0.28	C	S	.	.	H	α-helix	trans	-79.6	-44.2	167.9	-77.7	169.6	-23.9	0	0	110.8	F427 K428 A631 Q633	F427-Q431 VanDerWaalsContact O-CG 3.31Å; F427-Q431 WeakPolarHBondContact O-CG 3.42Å; F427-Q431 PolarHBondContact O-N 3.24Å; K428-Q431 PolarHBondContact O-N 3.16Å; Q431-A631 PolarHBondContact NE2-O 2.88Å; Q431-Q633 WeakPolarHBondContact CG-O 3.49Å; Q431-Q633 PolarHBondContact NE2-O 3.5Å
432	N	84.6	Confident	87	Confident	87 Å²	87	51.9 Å²	51.9	47%	0.465	28%	0.279	S	S	.	.	H	α-helix	trans	-81.4	-14.7	-176.5	-67.6	-12.4	0	0	0	114	D365 C366 K428	D365-N432 VanDerWaalsContact C-ND2 3.27Å; D365-N432 PolarHBondContact O-ND2 3.35Å; C366-N432 HydrophobicContact CB-CB 4.46Å; C366-N432 WeakPolarHBondContact CB-ND2 3.32Å; C366-N432 PolarHBondContact SG-ND2 3.17Å; C366-N432 VanDerWaalsContact SG-ND2 3.44Å; K428-N432 PolarHBondContact O-N 2.87Å
433	A	85.3	Confident	86.8	Confident	22 Å²	22	54.3 Å²	54.3	18%	0.182	29%	0.288	C	S	.	.	S	Bend	trans	-80.1	132.5	175.4	0	0	0	0	0	111.6	V429 G435 Y440	V429-A433 WeakPolarHBondContact O-CB 3.47Å; V429-A433 PolarHBondContact O-N 2.98Å; A433-G435 PolarHBondContact O-N 2.71Å; A433-Y440 HydrophobicContact CB-CD2 3.69Å; A433-Y440 HydrophobicContact CB-CE2 4.27Å; A433-Y440 WeakPolarHBondContact O-CD2 3.5Å
434	N	84.7	Confident	86.8	Confident	73 Å²	73	56.6 Å²	56.6	39%	0.39	30%	0.3	S	S	.	.			trans	-70.5	114.2	178.7	-177.9	-1.2	0	0	0	111.5	H436 E437 Y440	N434-H436 PolarHBondContact O-N 3.4Å; N434-H436 PolarHBondContact OD1-N 2.81Å; N434-H436 VanDerWaalsContact OD1-N 3.17Å; N434-E437 HydrophobicContact CB-CB 4.3Å; N434-E437 HydrophobicContact CB-CG 4.1Å; N434-E437 VanDerWaalsContact ND2-CD 3.34Å; N434-E437 PolarHBondContact ND2-OE1 3.46Å; N434-E437 PolarHBondContact O-N 3.19Å; N434-Y440 WeakPolarHBondContact O-CB 3.45Å
435	G	82.1	Confident	86.8	Confident	20 Å²	20	60.7 Å²	60.7	21%	0.206	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-14.2	-178.2	0	0	0	0	0	116.5	A433 Y636	A433-G435 PolarHBondContact O-N 2.71Å; G435-Y636 WeakPolarHBondContact O-CE1 3.41Å
436	H	84.5	Confident	86.9	Confident	151 Å²	151	61.3 Å²	61.3	70%	0.699	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-8.4	175.7	-63.6	-60.3	0	0	0	114.3	N434 Y636	N434-H436 PolarHBondContact O-N 3.4Å; N434-H436 PolarHBondContact OD1-N 2.81Å; N434-H436 VanDerWaalsContact OD1-N 3.17Å; H436-Y636 AromaticContact CE1-CZ 3.95Å; H436-Y636 PolarHBondContact CE1-OH 3.08Å
437	E	89.4	Confident	86.9	Confident	97 Å²	97	61.8 Å²	61.8	45%	0.453	31%	0.313	S	S	.	.	S	Bend	trans	-98.8	152.8	-177.7	-72	169.7	-156.8	0	0	111.9	N434 E439 Y440	N434-E437 HydrophobicContact CB-CB 4.3Å; N434-E437 HydrophobicContact CB-CG 4.1Å; N434-E437 VanDerWaalsContact ND2-CD 3.34Å; N434-E437 PolarHBondContact ND2-OE1 3.46Å; N434-E437 PolarHBondContact O-N 3.19Å; E437-E439 PolarHBondContact O-N 3.05Å; E437-Y440 WeakPolarHBondContact O-CB 3.35Å; E437-Y440 PolarHBondContact O-N 3.46Å; E437-Y440 VanDerWaalsContact O-N 3.17Å
438	S	88.3	Confident	87.1	Confident	92 Å²	92	69.4 Å²	69.4	64%	0.643	34%	0.341	S	S	*	.	H	α-helix	trans	-62.6	-26.5	179.2	51.7	0	0	0	0	113.1	Y440 V441 D442	S438-Y440 PolarHBondContact O-N 3.09Å; S438-V441 WeakPolarHBondContact O-CB 3.35Å; S438-V441 PolarHBondContact O-N 2.83Å; S438-D442 PolarHBondContact O-N 3.47Å
439	E	86.2	Confident	87.2	Confident	123 Å²	123	69.8 Å²	69.8	58%	0.575	34%	0.34	S	S	*	.	H	α-helix	trans	-56.9	-34.9	176.2	-58.8	-162.6	177.9	0	0	112.2	E437 V441 D442 R443	E437-E439 PolarHBondContact O-N 3.05Å; E439-V441 VanDerWaalsContact C-N 3.32Å; E439-V441 PolarHBondContact O-N 2.89Å; E439-D442 PolarHBondContact O-N 2.98Å; E439-R443 WeakPolarHBondContact O-CG 3.24Å; E439-R443 PolarHBondContact O-N 3.07Å
440	Y	90.4	Very high	87.4	Confident	8 Å²	8	69.4 Å²	69.4	3%	0.031	34%	0.338	C	S	.	.	H	α-helix	trans	-60.9	-42.1	176.3	-165.5	-84.9	0	0	0	112.1	L430 A433 N434 E437 S438 D442 R443 L444 P635 Y636 H637	L430-Y440 WeakPolarHBondContact O-CE2 3.38Å; A433-Y440 HydrophobicContact CB-CD2 3.69Å; A433-Y440 HydrophobicContact CB-CE2 4.27Å; A433-Y440 WeakPolarHBondContact O-CD2 3.5Å; N434-Y440 WeakPolarHBondContact O-CB 3.45Å; E437-Y440 WeakPolarHBondContact O-CB 3.35Å; E437-Y440 PolarHBondContact O-N 3.46Å; E437-Y440 VanDerWaalsContact O-N 3.17Å; S438-Y440 PolarHBondContact O-N 3.09Å; Y440-D442 VanDerWaalsContact C-N 3.33Å; Y440-R443 PolarHBondContact O-N 3.3Å; Y440-L444 HydrophobicContact CE1-CD2 4.46Å; Y440-L444 VanDerWaalsContact O-CB 3.29Å; Y440-L444 WeakPolarHBondContact O-CB 3.48Å; Y440-L444 PolarHBondContact O-N 3.34Å; Y440-P635 WeakPolarHBondContact OH-CB 3.3Å; Y440-Y636 PolarHBondContact OH-N 3.09Å; Y440-Y636 VanDerWaalsContact OH-N 3.1Å; Y440-H637 HydrophobicContact CE1-CB 4.12Å; Y440-H637 AromaticContact CZ-ND1 3.85Å; Y440-H637 PolarHBondContact OH-N 3.45Å; Y440-H637 PolarHBondContact OH-ND1 2.97Å
441	V	90	Very high	87.6	Confident	88 Å²	88	70.4 Å²	70.4	53%	0.533	35%	0.345	S	S	.	.	H	α-helix	trans	-68.8	-34.6	-179.8	-178	0	0	0	0	110.9	S438 E439	S438-V441 WeakPolarHBondContact O-CB 3.35Å; S438-V441 PolarHBondContact O-N 2.83Å; E439-V441 VanDerWaalsContact C-N 3.32Å; E439-V441 PolarHBondContact O-N 2.89Å
442	D	87.6	Confident	87.9	Confident	74 Å²	74	72.2 Å²	72.2	40%	0.396	36%	0.357	S	S	.	.	H	α-helix	trans	-69.6	-46.7	175	-71.7	-38	0	0	0	111.2	S438 E439 Y440 L444 R445	S438-D442 PolarHBondContact O-N 3.47Å; E439-D442 PolarHBondContact O-N 2.98Å; Y440-D442 VanDerWaalsContact C-N 3.33Å; D442-L444 VanDerWaalsContact C-N 3.3Å; D442-L444 PolarHBondContact O-N 2.77Å; D442-R445 VanDerWaalsContact O-CB 3.3Å; D442-R445 WeakPolarHBondContact O-CB 3.42Å; D442-R445 PolarHBondContact O-N 3.19Å; D442-R445 VanDerWaalsContact O-N 3.08Å; D442-R445 IonicContact OD1-CZ 2.78Å; D442-R445 IonicContact OD1-NE 2.64Å; D442-R445 IonicContact OD1-NH1 3.29Å; D442-R445 PolarHBondContact OD1-NH1 3.44Å; D442-R445 IonicContact OD1-NH2 2.77Å; D442-R445 PolarHBondContact OD1-NH2 3.48Å
443	R	86.3	Confident	88.2	Confident	50 Å²	50	68.1 Å²	68.1	19%	0.189	34%	0.335	C	S	.	.	H	α-helix	trans	-61.5	-34.7	174	-63.8	-57.8	-171.7	110.7	17.1	113	S369 V429 L430 E439 Y440 R445 D446	S369-R443 PolarHBondContact OG-NE 3.42Å; V429-R443 HydrophobicContact CG1-CB 4.36Å; V429-R443 HydrophobicContact CG1-CG 4.18Å; V429-R443 VanDerWaalsContact CG1-NH1 3.29Å; L430-R443 HydrophobicContact CD2-CB 3.89Å; E439-R443 WeakPolarHBondContact O-CG 3.24Å; E439-R443 PolarHBondContact O-N 3.07Å; Y440-R443 PolarHBondContact O-N 3.3Å; R443-R445 PolarHBondContact O-N 2.96Å; R443-D446 WeakPolarHBondContact O-CB 3.46Å; R443-D446 PolarHBondContact O-N 2.81Å; R443-D446 VanDerWaalsContact O-N 3.09Å
444	L	89.1	Confident	88.4	Confident	54 Å²	54	67.2 Å²	67.2	28%	0.283	33%	0.327	S	S	.	.	H	α-helix	trans	-65.5	-19	176.9	-169.6	62.5	0	0	0	112.8	Y440 D442 D446 E447 H637	Y440-L444 HydrophobicContact CE1-CD2 4.46Å; Y440-L444 VanDerWaalsContact O-CB 3.29Å; Y440-L444 WeakPolarHBondContact O-CB 3.48Å; Y440-L444 PolarHBondContact O-N 3.34Å; D442-L444 VanDerWaalsContact C-N 3.3Å; D442-L444 PolarHBondContact O-N 2.77Å; L444-D446 VanDerWaalsContact C-N 3.27Å; L444-D446 PolarHBondContact O-N 3.2Å; L444-E447 HydrophobicContact CD1-CB 4.27Å; L444-E447 WeakPolarHBondContact O-CB 3.4Å; L444-E447 PolarHBondContact O-N 3.03Å; L444-H637 HydrophobicContact CD1-CB 4.43Å; L444-H637 HydrophobicContact CD2-CB 4.25Å
445	R	88.5	Confident	88.7	Confident	161 Å²	161	66.8 Å²	66.8	61%	0.608	33%	0.325	S	S	*	.	H	α-helix	trans	-67.1	-30.3	172.6	-62.8	177.9	-174.1	151.5	17.8	112.2	D442 R443 E447 R448	D442-R445 VanDerWaalsContact O-CB 3.3Å; D442-R445 WeakPolarHBondContact O-CB 3.42Å; D442-R445 PolarHBondContact O-N 3.19Å; D442-R445 VanDerWaalsContact O-N 3.08Å; D442-R445 IonicContact OD1-CZ 2.78Å; D442-R445 IonicContact OD1-NE 2.64Å; D442-R445 IonicContact OD1-NH1 3.29Å; D442-R445 PolarHBondContact OD1-NH1 3.44Å; D442-R445 IonicContact OD1-NH2 2.77Å; D442-R445 PolarHBondContact OD1-NH2 3.48Å; R443-R445 PolarHBondContact O-N 2.96Å; R445-E447 PolarHBondContact O-N 3.35Å; R445-R448 WeakPolarHBondContact O-CB 3.16Å; R445-R448 PolarHBondContact O-N 2.87Å
446	D	87.9	Confident	89.1	Confident	21 Å²	21	69.9 Å²	69.9	11%	0.112	33%	0.33	C	S	.	.	H	α-helix	trans	-69.4	-25.8	179.9	-59.1	-33.2	0	0	0	111.8	F372 L376 R443 L444 R448 R449 V450	F372-D446 HydrophobicContact CD1-CB 4.27Å; F372-D446 HydrophobicContact CE1-CB 3.82Å; L376-D446 HydrophobicContact CD1-CB 4.05Å; R443-D446 WeakPolarHBondContact O-CB 3.46Å; R443-D446 PolarHBondContact O-N 2.81Å; R443-D446 VanDerWaalsContact O-N 3.09Å; L444-D446 VanDerWaalsContact C-N 3.27Å; L444-D446 PolarHBondContact O-N 3.2Å; D446-R448 PolarHBondContact O-N 3.1Å; D446-R449 WeakPolarHBondContact O-CA 3.3Å; D446-R449 VanDerWaalsContact O-CB 3.31Å; D446-R449 WeakPolarHBondContact O-CB 3.44Å; D446-R449 PolarHBondContact O-N 3.15Å; D446-V450 PolarHBondContact O-N 3.04Å
447	E	88	Confident	89.3	Confident	14 Å²	14	62.7 Å²	62.7	7%	0.065	30%	0.297	C	S	.	.	H	α-helix	trans	-58.5	-31.4	176	-152.6	-115.4	156.8	0	0	111.9	L444 R445 V450 C451 H481 Y484 K485	L444-E447 HydrophobicContact CD1-CB 4.27Å; L444-E447 WeakPolarHBondContact O-CB 3.4Å; L444-E447 PolarHBondContact O-N 3.03Å; R445-E447 PolarHBondContact O-N 3.35Å; E447-V450 PolarHBondContact O-N 2.95Å; E447-C451 WeakPolarHBondContact O-CB 3.35Å; E447-C451 PolarHBondContact O-N 3.49Å; E447-C451 PolarHBondContact O-SG 2.97Å; E447-H481 IonicContact OE1-CE1 2.69Å; E447-H481 IonicContact OE1-CG 3.7Å; E447-H481 IonicContact OE1-ND1 2.67Å; E447-H481 PolarHBondContact OE1-ND1 2.89Å; E447-Y484 PolarHBondContact OE1-OH 2.92Å; E447-K485 IonicContact OE1-NZ 2.69Å; E447-K485 PolarHBondContact OE1-NZ 3.12Å; E447-K485 WeakPolarHBondContact OE2-CE 3.39Å; E447-K485 IonicContact OE2-NZ 3.73Å; E447-K485 PolarHBondContact OE2-NZ 3.39Å
448	R	89.3	Confident	89.2	Confident	204 Å²	204	58.1 Å²	58.1	77%	0.77	28%	0.276	S	S	*	.	H	α-helix	trans	-65.3	-36.1	171.5	-116.2	-179	-178.5	177.2	1.3	112.6	R445 D446 N452	R445-R448 WeakPolarHBondContact O-CB 3.16Å; R445-R448 PolarHBondContact O-N 2.87Å; D446-R448 PolarHBondContact O-N 3.1Å; R448-N452 VanDerWaalsContact O-CG 3.23Å; R448-N452 PolarHBondContact O-N 3Å; R448-N452 VanDerWaalsContact O-N 3.17Å; R448-N452 PolarHBondContact O-ND2 2.76Å
449	R	90	Very high	89.3	Confident	60 Å²	60	56.9 Å²	56.9	23%	0.226	26%	0.264	C	S	.	.	H	α-helix	trans	-70.9	-43.1	175.3	-59.1	-175.2	62.9	-172.8	2	110.5	D373 L376 N377 D380 D446 C451 N452 I453	D373-R449 IonicContact OD1-NH1 2.63Å; D373-R449 PolarHBondContact OD1-NH1 3.17Å; L376-R449 HydrophobicContact CD1-CB 4.28Å; L376-R449 HydrophobicContact CD2-CB 4.39Å; N377-R449 PolarHBondContact OD1-NH2 3.49Å; D380-R449 IonicContact OD2-CZ 2.73Å; D380-R449 IonicContact OD2-NE 2.66Å; D380-R449 IonicContact OD2-NH2 2.79Å; D380-R449 PolarHBondContact OD2-NH2 2.78Å; D446-R449 WeakPolarHBondContact O-CA 3.3Å; D446-R449 VanDerWaalsContact O-CB 3.31Å; D446-R449 WeakPolarHBondContact O-CB 3.44Å; D446-R449 PolarHBondContact O-N 3.15Å; R449-C451 PolarHBondContact O-N 3.2Å; R449-N452 WeakPolarHBondContact O-CB 3.45Å; R449-N452 PolarHBondContact O-N 2.75Å; R449-I453 WeakPolarHBondContact O-CG1 3.38Å; R449-I453 PolarHBondContact O-N 3.18Å
450	V	91	Very high	89.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59	-46	174.4	178.1	0	0	0	0	111.1	F372 L376 L422 C426 D446 E447 N452 I453 I454	F372-V450 HydrophobicContact CZ-CG2 4.26Å; L376-V450 HydrophobicContact CD2-CG2 3.83Å; L422-V450 HydrophobicContact CD2-CG1 4.49Å; L422-V450 HydrophobicContact CD2-CG2 4.4Å; L422-V450 HydrophobicContact CG-CG2 4.42Å; C426-V450 HydrophobicContact CB-CG2 4.39Å; D446-V450 PolarHBondContact O-N 3.04Å; E447-V450 PolarHBondContact O-N 2.95Å; V450-N452 PolarHBondContact O-N 3.44Å; V450-I453 WeakPolarHBondContact O-CB 3.01Å; V450-I453 PolarHBondContact O-N 3.12Å; V450-I453 VanDerWaalsContact O-N 3.12Å; V450-I454 HydrophobicContact CG1-CD1 3.91Å; V450-I454 WeakPolarHBondContact O-CG1 3.29Å; V450-I454 PolarHBondContact O-N 2.9Å
451	C	90.3	Very high	89	Confident	26 Å²	26	51.1 Å²	51.1	18%	0.176	24%	0.237	C	C	.	.	H	α-helix	trans	-55.9	-46.2	173.8	-70.2	0	0	0	0	112.3	E447 R449 I453 I454 D455	E447-C451 WeakPolarHBondContact O-CB 3.35Å; E447-C451 PolarHBondContact O-N 3.49Å; E447-C451 PolarHBondContact O-SG 2.97Å; R449-C451 PolarHBondContact O-N 3.2Å; C451-I453 VanDerWaalsContact C-N 3.32Å; C451-I453 PolarHBondContact O-N 2.98Å; C451-I454 PolarHBondContact O-N 2.96Å; C451-D455 PolarHBondContact O-N 3.26Å
452	N	91.7	Very high	88.8	Confident	92 Å²	92	51.5 Å²	51.5	49%	0.492	23%	0.233	S	C	.	.	H	α-helix	trans	-63	-36	177.2	-68.6	-20.1	0	0	0	112.7	R448 R449 V450 D455 R456	R448-N452 VanDerWaalsContact O-CG 3.23Å; R448-N452 PolarHBondContact O-N 3Å; R448-N452 VanDerWaalsContact O-N 3.17Å; R448-N452 PolarHBondContact O-ND2 2.76Å; R449-N452 WeakPolarHBondContact O-CB 3.45Å; R449-N452 PolarHBondContact O-N 2.75Å; V450-N452 PolarHBondContact O-N 3.44Å; N452-D455 PolarHBondContact O-N 3.48Å; N452-R456 VanDerWaalsContact O-CG 3.3Å; N452-R456 WeakPolarHBondContact O-CG 3.46Å; N452-R456 PolarHBondContact O-N 3.38Å
453	I	91.3	Very high	88.7	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67.5	-40	176	-69.9	163	0	0	0	110.6	L376 F379 F383 V419 L422 R449 V450 C451 R456 L457	L376-I453 HydrophobicContact CD2-CD1 3.65Å; F379-I453 HydrophobicContact CB-CD1 3.76Å; F379-I453 HydrophobicContact CB-CG1 4.25Å; F379-I453 HydrophobicContact CB-CG2 4.2Å; F379-I453 HydrophobicContact CD1-CG2 4.23Å; F379-I453 HydrophobicContact CG-CD1 4.44Å; F379-I453 HydrophobicContact CG-CG2 4.35Å; F383-I453 HydrophobicContact CD2-CG2 4.13Å; F383-I453 HydrophobicContact CE2-CG2 3.64Å; V419-I453 HydrophobicContact CG2-CG2 4.5Å; L422-I453 HydrophobicContact CD2-CD1 4.03Å; L422-I453 HydrophobicContact CD2-CG2 4.08Å; R449-I453 WeakPolarHBondContact O-CG1 3.38Å; R449-I453 PolarHBondContact O-N 3.18Å; V450-I453 WeakPolarHBondContact O-CB 3.01Å; V450-I453 PolarHBondContact O-N 3.12Å; V450-I453 VanDerWaalsContact O-N 3.12Å; C451-I453 VanDerWaalsContact C-N 3.32Å; C451-I453 PolarHBondContact O-N 2.98Å; I453-R456 WeakPolarHBondContact O-CB 2.78Å; I453-R456 PolarHBondContact O-N 3.5Å; I453-L457 PolarHBondContact O-N 2.87Å
454	I	90.8	Very high	88.3	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-68.3	-39.2	175.3	-66.7	168	0	0	0	111.2	V419 V450 C451 R456 L457 C458 K478 H481	V419-I454 HydrophobicContact CG1-CG1 3.97Å; V450-I454 HydrophobicContact CG1-CD1 3.91Å; V450-I454 WeakPolarHBondContact O-CG1 3.29Å; V450-I454 PolarHBondContact O-N 2.9Å; C451-I454 PolarHBondContact O-N 2.96Å; I454-R456 PolarHBondContact O-N 3.39Å; I454-L457 WeakPolarHBondContact O-CB 3.3Å; I454-L457 PolarHBondContact O-N 3.37Å; I454-L457 VanDerWaalsContact O-N 3.14Å; I454-C458 PolarHBondContact O-N 2.87Å; I454-C458 PolarHBondContact O-SG 2.83Å; I454-K478 HydrophobicContact CG2-CB 3.81Å; I454-H481 WeakPolarHBondContact CD1-CD2 3.17Å; I454-H481 WeakPolarHBondContact CD1-NE2 3.43Å
455	D	90.5	Very high	87.9	Confident	64 Å²	64	61 Å²	61	34%	0.342	27%	0.273	S	S	.	.	H	α-helix	trans	-62.2	-42.4	172.8	-83.8	-28.7	0	0	0	112.1	C451 N452 L457 C458 V459 K478	C451-D455 PolarHBondContact O-N 3.26Å; N452-D455 PolarHBondContact O-N 3.48Å; D455-L457 VanDerWaalsContact C-N 3.3Å; D455-L457 PolarHBondContact O-N 2.8Å; D455-C458 PolarHBondContact O-N 3.03Å; D455-V459 WeakPolarHBondContact O-CG2 3.38Å; D455-V459 PolarHBondContact O-N 3.29Å; D455-V459 VanDerWaalsContact O-N 3.08Å; D455-K478 WeakPolarHBondContact OD1-CE 3.41Å; D455-K478 IonicContact OD1-NZ 2.82Å; D455-K478 PolarHBondContact OD1-NZ 3.32Å
456	R	89.9	Confident	87.2	Confident	85 Å²	85	56.1 Å²	56.1	32%	0.321	26%	0.255	S	S	.	.	H	α-helix	trans	-60.6	-38.5	171.8	-74.8	169.9	169.5	-131.4	-5.4	111.7	F383 D384 N452 I453 I454 Y460	F383-R456 HydrophobicContact CD1-CB 3.94Å; F383-R456 HydrophobicContact CE1-CB 4.3Å; F383-R456 HydrophobicContact CG-CB 4.1Å; D384-R456 IonicContact OD1-CZ 2.76Å; D384-R456 IonicContact OD1-NH1 3.73Å; D384-R456 PolarHBondContact OD1-NH1 3.15Å; D384-R456 IonicContact OD1-NH2 3.08Å; D384-R456 PolarHBondContact OD1-NH2 3.48Å; N452-R456 VanDerWaalsContact O-CG 3.3Å; N452-R456 WeakPolarHBondContact O-CG 3.46Å; N452-R456 PolarHBondContact O-N 3.38Å; I453-R456 WeakPolarHBondContact O-CB 2.78Å; I453-R456 PolarHBondContact O-N 3.5Å; I454-R456 PolarHBondContact O-N 3.39Å; R456-Y460 VanDerWaalsContact O-CB 3.23Å; R456-Y460 WeakPolarHBondContact O-CB 3.45Å; R456-Y460 PolarHBondContact O-N 2.89Å
457	L	88.9	Confident	86.9	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.4	-50.6	174.5	176.4	62	0	0	0	112	F383 I415 L416 V419 I453 I454 D455 V459 Y460 L461 A474	F383-L457 HydrophobicContact CE1-CB 4.27Å; F383-L457 HydrophobicContact CZ-CB 3.94Å; F383-L457 HydrophobicContact CZ-CD1 4.29Å; I415-L457 HydrophobicContact CB-CD1 4.25Å; I415-L457 HydrophobicContact CG2-CD1 3.61Å; L416-L457 HydrophobicContact CD1-CD2 4.4Å; V419-L457 HydrophobicContact CB-CD2 3.95Å; V419-L457 HydrophobicContact CG1-CD2 3.86Å; V419-L457 HydrophobicContact CG2-CD2 4.15Å; I453-L457 PolarHBondContact O-N 2.87Å; I454-L457 WeakPolarHBondContact O-CB 3.3Å; I454-L457 PolarHBondContact O-N 3.37Å; I454-L457 VanDerWaalsContact O-N 3.14Å; D455-L457 VanDerWaalsContact C-N 3.3Å; D455-L457 PolarHBondContact O-N 2.8Å; L457-V459 PolarHBondContact O-N 2.8Å; L457-Y460 PolarHBondContact O-N 2.78Å; L457-L461 HydrophobicContact CD1-CD1 3.77Å; L457-L461 HydrophobicContact CD1-CD2 4.45Å; L457-L461 HydrophobicContact CD1-CG 3.9Å; L457-L461 HydrophobicContact CG-CD1 3.88Å; L457-L461 HydrophobicContact CG-CG 4.39Å; L457-L461 WeakPolarHBondContact O-CG 3.4Å; L457-L461 PolarHBondContact O-N 3.12Å; L457-A474 HydrophobicContact CD2-CB 4.19Å; L457-A474 HydrophobicContact CG-CB 4.38Å
458	C	88	Confident	86.8	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.007	29%	0.285	C	S	.	.	H	α-helix	trans	-57.1	-51.5	178.9	-67.4	0	0	0	0	111.2	I454 D455 Y460 L461 E462 Y475	I454-C458 PolarHBondContact O-N 2.87Å; I454-C458 PolarHBondContact O-SG 2.83Å; D455-C458 PolarHBondContact O-N 3.03Å; C458-Y460 VanDerWaalsContact C-N 3.27Å; C458-Y460 PolarHBondContact O-N 3.4Å; C458-L461 PolarHBondContact O-N 3.39Å; C458-E462 WeakPolarHBondContact O-CB 3.38Å; C458-E462 VanDerWaalsContact O-CG 3.31Å; C458-E462 WeakPolarHBondContact O-CG 3.49Å; C458-E462 PolarHBondContact O-N 2.89Å; C458-Y475 HydrophobicContact CB-CE1 4.34Å
459	V	88.9	Confident	86.5	Confident	66 Å²	66	53.4 Å²	53.4	40%	0.4	26%	0.263	S	S	.	.	H	α-helix	trans	-60.4	-35.9	178.7	172.4	0	0	0	0	112.1	D455 L457 K463	D455-V459 WeakPolarHBondContact O-CG2 3.38Å; D455-V459 PolarHBondContact O-N 3.29Å; D455-V459 VanDerWaalsContact O-N 3.08Å; L457-V459 PolarHBondContact O-N 2.8Å; V459-K463 HydrophobicContact CG1-CD 4.21Å; V459-K463 WeakPolarHBondContact O-CB 3.22Å; V459-K463 VanDerWaalsContact O-CG 3.22Å; V459-K463 WeakPolarHBondContact O-CG 3.24Å; V459-K463 PolarHBondContact O-N 2.69Å; V459-K463 VanDerWaalsContact O-N 3.12Å
460	Y	85.6	Confident	86.2	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-69.1	-42.4	176.7	175.9	-91	0	0	0	112.6	L386 L393 I415 R456 L457 C458 K464 Y466	L386-Y460 HydrophobicContact CB-CD2 4.28Å; L386-Y460 HydrophobicContact CB-CE2 3.81Å; L386-Y460 HydrophobicContact CD2-CE2 4.32Å; L393-Y460 HydrophobicContact CD1-CE1 4.07Å; L393-Y460 WeakPolarHBondContact CD1-OH 3.4Å; I415-Y460 HydrophobicContact CD1-CD1 4Å; I415-Y460 HydrophobicContact CD1-CE1 3.47Å; I415-Y460 VanDerWaalsContact CD1-CE1 3.47Å; R456-Y460 VanDerWaalsContact O-CB 3.23Å; R456-Y460 WeakPolarHBondContact O-CB 3.45Å; R456-Y460 PolarHBondContact O-N 2.89Å; L457-Y460 PolarHBondContact O-N 2.78Å; C458-Y460 VanDerWaalsContact C-N 3.27Å; C458-Y460 PolarHBondContact O-N 3.4Å; Y460-K464 HydrophobicContact CE1-CD 4.13Å; Y460-K464 HydrophobicContact CE2-CD 3.89Å; Y460-K464 PolarHBondContact O-N 3.23Å; Y460-K464 PolarHBondContact OH-NZ 3.48Å; Y460-Y466 HydrophobicContact CE1-CE2 4.45Å
461	L	84.9	Confident	86	Confident	6 Å²	6	51.9 Å²	51.9	3%	0.031	26%	0.261	C	S	.	.	H	α-helix	trans	-69.3	-39.4	178.3	-67.8	171.8	0	0	0	112	L457 C458 K464 E465 Y466 L471 A474	L457-L461 HydrophobicContact CD1-CD1 3.77Å; L457-L461 HydrophobicContact CD1-CD2 4.45Å; L457-L461 HydrophobicContact CD1-CG 3.9Å; L457-L461 HydrophobicContact CG-CD1 3.88Å; L457-L461 HydrophobicContact CG-CG 4.39Å; L457-L461 WeakPolarHBondContact O-CG 3.4Å; L457-L461 PolarHBondContact O-N 3.12Å; C458-L461 PolarHBondContact O-N 3.39Å; L461-K464 PolarHBondContact O-N 3.45Å; L461-E465 PolarHBondContact O-N 2.94Å; L461-Y466 HydrophobicContact CD2-CD1 4.05Å; L461-Y466 HydrophobicContact CD2-CD2 3.72Å; L461-Y466 HydrophobicContact CD2-CE2 4.27Å; L461-Y466 HydrophobicContact CD2-CG 3.62Å; L461-Y466 PolarHBondContact O-N 3.49Å; L461-L471 HydrophobicContact CB-CD2 3.55Å; L461-L471 HydrophobicContact CB-CG 4.42Å; L461-A474 HydrophobicContact CD1-CB 3.46Å; L461-A474 VanDerWaalsContact CD1-CB 3.46Å
462	E	86.3	Confident	86	Confident	96 Å²	96	50.6 Å²	50.6	45%	0.449	25%	0.253	S	S	.	.	H	α-helix	trans	-59.1	-48.4	173.1	-74	168.5	-151.9	0	0	111.1	C458 K464 E465 L471 Y475	C458-E462 WeakPolarHBondContact O-CB 3.38Å; C458-E462 VanDerWaalsContact O-CG 3.31Å; C458-E462 WeakPolarHBondContact O-CG 3.49Å; C458-E462 PolarHBondContact O-N 2.89Å; E462-K464 VanDerWaalsContact C-N 3.28Å; E462-K464 PolarHBondContact O-N 3.14Å; E462-E465 PolarHBondContact O-N 3.38Å; E462-L471 HydrophobicContact CG-CD2 4.29Å; E462-Y475 PolarHBondContact OE1-OH 3.41Å
463	K	85.5	Confident	85.9	Confident	142 Å²	142	47.1 Å²	47.1	62%	0.617	24%	0.236	S	C	*	.	H	α-helix	trans	-63	-27.3	179.4	-78.8	173.7	-178.9	178	0	114.7	V459	V459-K463 HydrophobicContact CG1-CD 4.21Å; V459-K463 WeakPolarHBondContact O-CB 3.22Å; V459-K463 VanDerWaalsContact O-CG 3.22Å; V459-K463 WeakPolarHBondContact O-CG 3.24Å; V459-K463 PolarHBondContact O-N 2.69Å; V459-K463 VanDerWaalsContact O-N 3.12Å
464	K	78.9	Confident	85.7	Confident	57 Å²	57	47.1 Å²	47.1	25%	0.248	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	8.3	-176.2	-70.8	-165.8	178.3	-179.3	0	113.9	I389 I391 Y460 L461 E462 Y466	I389-K464 PolarHBondContact O-NZ 3.45Å; I391-K464 PolarHBondContact O-NZ 3.49Å; Y460-K464 HydrophobicContact CE1-CD 4.13Å; Y460-K464 HydrophobicContact CE2-CD 3.89Å; Y460-K464 PolarHBondContact O-N 3.23Å; Y460-K464 PolarHBondContact OH-NZ 3.48Å; L461-K464 PolarHBondContact O-N 3.45Å; E462-K464 VanDerWaalsContact C-N 3.28Å; E462-K464 PolarHBondContact O-N 3.14Å; K464-Y466 VanDerWaalsContact C-N 3.3Å; K464-Y466 HydrophobicContact CB-CD2 3.75Å; K464-Y466 HydrophobicContact CB-CE2 3.66Å; K464-Y466 HydrophobicContact CD-CE2 4.32Å; K464-Y466 PolarHBondContact O-N 2.92Å
465	E	79	Confident	85.8	Confident	177 Å²	177	48 Å²	48	83%	0.827	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.9	47.5	176.2	-60.3	-174.5	166.1	0	0	113.1	L461 E462	L461-E465 PolarHBondContact O-N 2.94Å; E462-E465 PolarHBondContact O-N 3.38Å
466	Y	74.8	Confident	85.8	Confident	60 Å²	60	45.5 Å²	45.5	24%	0.235	23%	0.226	C	C	.	.			trans	-61.7	155.2	176.6	-92.1	-100.3	0	0	0	112	L393 Y460 L461 K464	L393-Y466 WeakPolarHBondContact CB-OH 3.29Å; L393-Y466 PolarHBondContact O-OH 3.27Å; Y460-Y466 HydrophobicContact CE1-CE2 4.45Å; L461-Y466 HydrophobicContact CD2-CD1 4.05Å; L461-Y466 HydrophobicContact CD2-CD2 3.72Å; L461-Y466 HydrophobicContact CD2-CE2 4.27Å; L461-Y466 HydrophobicContact CD2-CG 3.62Å; L461-Y466 PolarHBondContact O-N 3.49Å; K464-Y466 VanDerWaalsContact C-N 3.3Å; K464-Y466 HydrophobicContact CB-CD2 3.75Å; K464-Y466 HydrophobicContact CB-CE2 3.66Å; K464-Y466 HydrophobicContact CD-CE2 4.32Å; K464-Y466 PolarHBondContact O-N 2.92Å
467	P	82.4	Confident	85.8	Confident	76 Å²	76	43.3 Å²	43.3	49%	0.494	22%	0.22	S	C	.	.			trans	-53.3	145.3	176.7	21.8	-34.9	0	0	0	112.1	D469 A470 L471	P467-D469 PolarHBondContact O-N 2.99Å; P467-D469 VanDerWaalsContact O-N 3.11Å; P467-A470 HydrophobicContact CG-CB 4.43Å; P467-A470 PolarHBondContact O-N 3.37Å; P467-L471 PolarHBondContact O-N 3.49Å
468	P	84	Confident	85.9	Confident	47 Å²	47	45.1 Å²	45.1	31%	0.305	23%	0.228	S	C	.	.	H	α-helix	trans	-56.6	-34.9	-171.8	20	-32.3	0	0	0	113.2	A470 L471 C472 N521	P468-A470 VanDerWaalsContact C-N 3.27Å; P468-A470 PolarHBondContact O-N 3.08Å; P468-L471 PolarHBondContact O-N 3.45Å; P468-L471 VanDerWaalsContact O-N 3.17Å; P468-C472 PolarHBondContact O-N 2.93Å; P468-C472 PolarHBondContact O-SG 3Å; P468-N521 HydrophobicContact CB-CB 3.94Å
469	D	84.4	Confident	86	Confident	59 Å²	59	45.1 Å²	45.1	32%	0.316	23%	0.227	S	C	.	.	H	α-helix	trans	-57.1	-39.2	178.5	-52.7	-33.5	0	0	0	111.9	P467 A473	P467-D469 PolarHBondContact O-N 2.99Å; P467-D469 VanDerWaalsContact O-N 3.11Å; D469-A473 PolarHBondContact O-N 3.28Å
470	A	83.5	Confident	86.1	Confident	16 Å²	16	43.1 Å²	43.1	13%	0.132	21%	0.214	C	C	.	.	H	α-helix	trans	-75.3	-34.7	178.9	0	0	0	0	0	112.6	L416 P467 P468 A474	L416-A470 HydrophobicContact CD2-CB 4.29Å; P467-A470 HydrophobicContact CG-CB 4.43Å; P467-A470 PolarHBondContact O-N 3.37Å; P468-A470 VanDerWaalsContact C-N 3.27Å; P468-A470 PolarHBondContact O-N 3.08Å; A470-A474 PolarHBondContact O-N 2.99Å; A470-A474 VanDerWaalsContact O-N 3.09Å
471	L	87.7	Confident	86.3	Confident	11 Å²	11	43.2 Å²	43.2	6%	0.058	21%	0.214	C	C	.	.	H	α-helix	trans	-67.3	-42.9	172.8	-77.3	166	0	0	0	111.2	L461 E462 P467 P468 A473 A474 Y475 Y517	L461-L471 HydrophobicContact CB-CD2 3.55Å; L461-L471 HydrophobicContact CB-CG 4.42Å; E462-L471 HydrophobicContact CG-CD2 4.29Å; P467-L471 PolarHBondContact O-N 3.49Å; P468-L471 PolarHBondContact O-N 3.45Å; P468-L471 VanDerWaalsContact O-N 3.17Å; L471-A473 VanDerWaalsContact C-N 3.34Å; L471-A473 PolarHBondContact O-N 3.21Å; L471-A474 PolarHBondContact O-N 3.1Å; L471-Y475 HydrophobicContact CD2-CE1 4.44Å; L471-Y475 WeakPolarHBondContact O-CB 3.16Å; L471-Y475 PolarHBondContact O-N 3.05Å; L471-Y517 HydrophobicContact CB-CE1 3.98Å; L471-Y517 WeakPolarHBondContact CD1-OH 3.5Å
472	C	89.4	Confident	86.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.2	-42.6	176.7	-65.6	0	0	0	0	111.8	P468 Y475 L476 I518 L527	P468-C472 PolarHBondContact O-N 2.93Å; P468-C472 PolarHBondContact O-SG 3Å; C472-Y475 PolarHBondContact O-N 2.68Å; C472-L476 PolarHBondContact O-N 2.79Å; C472-I518 HydrophobicContact CB-CG1 4.23Å; C472-L527 HydrophobicContact CB-CD1 4.46Å
473	A	88.7	Confident	86.7	Confident	18 Å²	18	40.2 Å²	40.2	15%	0.149	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-44.5	175.3	0	0	0	0	0	112.8	L416 D469 L471 Y475 L476 H477	L416-A473 HydrophobicContact CD1-CB 4.06Å; L416-A473 HydrophobicContact CD2-CB 3.74Å; L416-A473 HydrophobicContact CG-CB 4.46Å; D469-A473 PolarHBondContact O-N 3.28Å; L471-A473 VanDerWaalsContact C-N 3.34Å; L471-A473 PolarHBondContact O-N 3.21Å; A473-Y475 PolarHBondContact O-N 2.85Å; A473-L476 WeakPolarHBondContact O-CB 3.26Å; A473-L476 PolarHBondContact O-N 2.87Å; A473-H477 PolarHBondContact O-CD2 2.78Å; A473-H477 PolarHBondContact O-N 2.74Å; A473-H477 VanDerWaalsContact O-N 3.11Å
474	A	88.7	Confident	86.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.7	-39.2	176.5	0	0	0	0	0	112.5	L416 L457 L461 A470 L471 L476 H477 K478	L416-A474 HydrophobicContact CD1-CB 4.24Å; L457-A474 HydrophobicContact CD2-CB 4.19Å; L457-A474 HydrophobicContact CG-CB 4.38Å; L461-A474 HydrophobicContact CD1-CB 3.46Å; L461-A474 VanDerWaalsContact CD1-CB 3.46Å; A470-A474 PolarHBondContact O-N 2.99Å; A470-A474 VanDerWaalsContact O-N 3.09Å; L471-A474 PolarHBondContact O-N 3.1Å; A474-L476 VanDerWaalsContact C-N 3.32Å; A474-H477 PolarHBondContact O-N 3.46Å; A474-K478 PolarHBondContact O-N 2.77Å; A474-K478 VanDerWaalsContact O-N 3.09Å
475	Y	92	Very high	87.3	Confident	22 Å²	22	35.2 Å²	35.2	9%	0.086	18%	0.178	C	C	.	.	H	α-helix	trans	-65.4	-34.4	173	-67.7	-12.5	0	0	0	112.1	C458 E462 L471 C472 A473 K478 L479 L514 Y517	C458-Y475 HydrophobicContact CB-CE1 4.34Å; E462-Y475 PolarHBondContact OE1-OH 3.41Å; L471-Y475 HydrophobicContact CD2-CE1 4.44Å; L471-Y475 WeakPolarHBondContact O-CB 3.16Å; L471-Y475 PolarHBondContact O-N 3.05Å; C472-Y475 PolarHBondContact O-N 2.68Å; A473-Y475 PolarHBondContact O-N 2.85Å; Y475-K478 PolarHBondContact O-N 2.8Å; Y475-L479 WeakPolarHBondContact O-CB 3.34Å; Y475-L479 VanDerWaalsContact O-CG 3.24Å; Y475-L479 WeakPolarHBondContact O-CG 3.49Å; Y475-L479 PolarHBondContact O-N 3.26Å; Y475-L514 HydrophobicContact CD1-CD2 3.51Å; Y475-L514 HydrophobicContact CD2-CD2 3.84Å; Y475-L514 HydrophobicContact CE1-CD2 3.84Å; Y475-L514 HydrophobicContact CE2-CD2 4.16Å; Y475-L514 HydrophobicContact CG-CD2 3.52Å; Y475-Y517 AromaticContact CD2-CD1 3.66Å; Y475-Y517 HydrophobicContact CD2-CD1 3.66Å; Y475-Y517 HydrophobicContact CD2-CE1 4.26Å; Y475-Y517 HydrophobicContact CD2-CG 4.1Å; Y475-Y517 AromaticContact CE2-CD1 3.45Å; Y475-Y517 HydrophobicContact CE2-CD1 3.45Å; Y475-Y517 VanDerWaalsContact CE2-CD1 3.45Å; Y475-Y517 HydrophobicContact CE2-CD2 4.17Å; Y475-Y517 AromaticContact CE2-CE1 3.85Å; Y475-Y517 HydrophobicContact CE2-CE1 3.85Å; Y475-Y517 AromaticContact CE2-CG 3.63Å; Y475-Y517 HydrophobicContact CE2-CG 3.63Å
476	L	91.2	Very high	87.5	Confident	12 Å²	12	28.5 Å²	28.5	6%	0.063	15%	0.146	C	C	.	.	H	α-helix	trans	-63.7	-49	173.5	-177.4	64.1	0	0	0	111.6	C472 A473 A474 K478 L479 E480 L527 R530	C472-L476 PolarHBondContact O-N 2.79Å; A473-L476 WeakPolarHBondContact O-CB 3.26Å; A473-L476 PolarHBondContact O-N 2.87Å; A474-L476 VanDerWaalsContact C-N 3.32Å; L476-K478 VanDerWaalsContact C-N 3.27Å; L476-K478 PolarHBondContact O-N 3.23Å; L476-L479 WeakPolarHBondContact O-CB 3.2Å; L476-L479 PolarHBondContact O-N 3.2Å; L476-E480 HydrophobicContact CD1-CG 4.15Å; L476-E480 HydrophobicContact CG-CG 4.3Å; L476-E480 WeakPolarHBondContact CG-OE1 3.23Å; L476-E480 WeakPolarHBondContact O-CG 3.4Å; L476-E480 PolarHBondContact O-N 3.22Å; L476-L527 HydrophobicContact CD2-CB 4.47Å; L476-L527 HydrophobicContact CD2-CD2 3.45Å; L476-L527 VanDerWaalsContact CD2-CD2 3.45Å; L476-R530 HydrophobicContact CD1-CB 3.87Å; L476-R530 HydrophobicContact CD2-CB 4.27Å
477	H	89.3	Confident	87.7	Confident	39 Å²	39	28 Å²	28	18%	0.181	15%	0.148	C	C	.	.	H	α-helix	trans	-55.5	-43.1	174.7	-73.2	-71	0	0	0	111.8	D423 A473 A474 E480 H481	D423-H477 IonicContact OD2-CE1 3.34Å; D423-H477 IonicContact OD2-CG 3.25Å; D423-H477 IonicContact OD2-ND1 2.78Å; D423-H477 PolarHBondContact OD2-ND1 3.16Å; A473-H477 PolarHBondContact O-CD2 2.78Å; A473-H477 PolarHBondContact O-N 2.74Å; A473-H477 VanDerWaalsContact O-N 3.11Å; A474-H477 PolarHBondContact O-N 3.46Å; H477-E480 PolarHBondContact O-N 2.64Å; H477-H481 PolarHBondContact O-CD2 3.41Å; H477-H481 PolarHBondContact O-N 3.29Å
478	K	90.6	Very high	87.3	Confident	39 Å²	39	31.5 Å²	31.5	17%	0.17	16%	0.155	C	C	.	.	H	α-helix	trans	-62.1	-42.9	174.5	-178.6	165.5	175.2	162.3	0	112.8	I454 D455 A474 Y475 L476 M482 L514	I454-K478 HydrophobicContact CG2-CB 3.81Å; D455-K478 WeakPolarHBondContact OD1-CE 3.41Å; D455-K478 IonicContact OD1-NZ 2.82Å; D455-K478 PolarHBondContact OD1-NZ 3.32Å; A474-K478 PolarHBondContact O-N 2.77Å; A474-K478 VanDerWaalsContact O-N 3.09Å; Y475-K478 PolarHBondContact O-N 2.8Å; L476-K478 VanDerWaalsContact C-N 3.27Å; L476-K478 PolarHBondContact O-N 3.23Å; K478-M482 HydrophobicContact CG-SD 3.9Å; K478-M482 WeakPolarHBondContact O-CB 3.48Å; K478-M482 VanDerWaalsContact O-CG 3.26Å; K478-M482 WeakPolarHBondContact O-CG 3.29Å; K478-M482 PolarHBondContact O-N 2.83Å; K478-L514 HydrophobicContact CD-CD1 4.1Å; K478-L514 HydrophobicContact CG-CD1 4.16Å
479	L	91.7	Very high	86.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63	-41.9	175.7	-75	171.9	0	0	0	111.6	Y475 L476 H481 M482 Y483 I511 L514 I518 A531	Y475-L479 WeakPolarHBondContact O-CB 3.34Å; Y475-L479 VanDerWaalsContact O-CG 3.24Å; Y475-L479 WeakPolarHBondContact O-CG 3.49Å; Y475-L479 PolarHBondContact O-N 3.26Å; L476-L479 WeakPolarHBondContact O-CB 3.2Å; L476-L479 PolarHBondContact O-N 3.2Å; L479-H481 VanDerWaalsContact C-N 3.3Å; L479-H481 PolarHBondContact O-N 2.86Å; L479-M482 PolarHBondContact O-N 2.84Å; L479-Y483 WeakPolarHBondContact O-CB 2.94Å; L479-Y483 WeakPolarHBondContact O-CD1 3.48Å; L479-Y483 PolarHBondContact O-N 3.45Å; L479-I511 HydrophobicContact CD2-CB 4.07Å; L479-I511 HydrophobicContact CD2-CG1 3.81Å; L479-I511 HydrophobicContact CD2-CG2 3.86Å; L479-L514 HydrophobicContact CD1-CB 4.22Å; L479-L514 HydrophobicContact CD2-CB 3.97Å; L479-L514 HydrophobicContact CD2-CD1 3.95Å; L479-L514 HydrophobicContact CG-CB 4.14Å; L479-L514 HydrophobicContact CG-CD1 4.2Å; L479-I518 HydrophobicContact CD1-CD1 3.65Å; L479-A531 HydrophobicContact CD1-CB 4.3Å
480	E	90.4	Very high	86.4	Confident	24 Å²	24	32.5 Å²	32.5	11%	0.112	15%	0.153	C	C	.	.	H	α-helix	trans	-62.9	-32.8	-178.7	-72.9	-176.9	-175	0	0	112.6	L476 H477 Y483 Y484 R530	L476-E480 HydrophobicContact CD1-CG 4.15Å; L476-E480 HydrophobicContact CG-CG 4.3Å; L476-E480 WeakPolarHBondContact CG-OE1 3.23Å; L476-E480 WeakPolarHBondContact O-CG 3.4Å; L476-E480 PolarHBondContact O-N 3.22Å; H477-E480 PolarHBondContact O-N 2.64Å; E480-Y483 WeakPolarHBondContact O-CD1 3.49Å; E480-Y483 VanDerWaalsContact O-CE1 3.25Å; E480-Y483 WeakPolarHBondContact O-CE1 3.47Å; E480-Y484 WeakPolarHBondContact O-CE1 3.32Å; E480-R530 VanDerWaalsContact CD-NH2 3.3Å; E480-R530 IonicContact OE1-CZ 3.55Å; E480-R530 IonicContact OE1-NE 2.81Å; E480-R530 PolarHBondContact OE1-NE 3.2Å; E480-R530 IonicContact OE1-NH2 2.77Å; E480-R530 PolarHBondContact OE1-NH2 2.8Å; E480-R530 IonicContact OE2-NH2 3.61Å; E480-R530 PolarHBondContact OE2-NH2 3.35Å
481	H	89.6	Confident	85.8	Confident	7 Å²	7	31.8 Å²	31.8	3%	0.032	15%	0.148	C	C	.	.	H	α-helix	trans	-82.2	-12.5	170.2	-76.1	-76.6	0	0	0	115.4	D423 E447 I454 H477 L479 K485	D423-H481 IonicContact OD1-CE1 2.7Å; D423-H481 IonicContact OD1-NE2 3.85Å; D423-H481 PolarHBondContact OD1-NE2 2.68Å; E447-H481 IonicContact OE1-CE1 2.69Å; E447-H481 IonicContact OE1-CG 3.7Å; E447-H481 IonicContact OE1-ND1 2.67Å; E447-H481 PolarHBondContact OE1-ND1 2.89Å; I454-H481 WeakPolarHBondContact CD1-CD2 3.17Å; I454-H481 WeakPolarHBondContact CD1-NE2 3.43Å; H477-H481 PolarHBondContact O-CD2 3.41Å; H477-H481 PolarHBondContact O-N 3.29Å; L479-H481 VanDerWaalsContact C-N 3.3Å; L479-H481 PolarHBondContact O-N 2.86Å; H481-K485 VanDerWaalsContact O-CD 3.3Å; H481-K485 WeakPolarHBondContact O-CD 3.47Å; H481-K485 VanDerWaalsContact O-CE 3.26Å; H481-K485 WeakPolarHBondContact O-CE 3.39Å; H481-K485 PolarHBondContact O-NZ 3.47Å
482	M	88.1	Confident	85.1	Confident	32 Å²	32	38.8 Å²	38.8	16%	0.158	17%	0.173	C	C	.	.	H	α-helix	trans	-104.5	-36.6	-175.2	-73.2	-174.8	72.8	0	0	114	K478 L479 Y484 K485 N507 V510 I511	K478-M482 HydrophobicContact CG-SD 3.9Å; K478-M482 WeakPolarHBondContact O-CB 3.48Å; K478-M482 VanDerWaalsContact O-CG 3.26Å; K478-M482 WeakPolarHBondContact O-CG 3.29Å; K478-M482 PolarHBondContact O-N 2.83Å; L479-M482 PolarHBondContact O-N 2.84Å; M482-Y484 VanDerWaalsContact C-N 3.27Å; M482-Y484 PolarHBondContact O-N 3.16Å; M482-Y484 VanDerWaalsContact O-N 3.13Å; M482-K485 PolarHBondContact O-N 2.8Å; M482-N507 HydrophobicContact CE-CB 3.88Å; M482-V510 HydrophobicContact CE-CG1 4.25Å; M482-I511 HydrophobicContact CB-CD1 4.23Å
483	Y	91.4	Very high	84.4	Confident	7 Å²	7	44.2 Å²	44.2	3%	0.027	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-27	-163	80.3	-85.4	0	0	0	115.5	L479 E480 C534 Y537 L571 M638	L479-Y483 WeakPolarHBondContact O-CB 2.94Å; L479-Y483 WeakPolarHBondContact O-CD1 3.48Å; L479-Y483 PolarHBondContact O-N 3.45Å; E480-Y483 WeakPolarHBondContact O-CD1 3.49Å; E480-Y483 VanDerWaalsContact O-CE1 3.25Å; E480-Y483 WeakPolarHBondContact O-CE1 3.47Å; Y483-C534 HydrophobicContact CG-CB 4.12Å; Y483-Y537 AromaticContact CD2-CD1 3.46Å; Y483-Y537 HydrophobicContact CD2-CD1 3.46Å; Y483-Y537 VanDerWaalsContact CD2-CD1 3.46Å; Y483-Y537 HydrophobicContact CD2-CD2 4.23Å; Y483-Y537 HydrophobicContact CD2-CE1 4.1Å; Y483-Y537 AromaticContact CD2-CG 3.55Å; Y483-Y537 HydrophobicContact CD2-CG 3.55Å; Y483-Y537 AromaticContact CE2-CD1 3.78Å; Y483-Y537 HydrophobicContact CE2-CD1 3.78Å; Y483-Y537 AromaticContact CE2-CD2 3.86Å; Y483-Y537 HydrophobicContact CE2-CD2 3.86Å; Y483-Y537 HydrophobicContact CE2-CE1 4.1Å; Y483-Y537 HydrophobicContact CE2-CE2 4.16Å; Y483-Y537 AromaticContact CE2-CG 3.67Å; Y483-Y537 HydrophobicContact CE2-CG 3.67Å; Y483-L571 HydrophobicContact CE2-CD1 4.01Å; Y483-M638 HydrophobicContact CE1-CE 4Å; Y483-M638 WeakPolarHBondContact OH-CE 3.37Å
484	Y	90.4	Very high	83.6	Confident	28 Å²	28	43.4 Å²	43.4	11%	0.11	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-10.9	-176.4	67.8	-94.5	0	0	0	113.5	E447 E480 M482 F486 H637 M638	E447-Y484 PolarHBondContact OE1-OH 2.92Å; E480-Y484 WeakPolarHBondContact O-CE1 3.32Å; M482-Y484 VanDerWaalsContact C-N 3.27Å; M482-Y484 PolarHBondContact O-N 3.16Å; M482-Y484 VanDerWaalsContact O-N 3.13Å; Y484-F486 PolarHBondContact O-N 3.2Å; Y484-H637 AromaticContact CE2-CD2 3.6Å; Y484-H637 AromaticContact CE2-NE2 3.91Å; Y484-H637 AromaticContact CZ-CD2 3.9Å; Y484-H637 AromaticContact CZ-NE2 3.69Å; Y484-H637 PolarHBondContact OH-NE2 3.37Å; Y484-M638 HydrophobicContact CD1-CE 3.65Å; Y484-M638 HydrophobicContact CD2-CG 4.5Å; Y484-M638 HydrophobicContact CE1-CE 3.91Å; Y484-M638 HydrophobicContact CE1-SD 4.36Å; Y484-M638 HydrophobicContact CE2-CG 4.42Å; Y484-M638 HydrophobicContact CG-CE 4.2Å
485	K	87.3	Confident	82.6	Confident	65 Å²	65	48.1 Å²	48.1	28%	0.283	21%	0.212	S	C	.	.			trans	-82.2	113.1	-173.9	-70.3	179	177	144.3	0	111	E447 H481 M482 Y542	E447-K485 IonicContact OE1-NZ 2.69Å; E447-K485 PolarHBondContact OE1-NZ 3.12Å; E447-K485 WeakPolarHBondContact OE2-CE 3.39Å; E447-K485 IonicContact OE2-NZ 3.73Å; E447-K485 PolarHBondContact OE2-NZ 3.39Å; H481-K485 VanDerWaalsContact O-CD 3.3Å; H481-K485 WeakPolarHBondContact O-CD 3.47Å; H481-K485 VanDerWaalsContact O-CE 3.26Å; H481-K485 WeakPolarHBondContact O-CE 3.39Å; H481-K485 PolarHBondContact O-NZ 3.47Å; M482-K485 PolarHBondContact O-N 2.8Å; K485-Y542 PolarHBondContact O-OH 2.61Å
486	F	82.6	Confident	81.8	Confident	36 Å²	36	51.2 Å²	51.2	16%	0.158	24%	0.242	C	C	.	.			trans	-86.4	128.9	172.2	-170.1	-112.2	0	0	0	111.4	Y484 F488 W490 L541 Y542 F733	Y484-F486 PolarHBondContact O-N 3.2Å; F486-F488 AromaticContact CD1-CD1 3.85Å; F486-F488 HydrophobicContact CD1-CD1 3.85Å; F486-F488 AromaticContact CD1-CE1 3.99Å; F486-F488 HydrophobicContact CD1-CE1 3.99Å; F486-F488 HydrophobicContact CD1-CG 4.13Å; F486-F488 HydrophobicContact CD1-CZ 4.4Å; F486-F488 HydrophobicContact CE1-CD1 4.22Å; F486-F488 PolarHBondContact O-N 2.77Å; F486-W490 HydrophobicContact CE2-CE3 4.42Å; F486-W490 HydrophobicContact CE2-CZ3 4.38Å; F486-W490 HydrophobicContact CZ-CE3 4.43Å; F486-L541 HydrophobicContact CB-CD1 4.28Å; F486-L541 HydrophobicContact CB-CD2 4.05Å; F486-L541 HydrophobicContact CB-CG 4.36Å; F486-L541 HydrophobicContact CD2-CD1 4.24Å; F486-L541 HydrophobicContact CD2-CD2 4.24Å; F486-L541 HydrophobicContact CD2-CG 3.9Å; F486-Y542 HydrophobicContact CD2-CE1 4.26Å; F486-Y542 HydrophobicContact CD2-CE2 4.31Å; F486-Y542 HydrophobicContact CE2-CD1 4.26Å; F486-Y542 HydrophobicContact CE2-CE1 4.09Å; F486-F733 HydrophobicContact CE1-CB 4.2Å; F486-F733 AromaticContact CE1-CD2 3.76Å; F486-F733 HydrophobicContact CE1-CD2 3.76Å; F486-F733 HydrophobicContact CE1-CE2 4.35Å; F486-F733 AromaticContact CE1-CG 3.94Å; F486-F733 HydrophobicContact CE1-CG 3.94Å; F486-F733 AromaticContact CE2-CD1 3.94Å; F486-F733 HydrophobicContact CE2-CD1 3.94Å; F486-F733 HydrophobicContact CE2-CD2 4.43Å; F486-F733 HydrophobicContact CE2-CE1 4.26Å; F486-F733 HydrophobicContact CE2-CG 4.04Å; F486-F733 HydrophobicContact CZ-CB 4Å; F486-F733 AromaticContact CZ-CD1 3.66Å; F486-F733 HydrophobicContact CZ-CD1 3.66Å; F486-F733 AromaticContact CZ-CD2 3.38Å; F486-F733 HydrophobicContact CZ-CD2 3.38Å; F486-F733 AromaticContact CZ-CE1 3.95Å; F486-F733 HydrophobicContact CZ-CE1 3.95Å; F486-F733 AromaticContact CZ-CE2 3.73Å; F486-F733 HydrophobicContact CZ-CE2 3.73Å; F486-F733 AromaticContact CZ-CG 3.37Å; F486-F733 HydrophobicContact CZ-CG 3.37Å; F486-F733 AromaticContact CZ-CZ 3.99Å; F486-F733 HydrophobicContact CZ-CZ 3.99Å
487	D	79	Confident	80.7	Confident	51 Å²	51	53.1 Å²	53.1	27%	0.273	26%	0.256	S	S	.	.			trans	-83.2	101.9	169.4	179.8	18.5	0	0	0	111	E489 W490 G491 H505 Y542	D487-E489 PolarHBondContact O-N 3Å; D487-E489 WeakPolarHBondContact OD1-CA 3.4Å; D487-E489 WeakPolarHBondContact OD1-CB 3.33Å; D487-E489 PolarHBondContact OD1-N 2.78Å; D487-W490 HydrophobicContact CB-CB 4.13Å; D487-W490 PolarHBondContact O-N 2.99Å; D487-W490 WeakPolarHBondContact OD2-CB 3.35Å; D487-W490 PolarHBondContact OD2-N 3.34Å; D487-G491 PolarHBondContact O-N 2.89Å; D487-H505 WeakPolarHBondContact CB-NE2 3.44Å; D487-H505 IonicContact OD2-CD2 4Å; D487-H505 IonicContact OD2-NE2 2.78Å; D487-H505 PolarHBondContact OD2-NE2 3.17Å; D487-Y542 PolarHBondContact N-OH 3.2Å
488	F	73.5	Confident	79.7	Confident	148 Å²	148	54.1 Å²	54.1	65%	0.649	27%	0.268	S	S	*	.	H	α-helix	trans	-65.9	-16.9	173.7	-62.3	-82.8	0	0	0	113.9	F486 R492	F486-F488 AromaticContact CD1-CD1 3.85Å; F486-F488 HydrophobicContact CD1-CD1 3.85Å; F486-F488 AromaticContact CD1-CE1 3.99Å; F486-F488 HydrophobicContact CD1-CE1 3.99Å; F486-F488 HydrophobicContact CD1-CG 4.13Å; F486-F488 HydrophobicContact CD1-CZ 4.4Å; F486-F488 HydrophobicContact CE1-CD1 4.22Å; F486-F488 PolarHBondContact O-N 2.77Å; F488-R492 WeakPolarHBondContact O-CB 3.47Å; F488-R492 VanDerWaalsContact O-CG 3.31Å; F488-R492 WeakPolarHBondContact O-CG 3.49Å; F488-R492 PolarHBondContact O-N 3.26Å; F488-R492 VanDerWaalsContact O-N 3.1Å; F488-R492 PolarHBondContact O-NE 3.36Å; F488-R492 VanDerWaalsContact O-NE 3.1Å
489	E	72.5	Confident	78.4	Confident	114 Å²	114	55.3 Å²	55.3	53%	0.533	28%	0.275	S	S	.	.	H	α-helix	trans	-78.2	-48.9	173.5	-61.4	-164.5	176.2	0	0	111.8	D487 G491 R492 K493	D487-E489 PolarHBondContact O-N 3Å; D487-E489 WeakPolarHBondContact OD1-CA 3.4Å; D487-E489 WeakPolarHBondContact OD1-CB 3.33Å; D487-E489 PolarHBondContact OD1-N 2.78Å; E489-G491 VanDerWaalsContact C-N 3.29Å; E489-R492 PolarHBondContact O-N 3.2Å; E489-K493 WeakPolarHBondContact O-CG 3.33Å; E489-K493 PolarHBondContact O-N 2.94Å
490	W	78	Confident	77.1	Confident	13 Å²	13	64.1 Å²	64.1	5%	0.049	32%	0.316	C	S	.	.	H	α-helix	trans	-59	-42	168.4	179.9	92.7	0	0	0	111.3	F486 D487 R492 K493 V494 M499 V502 G503 H505 Y542 F733	F486-W490 HydrophobicContact CE2-CE3 4.42Å; F486-W490 HydrophobicContact CE2-CZ3 4.38Å; F486-W490 HydrophobicContact CZ-CE3 4.43Å; D487-W490 HydrophobicContact CB-CB 4.13Å; D487-W490 PolarHBondContact O-N 2.99Å; D487-W490 WeakPolarHBondContact OD2-CB 3.35Å; D487-W490 PolarHBondContact OD2-N 3.34Å; W490-R492 PolarHBondContact O-N 3.14Å; W490-K493 WeakPolarHBondContact O-CB 3.27Å; W490-K493 PolarHBondContact O-N 3.4Å; W490-K493 VanDerWaalsContact O-N 3.11Å; W490-V494 HydrophobicContact CD2-CG2 3.75Å; W490-V494 HydrophobicContact CE3-CG2 3.94Å; W490-V494 HydrophobicContact CG-CG2 4.44Å; W490-V494 HydrophobicContact CH2-CG2 3.75Å; W490-V494 HydrophobicContact CZ2-CG2 3.56Å; W490-V494 HydrophobicContact CZ3-CG2 3.91Å; W490-V494 WeakPolarHBondContact O-CG2 3.47Å; W490-V494 PolarHBondContact O-N 2.98Å; W490-M499 HydrophobicContact CH2-CG 4.33Å; W490-M499 HydrophobicContact CH2-SD 3.9Å; W490-M499 HydrophobicContact CZ2-CG 4.24Å; W490-M499 HydrophobicContact CZ2-SD 4.3Å; W490-V502 HydrophobicContact CG-CG1 4.45Å; W490-G503 PolarHBondContact NE1-O 3.37Å; W490-H505 AromaticContact CD1-CD2 3.86Å; W490-H505 HydrophobicContact CD2-CB 4.06Å; W490-H505 AromaticContact CD2-CD2 3.93Å; W490-H505 HydrophobicContact CG-CB 4.25Å; W490-H505 AromaticContact CG-CD2 3.48Å; W490-H505 VanDerWaalsContact CG-CD2 3.48Å; W490-H505 HydrophobicContact CZ2-CB 4.3Å; W490-Y542 HydrophobicContact CD2-CD1 4.44Å; W490-Y542 HydrophobicContact CD2-CE1 4.3Å; W490-Y542 AromaticContact CE3-CD1 3.79Å; W490-Y542 HydrophobicContact CE3-CD1 3.79Å; W490-Y542 AromaticContact CE3-CE1 3.77Å; W490-Y542 HydrophobicContact CE3-CE1 3.77Å; W490-Y542 AromaticContact CH2-CD1 3.76Å; W490-Y542 HydrophobicContact CH2-CD1 3.76Å; W490-Y542 HydrophobicContact CZ2-CD1 4.38Å; W490-Y542 AromaticContact CZ3-CD1 3.43Å; W490-Y542 HydrophobicContact CZ3-CD1 3.43Å; W490-Y542 VanDerWaalsContact CZ3-CD1 3.43Å; W490-Y542 AromaticContact CZ3-CE1 3.93Å; W490-Y542 HydrophobicContact CZ3-CE1 3.93Å; W490-F733 HydrophobicContact CE3-CZ 4.46Å; W490-F733 AromaticContact CZ3-CE1 3.92Å; W490-F733 HydrophobicContact CZ3-CE1 3.92Å; W490-F733 AromaticContact CZ3-CZ 3.88Å; W490-F733 HydrophobicContact CZ3-CZ 3.88Å
491	G	70.1	Confident	75.7	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.01	34%	0.343	C	S	.	.	H	α-helix	trans	-54.8	-52.1	175.5	0	0	0	0	0	112.5	D487 E489 K493 V494 E495 F733	D487-G491 PolarHBondContact O-N 2.89Å; E489-G491 VanDerWaalsContact C-N 3.29Å; G491-K493 VanDerWaalsContact C-N 3.3Å; G491-K493 PolarHBondContact O-N 3.29Å; G491-V494 PolarHBondContact O-N 3.37Å; G491-V494 VanDerWaalsContact O-N 3.13Å; G491-E495 WeakPolarHBondContact O-CG 3.43Å; G491-E495 PolarHBondContact O-N 3.39Å; G491-F733 WeakPolarHBondContact O-CE2 3.46Å
492	R	72.7	Confident	74.3	Confident	159 Å²	159	71.7 Å²	71.7	60%	0.6	35%	0.354	S	S	*	.	H	α-helix	trans	-62.4	-32.7	176.3	-76.5	-180	-68.5	172.9	0.5	113.6	F488 E489 W490 A496	F488-R492 WeakPolarHBondContact O-CB 3.47Å; F488-R492 VanDerWaalsContact O-CG 3.31Å; F488-R492 WeakPolarHBondContact O-CG 3.49Å; F488-R492 PolarHBondContact O-N 3.26Å; F488-R492 VanDerWaalsContact O-N 3.1Å; F488-R492 PolarHBondContact O-NE 3.36Å; F488-R492 VanDerWaalsContact O-NE 3.1Å; E489-R492 PolarHBondContact O-N 3.2Å; W490-R492 PolarHBondContact O-N 3.14Å; R492-A496 WeakPolarHBondContact O-CB 3.37Å; R492-A496 PolarHBondContact O-N 2.91Å
493	K	74.4	Confident	73.4	Confident	113 Å²	113	71.5 Å²	71.5	49%	0.491	36%	0.361	S	S	.	.	H	α-helix	trans	-67	-43	173.2	-69.4	164.4	-169.6	162.4	0	111	E489 W490 G491 A496 S497 V502	E489-K493 WeakPolarHBondContact O-CG 3.33Å; E489-K493 PolarHBondContact O-N 2.94Å; W490-K493 WeakPolarHBondContact O-CB 3.27Å; W490-K493 PolarHBondContact O-N 3.4Å; W490-K493 VanDerWaalsContact O-N 3.11Å; G491-K493 VanDerWaalsContact C-N 3.3Å; G491-K493 PolarHBondContact O-N 3.29Å; K493-A496 PolarHBondContact O-N 3.09Å; K493-S497 PolarHBondContact O-N 3.33Å; K493-V502 HydrophobicContact CB-CG1 3.97Å; K493-V502 HydrophobicContact CB-CG2 3.96Å; K493-V502 WeakPolarHBondContact O-CG2 3.36Å
494	V	71.9	Confident	72.4	Confident	2 Å²	2	74.9 Å²	74.9	1%	0.012	38%	0.379	C	S	.	.	H	α-helix	trans	-66.5	-38.2	177.8	170	0	0	0	0	111.7	W490 G491 A496 S498 M499 V502 F733	W490-V494 HydrophobicContact CD2-CG2 3.75Å; W490-V494 HydrophobicContact CE3-CG2 3.94Å; W490-V494 HydrophobicContact CG-CG2 4.44Å; W490-V494 HydrophobicContact CH2-CG2 3.75Å; W490-V494 HydrophobicContact CZ2-CG2 3.56Å; W490-V494 HydrophobicContact CZ3-CG2 3.91Å; W490-V494 WeakPolarHBondContact O-CG2 3.47Å; W490-V494 PolarHBondContact O-N 2.98Å; G491-V494 PolarHBondContact O-N 3.37Å; G491-V494 VanDerWaalsContact O-N 3.13Å; V494-A496 VanDerWaalsContact C-N 3.25Å; V494-A496 PolarHBondContact O-N 3.25Å; V494-S498 WeakPolarHBondContact O-CA 3.16Å; V494-S498 PolarHBondContact O-N 3.3Å; V494-M499 HydrophobicContact CG1-CB 3.89Å; V494-M499 HydrophobicContact CG1-CG 4.48Å; V494-V502 HydrophobicContact CG2-CB 3.9Å; V494-V502 HydrophobicContact CG2-CG1 3.98Å; V494-V502 HydrophobicContact CG2-CG2 4.13Å; V494-F733 HydrophobicContact CB-CZ 4.05Å; V494-F733 HydrophobicContact CG1-CZ 3.85Å
495	E	67.7	Low	71.5	Confident	99 Å²	99	73.9 Å²	73.9	46%	0.463	38%	0.376	S	S	.	.	H	α-helix	trans	-64.7	-28.5	172.8	-73	175.9	172.9	0	0	112.9	G491 F733 E734	G491-E495 WeakPolarHBondContact O-CG 3.43Å; G491-E495 PolarHBondContact O-N 3.39Å; E495-F733 HydrophobicContact CG-CE2 4.06Å; E495-E734 HydrophobicContact CG-CG 4.25Å; E495-E734 VanDerWaalsContact OE1-CA 3.24Å; E495-E734 WeakPolarHBondContact OE1-CA 3.3Å; E495-E734 PolarHBondContact OE1-N 3.13Å
496	A	75.1	Confident	71	Confident	87 Å²	87	74.6 Å²	74.6	72%	0.719	39%	0.386	S	S	*	.	H	α-helix	trans	-86.8	-38.2	179.2	0	0	0	0	0	114.3	R492 K493 V494	R492-A496 WeakPolarHBondContact O-CB 3.37Å; R492-A496 PolarHBondContact O-N 2.91Å; K493-A496 PolarHBondContact O-N 3.09Å; V494-A496 VanDerWaalsContact C-N 3.25Å; V494-A496 PolarHBondContact O-N 3.25Å
497	S	68.2	Low	70.8	Confident	51 Å²	51	75.5 Å²	75.5	36%	0.357	39%	0.393	S	S	.	.	H	α-helix	trans	-120.6	2.1	-168.5	-106.3	0	0	0	0	114.4	K493 E501	K493-S497 PolarHBondContact O-N 3.33Å; S497-E501 WeakPolarHBondContact CB-OE2 3.44Å; S497-E501 WeakPolarHBondContact O-CB 3.42Å; S497-E501 VanDerWaalsContact O-CD 3.23Å; S497-E501 VanDerWaalsContact O-CG 3.24Å; S497-E501 WeakPolarHBondContact O-CG 3.38Å; S497-E501 PolarHBondContact OG-OE2 3.43Å
498	S	67.7	Low	71	Confident	60 Å²	60	73.1 Å²	73.1	42%	0.42	38%	0.38	S	S	.	.	H	α-helix	trans	65.3	161.7	-168.5	86.6	0	0	0	0	114.6	V494 E500 V502	V494-S498 WeakPolarHBondContact O-CA 3.16Å; V494-S498 PolarHBondContact O-N 3.3Å; S498-E500 PolarHBondContact O-N 3.29Å; S498-V502 WeakPolarHBondContact O-CG2 3.3Å
499	M	64.2	Low	71.5	Confident	65 Å²	65	70.1 Å²	70.1	32%	0.32	37%	0.371	S	S	.	.	H	α-helix	trans	-70.9	-18.4	-175.2	-168.3	161.1	66.7	0	0	113.5	W490 V494 G503	W490-M499 HydrophobicContact CH2-CG 4.33Å; W490-M499 HydrophobicContact CH2-SD 3.9Å; W490-M499 HydrophobicContact CZ2-CG 4.24Å; W490-M499 HydrophobicContact CZ2-SD 4.3Å; V494-M499 HydrophobicContact CG1-CB 3.89Å; V494-M499 HydrophobicContact CG1-CG 4.48Å; M499-G503 PolarHBondContact O-N 3.42Å
500	E	63.5	Low	72.2	Confident	185 Å²	185	67.1 Å²	67.1	86%	0.864	36%	0.36	S	S	*	.	H	α-helix	trans	-76.3	-37.4	-179.7	-63.7	-176	-179.3	0	0	112.3	S498	S498-E500 PolarHBondContact O-N 3.29Å
501	E	61.1	Low	72.8	Confident	144 Å²	144	66.5 Å²	66.5	67%	0.673	36%	0.358	S	S	*	.	H	α-helix	trans	-78.3	-38	179.3	-62.3	-172.3	168.1	0	0	112.9	S497	S497-E501 WeakPolarHBondContact CB-OE2 3.44Å; S497-E501 WeakPolarHBondContact O-CB 3.42Å; S497-E501 VanDerWaalsContact O-CD 3.23Å; S497-E501 VanDerWaalsContact O-CG 3.24Å; S497-E501 WeakPolarHBondContact O-CG 3.38Å; S497-E501 PolarHBondContact OG-OE2 3.43Å
502	V	61.8	Low	73.7	Confident	45 Å²	45	69.4 Å²	69.4	27%	0.273	37%	0.371	S	S	.	.	H	α-helix	trans	-78.6	-24.4	-175.9	-175.5	0	0	0	0	112	W490 K493 V494 S498	W490-V502 HydrophobicContact CG-CG1 4.45Å; K493-V502 HydrophobicContact CB-CG1 3.97Å; K493-V502 HydrophobicContact CB-CG2 3.96Å; K493-V502 WeakPolarHBondContact O-CG2 3.36Å; V494-V502 HydrophobicContact CG2-CB 3.9Å; V494-V502 HydrophobicContact CG2-CG1 3.98Å; V494-V502 HydrophobicContact CG2-CG2 4.13Å; S498-V502 WeakPolarHBondContact O-CG2 3.3Å
503	G	68	Low	74.6	Confident	29 Å²	29	68.8 Å²	68.8	30%	0.299	37%	0.373	S	S	.	.			trans	72	177.2	-177.9	0	0	0	0	0	114	W490 M499 H505	W490-G503 PolarHBondContact NE1-O 3.37Å; M499-G503 PolarHBondContact O-N 3.42Å; G503-H505 PolarHBondContact O-N 3.34Å
504	L	69.8	Low	75.4	Confident	78 Å²	78	64.1 Å²	64.1	41%	0.408	35%	0.353	S	S	.	.	S	Bend	trans	-62.1	135.6	179	-100.8	73.1	0	0	0	111.3	T508 L509	L504-T508 HydrophobicContact CD2-CG2 4.13Å; L504-L509 HydrophobicContact CD2-CD2 4.36Å
505	H	72	Confident	76.3	Confident	7 Å²	7	64 Å²	64	3%	0.032	35%	0.352	C	S	.	.			trans	-54	133.9	171.8	-172.9	-76.8	0	0	0	111.1	D487 W490 G503 N507 T508 Y542	D487-H505 WeakPolarHBondContact CB-NE2 3.44Å; D487-H505 IonicContact OD2-CD2 4Å; D487-H505 IonicContact OD2-NE2 2.78Å; D487-H505 PolarHBondContact OD2-NE2 3.17Å; W490-H505 AromaticContact CD1-CD2 3.86Å; W490-H505 HydrophobicContact CD2-CB 4.06Å; W490-H505 AromaticContact CD2-CD2 3.93Å; W490-H505 HydrophobicContact CG-CB 4.25Å; W490-H505 AromaticContact CG-CD2 3.48Å; W490-H505 VanDerWaalsContact CG-CD2 3.48Å; W490-H505 HydrophobicContact CZ2-CB 4.3Å; G503-H505 PolarHBondContact O-N 3.34Å; H505-N507 VanDerWaalsContact C-N 3.33Å; H505-N507 PolarHBondContact CE1-ND2 2.94Å; H505-N507 VanDerWaalsContact ND1-CB 3.33Å; H505-N507 WeakPolarHBondContact ND1-CB 3.21Å; H505-N507 PolarHBondContact ND1-N 3.32Å; H505-N507 PolarHBondContact O-N 2.91Å; H505-T508 VanDerWaalsContact O-CB 3.26Å; H505-T508 WeakPolarHBondContact O-CB 3.48Å; H505-T508 PolarHBondContact O-N 3.48Å; H505-T508 PolarHBondContact O-OG1 3.27Å; H505-Y542 HydrophobicContact CB-CD1 3.83Å; H505-Y542 HydrophobicContact CB-CE1 3.51Å; H505-Y542 AromaticContact CD2-CE1 3.6Å; H505-Y542 AromaticContact CG-CE1 3.45Å; H505-Y542 VanDerWaalsContact CG-CE1 3.45Å; H505-Y542 AromaticContact CG-CZ 3.92Å
506	P	76.6	Confident	77.4	Confident	79 Å²	79	63.3 Å²	63.3	51%	0.513	35%	0.349	S	S	.	.	H	α-helix	trans	-57.1	-41.2	-176.3	20.3	-32.8	0	0	0	113.2	T508 L509 V510	P506-T508 PolarHBondContact O-N 3.38Å; P506-L509 WeakPolarHBondContact O-CB 3.26Å; P506-L509 PolarHBondContact O-N 2.63Å; P506-V510 PolarHBondContact O-N 3.29Å
507	N	78.4	Confident	78.2	Confident	55 Å²	55	62.4 Å²	62.4	29%	0.294	33%	0.327	S	S	.	.	H	α-helix	trans	-59.3	-27.1	175.4	-60.8	0.9	0	0	0	113.3	M482 H505 L509 V510 I511	M482-N507 HydrophobicContact CE-CB 3.88Å; H505-N507 VanDerWaalsContact C-N 3.33Å; H505-N507 PolarHBondContact CE1-ND2 2.94Å; H505-N507 VanDerWaalsContact ND1-CB 3.33Å; H505-N507 WeakPolarHBondContact ND1-CB 3.21Å; H505-N507 PolarHBondContact ND1-N 3.32Å; H505-N507 PolarHBondContact O-N 2.91Å; N507-L509 VanDerWaalsContact C-N 3.32Å; N507-L509 PolarHBondContact O-N 3.18Å; N507-V510 PolarHBondContact O-N 3.44Å; N507-I511 WeakPolarHBondContact O-CB 3.37Å; N507-I511 WeakPolarHBondContact O-CG1 3.12Å; N507-I511 PolarHBondContact O-N 3.22Å
508	T	82.8	Confident	79.2	Confident	1 Å²	1	60 Å²	60	1%	0.006	31%	0.31	C	S	.	.	H	α-helix	trans	-65.7	-38.2	175.7	-52.8	0	0	0	0	111	L504 H505 P506 Q512 H538 L539	L504-T508 HydrophobicContact CD2-CG2 4.13Å; H505-T508 VanDerWaalsContact O-CB 3.26Å; H505-T508 WeakPolarHBondContact O-CB 3.48Å; H505-T508 PolarHBondContact O-N 3.48Å; H505-T508 PolarHBondContact O-OG1 3.27Å; P506-T508 PolarHBondContact O-N 3.38Å; T508-Q512 WeakPolarHBondContact O-CB 3.31Å; T508-Q512 PolarHBondContact O-N 3.1Å; T508-H538 WeakPolarHBondContact CA-NE2 3.42Å; T508-H538 PolarHBondContact OG1-NE2 3.3Å; T508-L539 HydrophobicContact CG2-CD2 4.27Å
509	L	85.5	Confident	80.3	Confident	85 Å²	85	60.4 Å²	60.4	45%	0.445	30%	0.303	S	S	.	.	H	α-helix	trans	-70.4	-33	174.2	-60.5	174.9	0	0	0	112	L504 P506 N507 K513	L504-L509 HydrophobicContact CD2-CD2 4.36Å; P506-L509 WeakPolarHBondContact O-CB 3.26Å; P506-L509 PolarHBondContact O-N 2.63Å; N507-L509 VanDerWaalsContact C-N 3.32Å; N507-L509 PolarHBondContact O-N 3.18Å; L509-K513 WeakPolarHBondContact O-CB 3.34Å; L509-K513 WeakPolarHBondContact O-CD 3.21Å; L509-K513 WeakPolarHBondContact O-CG 3.49Å; L509-K513 PolarHBondContact O-N 3.31Å
510	V	87.5	Confident	81.5	Confident	52 Å²	52	64.2 Å²	64.2	32%	0.315	33%	0.325	S	S	.	.	H	α-helix	trans	-67.8	-52.2	174.3	178.1	0	0	0	0	110.4	M482 P506 N507 Q512 K513 L514	M482-V510 HydrophobicContact CE-CG1 4.25Å; P506-V510 PolarHBondContact O-N 3.29Å; N507-V510 PolarHBondContact O-N 3.44Å; V510-Q512 VanDerWaalsContact C-N 3.35Å; V510-Q512 PolarHBondContact O-N 3.1Å; V510-K513 PolarHBondContact O-N 2.87Å; V510-L514 HydrophobicContact CG1-CD1 3.9Å; V510-L514 HydrophobicContact CG1-CG 4.36Å; V510-L514 VanDerWaalsContact O-CG 3.31Å; V510-L514 WeakPolarHBondContact O-CG 3.22Å; V510-L514 PolarHBondContact O-N 3.48Å
511	I	89.4	Confident	82.6	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-44.6	179.4	-73.5	164.6	0	0	0	110.8	L479 M482 N507 K513 L514 C515 H538	L479-I511 HydrophobicContact CD2-CB 4.07Å; L479-I511 HydrophobicContact CD2-CG1 3.81Å; L479-I511 HydrophobicContact CD2-CG2 3.86Å; M482-I511 HydrophobicContact CB-CD1 4.23Å; N507-I511 WeakPolarHBondContact O-CB 3.37Å; N507-I511 WeakPolarHBondContact O-CG1 3.12Å; N507-I511 PolarHBondContact O-N 3.22Å; I511-K513 PolarHBondContact O-N 3.25Å; I511-L514 PolarHBondContact O-N 3.12Å; I511-C515 WeakPolarHBondContact O-CB 3.42Å; I511-C515 PolarHBondContact O-N 3.07Å; I511-C515 PolarHBondContact O-SG 3.19Å; I511-H538 HydrophobicContact CD1-CB 4.22Å; I511-H538 VanDerWaalsContact CD1-CE1 3.44Å; I511-H538 WeakPolarHBondContact CD1-CE1 3.44Å; I511-H538 WeakPolarHBondContact CD1-ND1 3.24Å; I511-H538 HydrophobicContact CG2-CB 4.42Å
512	Q	90.2	Very high	83.6	Confident	61 Å²	61	52 Å²	52	29%	0.285	27%	0.27	S	S	.	.	H	α-helix	trans	-57.4	-48.4	176	-178.9	176.5	-12	0	0	111.4	T508 V510 L514 C515 E516	T508-Q512 WeakPolarHBondContact O-CB 3.31Å; T508-Q512 PolarHBondContact O-N 3.1Å; V510-Q512 VanDerWaalsContact C-N 3.35Å; V510-Q512 PolarHBondContact O-N 3.1Å; Q512-L514 PolarHBondContact O-N 3.42Å; Q512-C515 PolarHBondContact O-N 2.99Å; Q512-E516 HydrophobicContact CG-CG 4.32Å; Q512-E516 VanDerWaalsContact CG-OE1 3.23Å; Q512-E516 WeakPolarHBondContact CG-OE1 3.44Å; Q512-E516 PolarHBondContact NE2-OE1 3.47Å; Q512-E516 WeakPolarHBondContact O-CB 3.46Å; Q512-E516 VanDerWaalsContact O-CG 3.28Å; Q512-E516 WeakPolarHBondContact O-CG 3.31Å; Q512-E516 PolarHBondContact O-N 2.82Å
513	K	90.6	Very high	84.5	Confident	147 Å²	147	59.1 Å²	59.1	64%	0.639	29%	0.292	S	S	*	.	H	α-helix	trans	-61.8	-42.4	177.7	-73.9	171.8	-178.2	-174.9	0	113.2	L509 V510 I511 Y517	L509-K513 WeakPolarHBondContact O-CB 3.34Å; L509-K513 WeakPolarHBondContact O-CD 3.21Å; L509-K513 WeakPolarHBondContact O-CG 3.49Å; L509-K513 PolarHBondContact O-N 3.31Å; V510-K513 PolarHBondContact O-N 2.87Å; I511-K513 PolarHBondContact O-N 3.25Å; K513-Y517 WeakPolarHBondContact O-CB 3.32Å; K513-Y517 PolarHBondContact O-N 3.27Å
514	L	90.6	Very high	85	Confident	14 Å²	14	61.1 Å²	61.1	7%	0.073	30%	0.298	C	S	.	.	H	α-helix	trans	-64.5	-43.9	177.8	-66.9	172.8	0	0	0	110.9	Y475 K478 L479 V510 I511 Q512 Y517 I518	Y475-L514 HydrophobicContact CD1-CD2 3.51Å; Y475-L514 HydrophobicContact CD2-CD2 3.84Å; Y475-L514 HydrophobicContact CE1-CD2 3.84Å; Y475-L514 HydrophobicContact CE2-CD2 4.16Å; Y475-L514 HydrophobicContact CG-CD2 3.52Å; K478-L514 HydrophobicContact CD-CD1 4.1Å; K478-L514 HydrophobicContact CG-CD1 4.16Å; L479-L514 HydrophobicContact CD1-CB 4.22Å; L479-L514 HydrophobicContact CD2-CB 3.97Å; L479-L514 HydrophobicContact CD2-CD1 3.95Å; L479-L514 HydrophobicContact CG-CB 4.14Å; L479-L514 HydrophobicContact CG-CD1 4.2Å; V510-L514 HydrophobicContact CG1-CD1 3.9Å; V510-L514 HydrophobicContact CG1-CG 4.36Å; V510-L514 VanDerWaalsContact O-CG 3.31Å; V510-L514 WeakPolarHBondContact O-CG 3.22Å; V510-L514 PolarHBondContact O-N 3.48Å; I511-L514 PolarHBondContact O-N 3.12Å; Q512-L514 PolarHBondContact O-N 3.42Å; L514-Y517 PolarHBondContact O-N 3.44Å; L514-I518 WeakPolarHBondContact O-CG1 3.41Å; L514-I518 PolarHBondContact O-N 3.05Å; L514-I518 VanDerWaalsContact O-N 3.1Å
515	C	91.3	Very high	85.6	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-66.9	-45.4	177.5	-63.5	0	0	0	0	111.8	I511 Q512 Y517 I518 Y519 H535	I511-C515 WeakPolarHBondContact O-CB 3.42Å; I511-C515 PolarHBondContact O-N 3.07Å; I511-C515 PolarHBondContact O-SG 3.19Å; Q512-C515 PolarHBondContact O-N 2.99Å; C515-Y517 VanDerWaalsContact C-N 3.27Å; C515-Y517 PolarHBondContact O-N 3.1Å; C515-I518 PolarHBondContact O-N 3.02Å; C515-I518 VanDerWaalsContact O-N 3.11Å; C515-Y519 HydrophobicContact CB-CE1 4.02Å; C515-Y519 HydrophobicContact CB-CE2 4.3Å; C515-Y519 WeakPolarHBondContact O-CD1 3.42Å; C515-Y519 PolarHBondContact O-N 3.24Å; C515-H535 HydrophobicContact CB-CB 4.43Å
516	E	91.4	Very high	86.4	Confident	84 Å²	84	68.5 Å²	68.5	39%	0.393	33%	0.328	S	S	.	.	H	α-helix	trans	-57.2	-39.6	175	-76.6	171.2	-178.4	0	0	111.9	Q512 Y519 L520	Q512-E516 HydrophobicContact CG-CG 4.32Å; Q512-E516 VanDerWaalsContact CG-OE1 3.23Å; Q512-E516 WeakPolarHBondContact CG-OE1 3.44Å; Q512-E516 PolarHBondContact NE2-OE1 3.47Å; Q512-E516 WeakPolarHBondContact O-CB 3.46Å; Q512-E516 VanDerWaalsContact O-CG 3.28Å; Q512-E516 WeakPolarHBondContact O-CG 3.31Å; Q512-E516 PolarHBondContact O-N 2.82Å; E516-Y519 PolarHBondContact O-N 3.23Å; E516-L520 WeakPolarHBondContact O-CG 3.29Å; E516-L520 PolarHBondContact O-N 2.96Å
517	Y	90.9	Very high	87	Confident	68 Å²	68	66.3 Å²	66.3	27%	0.267	31%	0.312	S	S	.	.	H	α-helix	trans	-63.9	-44.3	174.4	-172.8	-82.3	0	0	0	112.3	L471 Y475 K513 L514 C515 L520 N521	L471-Y517 HydrophobicContact CB-CE1 3.98Å; L471-Y517 WeakPolarHBondContact CD1-OH 3.5Å; Y475-Y517 AromaticContact CD2-CD1 3.66Å; Y475-Y517 HydrophobicContact CD2-CD1 3.66Å; Y475-Y517 HydrophobicContact CD2-CE1 4.26Å; Y475-Y517 HydrophobicContact CD2-CG 4.1Å; Y475-Y517 AromaticContact CE2-CD1 3.45Å; Y475-Y517 HydrophobicContact CE2-CD1 3.45Å; Y475-Y517 VanDerWaalsContact CE2-CD1 3.45Å; Y475-Y517 HydrophobicContact CE2-CD2 4.17Å; Y475-Y517 AromaticContact CE2-CE1 3.85Å; Y475-Y517 HydrophobicContact CE2-CE1 3.85Å; Y475-Y517 AromaticContact CE2-CG 3.63Å; Y475-Y517 HydrophobicContact CE2-CG 3.63Å; K513-Y517 WeakPolarHBondContact O-CB 3.32Å; K513-Y517 PolarHBondContact O-N 3.27Å; L514-Y517 PolarHBondContact O-N 3.44Å; C515-Y517 VanDerWaalsContact C-N 3.27Å; C515-Y517 PolarHBondContact O-N 3.1Å; Y517-L520 PolarHBondContact O-N 3.32Å; Y517-N521 HydrophobicContact CD1-CB 4.42Å; Y517-N521 WeakPolarHBondContact CD2-ND2 3.47Å; Y517-N521 HydrophobicContact CE1-CB 4.1Å; Y517-N521 WeakPolarHBondContact CE1-ND2 3.38Å; Y517-N521 VanDerWaalsContact CE2-ND2 3.33Å; Y517-N521 WeakPolarHBondContact CE2-ND2 3.43Å; Y517-N521 WeakPolarHBondContact O-CB 3.13Å; Y517-N521 PolarHBondContact O-N 3.37Å; Y517-N521 VanDerWaalsContact O-N 3.11Å; Y517-N521 PolarHBondContact O-ND2 2.97Å
518	I	90.8	Very high	87.6	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.1	-44.6	176.8	-66.2	166	0	0	0	110	C472 L479 L514 C515 L520 N521 D522 A531	C472-I518 HydrophobicContact CB-CG1 4.23Å; L479-I518 HydrophobicContact CD1-CD1 3.65Å; L514-I518 WeakPolarHBondContact O-CG1 3.41Å; L514-I518 PolarHBondContact O-N 3.05Å; L514-I518 VanDerWaalsContact O-N 3.1Å; C515-I518 PolarHBondContact O-N 3.02Å; C515-I518 VanDerWaalsContact O-N 3.11Å; I518-L520 PolarHBondContact O-N 3.42Å; I518-N521 PolarHBondContact O-N 3.15Å; I518-D522 HydrophobicContact CG2-CB 3.97Å; I518-D522 WeakPolarHBondContact O-CB 3.32Å; I518-D522 PolarHBondContact O-N 2.91Å; I518-A531 HydrophobicContact CB-CB 4.29Å; I518-A531 HydrophobicContact CD1-CB 3.81Å; I518-A531 HydrophobicContact CG2-CB 3.86Å
519	Y	90	Very high	88	Confident	69 Å²	69	68.6 Å²	68.6	27%	0.271	32%	0.32	S	S	.	.	H	α-helix	trans	-60.4	-31.2	-179	-59.9	-10.3	0	0	0	113.4	C515 E516 R528 A531 I532 H535	C515-Y519 HydrophobicContact CB-CE1 4.02Å; C515-Y519 HydrophobicContact CB-CE2 4.3Å; C515-Y519 WeakPolarHBondContact O-CD1 3.42Å; C515-Y519 PolarHBondContact O-N 3.24Å; E516-Y519 PolarHBondContact O-N 3.23Å; Y519-R528 HydrophobicContact CD1-CG 4.31Å; Y519-A531 HydrophobicContact CE1-CB 4.33Å; Y519-I532 HydrophobicContact CD1-CG1 4.3Å; Y519-I532 HydrophobicContact CE1-CD1 4.48Å; Y519-I532 HydrophobicContact CE1-CG1 3.49Å; Y519-I532 VanDerWaalsContact CE1-CG1 3.49Å; Y519-H535 AromaticContact CZ-ND1 3.95Å; Y519-H535 PolarHBondContact OH-ND1 2.88Å
520	L	90	Very high	88.3	Confident	146 Å²	146	66.1 Å²	66.1	76%	0.764	30%	0.304	S	S	*	.	H	α-helix	trans	-87.6	-35.1	-178.7	-70	171.9	0	0	0	113.8	E516 Y517 I518	E516-L520 WeakPolarHBondContact O-CG 3.29Å; E516-L520 PolarHBondContact O-N 2.96Å; Y517-L520 PolarHBondContact O-N 3.32Å; I518-L520 PolarHBondContact O-N 3.42Å
521	N	85.4	Confident	88.6	Confident	58 Å²	58	63.6 Å²	63.6	31%	0.31	29%	0.289	S	S	.	.	H	α-helix	trans	-109.6	-16.2	-165.9	-63	-58.9	0	0	0	114.4	P468 Y517 I518	P468-N521 HydrophobicContact CB-CB 3.94Å; Y517-N521 HydrophobicContact CD1-CB 4.42Å; Y517-N521 WeakPolarHBondContact CD2-ND2 3.47Å; Y517-N521 HydrophobicContact CE1-CB 4.1Å; Y517-N521 WeakPolarHBondContact CE1-ND2 3.38Å; Y517-N521 VanDerWaalsContact CE2-ND2 3.33Å; Y517-N521 WeakPolarHBondContact CE2-ND2 3.43Å; Y517-N521 WeakPolarHBondContact O-CB 3.13Å; Y517-N521 PolarHBondContact O-N 3.37Å; Y517-N521 VanDerWaalsContact O-N 3.11Å; Y517-N521 PolarHBondContact O-ND2 2.97Å; I518-N521 PolarHBondContact O-N 3.15Å
522	D	82.6	Confident	88.8	Confident	14 Å²	14	64.9 Å²	64.9	8%	0.075	30%	0.295	C	S	.	.			trans	-79.8	127.7	-173.5	-179.8	32.1	0	0	0	113.4	I518 T524 L527 R528	I518-D522 HydrophobicContact CG2-CB 3.97Å; I518-D522 WeakPolarHBondContact O-CB 3.32Å; I518-D522 PolarHBondContact O-N 2.91Å; D522-T524 WeakPolarHBondContact OD1-CA 3.42Å; D522-T524 WeakPolarHBondContact OD1-CB 3.18Å; D522-T524 PolarHBondContact OD1-N 2.85Å; D522-L527 WeakPolarHBondContact OD2-CB 3.43Å; D522-R528 WeakPolarHBondContact OD2-CB 3.3Å; D522-R528 PolarHBondContact OD2-N 3.33Å
523	R	80.9	Confident	89	Confident	195 Å²	195	62 Å²	62	74%	0.736	28%	0.282	S	S	*	.			trans	-91.7	-11.2	174.4	-63.1	174.1	172.6	176.5	-2.1	113.3
524	T	78	Confident	89.2	Confident	71 Å²	71	55 Å²	55	44%	0.436	25%	0.251	S	S	.	.			trans	-108.6	96.5	-169.1	-50.5	0	0	0	0	110.2	D522 R526 L527	D522-T524 WeakPolarHBondContact OD1-CA 3.42Å; D522-T524 WeakPolarHBondContact OD1-CB 3.18Å; D522-T524 PolarHBondContact OD1-N 2.85Å; T524-R526 HydrophobicContact CG2-CB 4.33Å; T524-R526 CarbonylContact O-C 3.58Å; T524-R526 PolarHBondContact O-N 3.09Å; T524-L527 HydrophobicContact CG2-CG 4.35Å; T524-L527 PolarHBondContact O-N 3.15Å
525	D	83.5	Confident	89.3	Confident	104 Å²	104	54.9 Å²	54.9	56%	0.556	25%	0.251	S	S	*	.	H	α-helix	trans	-44.6	-31.7	-174.2	-60.9	-17.8	0	0	0	115.3	R528 T529	D525-R528 IonicContact OD1-CZ 3.79Å; D525-R528 IonicContact OD1-NH1 2.9Å; D525-R528 PolarHBondContact OD1-NH1 2.88Å; D525-R528 VanDerWaalsContact OD1-NH1 3.14Å; D525-R528 IonicContact OD1-NH2 2.65Å; D525-R528 PolarHBondContact OD1-NH2 2.59Å; D525-T529 WeakPolarHBondContact O-CB 3.2Å; D525-T529 PolarHBondContact O-N 3.45Å; D525-T529 PolarHBondContact O-OG1 2.84Å
526	R	87.9	Confident	89.5	Confident	135 Å²	135	54.9 Å²	54.9	51%	0.509	25%	0.251	S	S	.	.	H	α-helix	trans	-60.1	-46.1	173.6	-169.3	179.1	-175.5	-141.5	-2.2	114.4	T524 T529 R530 D565	T524-R526 HydrophobicContact CG2-CB 4.33Å; T524-R526 CarbonylContact O-C 3.58Å; T524-R526 PolarHBondContact O-N 3.09Å; R526-T529 PolarHBondContact O-N 2.79Å; R526-R530 WeakPolarHBondContact O-CG 3.42Å; R526-R530 PolarHBondContact O-N 3.31Å; R526-D565 IonicContact CZ-OD1 3.59Å; R526-D565 IonicContact CZ-OD2 3.61Å; R526-D565 IonicContact NE-OD1 3.59Å; R526-D565 PolarHBondContact NE-OD1 2.89Å; R526-D565 IonicContact NE-OD2 3.35Å; R526-D565 VanDerWaalsContact NH2-CG 3.27Å; R526-D565 IonicContact NH2-OD1 2.76Å; R526-D565 IonicContact NH2-OD2 2.67Å; R526-D565 PolarHBondContact NH2-OD2 2.88Å
527	L	88.9	Confident	89.6	Confident	33 Å²	33	51.5 Å²	51.5	17%	0.173	23%	0.234	C	C	.	.	H	α-helix	trans	-69	-45.4	-176.7	-56.5	175.5	0	0	0	109.8	C472 L476 D522 T524 T529 R530 A531	C472-L527 HydrophobicContact CB-CD1 4.46Å; L476-L527 HydrophobicContact CD2-CB 4.47Å; L476-L527 HydrophobicContact CD2-CD2 3.45Å; L476-L527 VanDerWaalsContact CD2-CD2 3.45Å; D522-L527 WeakPolarHBondContact OD2-CB 3.43Å; T524-L527 HydrophobicContact CG2-CG 4.35Å; T524-L527 PolarHBondContact O-N 3.15Å; L527-T529 PolarHBondContact O-N 3.43Å; L527-R530 PolarHBondContact O-N 3.31Å; L527-A531 WeakPolarHBondContact O-CB 3.45Å; L527-A531 PolarHBondContact O-N 3.42Å
528	R	90.9	Very high	89.7	Confident	76 Å²	76	48.2 Å²	48.2	29%	0.287	22%	0.222	S	C	.	.	H	α-helix	trans	-53.9	-49.3	171.4	-170.5	168.9	68.2	-109.1	-1.1	112.8	Y519 D522 D525 R530 A531 I532	Y519-R528 HydrophobicContact CD1-CG 4.31Å; D522-R528 WeakPolarHBondContact OD2-CB 3.3Å; D522-R528 PolarHBondContact OD2-N 3.33Å; D525-R528 IonicContact OD1-CZ 3.79Å; D525-R528 IonicContact OD1-NH1 2.9Å; D525-R528 PolarHBondContact OD1-NH1 2.88Å; D525-R528 VanDerWaalsContact OD1-NH1 3.14Å; D525-R528 IonicContact OD1-NH2 2.65Å; D525-R528 PolarHBondContact OD1-NH2 2.59Å; R528-R530 PolarHBondContact O-N 3.48Å; R528-A531 PolarHBondContact O-N 3.05Å; R528-I532 HydrophobicContact CG-CD1 4.16Å; R528-I532 VanDerWaalsContact O-CG1 3.3Å; R528-I532 WeakPolarHBondContact O-CG1 3.31Å; R528-I532 PolarHBondContact O-N 2.86Å
529	T	91.9	Very high	89.8	Confident	29 Å²	29	48.4 Å²	48.4	18%	0.178	22%	0.222	C	C	.	.	H	α-helix	trans	-59.8	-46.3	177.2	-71	0	0	0	0	112.2	D525 R526 L527 A531 I532 L533 L557 T568	D525-T529 WeakPolarHBondContact O-CB 3.2Å; D525-T529 PolarHBondContact O-N 3.45Å; D525-T529 PolarHBondContact O-OG1 2.84Å; R526-T529 PolarHBondContact O-N 2.79Å; L527-T529 PolarHBondContact O-N 3.43Å; T529-A531 PolarHBondContact O-N 2.59Å; T529-I532 PolarHBondContact O-N 3.13Å; T529-L533 HydrophobicContact CG2-CD1 4.26Å; T529-L533 WeakPolarHBondContact O-CG 3.38Å; T529-L533 PolarHBondContact O-N 3.32Å; T529-L533 VanDerWaalsContact O-N 3.09Å; T529-L557 HydrophobicContact CG2-CD1 4.32Å; T529-L557 HydrophobicContact CG2-CD2 3.6Å; T529-T568 HydrophobicContact CG2-CG2 3.84Å
530	R	92.5	Very high	89.9	Confident	32 Å²	32	45.1 Å²	45.1	12%	0.121	21%	0.21	C	C	.	.	H	α-helix	trans	-63	-42	177.3	-68.9	178.8	71.5	89.5	-8.8	112.3	L476 E480 R526 L527 R528 I532 L533 C534 S567 T568 L571	L476-R530 HydrophobicContact CD1-CB 3.87Å; L476-R530 HydrophobicContact CD2-CB 4.27Å; E480-R530 VanDerWaalsContact CD-NH2 3.3Å; E480-R530 IonicContact OE1-CZ 3.55Å; E480-R530 IonicContact OE1-NE 2.81Å; E480-R530 PolarHBondContact OE1-NE 3.2Å; E480-R530 IonicContact OE1-NH2 2.77Å; E480-R530 PolarHBondContact OE1-NH2 2.8Å; E480-R530 IonicContact OE2-NH2 3.61Å; E480-R530 PolarHBondContact OE2-NH2 3.35Å; R526-R530 WeakPolarHBondContact O-CG 3.42Å; R526-R530 PolarHBondContact O-N 3.31Å; L527-R530 PolarHBondContact O-N 3.31Å; R528-R530 PolarHBondContact O-N 3.48Å; R530-I532 PolarHBondContact O-N 3.37Å; R530-L533 PolarHBondContact O-N 3.11Å; R530-C534 PolarHBondContact O-N 3.32Å; R530-C534 PolarHBondContact O-SG 2.79Å; R530-S567 PolarHBondContact NH1-OG 2.92Å; R530-T568 HydrophobicContact CG-CG2 4.1Å; R530-T568 PolarHBondContact NH1-OG1 3.1Å; R530-T568 VanDerWaalsContact NH1-OG1 3.13Å; R530-L571 HydrophobicContact CB-CD2 4.39Å; R530-L571 HydrophobicContact CG-CD2 4.49Å
531	A	93.1	Very high	89.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.3	-42	176.3	0	0	0	0	0	112.3	L479 I518 Y519 L527 R528 T529 L533 C534 H535	L479-A531 HydrophobicContact CD1-CB 4.3Å; I518-A531 HydrophobicContact CB-CB 4.29Å; I518-A531 HydrophobicContact CD1-CB 3.81Å; I518-A531 HydrophobicContact CG2-CB 3.86Å; Y519-A531 HydrophobicContact CE1-CB 4.33Å; L527-A531 WeakPolarHBondContact O-CB 3.45Å; L527-A531 PolarHBondContact O-N 3.42Å; R528-A531 PolarHBondContact O-N 3.05Å; T529-A531 PolarHBondContact O-N 2.59Å; A531-L533 PolarHBondContact O-N 3.38Å; A531-C534 PolarHBondContact O-N 3.13Å; A531-H535 WeakPolarHBondContact O-CB 3.38Å; A531-H535 PolarHBondContact O-N 3.49Å
532	I	93.5	Very high	90	Very high	26 Å²	26	36.4 Å²	36.4	13%	0.133	16%	0.164	C	C	.	.	H	α-helix	trans	-58.7	-47.6	173.9	-68.8	165.6	0	0	0	110.7	Y519 R528 T529 R530 H535 I536 L557	Y519-I532 HydrophobicContact CD1-CG1 4.3Å; Y519-I532 HydrophobicContact CE1-CD1 4.48Å; Y519-I532 HydrophobicContact CE1-CG1 3.49Å; Y519-I532 VanDerWaalsContact CE1-CG1 3.49Å; R528-I532 HydrophobicContact CG-CD1 4.16Å; R528-I532 VanDerWaalsContact O-CG1 3.3Å; R528-I532 WeakPolarHBondContact O-CG1 3.31Å; R528-I532 PolarHBondContact O-N 2.86Å; T529-I532 PolarHBondContact O-N 3.13Å; R530-I532 PolarHBondContact O-N 3.37Å; I532-H535 WeakPolarHBondContact O-CB 3.4Å; I532-H535 PolarHBondContact O-N 3.27Å; I532-I536 HydrophobicContact CG2-CD1 3.64Å; I532-I536 HydrophobicContact CG2-CG1 4.39Å; I532-I536 VanDerWaalsContact O-CG1 3.31Å; I532-I536 WeakPolarHBondContact O-CG1 3.49Å; I532-I536 PolarHBondContact O-N 3.19Å; I532-L557 HydrophobicContact CG2-CD1 3.95Å
533	L	94.5	Very high	90.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.6	-43.2	-179.4	-65.2	173.9	0	0	0	112.6	T529 R530 A531 H535 I536 Y537 L557 T568 L571 Y572 A575	T529-L533 HydrophobicContact CG2-CD1 4.26Å; T529-L533 WeakPolarHBondContact O-CG 3.38Å; T529-L533 PolarHBondContact O-N 3.32Å; T529-L533 VanDerWaalsContact O-N 3.09Å; R530-L533 PolarHBondContact O-N 3.11Å; A531-L533 PolarHBondContact O-N 3.38Å; L533-H535 VanDerWaalsContact C-N 3.32Å; L533-H535 PolarHBondContact O-N 3.47Å; L533-I536 PolarHBondContact O-N 2.99Å; L533-Y537 WeakPolarHBondContact O-CB 3.37Å; L533-Y537 PolarHBondContact O-N 2.76Å; L533-L557 HydrophobicContact CD2-CD1 3.76Å; L533-L557 HydrophobicContact CG-CD1 4.13Å; L533-T568 HydrophobicContact CD1-CG2 3.92Å; L533-L571 HydrophobicContact CB-CD2 3.84Å; L533-L571 HydrophobicContact CB-CG 3.85Å; L533-L571 HydrophobicContact CD1-CB 4.33Å; L533-L571 HydrophobicContact CD1-CD2 4.18Å; L533-L571 HydrophobicContact CD1-CG 4.12Å; L533-Y572 HydrophobicContact CD2-CD2 3.95Å; L533-A575 HydrophobicContact CD2-CB 4.39Å
534	C	93.6	Very high	90.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-60.5	-40.7	173.2	-71.6	0	0	0	0	111.9	Y483 R530 A531 Y537 H538	Y483-C534 HydrophobicContact CG-CB 4.12Å; R530-C534 PolarHBondContact O-N 3.32Å; R530-C534 PolarHBondContact O-SG 2.79Å; A531-C534 PolarHBondContact O-N 3.13Å; C534-Y537 PolarHBondContact O-N 3.43Å; C534-H538 WeakPolarHBondContact O-CB 3.25Å; C534-H538 PolarHBondContact O-N 3.11Å
535	H	94	Very high	91.1	Very high	12 Å²	12	24.8 Å²	24.8	6%	0.056	11%	0.112	C	C	.	.	H	α-helix	trans	-65.3	-45.2	177.2	-164.8	176.3	0	0	0	111.9	C515 Y519 A531 I532 L533 H538 L539	C515-H535 HydrophobicContact CB-CB 4.43Å; Y519-H535 AromaticContact CZ-ND1 3.95Å; Y519-H535 PolarHBondContact OH-ND1 2.88Å; A531-H535 WeakPolarHBondContact O-CB 3.38Å; A531-H535 PolarHBondContact O-N 3.49Å; I532-H535 WeakPolarHBondContact O-CB 3.4Å; I532-H535 PolarHBondContact O-N 3.27Å; L533-H535 VanDerWaalsContact C-N 3.32Å; L533-H535 PolarHBondContact O-N 3.47Å; H535-H538 PolarHBondContact O-N 3.42Å; H535-L539 VanDerWaalsContact CD2-CD1 3.49Å; H535-L539 WeakPolarHBondContact CD2-CD1 3.37Å; H535-L539 WeakPolarHBondContact O-CB 3.5Å; H535-L539 WeakPolarHBondContact O-CG 3.29Å; H535-L539 PolarHBondContact O-N 3.15Å
536	I	94.5	Very high	91.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.9	-46.3	176	-68	162.9	0	0	0	110.5	I532 L533 H538 L539 A540 A548 L551 M552 L579	I532-I536 HydrophobicContact CG2-CD1 3.64Å; I532-I536 HydrophobicContact CG2-CG1 4.39Å; I532-I536 VanDerWaalsContact O-CG1 3.31Å; I532-I536 WeakPolarHBondContact O-CG1 3.49Å; I532-I536 PolarHBondContact O-N 3.19Å; L533-I536 PolarHBondContact O-N 2.99Å; I536-H538 PolarHBondContact O-N 3.18Å; I536-L539 PolarHBondContact O-N 2.9Å; I536-A540 VanDerWaalsContact O-CB 3.23Å; I536-A540 WeakPolarHBondContact O-CB 3.25Å; I536-A540 PolarHBondContact O-N 3.22Å; I536-A548 HydrophobicContact CG2-CB 4.31Å; I536-L551 HydrophobicContact CD1-CB 4.36Å; I536-L551 HydrophobicContact CG1-CB 3.89Å; I536-M552 HydrophobicContact CD1-CB 3.98Å; I536-M552 HydrophobicContact CD1-CE 4.11Å; I536-M552 HydrophobicContact CD1-SD 4.13Å; I536-M552 HydrophobicContact CG2-CE 4.24Å; I536-L579 HydrophobicContact CG2-CD1 4.16Å
537	Y	95	Very high	91.8	Very high	13 Å²	13	23.6 Å²	23.6	5%	0.051	11%	0.106	C	C	.	.	H	α-helix	trans	-59.4	-46.5	178.4	-169.9	-70.5	0	0	0	111.5	Y483 L533 C534 A540 L541 R574 A575 Q578 I640	Y483-Y537 AromaticContact CD2-CD1 3.46Å; Y483-Y537 HydrophobicContact CD2-CD1 3.46Å; Y483-Y537 VanDerWaalsContact CD2-CD1 3.46Å; Y483-Y537 HydrophobicContact CD2-CD2 4.23Å; Y483-Y537 HydrophobicContact CD2-CE1 4.1Å; Y483-Y537 AromaticContact CD2-CG 3.55Å; Y483-Y537 HydrophobicContact CD2-CG 3.55Å; Y483-Y537 AromaticContact CE2-CD1 3.78Å; Y483-Y537 HydrophobicContact CE2-CD1 3.78Å; Y483-Y537 AromaticContact CE2-CD2 3.86Å; Y483-Y537 HydrophobicContact CE2-CD2 3.86Å; Y483-Y537 HydrophobicContact CE2-CE1 4.1Å; Y483-Y537 HydrophobicContact CE2-CE2 4.16Å; Y483-Y537 AromaticContact CE2-CG 3.67Å; Y483-Y537 HydrophobicContact CE2-CG 3.67Å; L533-Y537 WeakPolarHBondContact O-CB 3.37Å; L533-Y537 PolarHBondContact O-N 2.76Å; C534-Y537 PolarHBondContact O-N 3.43Å; Y537-A540 PolarHBondContact O-N 3.49Å; Y537-L541 WeakPolarHBondContact O-CB 3.42Å; Y537-L541 PolarHBondContact O-N 3.19Å; Y537-R574 HydrophobicContact CE2-CB 4.24Å; Y537-A575 HydrophobicContact CD2-CB 4.47Å; Y537-Q578 HydrophobicContact CD1-CG 4.14Å; Y537-Q578 HydrophobicContact CD2-CB 3.87Å; Y537-Q578 HydrophobicContact CD2-CG 4.11Å; Y537-Q578 HydrophobicContact CE1-CG 4.09Å; Y537-Q578 HydrophobicContact CE2-CB 3.84Å; Y537-Q578 HydrophobicContact CE2-CG 4.07Å; Y537-Q578 HydrophobicContact CG-CB 4.34Å; Y537-Q578 HydrophobicContact CG-CG 4.15Å; Y537-I640 HydrophobicContact CE2-CD1 4.19Å
538	H	92.8	Very high	92	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-63.1	-47.5	177.6	-177.9	81.3	0	0	0	112	T508 I511 C534 H535 I536 A540 L541 Y542	T508-H538 WeakPolarHBondContact CA-NE2 3.42Å; T508-H538 PolarHBondContact OG1-NE2 3.3Å; I511-H538 HydrophobicContact CD1-CB 4.22Å; I511-H538 VanDerWaalsContact CD1-CE1 3.44Å; I511-H538 WeakPolarHBondContact CD1-CE1 3.44Å; I511-H538 WeakPolarHBondContact CD1-ND1 3.24Å; I511-H538 HydrophobicContact CG2-CB 4.42Å; C534-H538 WeakPolarHBondContact O-CB 3.25Å; C534-H538 PolarHBondContact O-N 3.11Å; H535-H538 PolarHBondContact O-N 3.42Å; I536-H538 PolarHBondContact O-N 3.18Å; H538-A540 VanDerWaalsContact C-N 3.29Å; H538-A540 PolarHBondContact O-N 3.5Å; H538-L541 WeakPolarHBondContact O-CB 3.33Å; H538-L541 PolarHBondContact O-N 2.9Å; H538-L541 VanDerWaalsContact O-N 3.16Å; H538-Y542 AromaticContact CE1-CD2 3.39Å; H538-Y542 WeakPolarHBondContact CE1-CD2 3.36Å; H538-Y542 AromaticContact CE1-CE2 3.05Å; H538-Y542 WeakPolarHBondContact CE1-CE2 3.39Å; H538-Y542 AromaticContact CE1-CZ 3.85Å; H538-Y542 AromaticContact ND1-CD2 3.79Å; H538-Y542 AromaticContact ND1-CE2 3.53Å; H538-Y542 AromaticContact NE2-CD2 3.59Å; H538-Y542 AromaticContact NE2-CE2 3.71Å; H538-Y542 WeakPolarHBondContact O-CD2 3.25Å; H538-Y542 PolarHBondContact O-N 3.42Å; H538-Y542 VanDerWaalsContact O-N 3.09Å
539	L	91.8	Very high	92.1	Very high	3 Å²	3	22.3 Å²	22.3	2%	0.016	10%	0.099	C	C	.	.	H	α-helix	trans	-61.7	-38.6	176.9	-71.8	169.6	0	0	0	112.3	T508 H535 I536 Y542 Q544 K547 A548 L551	T508-L539 HydrophobicContact CG2-CD2 4.27Å; H535-L539 VanDerWaalsContact CD2-CD1 3.49Å; H535-L539 WeakPolarHBondContact CD2-CD1 3.37Å; H535-L539 WeakPolarHBondContact O-CB 3.5Å; H535-L539 WeakPolarHBondContact O-CG 3.29Å; H535-L539 PolarHBondContact O-N 3.15Å; I536-L539 PolarHBondContact O-N 2.9Å; L539-Y542 PolarHBondContact O-N 3.23Å; L539-Q544 HydrophobicContact CB-CB 4.38Å; L539-Q544 HydrophobicContact CD2-CB 4.12Å; L539-Q544 PolarHBondContact O-N 2.99Å; L539-K547 HydrophobicContact CD1-CB 4.02Å; L539-K547 HydrophobicContact CD2-CD 4.3Å; L539-A548 HydrophobicContact CB-CB 3.96Å; L539-L551 HydrophobicContact CD1-CD1 3.37Å
540	A	92.3	Very high	92.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-65.3	-41.3	174.3	0	0	0	0	0	111.6	I536 Y537 H538 Y542 N543 A548 Q578 C582 R585	I536-A540 VanDerWaalsContact O-CB 3.23Å; I536-A540 WeakPolarHBondContact O-CB 3.25Å; I536-A540 PolarHBondContact O-N 3.22Å; Y537-A540 PolarHBondContact O-N 3.49Å; H538-A540 VanDerWaalsContact C-N 3.29Å; H538-A540 PolarHBondContact O-N 3.5Å; A540-Y542 PolarHBondContact O-N 3.13Å; A540-N543 PolarHBondContact O-N 2.91Å; A540-A548 HydrophobicContact CB-CB 4.31Å; A540-Q578 HydrophobicContact CB-CB 4.48Å; A540-Q578 HydrophobicContact CB-CG 3.89Å; A540-C582 HydrophobicContact CB-CB 3.88Å; A540-C582 WeakPolarHBondContact O-CB 3.42Å; A540-C582 PolarHBondContact O-SG 2.77Å; A540-C582 VanDerWaalsContact O-SG 3.33Å; A540-R585 PolarHBondContact O-NH2 2.91Å
541	L	90.3	Very high	92.3	Very high	21 Å²	21	24.3 Å²	24.3	11%	0.11	11%	0.111	C	C	.	.	H	α-helix	trans	-57.9	-47	175.6	-175.8	65.2	0	0	0	111.8	F486 Y537 H538 N543 Q578 R585	F486-L541 HydrophobicContact CB-CD1 4.28Å; F486-L541 HydrophobicContact CB-CD2 4.05Å; F486-L541 HydrophobicContact CB-CG 4.36Å; F486-L541 HydrophobicContact CD2-CD1 4.24Å; F486-L541 HydrophobicContact CD2-CD2 4.24Å; F486-L541 HydrophobicContact CD2-CG 3.9Å; Y537-L541 WeakPolarHBondContact O-CB 3.42Å; Y537-L541 PolarHBondContact O-N 3.19Å; H538-L541 WeakPolarHBondContact O-CB 3.33Å; H538-L541 PolarHBondContact O-N 2.9Å; H538-L541 VanDerWaalsContact O-N 3.16Å; L541-N543 PolarHBondContact O-N 2.84Å; L541-Q578 VanDerWaalsContact CD1-NE2 3.28Å; L541-R585 PolarHBondContact O-NH1 3.43Å
542	Y	87	Confident	92.2	Very high	1 Å²	1	24.7 Å²	24.7	0%	0.004	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	28.7	-179.6	-72	-98	0	0	0	114.4	K485 F486 D487 W490 H505 H538 L539 A540 Q544	K485-Y542 PolarHBondContact O-OH 2.61Å; F486-Y542 HydrophobicContact CD2-CE1 4.26Å; F486-Y542 HydrophobicContact CD2-CE2 4.31Å; F486-Y542 HydrophobicContact CE2-CD1 4.26Å; F486-Y542 HydrophobicContact CE2-CE1 4.09Å; D487-Y542 PolarHBondContact N-OH 3.2Å; W490-Y542 HydrophobicContact CD2-CD1 4.44Å; W490-Y542 HydrophobicContact CD2-CE1 4.3Å; W490-Y542 AromaticContact CE3-CD1 3.79Å; W490-Y542 HydrophobicContact CE3-CD1 3.79Å; W490-Y542 AromaticContact CE3-CE1 3.77Å; W490-Y542 HydrophobicContact CE3-CE1 3.77Å; W490-Y542 AromaticContact CH2-CD1 3.76Å; W490-Y542 HydrophobicContact CH2-CD1 3.76Å; W490-Y542 HydrophobicContact CZ2-CD1 4.38Å; W490-Y542 AromaticContact CZ3-CD1 3.43Å; W490-Y542 HydrophobicContact CZ3-CD1 3.43Å; W490-Y542 VanDerWaalsContact CZ3-CD1 3.43Å; W490-Y542 AromaticContact CZ3-CE1 3.93Å; W490-Y542 HydrophobicContact CZ3-CE1 3.93Å; H505-Y542 HydrophobicContact CB-CD1 3.83Å; H505-Y542 HydrophobicContact CB-CE1 3.51Å; H505-Y542 AromaticContact CD2-CE1 3.6Å; H505-Y542 AromaticContact CG-CE1 3.45Å; H505-Y542 VanDerWaalsContact CG-CE1 3.45Å; H505-Y542 AromaticContact CG-CZ 3.92Å; H538-Y542 AromaticContact CE1-CD2 3.39Å; H538-Y542 WeakPolarHBondContact CE1-CD2 3.36Å; H538-Y542 AromaticContact CE1-CE2 3.05Å; H538-Y542 WeakPolarHBondContact CE1-CE2 3.39Å; H538-Y542 AromaticContact CE1-CZ 3.85Å; H538-Y542 AromaticContact ND1-CD2 3.79Å; H538-Y542 AromaticContact ND1-CE2 3.53Å; H538-Y542 AromaticContact NE2-CD2 3.59Å; H538-Y542 AromaticContact NE2-CE2 3.71Å; H538-Y542 WeakPolarHBondContact O-CD2 3.25Å; H538-Y542 PolarHBondContact O-N 3.42Å; H538-Y542 VanDerWaalsContact O-N 3.09Å; L539-Y542 PolarHBondContact O-N 3.23Å; A540-Y542 PolarHBondContact O-N 3.13Å; Y542-Q544 PolarHBondContact O-N 2.92Å; Y542-Q544 VanDerWaalsContact O-N 3.08Å
543	N	85	Confident	92.2	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.016	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	14.9	175.6	-78.8	-16.1	0	0	0	116	A540 L541 W545 R585 Q586 E734	A540-N543 PolarHBondContact O-N 2.91Å; L541-N543 PolarHBondContact O-N 2.84Å; N543-W545 VanDerWaalsContact C-N 3.27Å; N543-W545 PolarHBondContact O-N 3.05Å; N543-R585 WeakPolarHBondContact OD1-CD 3.39Å; N543-R585 PolarHBondContact OD1-NE 3.12Å; N543-R585 PolarHBondContact OD1-NH1 3.41Å; N543-Q586 PolarHBondContact O-NE2 2.85Å; N543-E734 PolarHBondContact ND2-OE2 2.99Å
544	Q	88.1	Confident	92	Very high	22 Å²	22	35 Å²	35	10%	0.103	16%	0.164	C	C	.	.			trans	-86.4	59.3	-179.9	-60.8	-170.5	33.1	0	0	112.1	L539 Y542 F546 K547 A548	L539-Q544 HydrophobicContact CB-CB 4.38Å; L539-Q544 HydrophobicContact CD2-CB 4.12Å; L539-Q544 PolarHBondContact O-N 2.99Å; Y542-Q544 PolarHBondContact O-N 2.92Å; Y542-Q544 VanDerWaalsContact O-N 3.08Å; Q544-F546 PolarHBondContact O-N 3.49Å; Q544-K547 PolarHBondContact O-N 2.85Å; Q544-A548 PolarHBondContact O-N 3.28Å; Q544-A548 VanDerWaalsContact O-N 3.14Å
545	W	91.8	Very high	91.8	Very high	10 Å²	10	36.4 Å²	36.4	4%	0.038	17%	0.174	C	C	.	.	H	α-helix	trans	-52	-50.8	-172.4	-179.6	72.8	0	0	0	114.3	N543 K547 A548 R549 Q586 H588 D591	N543-W545 VanDerWaalsContact C-N 3.27Å; N543-W545 PolarHBondContact O-N 3.05Å; W545-K547 PolarHBondContact O-N 3.09Å; W545-A548 PolarHBondContact O-N 2.85Å; W545-R549 WeakPolarHBondContact O-CB 3.05Å; W545-R549 PolarHBondContact O-N 3.44Å; W545-Q586 HydrophobicContact CB-CG 4.05Å; W545-H588 AromaticContact CD2-CD2 3.81Å; W545-H588 AromaticContact CE3-CD2 3.59Å; W545-H588 AromaticContact CE3-NE2 3.6Å; W545-H588 HydrophobicContact CZ2-CB 4.34Å; W545-H588 AromaticContact CZ3-CD2 3.71Å; W545-H588 AromaticContact CZ3-CE1 3.85Å; W545-H588 AromaticContact CZ3-NE2 3.53Å; W545-D591 HydrophobicContact CZ2-CB 4.1Å; W545-D591 WeakPolarHBondContact CZ2-OD2 3.41Å
546	F	93.7	Very high	91.6	Very high	119 Å²	119	41.2 Å²	41.2	52%	0.522	20%	0.2	S	C	.	.	H	α-helix	trans	-56.3	-49	-177.4	-66.4	-79.2	0	0	0	112.3	Q544 A548 R549 D550	Q544-F546 PolarHBondContact O-N 3.49Å; F546-A548 PolarHBondContact O-N 3.17Å; F546-R549 PolarHBondContact O-N 3.11Å; F546-D550 VanDerWaalsContact O-CB 3.32Å; F546-D550 WeakPolarHBondContact O-CB 3.44Å; F546-D550 PolarHBondContact O-N 2.78Å
547	K	92.3	Very high	91.2	Very high	96 Å²	96	41.4 Å²	41.4	42%	0.417	20%	0.201	S	C	.	.	H	α-helix	trans	-64.3	-41.2	178.3	-63.1	-174.8	-171.2	167.2	0	112.4	L539 Q544 W545 D550 L551	L539-K547 HydrophobicContact CD1-CB 4.02Å; L539-K547 HydrophobicContact CD2-CD 4.3Å; Q544-K547 PolarHBondContact O-N 2.85Å; W545-K547 PolarHBondContact O-N 3.09Å; K547-D550 PolarHBondContact O-N 3.25Å; K547-L551 WeakPolarHBondContact O-CB 3.35Å; K547-L551 WeakPolarHBondContact O-CG 3.31Å; K547-L551 PolarHBondContact O-N 2.68Å
548	A	93.7	Very high	90.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64	-43.6	178.7	0	0	0	0	0	111.7	I536 L539 A540 Q544 W545 F546 M552	I536-A548 HydrophobicContact CG2-CB 4.31Å; L539-A548 HydrophobicContact CB-CB 3.96Å; A540-A548 HydrophobicContact CB-CB 4.31Å; Q544-A548 PolarHBondContact O-N 3.28Å; Q544-A548 VanDerWaalsContact O-N 3.14Å; W545-A548 PolarHBondContact O-N 2.85Å; F546-A548 PolarHBondContact O-N 3.17Å; A548-M552 WeakPolarHBondContact O-CB 3.34Å; A548-M552 PolarHBondContact O-N 3.37Å
549	R	93.1	Very high	90.5	Very high	81 Å²	81	53.3 Å²	53.3	31%	0.306	26%	0.259	S	S	.	.	H	α-helix	trans	-61.9	-49.4	173.9	-178	-159.8	69.4	-174.1	1	111.4	W545 F546 L551 M552 L553	W545-R549 WeakPolarHBondContact O-CB 3.05Å; W545-R549 PolarHBondContact O-N 3.44Å; F546-R549 PolarHBondContact O-N 3.11Å; R549-L551 VanDerWaalsContact C-N 3.32Å; R549-L551 PolarHBondContact O-N 3.3Å; R549-M552 PolarHBondContact O-N 2.82Å; R549-L553 HydrophobicContact CG-CD1 3.99Å; R549-L553 WeakPolarHBondContact O-CG 3.24Å; R549-L553 PolarHBondContact O-N 3.07Å
550	D	94.4	Very high	90.2	Very high	69 Å²	69	56 Å²	56	37%	0.369	28%	0.278	S	S	.	.	H	α-helix	trans	-67.3	-35	-175.2	-64.1	-11.4	0	0	0	111.3	F546 K547 M554	F546-D550 VanDerWaalsContact O-CB 3.32Å; F546-D550 WeakPolarHBondContact O-CB 3.44Å; F546-D550 PolarHBondContact O-N 2.78Å; K547-D550 PolarHBondContact O-N 3.25Å; D550-M554 WeakPolarHBondContact O-CB 3.24Å; D550-M554 PolarHBondContact O-N 2.94Å
551	L	93.1	Very high	90	Very high	35 Å²	35	56.7 Å²	56.7	18%	0.183	28%	0.282	C	S	.	.	H	α-helix	trans	-68.6	-41.6	171.1	-76.2	168.3	0	0	0	112.9	I536 L539 K547 R549 M554 S555	I536-L551 HydrophobicContact CD1-CB 4.36Å; I536-L551 HydrophobicContact CG1-CB 3.89Å; L539-L551 HydrophobicContact CD1-CD1 3.37Å; K547-L551 WeakPolarHBondContact O-CB 3.35Å; K547-L551 WeakPolarHBondContact O-CG 3.31Å; K547-L551 PolarHBondContact O-N 2.68Å; R549-L551 VanDerWaalsContact C-N 3.32Å; R549-L551 PolarHBondContact O-N 3.3Å; L551-M554 PolarHBondContact O-N 3.34Å; L551-S555 WeakPolarHBondContact O-CB 3.46Å; L551-S555 PolarHBondContact O-N 2.97Å; L551-S555 VanDerWaalsContact O-N 3.15Å; L551-S555 PolarHBondContact O-OG 3.18Å
552	M	91.9	Very high	89.9	Confident	7 Å²	7	63 Å²	63	3%	0.034	31%	0.311	C	S	.	.	H	α-helix	trans	-59.5	-47.9	175.3	-177.6	62.5	85.8	0	0	110.6	I536 A548 R549 S555 Y572 M576 L579	I536-M552 HydrophobicContact CD1-CB 3.98Å; I536-M552 HydrophobicContact CD1-CE 4.11Å; I536-M552 HydrophobicContact CD1-SD 4.13Å; I536-M552 HydrophobicContact CG2-CE 4.24Å; A548-M552 WeakPolarHBondContact O-CB 3.34Å; A548-M552 PolarHBondContact O-N 3.37Å; R549-M552 PolarHBondContact O-N 2.82Å; M552-S555 PolarHBondContact O-N 3.41Å; M552-S555 PolarHBondContact O-OG 3.4Å; M552-Y572 HydrophobicContact CE-CD2 4.34Å; M552-Y572 HydrophobicContact CE-CE2 4.14Å; M552-Y572 HydrophobicContact SD-CE2 4.04Å; M552-M576 HydrophobicContact CE-CE 3.87Å; M552-M576 HydrophobicContact SD-CE 4.3Å; M552-L579 HydrophobicContact CB-CD1 4.08Å; M552-L579 HydrophobicContact CE-CD1 4.48Å; M552-L579 HydrophobicContact CG-CD1 4.35Å
553	L	93	Very high	89.9	Confident	94 Å²	94	71 Å²	71	49%	0.492	35%	0.348	S	S	.	.	H	α-helix	trans	-68.3	-38.6	178.6	-67	174	0	0	0	113	R549 S555	R549-L553 HydrophobicContact CG-CD1 3.99Å; R549-L553 WeakPolarHBondContact O-CG 3.24Å; R549-L553 PolarHBondContact O-N 3.07Å; L553-S555 PolarHBondContact O-N 3.24Å
554	M	91.7	Very high	90	Very high	148 Å²	148	72.3 Å²	72.3	73%	0.729	36%	0.359	S	S	*	.	H	α-helix	trans	-65.4	-23.3	177.3	-176.7	-176.3	-59	0	0	113.1	D550 L551	D550-M554 WeakPolarHBondContact O-CB 3.24Å; D550-M554 PolarHBondContact O-N 2.94Å; L551-M554 PolarHBondContact O-N 3.34Å
555	S	88.6	Confident	90	Very high	30 Å²	30	73.6 Å²	73.6	21%	0.21	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-15.3	-174.9	73.1	0	0	0	0	114.9	L551 M552 L553 L557	L551-S555 WeakPolarHBondContact O-CB 3.46Å; L551-S555 PolarHBondContact O-N 2.97Å; L551-S555 VanDerWaalsContact O-N 3.15Å; L551-S555 PolarHBondContact O-OG 3.18Å; M552-S555 PolarHBondContact O-N 3.41Å; M552-S555 PolarHBondContact O-OG 3.4Å; L553-S555 PolarHBondContact O-N 3.24Å; S555-L557 PolarHBondContact O-N 3.18Å; S555-L557 WeakPolarHBondContact OG-CD1 3.47Å; S555-L557 VanDerWaalsContact OG-CG 3.29Å; S555-L557 WeakPolarHBondContact OG-CG 3.33Å
556	D	89	Confident	89.9	Confident	113 Å²	113	78.4 Å²	78.4	60%	0.604	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	23.4	-173.7	-70.8	-40.3	0	0	0	114.8	Q558 M559	D556-Q558 PolarHBondContact O-N 2.92Å; D556-Q558 VanDerWaalsContact O-N 3.08Å; D556-M559 PolarHBondContact O-N 3.5Å; D556-M559 VanDerWaalsContact O-N 3.11Å
557	L	87.6	Confident	89.7	Confident	5 Å²	5	74.6 Å²	74.6	3%	0.026	38%	0.378	C	S	.	.	H	α-helix	trans	-61.1	-24.8	-175.3	-74	173	0	0	0	113.1	T529 I532 L533 S555 M559 S560 I561	T529-L557 HydrophobicContact CG2-CD1 4.32Å; T529-L557 HydrophobicContact CG2-CD2 3.6Å; I532-L557 HydrophobicContact CG2-CD1 3.95Å; L533-L557 HydrophobicContact CD2-CD1 3.76Å; L533-L557 HydrophobicContact CG-CD1 4.13Å; S555-L557 PolarHBondContact O-N 3.18Å; S555-L557 WeakPolarHBondContact OG-CD1 3.47Å; S555-L557 VanDerWaalsContact OG-CG 3.29Å; S555-L557 WeakPolarHBondContact OG-CG 3.33Å; L557-M559 PolarHBondContact O-N 3.26Å; L557-M559 VanDerWaalsContact O-N 3.12Å; L557-S560 PolarHBondContact O-N 3.04Å; L557-S560 VanDerWaalsContact O-N 3.11Å; L557-S560 PolarHBondContact O-OG 2.91Å; L557-I561 VanDerWaalsContact O-CB 3.27Å; L557-I561 WeakPolarHBondContact O-CB 3.5Å; L557-I561 WeakPolarHBondContact O-CG2 3.42Å; L557-I561 PolarHBondContact O-N 3.13Å
558	Q	86.3	Confident	89.7	Confident	103 Å²	103	70.1 Å²	70.1	48%	0.481	36%	0.358	S	S	.	.	H	α-helix	trans	-54.3	-30.1	176	-60.1	-177.5	-48.1	0	0	113.2	D556	D556-Q558 PolarHBondContact O-N 2.92Å; D556-Q558 VanDerWaalsContact O-N 3.08Å
559	M	85.4	Confident	89.6	Confident	160 Å²	160	73 Å²	73	79%	0.788	37%	0.372	S	S	*	.	H	α-helix	trans	-95.4	-15.4	-178.9	-61.3	-58.4	-57.6	0	0	114	D556 L557	D556-M559 PolarHBondContact O-N 3.5Å; D556-M559 VanDerWaalsContact O-N 3.11Å; L557-M559 PolarHBondContact O-N 3.26Å; L557-M559 VanDerWaalsContact O-N 3.12Å
560	S	86.2	Confident	89.6	Confident	59 Å²	59	70 Å²	70	41%	0.413	36%	0.362	S	S	.	.	H	α-helix	trans	-112	-20.6	-173.4	55.6	0	0	0	0	114	L557 E562 H563	L557-S560 PolarHBondContact O-N 3.04Å; L557-S560 VanDerWaalsContact O-N 3.11Å; L557-S560 PolarHBondContact O-OG 2.91Å; S560-E562 VanDerWaalsContact C-N 3.28Å; S560-E562 PolarHBondContact O-N 2.88Å; S560-H563 PolarHBondContact O-N 3.33Å
561	I	87.8	Confident	89.6	Confident	14 Å²	14	67.2 Å²	67.2	7%	0.072	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-63.1	-27.1	-172.3	-165.5	66.1	0	0	0	114.3	L557 H563 A564 T568 M569 Y572	L557-I561 VanDerWaalsContact O-CB 3.27Å; L557-I561 WeakPolarHBondContact O-CB 3.5Å; L557-I561 WeakPolarHBondContact O-CG2 3.42Å; L557-I561 PolarHBondContact O-N 3.13Å; I561-H563 PolarHBondContact O-N 3.11Å; I561-A564 HydrophobicContact CD1-CB 3.95Å; I561-A564 VanDerWaalsContact O-CB 3.27Å; I561-A564 WeakPolarHBondContact O-CB 3.44Å; I561-A564 PolarHBondContact O-N 3.18Å; I561-T568 HydrophobicContact CD1-CG2 4.15Å; I561-M569 HydrophobicContact CG1-CG 4.23Å; I561-M569 WeakPolarHBondContact O-CG 3.36Å; I561-Y572 HydrophobicContact CD1-CG 4.12Å; I561-Y572 HydrophobicContact CG1-CD1 3.92Å; I561-Y572 HydrophobicContact CG1-CD2 4.25Å; I561-Y572 HydrophobicContact CG1-CG 3.73Å; I561-Y572 HydrophobicContact CG2-CD1 4.28Å; I561-Y572 HydrophobicContact CG2-CE1 4.11Å
562	E	88	Confident	89.6	Confident	155 Å²	155	67 Å²	67	72%	0.724	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-60.5	-25.4	178.6	-61.8	-174.9	161.9	0	0	113.5	S560	S560-E562 VanDerWaalsContact C-N 3.28Å; S560-E562 PolarHBondContact O-N 2.88Å
563	H	86.7	Confident	89.7	Confident	167 Å²	167	68 Å²	68	77%	0.773	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-97.3	1.5	179.3	-57.2	84.5	0	0	0	112.8	S560 I561	S560-H563 PolarHBondContact O-N 3.33Å; I561-H563 PolarHBondContact O-N 3.11Å
564	A	88	Confident	89.8	Confident	31 Å²	31	63.5 Å²	63.5	26%	0.256	33%	0.326	S	S	.	.	S	Bend	trans	-81.8	165.5	-179.2	0	0	0	0	0	112.2	I561 T568 M569	I561-A564 HydrophobicContact CD1-CB 3.95Å; I561-A564 VanDerWaalsContact O-CB 3.27Å; I561-A564 WeakPolarHBondContact O-CB 3.44Å; I561-A564 PolarHBondContact O-N 3.18Å; A564-T568 HydrophobicContact CB-CG2 4.34Å; A564-M569 HydrophobicContact CB-CG 4.45Å
565	D	88.9	Confident	89.9	Confident	49 Å²	49	56.5 Å²	56.5	26%	0.262	29%	0.292	S	S	.	.			trans	-66.2	147	175	68.9	-78	0	0	0	111.8	R526 S567 T568 M569	R526-D565 IonicContact CZ-OD1 3.59Å; R526-D565 IonicContact CZ-OD2 3.61Å; R526-D565 IonicContact NE-OD1 3.59Å; R526-D565 PolarHBondContact NE-OD1 2.89Å; R526-D565 IonicContact NE-OD2 3.35Å; R526-D565 VanDerWaalsContact NH2-CG 3.27Å; R526-D565 IonicContact NH2-OD1 2.76Å; R526-D565 IonicContact NH2-OD2 2.67Å; R526-D565 PolarHBondContact NH2-OD2 2.88Å; D565-S567 PolarHBondContact O-N 3.3Å; D565-S567 VanDerWaalsContact O-N 3.09Å; D565-S567 PolarHBondContact OD2-OG 3.42Å; D565-T568 VanDerWaalsContact CG-OG1 3.28Å; D565-T568 WeakPolarHBondContact O-CA 3.45Å; D565-T568 WeakPolarHBondContact O-CB 3.49Å; D565-T568 PolarHBondContact O-N 2.97Å; D565-T568 WeakPolarHBondContact OD1-CB 3.47Å; D565-T568 PolarHBondContact OD1-OG1 3.04Å; D565-T568 PolarHBondContact OD2-N 3.44Å; D565-T568 PolarHBondContact OD2-OG1 3.18Å; D565-M569 PolarHBondContact O-N 3.48Å
566	Q	89.6	Confident	90.2	Very high	112 Å²	112	56.2 Å²	56.2	52%	0.523	29%	0.288	S	S	.	.	H	α-helix	trans	-53.1	-36.4	-175.3	-70.2	173.5	-24.1	0	0	113.2	T568 M569 I570 L632	Q566-T568 VanDerWaalsContact C-N 3.32Å; Q566-T568 PolarHBondContact O-N 2.71Å; Q566-M569 HydrophobicContact CB-CE 4.32Å; Q566-M569 HydrophobicContact CG-CE 3.78Å; Q566-M569 PolarHBondContact O-N 3.4Å; Q566-I570 WeakPolarHBondContact O-CD1 3.28Å; Q566-I570 VanDerWaalsContact O-CG1 3.29Å; Q566-I570 WeakPolarHBondContact O-CG1 3.39Å; Q566-I570 PolarHBondContact O-N 3.07Å; Q566-L632 HydrophobicContact CB-CD1 4.16Å; Q566-L632 VanDerWaalsContact OE1-CD1 3.31Å
567	S	89.5	Confident	90.4	Very high	38 Å²	38	50.9 Å²	50.9	27%	0.266	26%	0.259	S	S	.	.	H	α-helix	trans	-65.3	-34.1	176.7	87.1	0	0	0	0	113	R530 D565 L571	R530-S567 PolarHBondContact NH1-OG 2.92Å; D565-S567 PolarHBondContact O-N 3.3Å; D565-S567 VanDerWaalsContact O-N 3.09Å; D565-S567 PolarHBondContact OD2-OG 3.42Å; S567-L571 PolarHBondContact O-N 2.7Å; S567-L571 VanDerWaalsContact O-N 3.11Å
568	T	91.6	Very high	90.7	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.012	26%	0.26	C	S	.	.	H	α-helix	trans	-78.2	-33.6	176.9	-57.9	0	0	0	0	111.2	T529 R530 L533 I561 A564 D565 Q566 L571 Y572	T529-T568 HydrophobicContact CG2-CG2 3.84Å; R530-T568 HydrophobicContact CG-CG2 4.1Å; R530-T568 PolarHBondContact NH1-OG1 3.1Å; R530-T568 VanDerWaalsContact NH1-OG1 3.13Å; L533-T568 HydrophobicContact CD1-CG2 3.92Å; I561-T568 HydrophobicContact CD1-CG2 4.15Å; A564-T568 HydrophobicContact CB-CG2 4.34Å; D565-T568 VanDerWaalsContact CG-OG1 3.28Å; D565-T568 WeakPolarHBondContact O-CA 3.45Å; D565-T568 WeakPolarHBondContact O-CB 3.49Å; D565-T568 PolarHBondContact O-N 2.97Å; D565-T568 WeakPolarHBondContact OD1-CB 3.47Å; D565-T568 PolarHBondContact OD1-OG1 3.04Å; D565-T568 PolarHBondContact OD2-N 3.44Å; D565-T568 PolarHBondContact OD2-OG1 3.18Å; Q566-T568 VanDerWaalsContact C-N 3.32Å; Q566-T568 PolarHBondContact O-N 2.71Å; T568-L571 PolarHBondContact O-N 3.43Å; T568-Y572 PolarHBondContact O-N 3.08Å
569	M	92	Very high	91.1	Very high	60 Å²	60	47.1 Å²	47.1	30%	0.296	24%	0.242	S	C	.	.	H	α-helix	trans	-62.5	-43.7	169.5	-65.9	-163.3	-79.3	0	0	112.1	I561 A564 D565 Q566 L571 Y572 N573	I561-M569 HydrophobicContact CG1-CG 4.23Å; I561-M569 WeakPolarHBondContact O-CG 3.36Å; A564-M569 HydrophobicContact CB-CG 4.45Å; D565-M569 PolarHBondContact O-N 3.48Å; Q566-M569 HydrophobicContact CB-CE 4.32Å; Q566-M569 HydrophobicContact CG-CE 3.78Å; Q566-M569 PolarHBondContact O-N 3.4Å; M569-L571 VanDerWaalsContact C-N 3.33Å; M569-L571 PolarHBondContact O-N 2.97Å; M569-Y572 WeakPolarHBondContact O-CB 3.2Å; M569-Y572 PolarHBondContact O-N 3.02Å; M569-N573 PolarHBondContact O-N 3.01Å
570	I	92.6	Very high	91.5	Very high	19 Å²	19	39.5 Å²	39.5	10%	0.097	20%	0.204	C	C	.	.	H	α-helix	trans	-59.7	-44.3	174	-69.1	158.8	0	0	0	110.5	Q566 Y572 N573 R574 A610 L632 M634	Q566-I570 WeakPolarHBondContact O-CD1 3.28Å; Q566-I570 VanDerWaalsContact O-CG1 3.29Å; Q566-I570 WeakPolarHBondContact O-CG1 3.39Å; Q566-I570 PolarHBondContact O-N 3.07Å; I570-Y572 VanDerWaalsContact C-N 3.35Å; I570-Y572 PolarHBondContact O-N 2.76Å; I570-N573 PolarHBondContact O-N 3.24Å; I570-R574 HydrophobicContact CG2-CG 4.46Å; I570-R574 WeakPolarHBondContact O-CB 3.39Å; I570-R574 WeakPolarHBondContact O-CD 3.46Å; I570-R574 WeakPolarHBondContact O-CG 3.5Å; I570-R574 PolarHBondContact O-N 3.06Å; I570-A610 HydrophobicContact CD1-CB 3.71Å; I570-A610 HydrophobicContact CG1-CB 4.03Å; I570-A610 HydrophobicContact CG2-CB 3.81Å; I570-L632 HydrophobicContact CD1-CB 4.22Å; I570-M634 HydrophobicContact CG2-CG 4.28Å; I570-M634 HydrophobicContact CG2-SD 4.18Å
571	L	93.4	Very high	91.9	Very high	10 Å²	10	37 Å²	37	5%	0.052	19%	0.186	C	C	.	.	H	α-helix	trans	-62.4	-39.4	176.2	-176.8	61.8	0	0	0	112.3	Y483 R530 L533 S567 T568 M569 R574 A575	Y483-L571 HydrophobicContact CE2-CD1 4.01Å; R530-L571 HydrophobicContact CB-CD2 4.39Å; R530-L571 HydrophobicContact CG-CD2 4.49Å; L533-L571 HydrophobicContact CB-CD2 3.84Å; L533-L571 HydrophobicContact CB-CG 3.85Å; L533-L571 HydrophobicContact CD1-CB 4.33Å; L533-L571 HydrophobicContact CD1-CD2 4.18Å; L533-L571 HydrophobicContact CD1-CG 4.12Å; S567-L571 PolarHBondContact O-N 2.7Å; S567-L571 VanDerWaalsContact O-N 3.11Å; T568-L571 PolarHBondContact O-N 3.43Å; M569-L571 VanDerWaalsContact C-N 3.33Å; M569-L571 PolarHBondContact O-N 2.97Å; L571-R574 PolarHBondContact O-N 3.46Å; L571-A575 WeakPolarHBondContact O-CB 3.4Å; L571-A575 PolarHBondContact O-N 2.89Å
572	Y	94.8	Very high	92.1	Very high	31 Å²	31	36.3 Å²	36.3	12%	0.122	18%	0.182	C	C	.	.	H	α-helix	trans	-63.1	-48.3	174.3	169	-96.8	0	0	0	112.1	L533 M552 I561 T568 M569 I570 R574 A575 M576	L533-Y572 HydrophobicContact CD2-CD2 3.95Å; M552-Y572 HydrophobicContact CE-CD2 4.34Å; M552-Y572 HydrophobicContact CE-CE2 4.14Å; M552-Y572 HydrophobicContact SD-CE2 4.04Å; I561-Y572 HydrophobicContact CD1-CG 4.12Å; I561-Y572 HydrophobicContact CG1-CD1 3.92Å; I561-Y572 HydrophobicContact CG1-CD2 4.25Å; I561-Y572 HydrophobicContact CG1-CG 3.73Å; I561-Y572 HydrophobicContact CG2-CD1 4.28Å; I561-Y572 HydrophobicContact CG2-CE1 4.11Å; T568-Y572 PolarHBondContact O-N 3.08Å; M569-Y572 WeakPolarHBondContact O-CB 3.2Å; M569-Y572 PolarHBondContact O-N 3.02Å; I570-Y572 VanDerWaalsContact C-N 3.35Å; I570-Y572 PolarHBondContact O-N 2.76Å; Y572-R574 VanDerWaalsContact C-N 3.29Å; Y572-R574 PolarHBondContact O-N 3.02Å; Y572-A575 PolarHBondContact O-N 3.2Å; Y572-A575 VanDerWaalsContact O-N 3.16Å; Y572-M576 HydrophobicContact CE1-CE 4.49Å; Y572-M576 HydrophobicContact CE2-CE 3.87Å; Y572-M576 WeakPolarHBondContact O-CB 3.49Å; Y572-M576 PolarHBondContact O-N 3.15Å; Y572-M576 VanDerWaalsContact OH-CE 3.31Å; Y572-M576 WeakPolarHBondContact OH-CE 3.44Å
573	N	94	Very high	92.4	Very high	27 Å²	27	28.9 Å²	28.9	14%	0.144	15%	0.148	C	C	.	.	H	α-helix	trans	-58.4	-43.3	176.9	-67.8	-17.4	0	0	0	111.3	M569 I570 M576 V577 M599 L608 L609	M569-N573 PolarHBondContact O-N 3.01Å; I570-N573 PolarHBondContact O-N 3.24Å; N573-M576 PolarHBondContact O-N 2.95Å; N573-V577 WeakPolarHBondContact O-CG2 3.27Å; N573-V577 PolarHBondContact O-N 3.22Å; N573-M599 HydrophobicContact CB-CE 4.45Å; N573-M599 HydrophobicContact CB-SD 3.96Å; N573-L608 WeakPolarHBondContact CB-O 3.39Å; N573-L608 PolarHBondContact ND2-O 3.44Å; N573-L609 HydrophobicContact CB-CD2 4.06Å
574	R	94	Very high	92.7	Very high	1 Å²	1	21.5 Å²	21.5	0%	0.004	11%	0.113	C	C	.	.	H	α-helix	trans	-64	-42.2	176	-69.4	166.8	59.8	76.1	14.2	112.3	Y537 I570 L571 Y572 Q578 L609 M638	Y537-R574 HydrophobicContact CE2-CB 4.24Å; I570-R574 HydrophobicContact CG2-CG 4.46Å; I570-R574 WeakPolarHBondContact O-CB 3.39Å; I570-R574 WeakPolarHBondContact O-CD 3.46Å; I570-R574 WeakPolarHBondContact O-CG 3.5Å; I570-R574 PolarHBondContact O-N 3.06Å; L571-R574 PolarHBondContact O-N 3.46Å; Y572-R574 VanDerWaalsContact C-N 3.29Å; Y572-R574 PolarHBondContact O-N 3.02Å; R574-Q578 WeakPolarHBondContact O-CB 3.33Å; R574-Q578 PolarHBondContact O-N 3.23Å; R574-L609 HydrophobicContact CB-CD2 4.49Å; R574-L609 HydrophobicContact CG-CD2 3.84Å; R574-M638 VanDerWaalsContact CZ-O 3.23Å; R574-M638 PolarHBondContact NH1-O 2.66Å; R574-M638 PolarHBondContact NH2-O 2.92Å
575	A	94.1	Very high	92.9	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-65.9	-37.9	175.1	0	0	0	0	0	112.4	L533 Y537 L571 Y572 Q578 L579	L533-A575 HydrophobicContact CD2-CB 4.39Å; Y537-A575 HydrophobicContact CD2-CB 4.47Å; L571-A575 WeakPolarHBondContact O-CB 3.4Å; L571-A575 PolarHBondContact O-N 2.89Å; Y572-A575 PolarHBondContact O-N 3.2Å; Y572-A575 VanDerWaalsContact O-N 3.16Å; A575-Q578 PolarHBondContact O-N 2.83Å; A575-L579 WeakPolarHBondContact O-CB 3.47Å; A575-L579 PolarHBondContact O-N 2.94Å
576	M	93.8	Very high	92.9	Very high	25 Å²	25	21 Å²	21	12%	0.123	10%	0.104	C	C	.	.	H	α-helix	trans	-65.9	-46.2	176.4	-169.1	61	72.1	0	0	111.7	M552 Y572 N573 Q578 L579 G580 A595	M552-M576 HydrophobicContact CE-CE 3.87Å; M552-M576 HydrophobicContact SD-CE 4.3Å; Y572-M576 HydrophobicContact CE1-CE 4.49Å; Y572-M576 HydrophobicContact CE2-CE 3.87Å; Y572-M576 WeakPolarHBondContact O-CB 3.49Å; Y572-M576 PolarHBondContact O-N 3.15Å; Y572-M576 VanDerWaalsContact OH-CE 3.31Å; Y572-M576 WeakPolarHBondContact OH-CE 3.44Å; N573-M576 PolarHBondContact O-N 2.95Å; M576-Q578 VanDerWaalsContact C-N 3.32Å; M576-Q578 PolarHBondContact O-N 3.29Å; M576-L579 WeakPolarHBondContact O-CB 3.49Å; M576-L579 PolarHBondContact O-N 3.47Å; M576-G580 PolarHBondContact O-N 3.36Å; M576-A595 HydrophobicContact SD-CB 4.3Å
577	V	94.6	Very high	93	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-58.6	-44.9	173	166.3	0	0	0	0	111.1	N573 L579 G580 L581 L596 M599 L609 I640 I645	N573-V577 WeakPolarHBondContact O-CG2 3.27Å; N573-V577 PolarHBondContact O-N 3.22Å; V577-L579 VanDerWaalsContact C-N 3.33Å; V577-L579 PolarHBondContact O-N 3.5Å; V577-G580 PolarHBondContact O-N 3.26Å; V577-L581 HydrophobicContact CG1-CD1 4.26Å; V577-L581 WeakPolarHBondContact O-CG 3.26Å; V577-L581 PolarHBondContact O-N 2.96Å; V577-L596 HydrophobicContact CB-CD2 4.31Å; V577-L596 HydrophobicContact CG1-CD2 4.33Å; V577-L596 HydrophobicContact CG2-CD2 4.06Å; V577-M599 HydrophobicContact CG2-CG 4.23Å; V577-M599 HydrophobicContact CG2-SD 4.19Å; V577-L609 HydrophobicContact CG2-CD1 4.37Å; V577-L609 HydrophobicContact CG2-CD2 3.98Å; V577-I640 HydrophobicContact CG1-CD1 4.09Å; V577-I640 HydrophobicContact CG1-CG2 4.27Å; V577-I645 HydrophobicContact CG1-CD1 3.59Å; V577-I645 HydrophobicContact CG1-CG1 3.75Å; V577-I645 HydrophobicContact CG1-CG2 4.19Å
578	Q	94.4	Very high	93.1	Very high	13 Å²	13	18.3 Å²	18.3	6%	0.061	9%	0.091	C	C	.	.	H	α-helix	trans	-65.9	-34.7	178.8	-169.1	63.4	2.9	0	0	112.6	Y537 A540 L541 R574 A575 M576 L581 C582	Y537-Q578 HydrophobicContact CD1-CG 4.14Å; Y537-Q578 HydrophobicContact CD2-CB 3.87Å; Y537-Q578 HydrophobicContact CD2-CG 4.11Å; Y537-Q578 HydrophobicContact CE1-CG 4.09Å; Y537-Q578 HydrophobicContact CE2-CB 3.84Å; Y537-Q578 HydrophobicContact CE2-CG 4.07Å; Y537-Q578 HydrophobicContact CG-CB 4.34Å; Y537-Q578 HydrophobicContact CG-CG 4.15Å; A540-Q578 HydrophobicContact CB-CB 4.48Å; A540-Q578 HydrophobicContact CB-CG 3.89Å; L541-Q578 VanDerWaalsContact CD1-NE2 3.28Å; R574-Q578 WeakPolarHBondContact O-CB 3.33Å; R574-Q578 PolarHBondContact O-N 3.23Å; A575-Q578 PolarHBondContact O-N 2.83Å; M576-Q578 VanDerWaalsContact C-N 3.32Å; M576-Q578 PolarHBondContact O-N 3.29Å; Q578-L581 PolarHBondContact O-N 3.01Å; Q578-C582 WeakPolarHBondContact O-CB 3.32Å; Q578-C582 PolarHBondContact O-N 3.45Å
579	L	94.2	Very high	93.2	Very high	16 Å²	16	19.2 Å²	19.2	8%	0.084	10%	0.095	C	C	.	.	H	α-helix	trans	-65.3	-41.8	171.9	-169.7	156.1	0	0	0	111	I536 M552 A575 M576 V577 C582 A583	I536-L579 HydrophobicContact CG2-CD1 4.16Å; M552-L579 HydrophobicContact CB-CD1 4.08Å; M552-L579 HydrophobicContact CE-CD1 4.48Å; M552-L579 HydrophobicContact CG-CD1 4.35Å; A575-L579 WeakPolarHBondContact O-CB 3.47Å; A575-L579 PolarHBondContact O-N 2.94Å; M576-L579 WeakPolarHBondContact O-CB 3.49Å; M576-L579 PolarHBondContact O-N 3.47Å; V577-L579 VanDerWaalsContact C-N 3.33Å; V577-L579 PolarHBondContact O-N 3.5Å; L579-C582 WeakPolarHBondContact O-CB 3.45Å; L579-C582 PolarHBondContact O-N 2.97Å; L579-A583 WeakPolarHBondContact O-CB 3.46Å; L579-A583 PolarHBondContact O-N 2.83Å
580	G	94.2	Very high	93.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60	-44.5	171.9	0	0	0	0	0	113.2	M576 V577 C582 A583 F584	M576-G580 PolarHBondContact O-N 3.36Å; V577-G580 PolarHBondContact O-N 3.26Å; G580-C582 VanDerWaalsContact C-N 3.32Å; G580-C582 PolarHBondContact O-N 3.35Å; G580-A583 PolarHBondContact O-N 3.16Å; G580-F584 PolarHBondContact O-N 3.06Å
581	L	93.3	Very high	93.3	Very high	6 Å²	6	26.8 Å²	26.8	3%	0.031	12%	0.124	C	C	.	.	H	α-helix	trans	-66	-30.9	174.2	-67.2	175.2	0	0	0	112.7	V577 Q578 R585 I640 L644 V648	V577-L581 HydrophobicContact CG1-CD1 4.26Å; V577-L581 WeakPolarHBondContact O-CG 3.26Å; V577-L581 PolarHBondContact O-N 2.96Å; Q578-L581 PolarHBondContact O-N 3.01Å; L581-R585 WeakPolarHBondContact O-CG 3.4Å; L581-R585 PolarHBondContact O-N 3.43Å; L581-R585 PolarHBondContact O-NE 3.36Å; L581-R585 VanDerWaalsContact O-NE 3.12Å; L581-I640 HydrophobicContact CD1-CG2 3.81Å; L581-L644 HydrophobicContact CD2-CG 4.37Å; L581-V648 HydrophobicContact CD2-CB 4.16Å; L581-V648 HydrophobicContact CD2-CG1 4.13Å; L581-V648 HydrophobicContact CD2-CG2 3.93Å
582	C	93.2	Very high	93.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-70.3	-45.1	171.8	-173.5	0	0	0	0	111.8	A540 Q578 L579 G580 F584 R585 Q586	A540-C582 HydrophobicContact CB-CB 3.88Å; A540-C582 WeakPolarHBondContact O-CB 3.42Å; A540-C582 PolarHBondContact O-SG 2.77Å; A540-C582 VanDerWaalsContact O-SG 3.33Å; Q578-C582 WeakPolarHBondContact O-CB 3.32Å; Q578-C582 PolarHBondContact O-N 3.45Å; L579-C582 WeakPolarHBondContact O-CB 3.45Å; L579-C582 PolarHBondContact O-N 2.97Å; G580-C582 VanDerWaalsContact C-N 3.32Å; G580-C582 PolarHBondContact O-N 3.35Å; C582-F584 VanDerWaalsContact C-N 3.29Å; C582-F584 PolarHBondContact O-N 2.84Å; C582-R585 PolarHBondContact O-N 2.78Å; C582-Q586 PolarHBondContact O-N 2.84Å
583	A	94.1	Very high	93.3	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-57.8	-42.9	175	0	0	0	0	0	111.3	L579 G580 Q586 S587 H588 D591 A592	L579-A583 WeakPolarHBondContact O-CB 3.46Å; L579-A583 PolarHBondContact O-N 2.83Å; G580-A583 PolarHBondContact O-N 3.16Å; A583-Q586 CarbonylContact O-C 3.57Å; A583-Q586 PolarHBondContact O-N 2.9Å; A583-S587 PolarHBondContact O-N 2.89Å; A583-H588 HydrophobicContact CB-CB 4.24Å; A583-H588 WeakPolarHBondContact O-CA 3.36Å; A583-H588 PolarHBondContact O-N 3.48Å; A583-D591 HydrophobicContact CB-CB 4.36Å; A583-A592 HydrophobicContact CB-CB 3.9Å
584	F	93.6	Very high	93.2	Very high	11 Å²	11	28.5 Å²	28.5	5%	0.048	14%	0.135	C	C	.	.	H	α-helix	trans	-62.7	-47.4	176.5	-174	-96.5	0	0	0	112.5	G580 C582 Q586 S587 A592 V648 V651 S652 W729 V738 L742	G580-F584 PolarHBondContact O-N 3.06Å; C582-F584 VanDerWaalsContact C-N 3.29Å; C582-F584 PolarHBondContact O-N 2.84Å; F584-Q586 VanDerWaalsContact C-N 3.27Å; F584-Q586 PolarHBondContact O-N 3.41Å; F584-S587 PolarHBondContact O-N 2.85Å; F584-A592 HydrophobicContact CB-CB 3.96Å; F584-V648 HydrophobicContact CB-CG1 3.75Å; F584-V648 HydrophobicContact CD1-CG1 4.11Å; F584-V648 HydrophobicContact CD1-CG2 4.05Å; F584-V648 HydrophobicContact CD2-CG1 3.66Å; F584-V648 HydrophobicContact CE1-CG2 4.19Å; F584-V648 HydrophobicContact CE2-CG1 4.26Å; F584-V648 HydrophobicContact CG-CG1 3.55Å; F584-V648 HydrophobicContact CG-CG2 4.35Å; F584-V651 HydrophobicContact CE2-CG1 4.1Å; F584-V651 HydrophobicContact CZ-CG1 4.15Å; F584-S652 WeakPolarHBondContact CD2-OG 3.24Å; F584-W729 HydrophobicContact CE1-CH2 4.17Å; F584-W729 AromaticContact CE1-CZ3 3.71Å; F584-W729 HydrophobicContact CE1-CZ3 3.71Å; F584-W729 HydrophobicContact CZ-CH2 4.05Å; F584-W729 HydrophobicContact CZ-CZ3 4.07Å; F584-V738 HydrophobicContact CD1-CG1 4.3Å; F584-V738 HydrophobicContact CE1-CG1 3.79Å; F584-L742 HydrophobicContact CZ-CD1 4.42Å; F584-L742 HydrophobicContact CZ-CD2 4.41Å
585	R	90.9	Very high	93.1	Very high	10 Å²	10	29.3 Å²	29.3	4%	0.038	14%	0.143	C	C	.	.	H	α-helix	trans	-59.5	-36.7	177.2	-76.6	178.9	-73.3	156.3	4.7	112.7	A540 L541 N543 L581 C582 S587 V738	A540-R585 PolarHBondContact O-NH2 2.91Å; L541-R585 PolarHBondContact O-NH1 3.43Å; N543-R585 WeakPolarHBondContact OD1-CD 3.39Å; N543-R585 PolarHBondContact OD1-NE 3.12Å; N543-R585 PolarHBondContact OD1-NH1 3.41Å; L581-R585 WeakPolarHBondContact O-CG 3.4Å; L581-R585 PolarHBondContact O-N 3.43Å; L581-R585 PolarHBondContact O-NE 3.36Å; L581-R585 VanDerWaalsContact O-NE 3.12Å; C582-R585 PolarHBondContact O-N 2.78Å; R585-S587 VanDerWaalsContact C-N 3.25Å; R585-S587 PolarHBondContact O-N 3.17Å; R585-V738 HydrophobicContact CB-CG2 4.31Å; R585-V738 HydrophobicContact CG-CG2 3.84Å
586	Q	90.2	Very high	93	Very high	60 Å²	60	29.3 Å²	29.3	28%	0.28	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	12.1	174.8	-65.1	-68.6	11.1	0	0	114.1	N543 W545 C582 A583 F584 H588	N543-Q586 PolarHBondContact O-NE2 2.85Å; W545-Q586 HydrophobicContact CB-CG 4.05Å; C582-Q586 PolarHBondContact O-N 2.84Å; A583-Q586 CarbonylContact O-C 3.57Å; A583-Q586 PolarHBondContact O-N 2.9Å; F584-Q586 VanDerWaalsContact C-N 3.27Å; F584-Q586 PolarHBondContact O-N 3.41Å; Q586-H588 PolarHBondContact O-N 3.44Å
587	S	89.9	Confident	92.9	Very high	34 Å²	34	29.3 Å²	29.3	24%	0.238	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	14.6	179.1	-46.9	0	0	0	0	116.2	A583 F584 R585 I589 N741	A583-S587 PolarHBondContact O-N 2.89Å; F584-S587 PolarHBondContact O-N 2.85Å; R585-S587 VanDerWaalsContact C-N 3.25Å; R585-S587 PolarHBondContact O-N 3.17Å; S587-I589 PolarHBondContact O-N 2.87Å; S587-N741 VanDerWaalsContact OG-CB 3.32Å; S587-N741 WeakPolarHBondContact OG-CB 3.36Å; S587-N741 VanDerWaalsContact OG-CG 3.28Å; S587-N741 PolarHBondContact OG-ND2 2.91Å
588	H	92.8	Very high	92.6	Very high	60 Å²	60	35.9 Å²	35.9	28%	0.278	18%	0.182	S	C	.	.			trans	-81.9	65.5	173.3	-66.8	-67.5	0	0	0	110.7	W545 A583 Q586 R590 D591 A592	W545-H588 AromaticContact CD2-CD2 3.81Å; W545-H588 AromaticContact CE3-CD2 3.59Å; W545-H588 AromaticContact CE3-NE2 3.6Å; W545-H588 HydrophobicContact CZ2-CB 4.34Å; W545-H588 AromaticContact CZ3-CD2 3.71Å; W545-H588 AromaticContact CZ3-CE1 3.85Å; W545-H588 AromaticContact CZ3-NE2 3.53Å; A583-H588 HydrophobicContact CB-CB 4.24Å; A583-H588 WeakPolarHBondContact O-CA 3.36Å; A583-H588 PolarHBondContact O-N 3.48Å; Q586-H588 PolarHBondContact O-N 3.44Å; H588-R590 VanDerWaalsContact C-N 3.32Å; H588-R590 PolarHBondContact O-N 3.23Å; H588-D591 HydrophobicContact CB-CB 4.33Å; H588-D591 PolarHBondContact O-N 2.99Å; H588-A592 WeakPolarHBondContact O-CB 3.4Å; H588-A592 PolarHBondContact O-N 3.43Å
589	I	92.9	Very high	92.1	Very high	20 Å²	20	36.2 Å²	36.2	10%	0.103	18%	0.183	C	C	.	.	H	α-helix	trans	-58.2	-38.8	-171.6	-62.9	155.3	0	0	0	112.9	S587 A592 H593 L655 L656 K745	S587-I589 PolarHBondContact O-N 2.87Å; I589-A592 PolarHBondContact O-N 2.93Å; I589-H593 WeakPolarHBondContact O-CB 3.49Å; I589-H593 PolarHBondContact O-N 3.38Å; I589-L655 HydrophobicContact CD1-CD1 3.68Å; I589-L655 HydrophobicContact CG1-CD1 4.33Å; I589-L655 HydrophobicContact CG2-CB 4.35Å; I589-L655 HydrophobicContact CG2-CD1 4.43Å; I589-L656 HydrophobicContact CG2-CD1 4.43Å; I589-L656 HydrophobicContact CG2-CG 4.27Å; I589-K745 HydrophobicContact CD1-CB 3.95Å; I589-K745 HydrophobicContact CD1-CD 3.79Å; I589-K745 HydrophobicContact CD1-CG 3.73Å
590	R	93.2	Very high	91.8	Very high	172 Å²	172	36.2 Å²	36.2	65%	0.649	18%	0.183	S	C	*	.	H	α-helix	trans	-64.1	-45.5	178.5	-69.7	-177.7	-178.8	-164	-1.9	111.7	H588 H593 N594 L656	H588-R590 VanDerWaalsContact C-N 3.32Å; H588-R590 PolarHBondContact O-N 3.23Å; R590-H593 PolarHBondContact O-N 3.46Å; R590-N594 PolarHBondContact O-N 3.46Å; R590-N594 PolarHBondContact O-ND2 3.38Å; R590-N594 PolarHBondContact O-OD1 3.09Å; R590-L656 HydrophobicContact CG-CD1 4.29Å; R590-L656 HydrophobicContact CG-CD2 3.65Å
591	D	93.6	Very high	91.2	Very high	67 Å²	67	38.3 Å²	38.3	36%	0.358	21%	0.205	S	C	.	.	H	α-helix	trans	-71.4	-36.5	-179.4	-54.9	-41.7	0	0	0	111	W545 A583 H588 N594 A595	W545-D591 HydrophobicContact CZ2-CB 4.1Å; W545-D591 WeakPolarHBondContact CZ2-OD2 3.41Å; A583-D591 HydrophobicContact CB-CB 4.36Å; H588-D591 HydrophobicContact CB-CB 4.33Å; H588-D591 PolarHBondContact O-N 2.99Å; D591-N594 PolarHBondContact O-N 3.24Å; D591-A595 WeakPolarHBondContact O-CB 3.03Å; D591-A595 PolarHBondContact O-N 3.5Å
592	A	93.8	Very high	90.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.9	-42.8	171.6	0	0	0	0	0	112.5	A583 F584 H588 I589 L596	A583-A592 HydrophobicContact CB-CB 3.9Å; F584-A592 HydrophobicContact CB-CB 3.96Å; H588-A592 WeakPolarHBondContact O-CB 3.4Å; H588-A592 PolarHBondContact O-N 3.43Å; I589-A592 PolarHBondContact O-N 2.93Å; A592-L596 WeakPolarHBondContact O-CG 3.27Å; A592-L596 PolarHBondContact O-N 3.47Å
593	H	93.8	Very high	89.9	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.019	25%	0.246	C	C	.	.	H	α-helix	trans	-62.3	-50.1	175.6	-176.1	70.3	0	0	0	111.3	I589 R590 A595 L596 A597 Y649 L656	I589-H593 WeakPolarHBondContact O-CB 3.49Å; I589-H593 PolarHBondContact O-N 3.38Å; R590-H593 PolarHBondContact O-N 3.46Å; H593-A595 PolarHBondContact O-N 2.95Å; H593-L596 PolarHBondContact O-N 3.32Å; H593-A597 WeakPolarHBondContact O-CB 3.29Å; H593-A597 PolarHBondContact O-N 3.47Å; H593-Y649 AromaticContact CE1-CE2 3.27Å; H593-Y649 WeakPolarHBondContact CE1-CE2 3.26Å; H593-Y649 AromaticContact CE1-CZ 3.68Å; H593-Y649 AromaticContact ND1-CD2 3.77Å; H593-Y649 AromaticContact ND1-CE2 3.45Å; H593-Y649 WeakPolarHBondContact ND1-CE2 3.21Å; H593-L656 HydrophobicContact CB-CD1 3.78Å
594	N	92.9	Very high	89.4	Confident	99 Å²	99	52.2 Å²	52.2	53%	0.529	27%	0.272	S	S	.	.	H	α-helix	trans	-61.7	-44.1	-178	-66.9	-13.2	0	0	0	112	R590 D591 L596 A597	R590-N594 PolarHBondContact O-N 3.46Å; R590-N594 PolarHBondContact O-ND2 3.38Å; R590-N594 PolarHBondContact O-OD1 3.09Å; D591-N594 PolarHBondContact O-N 3.24Å; N594-L596 VanDerWaalsContact C-N 3.26Å; N594-L596 PolarHBondContact O-N 2.96Å; N594-A597 PolarHBondContact O-N 2.89Å
595	A	91.6	Very high	89	Confident	19 Å²	19	52.5 Å²	52.5	16%	0.157	27%	0.274	C	S	.	.	H	α-helix	trans	-65.6	-25	179.4	0	0	0	0	0	114	M576 D591 H593	M576-A595 HydrophobicContact SD-CB 4.3Å; D591-A595 WeakPolarHBondContact O-CB 3.03Å; D591-A595 PolarHBondContact O-N 3.5Å; H593-A595 PolarHBondContact O-N 2.95Å
596	L	92.9	Very high	88.8	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-101.7	-13.1	-178.4	-63.7	178.4	0	0	0	113.8	V577 A592 H593 N594 M599 I600 I645 V648 Y649	V577-L596 HydrophobicContact CB-CD2 4.31Å; V577-L596 HydrophobicContact CG1-CD2 4.33Å; V577-L596 HydrophobicContact CG2-CD2 4.06Å; A592-L596 WeakPolarHBondContact O-CG 3.27Å; A592-L596 PolarHBondContact O-N 3.47Å; H593-L596 PolarHBondContact O-N 3.32Å; N594-L596 VanDerWaalsContact C-N 3.26Å; N594-L596 PolarHBondContact O-N 2.96Å; L596-M599 PolarHBondContact O-N 3.31Å; L596-I600 HydrophobicContact CB-CD1 4.45Å; L596-I600 PolarHBondContact O-N 3.29Å; L596-I600 VanDerWaalsContact O-N 3.15Å; L596-I645 HydrophobicContact CD1-CG2 4.36Å; L596-I645 HydrophobicContact CD2-CG2 3.88Å; L596-V648 HydrophobicContact CD1-CG1 3.91Å; L596-Y649 HydrophobicContact CB-CD2 3.94Å
597	A	90.7	Very high	88.5	Confident	24 Å²	24	57.1 Å²	57.1	20%	0.198	29%	0.291	C	S	.	.	H	α-helix	trans	-60.7	-48.4	-173.4	0	0	0	0	0	113.3	H593 N594 G601 Y649	H593-A597 WeakPolarHBondContact O-CB 3.29Å; H593-A597 PolarHBondContact O-N 3.47Å; N594-A597 PolarHBondContact O-N 2.89Å; A597-G601 WeakPolarHBondContact O-CA 3.39Å; A597-G601 PolarHBondContact O-N 3.48Å; A597-Y649 HydrophobicContact CB-CE2 4.09Å
598	D	87.5	Confident	88.4	Confident	139 Å²	139	58.2 Å²	58.2	74%	0.743	29%	0.294	S	S	*	.	H	α-helix	trans	-70.1	-36.8	-177.4	-60.1	-32	0	0	0	111.7	S602	D598-S602 PolarHBondContact O-N 2.85Å
599	M	85.4	Confident	88.3	Confident	20 Å²	20	55.3 Å²	55.3	10%	0.099	28%	0.28	C	S	.	.	H	α-helix	trans	-63.5	-48.2	179.5	-65.1	-90.4	69.1	0	0	111.7	N573 V577 L596 S602 L608	N573-M599 HydrophobicContact CB-CE 4.45Å; N573-M599 HydrophobicContact CB-SD 3.96Å; V577-M599 HydrophobicContact CG2-CG 4.23Å; V577-M599 HydrophobicContact CG2-SD 4.19Å; L596-M599 PolarHBondContact O-N 3.31Å; M599-S602 PolarHBondContact O-OG 3.13Å; M599-L608 HydrophobicContact CE-CB 3.92Å; M599-L608 HydrophobicContact CE-CD1 3.62Å; M599-L608 HydrophobicContact CE-CG 4.29Å
600	I	86.4	Confident	87.9	Confident	16 Å²	16	54.8 Å²	54.8	8%	0.082	28%	0.279	C	S	.	.	H	α-helix	trans	-79.8	-35.5	-179	-69	165.9	0	0	0	111.6	L596 S602 N603 I605 I645 Y649	L596-I600 HydrophobicContact CB-CD1 4.45Å; L596-I600 PolarHBondContact O-N 3.29Å; L596-I600 VanDerWaalsContact O-N 3.15Å; I600-S602 PolarHBondContact O-N 3.48Å; I600-S602 VanDerWaalsContact O-N 3.1Å; I600-N603 PolarHBondContact O-N 3.42Å; I600-I605 HydrophobicContact CG1-CD1 3.84Å; I600-I645 HydrophobicContact CD1-CG2 4.2Å; I600-Y649 HydrophobicContact CB-CD1 4.3Å; I600-Y649 HydrophobicContact CB-CE1 4.41Å; I600-Y649 HydrophobicContact CD1-CD1 3.65Å; I600-Y649 HydrophobicContact CD1-CD2 4.03Å; I600-Y649 HydrophobicContact CD1-CG 3.33Å; I600-Y649 HydrophobicContact CG2-CD1 3.9Å; I600-Y649 HydrophobicContact CG2-CE1 3.93Å
601	G	82.2	Confident	87.5	Confident	44 Å²	44	47.5 Å²	47.5	45%	0.454	25%	0.252	S	S	.	.	H	α-helix	trans	-57.1	-26	177.5	0	0	0	0	0	113.9	A597	A597-G601 WeakPolarHBondContact O-CA 3.39Å; A597-G601 PolarHBondContact O-N 3.48Å
602	S	80.1	Confident	86.7	Confident	47 Å²	47	45.1 Å²	45.1	33%	0.329	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-21.3	175.2	76.7	0	0	0	0	115.1	D598 M599 I600 R604 L608	D598-S602 PolarHBondContact O-N 2.85Å; M599-S602 PolarHBondContact O-OG 3.13Å; I600-S602 PolarHBondContact O-N 3.48Å; I600-S602 VanDerWaalsContact O-N 3.1Å; S602-R604 PolarHBondContact O-N 3.27Å; S602-R604 PolarHBondContact OG-N 3.06Å; S602-L608 WeakPolarHBondContact OG-CD1 3.44Å
603	N	78.5	Confident	85.5	Confident	106 Å²	106	47.6 Å²	47.6	57%	0.567	26%	0.257	S	S	*	.	S	Bend	trans	55.3	-0.6	-162.1	-65.9	-44.2	0	0	0	116.3	I600 H614	I600-N603 PolarHBondContact O-N 3.42Å; N603-H614 PolarHBondContact O-CE1 3.37Å
604	R	83.8	Confident	83.9	Confident	144 Å²	144	50.1 Å²	50.1	54%	0.543	27%	0.268	S	S	.	.			trans	-97.7	21.6	-177.6	-61.6	-176.4	-166	-176.3	1.6	113.5	S602 R606 E607 L608	S602-R604 PolarHBondContact O-N 3.27Å; S602-R604 PolarHBondContact OG-N 3.06Å; R604-R606 PolarHBondContact O-N 3.33Å; R604-E607 PolarHBondContact O-N 3.12Å; R604-L608 HydrophobicContact CB-CD1 4.18Å; R604-L608 HydrophobicContact CB-CG 4.32Å; R604-L608 WeakPolarHBondContact O-CG 3.35Å; R604-L608 PolarHBondContact O-N 3.44Å
605	I	86.3	Confident	82.2	Confident	17 Å²	17	52 Å²	52	9%	0.087	28%	0.283	C	S	.	.	H	α-helix	trans	-54.4	-31.3	-173.5	-168.1	165.5	0	0	0	114.2	I600 L609 I642 I645	I600-I605 HydrophobicContact CG1-CD1 3.84Å; I605-L609 HydrophobicContact CD1-CD1 4.36Å; I605-L609 HydrophobicContact CG1-CD1 3.79Å; I605-L609 HydrophobicContact CG1-CG 4.28Å; I605-L609 WeakPolarHBondContact O-CB 3.34Å; I605-L609 WeakPolarHBondContact O-CG 3.42Å; I605-L609 PolarHBondContact O-N 3.26Å; I605-L609 VanDerWaalsContact O-N 3.15Å; I605-I642 HydrophobicContact CG2-CG2 3.87Å; I605-I645 HydrophobicContact CD1-CB 4.38Å; I605-I645 HydrophobicContact CD1-CD1 4.36Å; I605-I645 HydrophobicContact CD1-CG2 3.86Å
606	R	85.7	Confident	80.5	Confident	122 Å²	122	56.5 Å²	56.5	46%	0.46	30%	0.301	S	S	.	.	H	α-helix	trans	-65.5	-41.5	176.4	-57.9	-160.3	176.3	-160.7	-5.4	112.6	R604 A610 Q611 G612 I642	R604-R606 PolarHBondContact O-N 3.33Å; R606-A610 PolarHBondContact O-N 2.82Å; R606-Q611 PolarHBondContact O-N 2.91Å; R606-G612 CarbonylContact C-O 3.58Å; R606-I642 HydrophobicContact CG-CD1 3.74Å; R606-I642 HydrophobicContact CG-CG1 4.44Å
607	E	85	Confident	78.5	Confident	45 Å²	45	61.6 Å²	61.6	21%	0.21	34%	0.337	C	S	.	.	H	α-helix	trans	-74.2	-44.6	177.9	-62.8	177.1	142.1	0	0	110.7	R604 L609 A610 H614 K621	R604-E607 PolarHBondContact O-N 3.12Å; E607-L609 PolarHBondContact O-N 3.21Å; E607-A610 WeakPolarHBondContact O-CA 3.4Å; E607-A610 PolarHBondContact O-N 3.12Å; E607-H614 HydrophobicContact CG-CB 3.77Å; E607-H614 PolarHBondContact OE1-N 2.87Å; E607-K621 IonicContact OE1-NZ 3.82Å; E607-K621 PolarHBondContact OE1-NZ 2.91Å
608	L	87.8	Confident	76.8	Confident	57 Å²	57	70.7 Å²	70.7	30%	0.298	37%	0.366	S	S	.	.	H	α-helix	trans	-66	-23.1	-177.3	-65.2	171	0	0	0	113.5	N573 M599 S602 R604	N573-L608 WeakPolarHBondContact CB-O 3.39Å; N573-L608 PolarHBondContact ND2-O 3.44Å; M599-L608 HydrophobicContact CE-CB 3.92Å; M599-L608 HydrophobicContact CE-CD1 3.62Å; M599-L608 HydrophobicContact CE-CG 4.29Å; S602-L608 WeakPolarHBondContact OG-CD1 3.44Å; R604-L608 HydrophobicContact CB-CD1 4.18Å; R604-L608 HydrophobicContact CB-CG 4.32Å; R604-L608 WeakPolarHBondContact O-CG 3.35Å; R604-L608 PolarHBondContact O-N 3.44Å
609	L	89.3	Confident	75.5	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	2.4	171.4	-62.1	177.5	0	0	0	113.7	N573 R574 V577 I605 E607 Q611 I645	N573-L609 HydrophobicContact CB-CD2 4.06Å; R574-L609 HydrophobicContact CB-CD2 4.49Å; R574-L609 HydrophobicContact CG-CD2 3.84Å; V577-L609 HydrophobicContact CG2-CD1 4.37Å; V577-L609 HydrophobicContact CG2-CD2 3.98Å; I605-L609 HydrophobicContact CD1-CD1 4.36Å; I605-L609 HydrophobicContact CG1-CD1 3.79Å; I605-L609 HydrophobicContact CG1-CG 4.28Å; I605-L609 WeakPolarHBondContact O-CB 3.34Å; I605-L609 WeakPolarHBondContact O-CG 3.42Å; I605-L609 PolarHBondContact O-N 3.26Å; I605-L609 VanDerWaalsContact O-N 3.15Å; E607-L609 PolarHBondContact O-N 3.21Å; L609-Q611 VanDerWaalsContact C-N 3.34Å; L609-Q611 HydrophobicContact CB-CG 3.95Å; L609-Q611 PolarHBondContact O-N 3.43Å; L609-I645 HydrophobicContact CD1-CD1 3.75Å
610	A	85.5	Confident	74.3	Confident	8 Å²	8	81.1 Å²	81.1	7%	0.066	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	50	47.5	-176	0	0	0	0	0	113.9	I570 R606 E607 L632 Q633 M634	I570-A610 HydrophobicContact CD1-CB 3.71Å; I570-A610 HydrophobicContact CG1-CB 4.03Å; I570-A610 HydrophobicContact CG2-CB 3.81Å; R606-A610 PolarHBondContact O-N 2.82Å; E607-A610 WeakPolarHBondContact O-CA 3.4Å; E607-A610 PolarHBondContact O-N 3.12Å; A610-L632 WeakPolarHBondContact CB-O 3.4Å; A610-Q633 WeakPolarHBondContact O-CA 3.34Å; A610-M634 HydrophobicContact CB-CG 4.39Å; A610-M634 PolarHBondContact O-N 3.19Å
611	Q	85.6	Confident	73.3	Confident	19 Å²	19	83.1 Å²	83.1	9%	0.089	41%	0.411	C	S	.	.	S	Bend	trans	-105.7	13.4	177.1	-54.2	-173.4	10.1	0	0	113.2	R606 L609 Y639 I640	R606-Q611 PolarHBondContact O-N 2.91Å; L609-Q611 VanDerWaalsContact C-N 3.34Å; L609-Q611 HydrophobicContact CB-CG 3.95Å; L609-Q611 PolarHBondContact O-N 3.43Å; Q611-Y639 HydrophobicContact CB-CD1 4.07Å; Q611-Y639 HydrophobicContact CB-CD2 4.22Å; Q611-Y639 HydrophobicContact CB-CE1 3.89Å; Q611-Y639 HydrophobicContact CB-CE2 4.09Å; Q611-Y639 HydrophobicContact CB-CG 4.23Å; Q611-Y639 HydrophobicContact CG-CD1 3.65Å; Q611-Y639 HydrophobicContact CG-CD2 4.44Å; Q611-Y639 HydrophobicContact CG-CE1 3.87Å; Q611-Y639 HydrophobicContact CG-CG 3.96Å; Q611-I640 PolarHBondContact NE2-O 3.34Å; Q611-I640 PolarHBondContact OE1-O 2.88Å
612	G	76.6	Confident	73.1	Confident	18 Å²	18	84.7 Å²	84.7	19%	0.186	41%	0.412	C	S	.	.	S	Bend	trans	135.7	160.9	179.1	0	0	0	0	0	113.3	R606	R606-G612 CarbonylContact C-O 3.58Å
613	L	67.1	Low	72.9	Confident	52 Å²	52	87.2 Å²	87.2	27%	0.272	43%	0.426	S	S	.	.			trans	-70.2	138.8	178.1	-61.6	167.6	0	0	0	110.6	T615 E629 Q630	L613-T615 PolarHBondContact O-N 3.46Å; L613-E629 HydrophobicContact CD2-CB 3.88Å; L613-E629 WeakPolarHBondContact CD2-OE2 3.47Å; L613-Q630 HydrophobicContact CD1-CG 4.39Å
614	H	62.2	Low	72.8	Confident	56 Å²	56	88.9 Å²	88.9	26%	0.259	43%	0.43	S	S	.	.			trans	-87.2	109.1	172.3	-159.2	82.7	0	0	0	109.3	N603 E607 Q616	N603-H614 PolarHBondContact O-CE1 3.37Å; E607-H614 HydrophobicContact CG-CB 3.77Å; E607-H614 PolarHBondContact OE1-N 2.87Å; H614-Q616 PolarHBondContact NE2-NE2 3Å; H614-Q616 VanDerWaalsContact NE2-NE2 3.1Å; H614-Q616 PolarHBondContact O-N 3.39Å
615	T	56.8	Low	72.7	Confident	139 Å²	139	85.6 Å²	85.6	85%	0.853	42%	0.421	S	S	*	.			trans	-71.3	28.5	-171.1	-27.6	0	0	0	0	114.7	L613 S617	L613-T615 PolarHBondContact O-N 3.46Å; T615-S617 PolarHBondContact O-N 3.46Å
616	Q	54.9	Low	72.2	Confident	113 Å²	113	88.2 Å²	88.2	53%	0.528	43%	0.433	S	S	.	.			trans	-76	95.3	175.1	-81.9	-165.2	41.4	0	0	110.8	H614 R618	H614-Q616 PolarHBondContact NE2-NE2 3Å; H614-Q616 VanDerWaalsContact NE2-NE2 3.1Å; H614-Q616 PolarHBondContact O-N 3.39Å; Q616-R618 PolarHBondContact O-N 3.38Å
617	S	51.1	Low	71.8	Confident	107 Å²	107	89.2 Å²	89.2	75%	0.748	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	7.6	178.4	-167.5	0	0	0	0	118.2	T615	T615-S617 PolarHBondContact O-N 3.46Å
618	R	54.8	Low	71.5	Confident	216 Å²	216	93.3 Å²	93.3	82%	0.815	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-19.1	179	-66.2	-167	-167.5	-161.8	3.6	113.9	Q616	Q616-R618 PolarHBondContact O-N 3.38Å
619	Y	60.9	Low	71	Confident	191 Å²	191	93.9 Å²	93.9	75%	0.749	46%	0.455	S	S	*	.	S	Bend	trans	-134	105.6	172.6	-64.6	-82.3	0	0	0	107.7	K621	Y619-K621 PolarHBondContact O-N 2.86Å; Y619-K621 VanDerWaalsContact O-N 3.1Å
620	E	58.9	Low	70.5	Confident	186 Å²	186	98.1 Å²	98.1	87%	0.869	48%	0.475	S	S	*	.			trans	-67.3	104.9	166.5	-68	-173.7	156.9	0	0	107.4
621	K	66.5	Low	70.3	Confident	59 Å²	59	100.8 Å²	100.8	26%	0.257	50%	0.497	S	S	.	.			trans	-65.5	149.4	174.7	-63	-172	-171	-176.8	0	108.9	E607 Y619 E626 E629	E607-K621 IonicContact OE1-NZ 3.82Å; E607-K621 PolarHBondContact OE1-NZ 2.91Å; Y619-K621 PolarHBondContact O-N 2.86Å; Y619-K621 VanDerWaalsContact O-N 3.1Å; K621-E626 HydrophobicContact CB-CG 3.87Å; K621-E629 WeakPolarHBondContact CD-OE2 3.46Å; K621-E629 IonicContact NZ-OE1 3.18Å; K621-E629 PolarHBondContact NZ-OE1 3.49Å; K621-E629 IonicContact NZ-OE2 2.7Å; K621-E629 PolarHBondContact NZ-OE2 2.74Å
622	T	77.4	Confident	70.2	Confident	76 Å²	76	102.5 Å²	102.5	47%	0.466	51%	0.506	S	S	.	.			trans	-66.8	146.3	175.2	63	0	0	0	0	110.1	E624 E625 E626	T622-E624 PolarHBondContact O-N 3.1Å; T622-E625 WeakPolarHBondContact CB-OE2 3.4Å; T622-E625 PolarHBondContact N-OE2 2.94Å; T622-E625 WeakPolarHBondContact O-CA 3.05Å; T622-E625 WeakPolarHBondContact O-CB 3.39Å; T622-E625 PolarHBondContact O-N 2.93Å; T622-E625 WeakPolarHBondContact OG1-CG 3.44Å; T622-E625 PolarHBondContact OG1-N 3.12Å; T622-E625 PolarHBondContact OG1-OE2 3.28Å; T622-E626 PolarHBondContact O-N 3.24Å
623	T	76.8	Confident	70.7	Confident	101 Å²	101	103.7 Å²	103.7	62%	0.62	51%	0.507	S	S	*	.	H	α-helix	trans	-62.3	-19	-177.9	57.3	0	0	0	0	113.3	K627	T623-K627 VanDerWaalsContact O-CG 3.27Å; T623-K627 WeakPolarHBondContact O-CG 3.23Å; T623-K627 PolarHBondContact O-N 3.01Å
624	E	76.2	Confident	71.7	Confident	141 Å²	141	102.8 Å²	102.8	66%	0.659	50%	0.502	S	S	*	.	H	α-helix	trans	-79.5	-32.9	171.4	-61.4	-167.9	165.7	0	0	112.9	T622 R628	T622-E624 PolarHBondContact O-N 3.1Å; E624-R628 WeakPolarHBondContact O-CG 3.48Å; E624-R628 PolarHBondContact O-N 3.41Å; E624-R628 VanDerWaalsContact O-N 3.07Å; E624-R628 PolarHBondContact O-NE 3.11Å
625	E	80.4	Confident	73	Confident	75 Å²	75	100.1 Å²	100.1	35%	0.35	49%	0.49	S	S	.	.	H	α-helix	trans	-70	-44.5	171.8	-73.5	165.2	147.2	0	0	111.1	T622 K627 R628 E629	T622-E625 WeakPolarHBondContact CB-OE2 3.4Å; T622-E625 PolarHBondContact N-OE2 2.94Å; T622-E625 WeakPolarHBondContact O-CA 3.05Å; T622-E625 WeakPolarHBondContact O-CB 3.39Å; T622-E625 PolarHBondContact O-N 2.93Å; T622-E625 WeakPolarHBondContact OG1-CG 3.44Å; T622-E625 PolarHBondContact OG1-N 3.12Å; T622-E625 PolarHBondContact OG1-OE2 3.28Å; E625-K627 VanDerWaalsContact C-N 3.28Å; E625-K627 PolarHBondContact O-N 2.9Å; E625-R628 PolarHBondContact O-N 3.46Å; E625-R628 VanDerWaalsContact O-N 3.09Å; E625-E629 WeakPolarHBondContact O-CG 3.36Å; E625-E629 PolarHBondContact O-N 3.16Å
626	E	76.4	Confident	74.5	Confident	71 Å²	71	98.1 Å²	98.1	33%	0.332	47%	0.467	S	S	.	.	H	α-helix	trans	-58.5	-41	175.5	-65.6	-169.7	145.3	0	0	111.7	K621 T622 E629 Q630	K621-E626 HydrophobicContact CB-CG 3.87Å; T622-E626 PolarHBondContact O-N 3.24Å; E626-E629 PolarHBondContact O-N 3.33Å; E626-Q630 VanDerWaalsContact O-CB 3.3Å; E626-Q630 WeakPolarHBondContact O-CB 3.34Å; E626-Q630 WeakPolarHBondContact O-CG 3.48Å; E626-Q630 PolarHBondContact O-N 2.9Å
627	K	77.9	Confident	76.1	Confident	143 Å²	143	95.2 Å²	95.2	62%	0.622	45%	0.454	S	S	*	.	H	α-helix	trans	-65.2	-39.4	174.2	-77.4	176.2	179.5	-173.4	0	113	T623 E625 Q630 A631	T623-K627 VanDerWaalsContact O-CG 3.27Å; T623-K627 WeakPolarHBondContact O-CG 3.23Å; T623-K627 PolarHBondContact O-N 3.01Å; E625-K627 VanDerWaalsContact C-N 3.28Å; E625-K627 PolarHBondContact O-N 2.9Å; K627-Q630 PolarHBondContact O-N 2.86Å; K627-A631 WeakPolarHBondContact O-CB 3.41Å; K627-A631 PolarHBondContact O-N 3.33Å
628	R	78.4	Confident	78	Confident	132 Å²	132	90.4 Å²	90.4	50%	0.498	42%	0.419	S	S	.	.	H	α-helix	trans	-66.2	-42.4	174.7	-79.4	-175.2	-81.7	119.9	-12.3	111.6	E624 E625 A631 L632	E624-R628 WeakPolarHBondContact O-CG 3.48Å; E624-R628 PolarHBondContact O-N 3.41Å; E624-R628 VanDerWaalsContact O-N 3.07Å; E624-R628 PolarHBondContact O-NE 3.11Å; E625-R628 PolarHBondContact O-N 3.46Å; E625-R628 VanDerWaalsContact O-N 3.09Å; R628-A631 PolarHBondContact O-N 3.46Å; R628-L632 VanDerWaalsContact O-CG 3.32Å; R628-L632 WeakPolarHBondContact O-CG 3.41Å; R628-L632 PolarHBondContact O-N 2.88Å
629	E	77.5	Confident	79.7	Confident	69 Å²	69	83.3 Å²	83.3	32%	0.322	39%	0.393	S	S	.	.	H	α-helix	trans	-66.4	-39.2	175.2	-72.4	-175.8	166.6	0	0	111.7	L613 K621 E625 E626 L632 Q633	L613-E629 HydrophobicContact CD2-CB 3.88Å; L613-E629 WeakPolarHBondContact CD2-OE2 3.47Å; K621-E629 WeakPolarHBondContact CD-OE2 3.46Å; K621-E629 IonicContact NZ-OE1 3.18Å; K621-E629 PolarHBondContact NZ-OE1 3.49Å; K621-E629 IonicContact NZ-OE2 2.7Å; K621-E629 PolarHBondContact NZ-OE2 2.74Å; E625-E629 WeakPolarHBondContact O-CG 3.36Å; E625-E629 PolarHBondContact O-N 3.16Å; E626-E629 PolarHBondContact O-N 3.33Å; E629-L632 PolarHBondContact O-N 3.4Å; E629-Q633 WeakPolarHBondContact O-CG 3.34Å; E629-Q633 PolarHBondContact O-N 2.87Å
630	Q	79.1	Confident	81.2	Confident	88 Å²	88	74.8 Å²	74.8	41%	0.411	36%	0.36	S	S	.	.	H	α-helix	trans	-60.8	-46.1	172.9	-76.5	166.6	17.5	0	0	112	L613 E626 K627 L632 Q633	L613-Q630 HydrophobicContact CD1-CG 4.39Å; E626-Q630 VanDerWaalsContact O-CB 3.3Å; E626-Q630 WeakPolarHBondContact O-CB 3.34Å; E626-Q630 WeakPolarHBondContact O-CG 3.48Å; E626-Q630 PolarHBondContact O-N 2.9Å; K627-Q630 PolarHBondContact O-N 2.86Å; Q630-L632 PolarHBondContact O-N 3.35Å; Q630-Q633 WeakPolarHBondContact O-CB 3.35Å; Q630-Q633 PolarHBondContact O-N 3.18Å
631	A	80	Confident	82.7	Confident	65 Å²	65	68.9 Å²	68.9	54%	0.537	34%	0.335	S	S	.	.	H	α-helix	trans	-63	-21.6	175.9	0	0	0	0	0	113.7	Q431 K627 R628	Q431-A631 PolarHBondContact NE2-O 2.88Å; K627-A631 WeakPolarHBondContact O-CB 3.41Å; K627-A631 PolarHBondContact O-N 3.33Å; R628-A631 PolarHBondContact O-N 3.46Å
632	L	84.8	Confident	83.9	Confident	54 Å²	54	67.1 Å²	67.1	28%	0.283	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-3.5	175.4	-69.4	168.9	0	0	0	113.7	Q566 I570 A610 R628 E629 Q630	Q566-L632 HydrophobicContact CB-CD1 4.16Å; Q566-L632 VanDerWaalsContact OE1-CD1 3.31Å; I570-L632 HydrophobicContact CD1-CB 4.22Å; A610-L632 WeakPolarHBondContact CB-O 3.4Å; R628-L632 VanDerWaalsContact O-CG 3.32Å; R628-L632 WeakPolarHBondContact O-CG 3.41Å; R628-L632 PolarHBondContact O-N 2.88Å; E629-L632 PolarHBondContact O-N 3.4Å; Q630-L632 PolarHBondContact O-N 3.35Å
633	Q	85.9	Confident	84.5	Confident	43 Å²	43	66.9 Å²	66.9	20%	0.201	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-65.2	138.9	178.6	-70.9	177.2	19.3	0	0	111	Q431 A610 E629 Q630	Q431-Q633 WeakPolarHBondContact CG-O 3.49Å; Q431-Q633 PolarHBondContact NE2-O 3.5Å; A610-Q633 WeakPolarHBondContact O-CA 3.34Å; E629-Q633 WeakPolarHBondContact O-CG 3.34Å; E629-Q633 PolarHBondContact O-N 2.87Å; Q630-Q633 WeakPolarHBondContact O-CB 3.35Å; Q630-Q633 PolarHBondContact O-N 3.18Å
634	M	88.4	Confident	85.2	Confident	33 Å²	33	62.5 Å²	62.5	16%	0.163	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-72.7	152.7	172.3	-57.9	-55.7	-56.2	0	0	109.8	F427 I570 A610 M638 Y639	F427-M634 HydrophobicContact CE1-CE 4.22Å; I570-M634 HydrophobicContact CG2-CG 4.28Å; I570-M634 HydrophobicContact CG2-SD 4.18Å; A610-M634 HydrophobicContact CB-CG 4.39Å; A610-M634 PolarHBondContact O-N 3.19Å; M634-M638 HydrophobicContact CB-CB 4.35Å; M634-M638 HydrophobicContact CE-CE 3.5Å; M634-M638 VanDerWaalsContact CE-CE 3.5Å; M634-M638 HydrophobicContact CE-SD 3.49Å; M634-M638 WeakPolarHBondContact CE-SD 3.48Å; M634-Y639 HydrophobicContact CB-CD1 4.36Å; M634-Y639 HydrophobicContact CB-CE1 4.06Å; M634-Y639 WeakPolarHBondContact O-CE1 3.34Å; M634-Y639 PolarHBondContact O-OH 3.43Å
635	P	89.3	Confident	86	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.006	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-61.5	147.9	167.3	-26.7	36.7	0	0	0	112.6	F427 L430 Y440 H637 M638 Y639	F427-P635 HydrophobicContact CD1-CG 3.52Å; F427-P635 HydrophobicContact CE1-CG 3.8Å; L430-P635 HydrophobicContact CB-CB 3.93Å; L430-P635 HydrophobicContact CB-CG 4.11Å; Y440-P635 WeakPolarHBondContact OH-CB 3.3Å; P635-H637 VanDerWaalsContact C-N 3.32Å; P635-H637 PolarHBondContact O-N 3.33Å; P635-M638 HydrophobicContact CG-SD 4.35Å; P635-M638 WeakPolarHBondContact O-CA 3.18Å; P635-M638 WeakPolarHBondContact O-CB 3.5Å; P635-M638 PolarHBondContact O-N 2.91Å; P635-Y639 WeakPolarHBondContact O-CD1 3.38Å
636	Y	88.6	Confident	86.5	Confident	97 Å²	97	55.2 Å²	55.2	38%	0.38	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-53	-39.2	-177.3	-175.6	-102.8	0	0	0	114.8	G435 H436 Y440 M638 Y639	G435-Y636 WeakPolarHBondContact O-CE1 3.41Å; H436-Y636 AromaticContact CE1-CZ 3.95Å; H436-Y636 PolarHBondContact CE1-OH 3.08Å; Y440-Y636 PolarHBondContact OH-N 3.09Å; Y440-Y636 VanDerWaalsContact OH-N 3.1Å; Y636-M638 PolarHBondContact O-N 2.88Å; Y636-M638 VanDerWaalsContact O-N 3.12Å; Y636-Y639 AromaticContact CD2-CD2 3.53Å; Y636-Y639 HydrophobicContact CD2-CD2 3.53Å; Y636-Y639 AromaticContact CD2-CE2 3.76Å; Y636-Y639 HydrophobicContact CD2-CE2 3.76Å; Y636-Y639 HydrophobicContact CD2-CG 4.4Å; Y636-Y639 HydrophobicContact CE2-CD2 4.08Å; Y636-Y639 HydrophobicContact CG-CD2 4.34Å; Y636-Y639 VanDerWaalsContact O-CB 3.3Å; Y636-Y639 WeakPolarHBondContact O-CB 3.41Å; Y636-Y639 PolarHBondContact O-N 3.16Å
637	H	89.2	Confident	87.2	Confident	51 Å²	51	51.9 Å²	51.9	24%	0.236	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-65.7	-14	177.5	69.3	-90.3	0	0	0	114.1	Y440 L444 Y484 P635	Y440-H637 HydrophobicContact CE1-CB 4.12Å; Y440-H637 AromaticContact CZ-ND1 3.85Å; Y440-H637 PolarHBondContact OH-N 3.45Å; Y440-H637 PolarHBondContact OH-ND1 2.97Å; L444-H637 HydrophobicContact CD1-CB 4.43Å; L444-H637 HydrophobicContact CD2-CB 4.25Å; Y484-H637 AromaticContact CE2-CD2 3.6Å; Y484-H637 AromaticContact CE2-NE2 3.91Å; Y484-H637 AromaticContact CZ-CD2 3.9Å; Y484-H637 AromaticContact CZ-NE2 3.69Å; Y484-H637 PolarHBondContact OH-NE2 3.37Å; P635-H637 VanDerWaalsContact C-N 3.32Å; P635-H637 PolarHBondContact O-N 3.33Å
638	M	90.4	Very high	87.9	Confident	6 Å²	6	45 Å²	45	3%	0.03	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-95	1.7	173.8	-55.5	-175.5	73	0	0	112.3	F427 Y483 Y484 R574 M634 P635 Y636	F427-M638 HydrophobicContact CE1-SD 3.77Å; F427-M638 HydrophobicContact CZ-SD 4.15Å; Y483-M638 HydrophobicContact CE1-CE 4Å; Y483-M638 WeakPolarHBondContact OH-CE 3.37Å; Y484-M638 HydrophobicContact CD1-CE 3.65Å; Y484-M638 HydrophobicContact CD2-CG 4.5Å; Y484-M638 HydrophobicContact CE1-CE 3.91Å; Y484-M638 HydrophobicContact CE1-SD 4.36Å; Y484-M638 HydrophobicContact CE2-CG 4.42Å; Y484-M638 HydrophobicContact CG-CE 4.2Å; R574-M638 VanDerWaalsContact CZ-O 3.23Å; R574-M638 PolarHBondContact NH1-O 2.66Å; R574-M638 PolarHBondContact NH2-O 2.92Å; M634-M638 HydrophobicContact CB-CB 4.35Å; M634-M638 HydrophobicContact CE-CE 3.5Å; M634-M638 VanDerWaalsContact CE-CE 3.5Å; M634-M638 HydrophobicContact CE-SD 3.49Å; M634-M638 WeakPolarHBondContact CE-SD 3.48Å; P635-M638 HydrophobicContact CG-SD 4.35Å; P635-M638 WeakPolarHBondContact O-CA 3.18Å; P635-M638 WeakPolarHBondContact O-CB 3.5Å; P635-M638 PolarHBondContact O-N 2.91Å; Y636-M638 PolarHBondContact O-N 2.88Å; Y636-M638 VanDerWaalsContact O-N 3.12Å
639	Y	91.5	Very high	88.6	Confident	68 Å²	68	39 Å²	39	27%	0.267	19%	0.194	S	C	.	.	P	Polyproline II helix	trans	-71.6	134.6	-179.9	-71.2	-0.4	0	0	0	111.7	Q611 M634 P635 Y636	Q611-Y639 HydrophobicContact CB-CD1 4.07Å; Q611-Y639 HydrophobicContact CB-CD2 4.22Å; Q611-Y639 HydrophobicContact CB-CE1 3.89Å; Q611-Y639 HydrophobicContact CB-CE2 4.09Å; Q611-Y639 HydrophobicContact CB-CG 4.23Å; Q611-Y639 HydrophobicContact CG-CD1 3.65Å; Q611-Y639 HydrophobicContact CG-CD2 4.44Å; Q611-Y639 HydrophobicContact CG-CE1 3.87Å; Q611-Y639 HydrophobicContact CG-CG 3.96Å; M634-Y639 HydrophobicContact CB-CD1 4.36Å; M634-Y639 HydrophobicContact CB-CE1 4.06Å; M634-Y639 WeakPolarHBondContact O-CE1 3.34Å; M634-Y639 PolarHBondContact O-OH 3.43Å; P635-Y639 WeakPolarHBondContact O-CD1 3.38Å; Y636-Y639 AromaticContact CD2-CD2 3.53Å; Y636-Y639 HydrophobicContact CD2-CD2 3.53Å; Y636-Y639 AromaticContact CD2-CE2 3.76Å; Y636-Y639 HydrophobicContact CD2-CE2 3.76Å; Y636-Y639 HydrophobicContact CD2-CG 4.4Å; Y636-Y639 HydrophobicContact CE2-CD2 4.08Å; Y636-Y639 HydrophobicContact CG-CD2 4.34Å; Y636-Y639 VanDerWaalsContact O-CB 3.3Å; Y636-Y639 WeakPolarHBondContact O-CB 3.41Å; Y636-Y639 PolarHBondContact O-N 3.16Å
640	I	91.5	Very high	89.4	Confident	12 Å²	12	36 Å²	36	6%	0.062	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-96.2	117.7	168.5	-51.4	174.2	0	0	0	105.7	Y537 V577 L581 Q611 I642 I645	Y537-I640 HydrophobicContact CE2-CD1 4.19Å; V577-I640 HydrophobicContact CG1-CD1 4.09Å; V577-I640 HydrophobicContact CG1-CG2 4.27Å; L581-I640 HydrophobicContact CD1-CG2 3.81Å; Q611-I640 PolarHBondContact NE2-O 3.34Å; Q611-I640 PolarHBondContact OE1-O 2.88Å; I640-I642 PolarHBondContact O-N 3.48Å; I640-I642 VanDerWaalsContact O-N 3.16Å; I640-I645 HydrophobicContact CB-CD1 4.13Å; I640-I645 HydrophobicContact CG2-CD1 3.75Å; I640-I645 HydrophobicContact CG2-CG1 3.92Å
641	N	90.5	Very high	90	Very high	61 Å²	61	31.8 Å²	31.8	33%	0.326	16%	0.161	S	C	.	.	P	Polyproline II helix	trans	-54	120.2	-174.5	-178.5	1	0	0	0	111.5	D643 L644 I645 L731	N641-D643 VanDerWaalsContact C-N 3.32Å; N641-D643 PolarHBondContact O-N 3.44Å; N641-D643 PolarHBondContact OD1-N 3.41Å; N641-L644 HydrophobicContact CB-CB 4.04Å; N641-L644 WeakPolarHBondContact O-CB 3.36Å; N641-L644 PolarHBondContact O-N 3.03Å; N641-I645 WeakPolarHBondContact O-CG1 3.39Å; N641-I645 PolarHBondContact O-N 2.98Å; N641-L731 HydrophobicContact CB-CD1 4.23Å; N641-L731 WeakPolarHBondContact ND2-CD1 3.28Å
642	I	91.3	Very high	90.7	Very high	23 Å²	23	28.7 Å²	28.7	12%	0.118	14%	0.135	C	C	.	.	H	α-helix	trans	-63.6	-37.7	-177.7	-61.8	138.7	0	0	0	111.3	I605 R606 I640 L644 I645 E646	I605-I642 HydrophobicContact CG2-CG2 3.87Å; R606-I642 HydrophobicContact CG-CD1 3.74Å; R606-I642 HydrophobicContact CG-CG1 4.44Å; I640-I642 PolarHBondContact O-N 3.48Å; I640-I642 VanDerWaalsContact O-N 3.16Å; I642-L644 VanDerWaalsContact C-N 3.27Å; I642-L644 PolarHBondContact O-N 3.3Å; I642-I645 PolarHBondContact O-N 2.96Å; I642-I645 VanDerWaalsContact O-N 3.13Å; I642-E646 PolarHBondContact O-N 2.84Å
643	D	90.3	Very high	91.1	Very high	70 Å²	70	26.1 Å²	26.1	37%	0.374	12%	0.122	S	C	.	.	H	α-helix	trans	-65.4	-32.8	179.1	-66.3	0.7	0	0	0	111.6	N641 C647	N641-D643 VanDerWaalsContact C-N 3.32Å; N641-D643 PolarHBondContact O-N 3.44Å; N641-D643 PolarHBondContact OD1-N 3.41Å; D643-C647 WeakPolarHBondContact O-CB 3.3Å; D643-C647 PolarHBondContact O-N 2.9Å
644	L	91.7	Very high	91.4	Very high	10 Å²	10	24.1 Å²	24.1	5%	0.052	11%	0.113	C	C	.	.	H	α-helix	trans	-67.3	-44.9	172.7	167	64.9	0	0	0	110.7	L581 N641 I642 C647 V648 I728 L731 L732	L581-L644 HydrophobicContact CD2-CG 4.37Å; N641-L644 HydrophobicContact CB-CB 4.04Å; N641-L644 WeakPolarHBondContact O-CB 3.36Å; N641-L644 PolarHBondContact O-N 3.03Å; I642-L644 VanDerWaalsContact C-N 3.27Å; I642-L644 PolarHBondContact O-N 3.3Å; L644-C647 PolarHBondContact O-N 2.7Å; L644-V648 HydrophobicContact CD1-CG2 3.94Å; L644-V648 WeakPolarHBondContact O-CB 3.48Å; L644-V648 VanDerWaalsContact O-CG2 3.31Å; L644-V648 WeakPolarHBondContact O-CG2 3.33Å; L644-V648 PolarHBondContact O-N 3.43Å; L644-I728 HydrophobicContact CD1-CG2 3.6Å; L644-L731 HydrophobicContact CD2-CB 4.44Å; L644-L732 HydrophobicContact CD1-CD1 4.22Å; L644-L732 HydrophobicContact CD1-CD2 3.99Å; L644-L732 HydrophobicContact CD1-CG 4.01Å; L644-L732 HydrophobicContact CD2-CD2 4.02Å
645	I	92.6	Very high	91.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-65.7	-46.5	179.4	-55.4	160.4	0	0	0	110.6	V577 L596 I600 I605 L609 I640 N641 I642 V648 Y649	V577-I645 HydrophobicContact CG1-CD1 3.59Å; V577-I645 HydrophobicContact CG1-CG1 3.75Å; V577-I645 HydrophobicContact CG1-CG2 4.19Å; L596-I645 HydrophobicContact CD1-CG2 4.36Å; L596-I645 HydrophobicContact CD2-CG2 3.88Å; I600-I645 HydrophobicContact CD1-CG2 4.2Å; I605-I645 HydrophobicContact CD1-CB 4.38Å; I605-I645 HydrophobicContact CD1-CD1 4.36Å; I605-I645 HydrophobicContact CD1-CG2 3.86Å; L609-I645 HydrophobicContact CD1-CD1 3.75Å; I640-I645 HydrophobicContact CB-CD1 4.13Å; I640-I645 HydrophobicContact CG2-CD1 3.75Å; I640-I645 HydrophobicContact CG2-CG1 3.92Å; N641-I645 WeakPolarHBondContact O-CG1 3.39Å; N641-I645 PolarHBondContact O-N 2.98Å; I642-I645 PolarHBondContact O-N 2.96Å; I642-I645 VanDerWaalsContact O-N 3.13Å; I645-V648 PolarHBondContact O-N 3.26Å; I645-Y649 WeakPolarHBondContact O-CB 3.46Å; I645-Y649 PolarHBondContact O-N 3.05Å
646	E	90.7	Very high	91.8	Very high	62 Å²	62	24 Å²	24	29%	0.29	11%	0.112	S	C	.	.	H	α-helix	trans	-61.5	-45.5	176.2	-173	177.5	167.6	0	0	110.8	I642 Y649 L650 R697	I642-E646 PolarHBondContact O-N 2.84Å; E646-Y649 PolarHBondContact O-N 3.39Å; E646-L650 HydrophobicContact CG-CD1 3.85Å; E646-L650 HydrophobicContact CG-CG 4.17Å; E646-L650 WeakPolarHBondContact O-CB 3.19Å; E646-L650 VanDerWaalsContact O-CG 3.26Å; E646-L650 WeakPolarHBondContact O-CG 3.22Å; E646-L650 PolarHBondContact O-N 2.87Å; E646-R697 IonicContact OE1-NH1 2.87Å
647	C	91.8	Very high	91.8	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.007	10%	0.095	C	C	.	.	H	α-helix	trans	-64.5	-43.8	178	-172.8	0	0	0	0	112.8	D643 L644 Y649 L650 V651 M724 I728	D643-C647 WeakPolarHBondContact O-CB 3.3Å; D643-C647 PolarHBondContact O-N 2.9Å; L644-C647 PolarHBondContact O-N 2.7Å; C647-Y649 VanDerWaalsContact C-N 3.29Å; C647-Y649 PolarHBondContact O-N 3.18Å; C647-L650 PolarHBondContact O-N 3.38Å; C647-V651 WeakPolarHBondContact O-CB 3.36Å; C647-V651 VanDerWaalsContact O-CG2 3.29Å; C647-V651 WeakPolarHBondContact O-CG2 3.13Å; C647-V651 PolarHBondContact O-N 2.88Å; C647-M724 VanDerWaalsContact SG-CE 3.57Å; C647-I728 HydrophobicContact CB-CD1 3.56Å; C647-I728 HydrophobicContact CB-CG1 4.45Å; C647-I728 HydrophobicContact CB-CG2 4.4Å
648	V	92.8	Very high	91.8	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-60.7	-41.4	177.6	163.6	0	0	0	0	110.9	L581 F584 L596 L644 I645 S652	L581-V648 HydrophobicContact CD2-CB 4.16Å; L581-V648 HydrophobicContact CD2-CG1 4.13Å; L581-V648 HydrophobicContact CD2-CG2 3.93Å; F584-V648 HydrophobicContact CB-CG1 3.75Å; F584-V648 HydrophobicContact CD1-CG1 4.11Å; F584-V648 HydrophobicContact CD1-CG2 4.05Å; F584-V648 HydrophobicContact CD2-CG1 3.66Å; F584-V648 HydrophobicContact CE1-CG2 4.19Å; F584-V648 HydrophobicContact CE2-CG1 4.26Å; F584-V648 HydrophobicContact CG-CG1 3.55Å; F584-V648 HydrophobicContact CG-CG2 4.35Å; L596-V648 HydrophobicContact CD1-CG1 3.91Å; L644-V648 HydrophobicContact CD1-CG2 3.94Å; L644-V648 WeakPolarHBondContact O-CB 3.48Å; L644-V648 VanDerWaalsContact O-CG2 3.31Å; L644-V648 WeakPolarHBondContact O-CG2 3.33Å; L644-V648 PolarHBondContact O-N 3.43Å; I645-V648 PolarHBondContact O-N 3.26Å; V648-S652 VanDerWaalsContact O-CB 3.3Å; V648-S652 WeakPolarHBondContact O-CB 3.37Å; V648-S652 PolarHBondContact O-N 2.82Å; V648-S652 PolarHBondContact O-OG 2.87Å
649	Y	93.8	Very high	91.7	Very high	4 Å²	4	17.2 Å²	17.2	2%	0.016	9%	0.085	C	C	.	.	H	α-helix	trans	-65.5	-47.7	174.1	173.1	-101.3	0	0	0	112.9	H593 L596 A597 I600 I645 E646 C647 V651 S652 A653 S674 P676	H593-Y649 AromaticContact CE1-CE2 3.27Å; H593-Y649 WeakPolarHBondContact CE1-CE2 3.26Å; H593-Y649 AromaticContact CE1-CZ 3.68Å; H593-Y649 AromaticContact ND1-CD2 3.77Å; H593-Y649 AromaticContact ND1-CE2 3.45Å; H593-Y649 WeakPolarHBondContact ND1-CE2 3.21Å; L596-Y649 HydrophobicContact CB-CD2 3.94Å; A597-Y649 HydrophobicContact CB-CE2 4.09Å; I600-Y649 HydrophobicContact CB-CD1 4.3Å; I600-Y649 HydrophobicContact CB-CE1 4.41Å; I600-Y649 HydrophobicContact CD1-CD1 3.65Å; I600-Y649 HydrophobicContact CD1-CD2 4.03Å; I600-Y649 HydrophobicContact CD1-CG 3.33Å; I600-Y649 HydrophobicContact CG2-CD1 3.9Å; I600-Y649 HydrophobicContact CG2-CE1 3.93Å; I645-Y649 WeakPolarHBondContact O-CB 3.46Å; I645-Y649 PolarHBondContact O-N 3.05Å; E646-Y649 PolarHBondContact O-N 3.39Å; C647-Y649 VanDerWaalsContact C-N 3.29Å; C647-Y649 PolarHBondContact O-N 3.18Å; Y649-V651 PolarHBondContact O-N 3.42Å; Y649-S652 PolarHBondContact O-N 3.21Å; Y649-A653 WeakPolarHBondContact O-CB 3.44Å; Y649-A653 PolarHBondContact O-N 3.18Å; Y649-S674 PolarHBondContact OH-OG 2.95Å; Y649-P676 HydrophobicContact CE1-CB 4.31Å
650	L	93	Very high	91.4	Very high	6 Å²	6	16 Å²	16	3%	0.031	8%	0.083	C	C	.	.	H	α-helix	trans	-64	-38.8	-180	-70.1	175.5	0	0	0	111.7	E646 C647 A653 M654 F677 R697 V700	E646-L650 HydrophobicContact CG-CD1 3.85Å; E646-L650 HydrophobicContact CG-CG 4.17Å; E646-L650 WeakPolarHBondContact O-CB 3.19Å; E646-L650 VanDerWaalsContact O-CG 3.26Å; E646-L650 WeakPolarHBondContact O-CG 3.22Å; E646-L650 PolarHBondContact O-N 2.87Å; C647-L650 PolarHBondContact O-N 3.38Å; L650-A653 PolarHBondContact O-N 3.46Å; L650-M654 WeakPolarHBondContact O-CB 3.48Å; L650-M654 PolarHBondContact O-N 3.36Å; L650-F677 HydrophobicContact CD2-CB 4.34Å; L650-F677 HydrophobicContact CD2-CD2 3.94Å; L650-R697 HydrophobicContact CD1-CB 4.02Å; L650-R697 HydrophobicContact CD1-CG 3.94Å; L650-V700 HydrophobicContact CB-CB 4.4Å; L650-V700 HydrophobicContact CB-CG1 3.94Å
651	V	93.1	Very high	91.2	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-66.3	-41.1	173.4	171.1	0	0	0	0	110.9	F584 C647 Y649 M654 L655 V700 W729 L742	F584-V651 HydrophobicContact CE2-CG1 4.1Å; F584-V651 HydrophobicContact CZ-CG1 4.15Å; C647-V651 WeakPolarHBondContact O-CB 3.36Å; C647-V651 VanDerWaalsContact O-CG2 3.29Å; C647-V651 WeakPolarHBondContact O-CG2 3.13Å; C647-V651 PolarHBondContact O-N 2.88Å; Y649-V651 PolarHBondContact O-N 3.42Å; V651-M654 WeakPolarHBondContact O-CB 3.37Å; V651-M654 PolarHBondContact O-N 3.45Å; V651-L655 HydrophobicContact CG1-CD1 4.25Å; V651-L655 WeakPolarHBondContact O-CG 3.49Å; V651-L655 PolarHBondContact O-N 3.3Å; V651-V700 HydrophobicContact CG2-CG1 4.25Å; V651-V700 HydrophobicContact CG2-CG2 3.64Å; V651-W729 HydrophobicContact CG2-CH2 4.45Å; V651-L742 HydrophobicContact CG1-CD1 3.66Å; V651-L742 HydrophobicContact CG1-CD2 4.33Å
652	S	93.5	Very high	90.8	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.1	-40.7	176.6	-57.2	0	0	0	0	111.9	F584 V648 Y649 L656	F584-S652 WeakPolarHBondContact CD2-OG 3.24Å; V648-S652 VanDerWaalsContact O-CB 3.3Å; V648-S652 WeakPolarHBondContact O-CB 3.37Å; V648-S652 PolarHBondContact O-N 2.82Å; V648-S652 PolarHBondContact O-OG 2.87Å; Y649-S652 PolarHBondContact O-N 3.21Å; S652-L656 VanDerWaalsContact O-CG 3.3Å; S652-L656 WeakPolarHBondContact O-CG 3.49Å; S652-L656 PolarHBondContact O-N 2.98Å
653	A	93.2	Very high	90.4	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.008	9%	0.085	C	C	.	.	H	α-helix	trans	-64.8	-43.3	173.1	0	0	0	0	0	111.4	Y649 L650 L655 L656 E657 F677	Y649-A653 WeakPolarHBondContact O-CB 3.44Å; Y649-A653 PolarHBondContact O-N 3.18Å; L650-A653 PolarHBondContact O-N 3.46Å; A653-L655 PolarHBondContact O-N 3.27Å; A653-L656 PolarHBondContact O-N 3.29Å; A653-E657 WeakPolarHBondContact O-CB 3.23Å; A653-E657 PolarHBondContact O-N 3.45Å; A653-F677 HydrophobicContact CB-CB 3.76Å; A653-F677 HydrophobicContact CB-CD1 4.44Å; A653-F677 HydrophobicContact CB-CD2 4.05Å; A653-F677 HydrophobicContact CB-CG 3.83Å
654	M	93.2	Very high	89.8	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-56.1	-47.4	177	-175.2	-160.1	71.8	0	0	111.9	L650 V651 L656 I658 F677 V700 A703 A704 M707 I719	L650-M654 WeakPolarHBondContact O-CB 3.48Å; L650-M654 PolarHBondContact O-N 3.36Å; V651-M654 WeakPolarHBondContact O-CB 3.37Å; V651-M654 PolarHBondContact O-N 3.45Å; M654-L656 VanDerWaalsContact C-N 3.3Å; M654-L656 PolarHBondContact O-N 3.45Å; M654-I658 HydrophobicContact CB-CD1 4.45Å; M654-I658 HydrophobicContact CG-CD1 3.37Å; M654-I658 HydrophobicContact CG-CG1 4.35Å; M654-I658 WeakPolarHBondContact O-CB 3.36Å; M654-I658 VanDerWaalsContact O-CG1 3.3Å; M654-I658 WeakPolarHBondContact O-CG1 3.34Å; M654-I658 PolarHBondContact O-N 3.17Å; M654-F677 HydrophobicContact CB-CE2 3.86Å; M654-F677 HydrophobicContact CB-CZ 3.93Å; M654-F677 HydrophobicContact CG-CE2 4.42Å; M654-F677 HydrophobicContact CG-CZ 4.2Å; M654-V700 HydrophobicContact CB-CG1 4.14Å; M654-V700 HydrophobicContact CG-CG1 4.43Å; M654-V700 HydrophobicContact SD-CG1 4.09Å; M654-A703 HydrophobicContact SD-CB 3.93Å; M654-A704 HydrophobicContact CG-CB 4.04Å; M654-A704 HydrophobicContact SD-CB 4.49Å; M654-M707 HydrophobicContact CE-SD 3.83Å; M654-M707 HydrophobicContact CG-SD 4.36Å; M654-M707 HydrophobicContact SD-SD 4.41Å; M654-I719 HydrophobicContact CE-CD1 3.61Å; M654-I719 HydrophobicContact SD-CD1 4.02Å
655	L	93.1	Very high	88.8	Confident	2 Å²	2	22.1 Å²	22.1	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-68.5	-25.2	-179	-69.1	172.6	0	0	0	113.6	I589 V651 A653 P659 M707 L742 K745 I746 E749	I589-L655 HydrophobicContact CD1-CD1 3.68Å; I589-L655 HydrophobicContact CG1-CD1 4.33Å; I589-L655 HydrophobicContact CG2-CB 4.35Å; I589-L655 HydrophobicContact CG2-CD1 4.43Å; V651-L655 HydrophobicContact CG1-CD1 4.25Å; V651-L655 WeakPolarHBondContact O-CG 3.49Å; V651-L655 PolarHBondContact O-N 3.3Å; A653-L655 PolarHBondContact O-N 3.27Å; L655-P659 WeakPolarHBondContact O-CD 3.49Å; L655-P659 WeakPolarHBondContact O-CG 2.76Å; L655-M707 HydrophobicContact CD2-CE 3.98Å; L655-M707 HydrophobicContact CD2-SD 4.22Å; L655-L742 HydrophobicContact CD1-CD1 3.9Å; L655-K745 HydrophobicContact CD1-CB 4.33Å; L655-I746 HydrophobicContact CD2-CG1 4.04Å; L655-E749 HydrophobicContact CD2-CB 4.32Å; L655-E749 HydrophobicContact CD2-CG 4.49Å
656	L	91.9	Very high	87.3	Confident	29 Å²	29	25.9 Å²	25.9	15%	0.152	14%	0.137	C	C	.	.	H	α-helix	trans	-93.2	-41	178.9	-63.3	172.8	0	0	0	112.7	I589 R590 H593 S652 A653 M654 N660 I673	I589-L656 HydrophobicContact CG2-CD1 4.43Å; I589-L656 HydrophobicContact CG2-CG 4.27Å; R590-L656 HydrophobicContact CG-CD1 4.29Å; R590-L656 HydrophobicContact CG-CD2 3.65Å; H593-L656 HydrophobicContact CB-CD1 3.78Å; S652-L656 VanDerWaalsContact O-CG 3.3Å; S652-L656 WeakPolarHBondContact O-CG 3.49Å; S652-L656 PolarHBondContact O-N 2.98Å; A653-L656 PolarHBondContact O-N 3.29Å; M654-L656 VanDerWaalsContact C-N 3.3Å; M654-L656 PolarHBondContact O-N 3.45Å; L656-N660 WeakPolarHBondContact O-CB 3.29Å; L656-I673 HydrophobicContact CB-CD1 4.11Å
657	E	89.5	Confident	86	Confident	3 Å²	3	25.7 Å²	25.7	1%	0.014	14%	0.139	C	C	.	.	H	α-helix	trans	-80.7	-35.7	-171.3	-166.1	80.2	125.9	0	0	112.4	A653 N660 L661 W670 P672 I673 S674 F677	A653-E657 WeakPolarHBondContact O-CB 3.23Å; A653-E657 PolarHBondContact O-N 3.45Å; E657-N660 WeakPolarHBondContact O-CB 3.43Å; E657-N660 PolarHBondContact O-N 3.24Å; E657-N660 PolarHBondContact OE2-ND2 3.47Å; E657-L661 WeakPolarHBondContact O-CB 3.13Å; E657-L661 PolarHBondContact O-N 2.87Å; E657-W670 HydrophobicContact CG-CZ2 4.31Å; E657-P672 WeakPolarHBondContact OE1-CA 3.47Å; E657-P672 VanDerWaalsContact OE1-CB 3.24Å; E657-P672 WeakPolarHBondContact OE1-CB 3.38Å; E657-I673 VanDerWaalsContact CD-N 3.35Å; E657-I673 PolarHBondContact OE1-N 3.1Å; E657-I673 WeakPolarHBondContact OE2-CB 3.42Å; E657-I673 VanDerWaalsContact OE2-CG1 3.27Å; E657-I673 WeakPolarHBondContact OE2-CG1 3.27Å; E657-I673 PolarHBondContact OE2-N 3.47Å; E657-S674 PolarHBondContact OE1-N 3.39Å; E657-F677 HydrophobicContact CB-CD1 4.07Å; E657-F677 HydrophobicContact CB-CE1 4.04Å; E657-F677 HydrophobicContact CG-CD1 4.08Å; E657-F677 HydrophobicContact CG-CE1 4.21Å
658	I	89.3	Confident	84.5	Confident	8 Å²	8	30.8 Å²	30.8	4%	0.041	17%	0.165	C	C	.	.	H	α-helix	trans	-68.7	-46.3	-175.9	-62.8	173	0	0	0	112.9	M654 N660 L661 A662 A704 M707 R708	M654-I658 HydrophobicContact CB-CD1 4.45Å; M654-I658 HydrophobicContact CG-CD1 3.37Å; M654-I658 HydrophobicContact CG-CG1 4.35Å; M654-I658 WeakPolarHBondContact O-CB 3.36Å; M654-I658 VanDerWaalsContact O-CG1 3.3Å; M654-I658 WeakPolarHBondContact O-CG1 3.34Å; M654-I658 PolarHBondContact O-N 3.17Å; I658-N660 PolarHBondContact O-N 2.97Å; I658-L661 PolarHBondContact O-N 3.19Å; I658-A662 VanDerWaalsContact O-CB 3.32Å; I658-A662 WeakPolarHBondContact O-CB 3.2Å; I658-A662 PolarHBondContact O-N 3Å; I658-A704 HydrophobicContact CD1-CB 3.54Å; I658-M707 HydrophobicContact CB-CE 4.49Å; I658-M707 HydrophobicContact CD1-CB 4.04Å; I658-M707 HydrophobicContact CD1-CG 4.22Å; I658-M707 HydrophobicContact CD1-SD 3.96Å; I658-M707 HydrophobicContact CG2-CG 4.16Å; I658-R708 HydrophobicContact CG2-CB 4.26Å
659	P	87.4	Confident	83	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.013	20%	0.195	C	C	.	.	H	α-helix	trans	-61.6	-36.1	174.1	-20.7	32.8	0	0	0	111.7	L655 A663 M707 E749 R752 F756	L655-P659 WeakPolarHBondContact O-CD 3.49Å; L655-P659 WeakPolarHBondContact O-CG 2.76Å; P659-A663 WeakPolarHBondContact O-CB 3.33Å; P659-A663 PolarHBondContact O-N 3.48Å; P659-M707 HydrophobicContact CG-CE 4.27Å; P659-E749 HydrophobicContact CG-CB 3.93Å; P659-E749 HydrophobicContact CG-CG 4.41Å; P659-E749 WeakPolarHBondContact CG-OE2 3.31Å; P659-R752 HydrophobicContact CB-CB 4.39Å; P659-F756 HydrophobicContact CB-CE2 4.3Å; P659-F756 WeakPolarHBondContact O-CD2 3.27Å; P659-F756 WeakPolarHBondContact O-CE2 3.45Å
660	N	86.5	Confident	81.7	Confident	42 Å²	42	41.3 Å²	41.3	23%	0.225	21%	0.205	C	C	.	.	H	α-helix	trans	-67.5	-42.9	177.5	-177	42.1	0	0	0	112.3	L656 E657 I658 A663 H664 W670 I673	L656-N660 WeakPolarHBondContact O-CB 3.29Å; E657-N660 WeakPolarHBondContact O-CB 3.43Å; E657-N660 PolarHBondContact O-N 3.24Å; E657-N660 PolarHBondContact OE2-ND2 3.47Å; I658-N660 PolarHBondContact O-N 2.97Å; N660-A663 PolarHBondContact O-N 3.16Å; N660-H664 PolarHBondContact O-CD2 2.87Å; N660-H664 PolarHBondContact O-N 2.76Å; N660-H664 VanDerWaalsContact O-N 3.17Å; N660-W670 PolarHBondContact ND2-NE1 2.77Å; N660-I673 HydrophobicContact CB-CD1 4.31Å
661	L	85.2	Confident	80.7	Confident	38 Å²	38	51.1 Å²	51.1	20%	0.199	24%	0.241	C	C	.	.	H	α-helix	trans	-67.4	-40.2	175.9	-175	155.5	0	0	0	111.3	E657 I658 H664 E665 W670	E657-L661 WeakPolarHBondContact O-CB 3.13Å; E657-L661 PolarHBondContact O-N 2.87Å; I658-L661 PolarHBondContact O-N 3.19Å; L661-H664 PolarHBondContact O-N 2.95Å; L661-E665 PolarHBondContact O-N 3.44Å; L661-E665 VanDerWaalsContact O-N 3.09Å; L661-W670 HydrophobicContact CB-CZ2 4.42Å; L661-W670 HydrophobicContact CD1-CH2 4.49Å; L661-W670 HydrophobicContact CD1-CZ2 4.37Å
662	A	83.8	Confident	80	Confident	7 Å²	7	53.3 Å²	53.3	6%	0.058	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-39.8	175.5	0	0	0	0	0	112.4	I658 H664 F756 T757	I658-A662 VanDerWaalsContact O-CB 3.32Å; I658-A662 WeakPolarHBondContact O-CB 3.2Å; I658-A662 PolarHBondContact O-N 3Å; A662-H664 VanDerWaalsContact C-N 3.35Å; A662-F756 HydrophobicContact CB-CB 3.88Å; A662-F756 HydrophobicContact CB-CD2 4.32Å; A662-T757 HydrophobicContact CB-CG2 4.06Å
663	A	82.4	Confident	79.5	Confident	36 Å²	36	57.4 Å²	57.4	30%	0.298	28%	0.276	S	S	.	.	H	α-helix	trans	-67.2	-33.3	176.8	0	0	0	0	0	113.2	P659 N660 F756	P659-A663 WeakPolarHBondContact O-CB 3.33Å; P659-A663 PolarHBondContact O-N 3.48Å; N660-A663 PolarHBondContact O-N 3.16Å; A663-F756 HydrophobicContact CB-CD1 3.96Å; A663-F756 HydrophobicContact CB-CD2 3.96Å; A663-F756 HydrophobicContact CB-CE1 3.95Å; A663-F756 HydrophobicContact CB-CE2 3.94Å; A663-F756 HydrophobicContact CB-CG 3.98Å; A663-F756 HydrophobicContact CB-CZ 3.94Å
664	H	76.9	Confident	79	Confident	74 Å²	74	57.4 Å²	57.4	34%	0.343	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	21.4	-172.2	-69.7	-66.2	0	0	0	114.7	N660 L661 A662 T666 D667 W670	N660-H664 PolarHBondContact O-CD2 2.87Å; N660-H664 PolarHBondContact O-N 2.76Å; N660-H664 VanDerWaalsContact O-N 3.17Å; L661-H664 PolarHBondContact O-N 2.95Å; A662-H664 VanDerWaalsContact C-N 3.35Å; H664-T666 PolarHBondContact O-N 3.02Å; H664-D667 HydrophobicContact CB-CB 4.24Å; H664-D667 IonicContact CE1-OD2 2.87Å; H664-D667 IonicContact CG-OD2 2.76Å; H664-D667 IonicContact ND1-OD2 3.96Å; H664-D667 PolarHBondContact ND1-OD2 3.27Å; H664-D667 PolarHBondContact O-N 3.22Å; H664-W670 HydrophobicContact CB-CB 4.09Å; H664-W670 HydrophobicContact CB-CG 4.18Å
665	E	70.6	Confident	78.6	Confident	149 Å²	149	65.5 Å²	65.5	70%	0.696	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-25.4	-179.3	-173	172	-172.8	0	0	113.1	L661	L661-E665 PolarHBondContact O-N 3.44Å; L661-E665 VanDerWaalsContact O-N 3.09Å
666	T	61.1	Low	78.3	Confident	79 Å²	79	67.3 Å²	67.3	49%	0.485	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-4.5	177.6	63.4	0	0	0	0	115.4	H664 Q821	H664-T666 PolarHBondContact O-N 3.02Å; T666-Q821 PolarHBondContact O-NE2 2.86Å
667	D	64.7	Low	78.2	Confident	59 Å²	59	66 Å²	66	32%	0.316	32%	0.317	S	S	.	.			trans	-104.5	112.6	-172.3	-74.1	-28.2	0	0	0	112.5	H664 R669 W670	H664-D667 HydrophobicContact CB-CB 4.24Å; H664-D667 IonicContact CE1-OD2 2.87Å; H664-D667 IonicContact CG-OD2 2.76Å; H664-D667 IonicContact ND1-OD2 3.96Å; H664-D667 PolarHBondContact ND1-OD2 3.27Å; H664-D667 PolarHBondContact O-N 3.22Å; D667-R669 PolarHBondContact O-N 3.45Å; D667-R669 VanDerWaalsContact O-N 3.09Å; D667-W670 WeakPolarHBondContact O-CB 3.45Å; D667-W670 PolarHBondContact O-N 2.95Å; D667-W670 VanDerWaalsContact O-N 3.11Å
668	L	59.5	Low	78	Confident	107 Å²	107	67.8 Å²	67.8	56%	0.56	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.4	175.2	-101.7	75.8	0	0	0	114.2	W670 Q821 K825	L668-W670 VanDerWaalsContact C-N 3.27Å; L668-Q821 VanDerWaalsContact CD1-CD 3.44Å; L668-Q821 HydrophobicContact CD1-CG 3.94Å; L668-K825 VanDerWaalsContact CD2-CE 3.41Å
669	R	60.7	Low	77.9	Confident	168 Å²	168	72.2 Å²	72.2	63%	0.634	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-4.4	176.9	-67.7	-172.9	-176.5	-118.4	5.7	113.3	D667 R671 D824	D667-R669 PolarHBondContact O-N 3.45Å; D667-R669 VanDerWaalsContact O-N 3.09Å; R669-R671 PolarHBondContact O-N 2.81Å; R669-D824 IonicContact CZ-OD1 2.72Å; R669-D824 IonicContact CZ-OD2 3.52Å; R669-D824 VanDerWaalsContact NE-CG 3.31Å; R669-D824 IonicContact NE-OD1 3.16Å; R669-D824 IonicContact NE-OD2 2.68Å; R669-D824 PolarHBondContact NE-OD2 3.48Å; R669-D824 IonicContact NH2-OD1 2.71Å; R669-D824 PolarHBondContact NH2-OD1 2.87Å; R669-D824 IonicContact NH2-OD2 3.54Å
670	W	66.9	Low	77.9	Confident	57 Å²	57	72.3 Å²	72.3	22%	0.216	35%	0.349	C	S	.	.			trans	-55	134.1	178.1	176.9	78.6	0	0	0	111.6	E657 N660 L661 H664 D667 L668 P672 H678	E657-W670 HydrophobicContact CG-CZ2 4.31Å; N660-W670 PolarHBondContact ND2-NE1 2.77Å; L661-W670 HydrophobicContact CB-CZ2 4.42Å; L661-W670 HydrophobicContact CD1-CH2 4.49Å; L661-W670 HydrophobicContact CD1-CZ2 4.37Å; H664-W670 HydrophobicContact CB-CB 4.09Å; H664-W670 HydrophobicContact CB-CG 4.18Å; D667-W670 WeakPolarHBondContact O-CB 3.45Å; D667-W670 PolarHBondContact O-N 2.95Å; D667-W670 VanDerWaalsContact O-N 3.11Å; L668-W670 VanDerWaalsContact C-N 3.27Å; W670-P672 HydrophobicContact CH2-CB 3.61Å; W670-P672 HydrophobicContact CH2-CG 4.36Å; W670-P672 HydrophobicContact CZ2-CB 4.03Å; W670-P672 HydrophobicContact CZ3-CB 4.1Å; W670-P672 HydrophobicContact CZ3-CG 4.37Å; W670-H678 AromaticContact CH2-CD2 3.67Å; W670-H678 AromaticContact CH2-NE2 3.71Å; W670-H678 AromaticContact CZ3-CE1 3.84Å; W670-H678 AromaticContact CZ3-NE2 3.76Å
671	R	72	Confident	77.9	Confident	213 Å²	213	71.3 Å²	71.3	80%	0.804	34%	0.343	S	S	*	.			trans	-118.6	126.7	175.8	-66.6	-179.9	-178.8	-108.2	-1.1	108.2	R669 I673	R669-R671 PolarHBondContact O-N 2.81Å; R671-I673 PolarHBondContact O-N 3.2Å
672	P	79.5	Confident	78.1	Confident	45 Å²	45	75.5 Å²	75.5	29%	0.292	36%	0.357	S	S	.	.			trans	-63.4	132.4	174.6	25.3	-32.6	0	0	0	109.8	E657 W670 S674 H678	E657-P672 WeakPolarHBondContact OE1-CA 3.47Å; E657-P672 VanDerWaalsContact OE1-CB 3.24Å; E657-P672 WeakPolarHBondContact OE1-CB 3.38Å; W670-P672 HydrophobicContact CH2-CB 3.61Å; W670-P672 HydrophobicContact CH2-CG 4.36Å; W670-P672 HydrophobicContact CZ2-CB 4.03Å; W670-P672 HydrophobicContact CZ3-CB 4.1Å; W670-P672 HydrophobicContact CZ3-CG 4.37Å; P672-S674 VanDerWaalsContact C-N 3.31Å; P672-H678 HydrophobicContact CB-CB 4.09Å
673	I	81.3	Confident	78.3	Confident	86 Å²	86	79 Å²	79	44%	0.441	38%	0.377	S	S	.	.	S	Bend	trans	-67	-40.8	171.7	-58.3	167.6	0	0	0	108.6	L656 E657 N660 R671	L656-I673 HydrophobicContact CB-CD1 4.11Å; E657-I673 VanDerWaalsContact CD-N 3.35Å; E657-I673 PolarHBondContact OE1-N 3.1Å; E657-I673 WeakPolarHBondContact OE2-CB 3.42Å; E657-I673 VanDerWaalsContact OE2-CG1 3.27Å; E657-I673 WeakPolarHBondContact OE2-CG1 3.27Å; E657-I673 PolarHBondContact OE2-N 3.47Å; N660-I673 HydrophobicContact CB-CD1 4.31Å; R671-I673 PolarHBondContact O-N 3.2Å
674	S	84.1	Confident	78.6	Confident	2 Å²	2	78.3 Å²	78.3	1%	0.014	37%	0.368	C	S	.	.			trans	-121.2	103.6	-178.5	176.9	0	0	0	0	111.4	Y649 E657 P672 F677 H678	Y649-S674 PolarHBondContact OH-OG 2.95Å; E657-S674 PolarHBondContact OE1-N 3.39Å; P672-S674 VanDerWaalsContact C-N 3.31Å; S674-F677 PolarHBondContact O-N 3.45Å; S674-F677 VanDerWaalsContact OG-CB 3.23Å; S674-F677 WeakPolarHBondContact OG-CB 3.44Å; S674-F677 PolarHBondContact OG-N 3.3Å; S674-F677 VanDerWaalsContact OG-N 3.16Å; S674-H678 WeakPolarHBondContact O-CB 3.3Å; S674-H678 PolarHBondContact O-N 3.25Å
675	K	84.8	Confident	79	Confident	170 Å²	170	78.6 Å²	78.6	74%	0.739	37%	0.372	S	S	*	.	H	α-helix	trans	-56.3	-45.2	171.1	-62.4	178.2	-177.6	174.7	0	112.5	L679	K675-L679 WeakPolarHBondContact O-CB 3.36Å; K675-L679 PolarHBondContact O-N 3.34Å
676	P	86.6	Confident	79.9	Confident	40 Å²	40	79.4 Å²	79.4	26%	0.26	37%	0.369	S	S	.	.	H	α-helix	trans	-64.2	-44.2	179.8	-22.8	34.6	0	0	0	113.4	Y649 L679 A680	Y649-P676 HydrophobicContact CE1-CB 4.31Å; P676-L679 PolarHBondContact O-N 3.15Å; P676-A680 WeakPolarHBondContact O-CB 3.48Å; P676-A680 PolarHBondContact O-N 2.81Å
677	F	89	Confident	81.2	Confident	2 Å²	2	77.9 Å²	77.9	1%	0.009	36%	0.364	C	S	.	.	H	α-helix	trans	-65	-45	178.1	176.1	-96.4	0	0	0	111.6	L650 A653 M654 E657 S674 L679 A680 L681 V700 L701 A704	L650-F677 HydrophobicContact CD2-CB 4.34Å; L650-F677 HydrophobicContact CD2-CD2 3.94Å; A653-F677 HydrophobicContact CB-CB 3.76Å; A653-F677 HydrophobicContact CB-CD1 4.44Å; A653-F677 HydrophobicContact CB-CD2 4.05Å; A653-F677 HydrophobicContact CB-CG 3.83Å; M654-F677 HydrophobicContact CB-CE2 3.86Å; M654-F677 HydrophobicContact CB-CZ 3.93Å; M654-F677 HydrophobicContact CG-CE2 4.42Å; M654-F677 HydrophobicContact CG-CZ 4.2Å; E657-F677 HydrophobicContact CB-CD1 4.07Å; E657-F677 HydrophobicContact CB-CE1 4.04Å; E657-F677 HydrophobicContact CG-CD1 4.08Å; E657-F677 HydrophobicContact CG-CE1 4.21Å; S674-F677 PolarHBondContact O-N 3.45Å; S674-F677 VanDerWaalsContact OG-CB 3.23Å; S674-F677 WeakPolarHBondContact OG-CB 3.44Å; S674-F677 PolarHBondContact OG-N 3.3Å; S674-F677 VanDerWaalsContact OG-N 3.16Å; F677-L679 PolarHBondContact O-N 2.99Å; F677-A680 WeakPolarHBondContact O-CB 3.36Å; F677-A680 PolarHBondContact O-N 3.31Å; F677-L681 HydrophobicContact CE1-CD2 4.49Å; F677-L681 WeakPolarHBondContact O-CB 3.5Å; F677-L681 PolarHBondContact O-N 2.85Å; F677-V700 HydrophobicContact CE2-CG1 4.42Å; F677-L701 HydrophobicContact CE2-CD2 4.29Å; F677-A704 HydrophobicContact CZ-CB 4.05Å
678	H	85.9	Confident	82.2	Confident	40 Å²	40	80.6 Å²	80.6	19%	0.185	40%	0.395	C	S	.	.	H	α-helix	trans	-64.8	-37.6	178.6	-179.4	-121.5	0	0	0	112.6	W670 P672 S674 L681 R682	W670-H678 AromaticContact CH2-CD2 3.67Å; W670-H678 AromaticContact CH2-NE2 3.71Å; W670-H678 AromaticContact CZ3-CE1 3.84Å; W670-H678 AromaticContact CZ3-NE2 3.76Å; P672-H678 HydrophobicContact CB-CB 4.09Å; S674-H678 WeakPolarHBondContact O-CB 3.3Å; S674-H678 PolarHBondContact O-N 3.25Å; H678-L681 PolarHBondContact O-N 3.33Å; H678-R682 PolarHBondContact CE1-NH2 3.19Å; H678-R682 WeakPolarHBondContact O-CB 3.41Å; H678-R682 PolarHBondContact O-N 3.07Å
679	L	86.9	Confident	83.5	Confident	101 Å²	101	83 Å²	83	53%	0.529	41%	0.407	S	S	.	.	H	α-helix	trans	-63.5	-44.8	171.7	-178.9	63.2	0	0	0	111.3	K675 P676 F677 L681 R682 V683	K675-L679 WeakPolarHBondContact O-CB 3.36Å; K675-L679 PolarHBondContact O-N 3.34Å; P676-L679 PolarHBondContact O-N 3.15Å; F677-L679 PolarHBondContact O-N 2.99Å; L679-L681 VanDerWaalsContact C-N 3.34Å; L679-L681 PolarHBondContact O-N 2.67Å; L679-R682 PolarHBondContact O-N 3.14Å; L679-V683 HydrophobicContact CD1-CG2 4.47Å; L679-V683 WeakPolarHBondContact O-CG2 3.3Å; L679-V683 PolarHBondContact O-N 3.02Å
680	A	87.4	Confident	84.6	Confident	3 Å²	3	78.4 Å²	78.4	3%	0.025	40%	0.398	C	S	.	.	H	α-helix	trans	-61.2	-41.3	177.4	0	0	0	0	0	112.3	P676 F677 V683 H684 L701	P676-A680 WeakPolarHBondContact O-CB 3.48Å; P676-A680 PolarHBondContact O-N 2.81Å; F677-A680 WeakPolarHBondContact O-CB 3.36Å; F677-A680 PolarHBondContact O-N 3.31Å; A680-V683 PolarHBondContact O-N 3.35Å; A680-H684 WeakPolarHBondContact O-CB 3.46Å; A680-H684 PolarHBondContact O-N 2.97Å; A680-H684 VanDerWaalsContact O-N 3.08Å; A680-L701 HydrophobicContact CB-CD1 4.19Å; A680-L701 HydrophobicContact CB-CD2 4.19Å
681	L	87.5	Confident	85.5	Confident	21 Å²	21	77.9 Å²	77.9	11%	0.11	41%	0.409	C	S	.	.	H	α-helix	trans	-63.3	-46.3	174.6	-175.1	63.3	0	0	0	111.7	F677 H678 L679 V683 H684 D685 L701	F677-L681 HydrophobicContact CE1-CD2 4.49Å; F677-L681 WeakPolarHBondContact O-CB 3.5Å; F677-L681 PolarHBondContact O-N 2.85Å; H678-L681 PolarHBondContact O-N 3.33Å; L679-L681 VanDerWaalsContact C-N 3.34Å; L679-L681 PolarHBondContact O-N 2.67Å; L681-V683 PolarHBondContact O-N 3.06Å; L681-H684 CarbonylContact O-C 3.52Å; L681-H684 PolarHBondContact O-N 2.92Å; L681-D685 PolarHBondContact O-N 3.4Å; L681-L701 HydrophobicContact CB-CD2 4.26Å; L681-L701 HydrophobicContact CD1-CD2 4.38Å
682	R	87.6	Confident	86.2	Confident	127 Å²	127	73 Å²	73	48%	0.479	41%	0.405	S	S	.	.	H	α-helix	trans	-60.3	-42.3	177	-176	-174	-66.3	173.9	-6.2	112.5	H678 L679 H684 D685 R686	H678-R682 PolarHBondContact CE1-NH2 3.19Å; H678-R682 WeakPolarHBondContact O-CB 3.41Å; H678-R682 PolarHBondContact O-N 3.07Å; L679-R682 PolarHBondContact O-N 3.14Å; R682-H684 VanDerWaalsContact C-N 3.34Å; R682-D685 PolarHBondContact O-N 3.46Å; R682-R686 PolarHBondContact O-N 3.1Å
683	V	89.2	Confident	86.6	Confident	81 Å²	81	71.9 Å²	71.9	49%	0.491	40%	0.398	S	S	.	.	H	α-helix	trans	-63.2	-42.5	176.3	170.5	0	0	0	0	110.8	L679 A680 L681 D685 R686 A687	L679-V683 HydrophobicContact CD1-CG2 4.47Å; L679-V683 WeakPolarHBondContact O-CG2 3.3Å; L679-V683 PolarHBondContact O-N 3.02Å; A680-V683 PolarHBondContact O-N 3.35Å; L681-V683 PolarHBondContact O-N 3.06Å; V683-D685 VanDerWaalsContact C-N 3.3Å; V683-D685 PolarHBondContact O-N 2.7Å; V683-R686 PolarHBondContact O-N 3.18Å; V683-A687 PolarHBondContact O-N 3.15Å
684	H	87.6	Confident	86.8	Confident	20 Å²	20	73.4 Å²	73.4	9%	0.093	40%	0.404	C	S	.	.	H	α-helix	trans	-72.6	-17	176.9	177.5	-111.6	0	0	0	114.2	A680 L681 R682 V690 L701 K705	A680-H684 WeakPolarHBondContact O-CB 3.46Å; A680-H684 PolarHBondContact O-N 2.97Å; A680-H684 VanDerWaalsContact O-N 3.08Å; L681-H684 CarbonylContact O-C 3.52Å; L681-H684 PolarHBondContact O-N 2.92Å; R682-H684 VanDerWaalsContact C-N 3.34Å; H684-V690 VanDerWaalsContact NE2-CG1 3.32Å; H684-V690 WeakPolarHBondContact NE2-CG1 3.45Å; H684-L701 HydrophobicContact CB-CB 4.5Å; H684-L701 HydrophobicContact CB-CD1 3.91Å; H684-K705 VanDerWaalsContact CE1-CE 3.49Å; H684-K705 WeakPolarHBondContact CE1-CE 3.4Å; H684-K705 PolarHBondContact CE1-NZ 2.96Å; H684-K705 VanDerWaalsContact ND1-CE 3.28Å; H684-K705 WeakPolarHBondContact ND1-CE 3.4Å; H684-K705 PolarHBondContact ND1-NZ 3.39Å; H684-K705 PolarHBondContact O-NZ 3.18Å
685	D	86.2	Confident	87	Confident	81 Å²	81	76.3 Å²	76.3	43%	0.433	42%	0.421	S	S	.	.	H	α-helix	trans	-87	-30.3	168.8	-81.7	-15.7	0	0	0	113.2	L681 R682 V683 A687 K705	L681-D685 PolarHBondContact O-N 3.4Å; R682-D685 PolarHBondContact O-N 3.46Å; V683-D685 VanDerWaalsContact C-N 3.3Å; V683-D685 PolarHBondContact O-N 2.7Å; D685-A687 VanDerWaalsContact C-N 3.33Å; D685-K705 WeakPolarHBondContact OD1-CE 3.37Å; D685-K705 IonicContact OD1-NZ 3.33Å; D685-K705 PolarHBondContact OD1-NZ 3.32Å
686	R	89.4	Confident	87.1	Confident	166 Å²	166	69.1 Å²	69.1	63%	0.626	39%	0.392	S	S	*	.	H	α-helix	trans	-75	-19.8	171.9	-76.3	-176.8	167.7	-155.9	-7.9	113.1	D215 R682 V683 A688	D215-R686 IonicContact OD1-NH1 3.92Å; D215-R686 IonicContact OD2-CZ 3.82Å; D215-R686 VanDerWaalsContact OD2-CZ 3.3Å; D215-R686 IonicContact OD2-NH1 2.83Å; D215-R686 PolarHBondContact OD2-NH1 3.4Å; D215-R686 IonicContact OD2-NH2 2.68Å; D215-R686 PolarHBondContact OD2-NH2 3.21Å; R682-R686 PolarHBondContact O-N 3.1Å; V683-R686 PolarHBondContact O-N 3.18Å; R686-A688 PolarHBondContact O-N 3.47Å
687	A	88.2	Confident	87.3	Confident	46 Å²	46	71.8 Å²	71.8	38%	0.38	40%	0.397	S	S	.	.			trans	-65	112.7	-179.5	0	0	0	0	0	112.2	V683 D685 L689 V690	V683-A687 PolarHBondContact O-N 3.15Å; D685-A687 VanDerWaalsContact C-N 3.33Å; A687-L689 PolarHBondContact O-N 3.39Å; A687-V690 HydrophobicContact CB-CG2 4.22Å
688	A	85.9	Confident	87.3	Confident	117 Å²	117	74.3 Å²	74.3	97%	0.967	41%	0.41	S	S	*	.	S	Bend	trans	-62.6	-27.3	-177.4	0	0	0	0	0	114.4	R686	R686-A688 PolarHBondContact O-N 3.47Å
689	L	87.3	Confident	87.6	Confident	158 Å²	158	72.5 Å²	72.5	83%	0.827	40%	0.402	S	S	*	.			trans	-127.2	104.3	173.6	-179.7	64.8	0	0	0	109.5	A687	A687-L689 PolarHBondContact O-N 3.39Å
690	V	84.3	Confident	87.9	Confident	71 Å²	71	67.7 Å²	67.7	43%	0.43	38%	0.377	S	S	.	.			trans	-90.7	106.6	170	177.5	0	0	0	0	108.4	H684 A687	H684-V690 VanDerWaalsContact NE2-CG1 3.32Å; H684-V690 WeakPolarHBondContact NE2-CG1 3.45Å; A687-V690 HydrophobicContact CB-CG2 4.22Å
691	G	86.1	Confident	88.1	Confident	45 Å²	45	67.7 Å²	67.7	46%	0.464	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-73	173.8	172.8	0	0	0	0	0	113
692	P	86.6	Confident	88.3	Confident	110 Å²	110	67.4 Å²	67.4	71%	0.714	38%	0.377	S	S	*	.	S	Bend	trans	-61.2	143	166.7	29	-34.4	0	0	0	109.9
693	P	86.9	Confident	88.5	Confident	23 Å²	23	61.4 Å²	61.4	15%	0.149	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-68.7	137.9	-172	27.7	-35.4	0	0	0	112.5	D698 H699 A702 F718	P693-D698 HydrophobicContact CB-CB 3.83Å; P693-H699 VanDerWaalsContact C-CE1 3.43Å; P693-H699 HydrophobicContact CB-CB 4.35Å; P693-H699 PolarHBondContact O-CE1 3.39Å; P693-H699 PolarHBondContact O-NE2 3.15Å; P693-A702 HydrophobicContact CB-CB 4.46Å; P693-A702 HydrophobicContact CG-CB 4.26Å; P693-F718 HydrophobicContact CG-CD1 3.9Å; P693-F718 HydrophobicContact CG-CE1 4.07Å
694	E	86.1	Confident	88.7	Confident	118 Å²	118	57.7 Å²	57.7	55%	0.551	33%	0.332	S	S	*	.			trans	-127.5	-42.5	-178.1	-63.9	-122.3	110.4	0	0	112.7	K723 K727	E694-K723 IonicContact OE1-NZ 2.79Å; E694-K723 PolarHBondContact OE1-NZ 3.37Å; E694-K727 PolarHBondContact O-NZ 2.96Å
695	T	88.3	Confident	88.8	Confident	63 Å²	63	59.2 Å²	59.2	39%	0.387	34%	0.339	S	S	.	.	S	Bend	trans	-80	154.1	172.3	79.2	0	0	0	0	110	R697 D698 H699	T695-R697 PolarHBondContact O-N 2.96Å; T695-D698 WeakPolarHBondContact CB-OD2 3.43Å; T695-D698 WeakPolarHBondContact CG2-OD2 3.22Å; T695-D698 PolarHBondContact N-OD2 3.39Å; T695-D698 PolarHBondContact O-N 3.31Å; T695-D698 PolarHBondContact OG1-N 2.85Å; T695-D698 VanDerWaalsContact OG1-N 3.1Å; T695-D698 PolarHBondContact OG1-OD2 3.2Å; T695-H699 PolarHBondContact O-N 3.41Å; T695-H699 VanDerWaalsContact O-N 3.15Å; T695-H699 PolarHBondContact O-ND1 2.84Å
696	P	87.3	Confident	89	Confident	19 Å²	19	56 Å²	56	12%	0.123	32%	0.323	C	S	.	.	H	α-helix	trans	-62.9	-33.6	178.1	26	-34.7	0	0	0	112.4	H699 V700 M724 I728	P696-H699 PolarHBondContact O-N 3.23Å; P696-V700 WeakPolarHBondContact O-CG2 3.48Å; P696-V700 PolarHBondContact O-N 3.24Å; P696-V700 VanDerWaalsContact O-N 3.15Å; P696-M724 HydrophobicContact CB-CE 4.01Å; P696-M724 HydrophobicContact CB-SD 3.83Å; P696-I728 HydrophobicContact CB-CD1 3.4Å; P696-I728 VanDerWaalsContact CB-CD1 3.4Å; P696-I728 HydrophobicContact CG-CD1 4.25Å
697	R	89.1	Confident	89.2	Confident	96 Å²	96	48.1 Å²	48.1	36%	0.362	29%	0.293	S	S	.	.	H	α-helix	trans	-59.8	-46.3	172.5	173.9	168.5	165	168	-6.5	112.2	E646 L650 T695 H699 V700 L701	E646-R697 IonicContact OE1-NH1 2.87Å; L650-R697 HydrophobicContact CD1-CB 4.02Å; L650-R697 HydrophobicContact CD1-CG 3.94Å; T695-R697 PolarHBondContact O-N 2.96Å; R697-H699 VanDerWaalsContact C-N 3.32Å; R697-H699 PolarHBondContact O-N 3.44Å; R697-V700 PolarHBondContact O-N 3.37Å; R697-L701 HydrophobicContact CG-CD1 3.91Å; R697-L701 HydrophobicContact CG-CG 4.48Å; R697-L701 VanDerWaalsContact O-CG 3.32Å; R697-L701 WeakPolarHBondContact O-CG 3.39Å; R697-L701 PolarHBondContact O-N 2.91Å
698	D	90.5	Very high	89.2	Confident	54 Å²	54	49.6 Å²	49.6	29%	0.289	29%	0.289	S	S	.	.	H	α-helix	trans	-65.2	-36.1	178.3	-56.3	-40.2	0	0	0	112.2	P693 T695 V700 L701 A702	P693-D698 HydrophobicContact CB-CB 3.83Å; T695-D698 WeakPolarHBondContact CB-OD2 3.43Å; T695-D698 WeakPolarHBondContact CG2-OD2 3.22Å; T695-D698 PolarHBondContact N-OD2 3.39Å; T695-D698 PolarHBondContact O-N 3.31Å; T695-D698 PolarHBondContact OG1-N 2.85Å; T695-D698 VanDerWaalsContact OG1-N 3.1Å; T695-D698 PolarHBondContact OG1-OD2 3.2Å; D698-V700 VanDerWaalsContact C-N 3.34Å; D698-V700 PolarHBondContact O-N 3.07Å; D698-L701 PolarHBondContact O-N 3.34Å; D698-A702 VanDerWaalsContact O-CB 3.3Å; D698-A702 WeakPolarHBondContact O-CB 3.5Å; D698-A702 PolarHBondContact O-N 2.85Å
699	H	92.1	Very high	89.2	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.009	27%	0.269	C	S	.	.	H	α-helix	trans	-60.5	-44.3	174.6	-74.4	80.5	0	0	0	111.1	P693 T695 P696 R697 A702 A703 F718 N721 M724	P693-H699 VanDerWaalsContact C-CE1 3.43Å; P693-H699 HydrophobicContact CB-CB 4.35Å; P693-H699 PolarHBondContact O-CE1 3.39Å; P693-H699 PolarHBondContact O-NE2 3.15Å; T695-H699 PolarHBondContact O-N 3.41Å; T695-H699 VanDerWaalsContact O-N 3.15Å; T695-H699 PolarHBondContact O-ND1 2.84Å; P696-H699 PolarHBondContact O-N 3.23Å; R697-H699 VanDerWaalsContact C-N 3.32Å; R697-H699 PolarHBondContact O-N 3.44Å; H699-A702 PolarHBondContact O-N 3.42Å; H699-A703 VanDerWaalsContact O-CB 3.27Å; H699-A703 WeakPolarHBondContact O-CB 3.31Å; H699-A703 PolarHBondContact O-N 3.27Å; H699-F718 PolarHBondContact CD2-O 3.03Å; H699-F718 VanDerWaalsContact CD2-O 3.27Å; H699-N721 PolarHBondContact NE2-ND2 2.95Å; H699-M724 HydrophobicContact CB-CE 4.18Å; H699-M724 HydrophobicContact CB-CG 4.12Å; H699-M724 HydrophobicContact CB-SD 3.74Å
700	V	92.6	Very high	89.1	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-68.4	-37.2	177	-178.6	0	0	0	0	111.9	L650 V651 M654 F677 P696 R697 D698 A703 A704	L650-V700 HydrophobicContact CB-CB 4.4Å; L650-V700 HydrophobicContact CB-CG1 3.94Å; V651-V700 HydrophobicContact CG2-CG1 4.25Å; V651-V700 HydrophobicContact CG2-CG2 3.64Å; M654-V700 HydrophobicContact CB-CG1 4.14Å; M654-V700 HydrophobicContact CG-CG1 4.43Å; M654-V700 HydrophobicContact SD-CG1 4.09Å; F677-V700 HydrophobicContact CE2-CG1 4.42Å; P696-V700 WeakPolarHBondContact O-CG2 3.48Å; P696-V700 PolarHBondContact O-N 3.24Å; P696-V700 VanDerWaalsContact O-N 3.15Å; R697-V700 PolarHBondContact O-N 3.37Å; D698-V700 VanDerWaalsContact C-N 3.34Å; D698-V700 PolarHBondContact O-N 3.07Å; V700-A703 PolarHBondContact O-N 2.82Å; V700-A704 WeakPolarHBondContact O-CB 3.06Å; V700-A704 PolarHBondContact O-N 3.11Å
701	L	91.5	Very high	89.4	Confident	3 Å²	3	44 Å²	44	2%	0.016	23%	0.234	C	C	.	.	H	α-helix	trans	-72.1	-32.6	177.3	-65.6	173.4	0	0	0	113	F677 A680 L681 H684 R697 D698 A704 K705	F677-L701 HydrophobicContact CE2-CD2 4.29Å; A680-L701 HydrophobicContact CB-CD1 4.19Å; A680-L701 HydrophobicContact CB-CD2 4.19Å; L681-L701 HydrophobicContact CB-CD2 4.26Å; L681-L701 HydrophobicContact CD1-CD2 4.38Å; H684-L701 HydrophobicContact CB-CB 4.5Å; H684-L701 HydrophobicContact CB-CD1 3.91Å; R697-L701 HydrophobicContact CG-CD1 3.91Å; R697-L701 HydrophobicContact CG-CG 4.48Å; R697-L701 VanDerWaalsContact O-CG 3.32Å; R697-L701 WeakPolarHBondContact O-CG 3.39Å; R697-L701 PolarHBondContact O-N 2.91Å; D698-L701 PolarHBondContact O-N 3.34Å; L701-A704 WeakPolarHBondContact O-CB 3.42Å; L701-K705 PolarHBondContact O-N 3.36Å
702	A	90.9	Very high	89.7	Confident	15 Å²	15	42.9 Å²	42.9	12%	0.124	22%	0.215	C	C	.	.	H	α-helix	trans	-69.4	-42.5	169.9	0	0	0	0	0	111.6	P693 D698 H699 A704 K705 A706 F718	P693-A702 HydrophobicContact CB-CB 4.46Å; P693-A702 HydrophobicContact CG-CB 4.26Å; D698-A702 VanDerWaalsContact O-CB 3.3Å; D698-A702 WeakPolarHBondContact O-CB 3.5Å; D698-A702 PolarHBondContact O-N 2.85Å; H699-A702 PolarHBondContact O-N 3.42Å; A702-A704 VanDerWaalsContact C-N 3.29Å; A702-A704 PolarHBondContact O-N 3.43Å; A702-K705 PolarHBondContact O-N 3.4Å; A702-A706 PolarHBondContact O-N 3.03Å; A702-A706 VanDerWaalsContact O-N 3.12Å; A702-F718 HydrophobicContact CB-CD1 4.2Å; A702-F718 HydrophobicContact CB-CD2 4.2Å; A702-F718 HydrophobicContact CB-CE1 4.28Å; A702-F718 HydrophobicContact CB-CE2 4.27Å; A702-F718 HydrophobicContact CB-CG 4.18Å; A702-F718 HydrophobicContact CB-CZ 4.31Å
703	A	93.4	Very high	90.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59	-41	172.5	0	0	0	0	0	111.7	M654 H699 V700 K705 A706 M707 F718 I719	M654-A703 HydrophobicContact SD-CB 3.93Å; H699-A703 VanDerWaalsContact O-CB 3.27Å; H699-A703 WeakPolarHBondContact O-CB 3.31Å; H699-A703 PolarHBondContact O-N 3.27Å; V700-A703 PolarHBondContact O-N 2.82Å; A703-K705 PolarHBondContact O-N 2.99Å; A703-A706 PolarHBondContact O-N 3.04Å; A703-M707 WeakPolarHBondContact O-CB 3.48Å; A703-M707 PolarHBondContact O-N 3.34Å; A703-F718 HydrophobicContact CB-CB 3.91Å; A703-I719 HydrophobicContact CB-CD1 3.79Å; A703-I719 HydrophobicContact CB-CG1 3.71Å
704	A	92.7	Very high	90.3	Very high	3 Å²	3	42.3 Å²	42.3	3%	0.025	20%	0.204	C	C	.	.	H	α-helix	trans	-58.5	-46.1	175.9	0	0	0	0	0	112.5	M654 I658 F677 V700 L701 A702 A706 M707 R708	M654-A704 HydrophobicContact CG-CB 4.04Å; M654-A704 HydrophobicContact SD-CB 4.49Å; I658-A704 HydrophobicContact CD1-CB 3.54Å; F677-A704 HydrophobicContact CZ-CB 4.05Å; V700-A704 WeakPolarHBondContact O-CB 3.06Å; V700-A704 PolarHBondContact O-N 3.11Å; L701-A704 WeakPolarHBondContact O-CB 3.42Å; A702-A704 VanDerWaalsContact C-N 3.29Å; A702-A704 PolarHBondContact O-N 3.43Å; A704-A706 PolarHBondContact O-N 3.27Å; A704-M707 PolarHBondContact O-N 3.32Å; A704-R708 PolarHBondContact O-N 3.28Å
705	K	89.3	Confident	90.6	Very high	53 Å²	53	36.7 Å²	36.7	23%	0.23	18%	0.178	C	C	.	.	H	α-helix	trans	-60.4	-43.3	175.1	-72.5	-177.7	175.1	-179.9	0	112	H684 D685 L701 A702 A703 Y709	H684-K705 VanDerWaalsContact CE1-CE 3.49Å; H684-K705 WeakPolarHBondContact CE1-CE 3.4Å; H684-K705 PolarHBondContact CE1-NZ 2.96Å; H684-K705 VanDerWaalsContact ND1-CE 3.28Å; H684-K705 WeakPolarHBondContact ND1-CE 3.4Å; H684-K705 PolarHBondContact ND1-NZ 3.39Å; H684-K705 PolarHBondContact O-NZ 3.18Å; D685-K705 WeakPolarHBondContact OD1-CE 3.37Å; D685-K705 IonicContact OD1-NZ 3.33Å; D685-K705 PolarHBondContact OD1-NZ 3.32Å; L701-K705 PolarHBondContact O-N 3.36Å; A702-K705 PolarHBondContact O-N 3.4Å; A703-K705 PolarHBondContact O-N 2.99Å; K705-Y709 WeakPolarHBondContact O-CD2 3.3Å
706	A	91.2	Very high	90.8	Very high	13 Å²	13	34.3 Å²	34.3	11%	0.107	16%	0.163	C	C	.	.	H	α-helix	trans	-64.7	-41.2	176.9	0	0	0	0	0	112.8	A702 A703 A704 Y709 N711 A714 C715 F718	A702-A706 PolarHBondContact O-N 3.03Å; A702-A706 VanDerWaalsContact O-N 3.12Å; A703-A706 PolarHBondContact O-N 3.04Å; A704-A706 PolarHBondContact O-N 3.27Å; A706-Y709 PolarHBondContact O-N 2.83Å; A706-N711 PolarHBondContact O-N 3.02Å; A706-A714 HydrophobicContact CB-CB 3.76Å; A706-C715 HydrophobicContact CB-CB 4.35Å; A706-F718 HydrophobicContact CB-CD2 4.41Å; A706-F718 HydrophobicContact CB-CE2 4.31Å
707	M	92.7	Very high	91	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-67.4	-35.6	-179.6	-174.8	173.2	169	0	0	112.8	M654 L655 I658 P659 A703 A704 Y709 G710 C715 E749	M654-M707 HydrophobicContact CE-SD 3.83Å; M654-M707 HydrophobicContact CG-SD 4.36Å; M654-M707 HydrophobicContact SD-SD 4.41Å; L655-M707 HydrophobicContact CD2-CE 3.98Å; L655-M707 HydrophobicContact CD2-SD 4.22Å; I658-M707 HydrophobicContact CB-CE 4.49Å; I658-M707 HydrophobicContact CD1-CB 4.04Å; I658-M707 HydrophobicContact CD1-CG 4.22Å; I658-M707 HydrophobicContact CD1-SD 3.96Å; I658-M707 HydrophobicContact CG2-CG 4.16Å; P659-M707 HydrophobicContact CG-CE 4.27Å; A703-M707 WeakPolarHBondContact O-CB 3.48Å; A703-M707 PolarHBondContact O-N 3.34Å; A704-M707 PolarHBondContact O-N 3.32Å; M707-Y709 PolarHBondContact O-N 3.14Å; M707-G710 PolarHBondContact O-N 3.47Å; M707-C715 HydrophobicContact CB-CB 4.38Å; M707-E749 HydrophobicContact CE-CB 3.31Å
708	R	87.7	Confident	91.1	Very high	77 Å²	77	37.1 Å²	37.1	29%	0.291	18%	0.182	S	C	.	.	H	α-helix	trans	-56.5	-36	174.5	-171.9	177.6	70.6	-173.8	0.8	112.6	I658 A704 G710	I658-R708 HydrophobicContact CG2-CB 4.26Å; A704-R708 PolarHBondContact O-N 3.28Å; R708-G710 VanDerWaalsContact C-N 3.3Å
709	Y	86.3	Confident	91.1	Very high	140 Å²	140	34.6 Å²	34.6	55%	0.549	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	9	176.1	-59	-66.5	0	0	0	113.8	K705 A706 M707 N711	K705-Y709 WeakPolarHBondContact O-CD2 3.3Å; A706-Y709 PolarHBondContact O-N 2.83Å; M707-Y709 PolarHBondContact O-N 3.14Å; Y709-N711 PolarHBondContact O-N 3.08Å
710	G	85.6	Confident	90.9	Very high	7 Å²	7	37 Å²	37	7%	0.072	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	7.9	-176.6	0	0	0	0	0	115.2	M707 R708 W712	M707-G710 PolarHBondContact O-N 3.47Å; R708-G710 VanDerWaalsContact C-N 3.3Å; G710-W712 VanDerWaalsContact C-N 3.33Å; G710-W712 PolarHBondContact O-N 3.38Å
711	N	90.6	Very high	90.7	Very high	82 Å²	82	38.8 Å²	38.8	44%	0.439	19%	0.19	S	C	.	.			trans	-81.8	80.5	-179.7	-172.2	-10.2	0	0	0	110.9	A706 Y709 K713 A714 C715	A706-N711 PolarHBondContact O-N 3.02Å; Y709-N711 PolarHBondContact O-N 3.08Å; N711-K713 VanDerWaalsContact C-N 3.3Å; N711-K713 PolarHBondContact O-N 3.19Å; N711-K713 PolarHBondContact OD1-N 2.67Å; N711-A714 HydrophobicContact CB-CB 4.37Å; N711-A714 PolarHBondContact O-N 3.4Å; N711-A714 PolarHBondContact OD1-N 2.68Å; N711-A714 VanDerWaalsContact OD1-N 3.1Å; N711-C715 PolarHBondContact O-N 3.12Å; N711-C715 VanDerWaalsContact O-N 3.15Å
712	W	93.2	Very high	90.3	Very high	21 Å²	21	43.6 Å²	43.6	8%	0.08	22%	0.221	C	C	.	.	H	α-helix	trans	-60.3	-36.6	179.9	74.1	-97.7	0	0	0	112.8	G710 A714 C715 T716 I746 K747 S750 C773 F774 E775	G710-W712 VanDerWaalsContact C-N 3.33Å; G710-W712 PolarHBondContact O-N 3.38Å; W712-A714 PolarHBondContact O-N 2.96Å; W712-C715 WeakPolarHBondContact O-CB 3.32Å; W712-C715 PolarHBondContact O-N 3.11Å; W712-T716 HydrophobicContact CE3-CG2 4Å; W712-T716 HydrophobicContact CZ3-CG2 4.44Å; W712-T716 WeakPolarHBondContact O-CG2 3.29Å; W712-T716 PolarHBondContact O-N 3.11Å; W712-T716 PolarHBondContact O-OG1 2.88Å; W712-I746 HydrophobicContact CB-CG2 4.41Å; W712-K747 HydrophobicContact CD2-CG 4.03Å; W712-K747 HydrophobicContact CE3-CD 4.44Å; W712-K747 HydrophobicContact CE3-CG 3.97Å; W712-K747 HydrophobicContact CG-CG 4.38Å; W712-K747 HydrophobicContact CZ3-CD 4.41Å; W712-K747 HydrophobicContact CZ3-CG 4.43Å; W712-S750 VanDerWaalsContact CB-OG 3.28Å; W712-S750 WeakPolarHBondContact CB-OG 3.21Å; W712-C773 PolarHBondContact NE1-O 2.93Å; W712-F774 AromaticContact CD1-CD1 3.52Å; W712-F774 AromaticContact CD1-CE1 3.9Å; W712-F774 HydrophobicContact CG-CD1 4.28Å; W712-E775 HydrophobicContact CH2-CB 4.49Å; W712-E775 HydrophobicContact CH2-CG 4.49Å; W712-E775 VanDerWaalsContact CH2-OE2 3.27Å; W712-E775 WeakPolarHBondContact CH2-OE2 3.36Å; W712-E775 HydrophobicContact CZ2-CB 4.08Å; W712-E775 VanDerWaalsContact CZ2-CD 3.46Å; W712-E775 HydrophobicContact CZ2-CG 3.93Å
713	K	93.5	Very high	90	Very high	97 Å²	97	47.2 Å²	47.2	42%	0.422	23%	0.234	S	C	.	.	H	α-helix	trans	-64.9	-40.1	-178.9	-64.8	-168.5	174.7	-169.1	0	112.4	N711 T716 N717 E775	N711-K713 VanDerWaalsContact C-N 3.3Å; N711-K713 PolarHBondContact O-N 3.19Å; N711-K713 PolarHBondContact OD1-N 2.67Å; K713-T716 WeakPolarHBondContact CA-OG1 3.27Å; K713-T716 PolarHBondContact O-OG1 3.24Å; K713-N717 WeakPolarHBondContact O-CB 3.28Å; K713-N717 PolarHBondContact O-N 2.78Å; K713-N717 VanDerWaalsContact O-N 3.13Å; K713-N717 PolarHBondContact O-ND2 3.44Å; K713-N717 PolarHBondContact O-OD1 3Å; K713-E775 VanDerWaalsContact CE-OE1 3.26Å; K713-E775 WeakPolarHBondContact CE-OE1 3.49Å; K713-E775 IonicContact NZ-OE1 3.46Å; K713-E775 PolarHBondContact NZ-OE1 2.76Å
714	A	91.7	Very high	89.5	Confident	25 Å²	25	47.3 Å²	47.3	21%	0.207	24%	0.235	C	C	.	.	H	α-helix	trans	-68.4	-42	172.8	0	0	0	0	0	111.2	A706 N711 W712 N717 F718	A706-A714 HydrophobicContact CB-CB 3.76Å; N711-A714 HydrophobicContact CB-CB 4.37Å; N711-A714 PolarHBondContact O-N 3.4Å; N711-A714 PolarHBondContact OD1-N 2.68Å; N711-A714 VanDerWaalsContact OD1-N 3.1Å; W712-A714 PolarHBondContact O-N 2.96Å; A714-N717 PolarHBondContact O-N 3.21Å; A714-F718 HydrophobicContact CB-CE2 4.32Å; A714-F718 WeakPolarHBondContact O-CD2 3.39Å; A714-F718 PolarHBondContact O-N 3.3Å
715	C	92.6	Very high	89.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.2	-49	176.1	-175.4	0	0	0	0	112.4	A706 M707 N711 W712 N717 F718 I719 I746	A706-C715 HydrophobicContact CB-CB 4.35Å; M707-C715 HydrophobicContact CB-CB 4.38Å; N711-C715 PolarHBondContact O-N 3.12Å; N711-C715 VanDerWaalsContact O-N 3.15Å; W712-C715 WeakPolarHBondContact O-CB 3.32Å; W712-C715 PolarHBondContact O-N 3.11Å; C715-N717 VanDerWaalsContact C-N 3.34Å; C715-N717 PolarHBondContact O-N 3.41Å; C715-F718 PolarHBondContact O-N 3.46Å; C715-I719 WeakPolarHBondContact O-CG1 3.45Å; C715-I719 PolarHBondContact O-N 2.98Å; C715-I719 VanDerWaalsContact O-N 3.12Å; C715-I746 HydrophobicContact CB-CG2 3.99Å
716	T	91.7	Very high	88.7	Confident	12 Å²	12	49.5 Å²	49.5	7%	0.074	26%	0.259	C	S	.	.	H	α-helix	trans	-62.5	-38.8	176.6	52.6	0	0	0	0	112.1	W712 K713 F718 I719 I720 E743 I746	W712-T716 HydrophobicContact CE3-CG2 4Å; W712-T716 HydrophobicContact CZ3-CG2 4.44Å; W712-T716 WeakPolarHBondContact O-CG2 3.29Å; W712-T716 PolarHBondContact O-N 3.11Å; W712-T716 PolarHBondContact O-OG1 2.88Å; K713-T716 WeakPolarHBondContact CA-OG1 3.27Å; K713-T716 PolarHBondContact O-OG1 3.24Å; T716-F718 VanDerWaalsContact C-N 3.33Å; T716-F718 PolarHBondContact O-N 3.47Å; T716-I719 PolarHBondContact O-N 3.08Å; T716-I720 WeakPolarHBondContact O-CA 3.35Å; T716-I720 WeakPolarHBondContact O-CB 3.26Å; T716-I720 PolarHBondContact O-N 3.5Å; T716-E743 HydrophobicContact CG2-CG 4.01Å; T716-I746 HydrophobicContact CG2-CB 4.36Å; T716-I746 HydrophobicContact CG2-CD1 4.15Å; T716-I746 HydrophobicContact CG2-CG2 3.94Å
717	N	92.2	Very high	88.3	Confident	111 Å²	111	53.6 Å²	53.6	59%	0.594	27%	0.274	S	S	*	.	H	α-helix	trans	-69.3	-27.3	178.5	-69.4	-5.1	0	0	0	113.6	K713 A714 C715	K713-N717 WeakPolarHBondContact O-CB 3.28Å; K713-N717 PolarHBondContact O-N 2.78Å; K713-N717 VanDerWaalsContact O-N 3.13Å; K713-N717 PolarHBondContact O-ND2 3.44Å; K713-N717 PolarHBondContact O-OD1 3Å; A714-N717 PolarHBondContact O-N 3.21Å; C715-N717 VanDerWaalsContact C-N 3.34Å; C715-N717 PolarHBondContact O-N 3.41Å
718	F	91.7	Very high	88	Confident	64 Å²	64	53.6 Å²	53.6	28%	0.281	27%	0.274	S	S	.	.	H	α-helix	trans	-77.5	-36.1	173.1	-70.5	-54.6	0	0	0	112.1	P693 H699 A702 A703 A706 A714 C715 T716	P693-F718 HydrophobicContact CG-CD1 3.9Å; P693-F718 HydrophobicContact CG-CE1 4.07Å; H699-F718 PolarHBondContact CD2-O 3.03Å; H699-F718 VanDerWaalsContact CD2-O 3.27Å; A702-F718 HydrophobicContact CB-CD1 4.2Å; A702-F718 HydrophobicContact CB-CD2 4.2Å; A702-F718 HydrophobicContact CB-CE1 4.28Å; A702-F718 HydrophobicContact CB-CE2 4.27Å; A702-F718 HydrophobicContact CB-CG 4.18Å; A702-F718 HydrophobicContact CB-CZ 4.31Å; A703-F718 HydrophobicContact CB-CB 3.91Å; A706-F718 HydrophobicContact CB-CD2 4.41Å; A706-F718 HydrophobicContact CB-CE2 4.31Å; A714-F718 HydrophobicContact CB-CE2 4.32Å; A714-F718 WeakPolarHBondContact O-CD2 3.39Å; A714-F718 PolarHBondContact O-N 3.3Å; C715-F718 PolarHBondContact O-N 3.46Å; T716-F718 VanDerWaalsContact C-N 3.33Å; T716-F718 PolarHBondContact O-N 3.47Å
719	I	90.4	Very high	88	Confident	1 Å²	1	50 Å²	50	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-82.3	-42.6	-177.4	-69.3	172.3	0	0	0	111.9	M654 A703 C715 T716 N721 M724 W729 L742 I746	M654-I719 HydrophobicContact CE-CD1 3.61Å; M654-I719 HydrophobicContact SD-CD1 4.02Å; A703-I719 HydrophobicContact CB-CD1 3.79Å; A703-I719 HydrophobicContact CB-CG1 3.71Å; C715-I719 WeakPolarHBondContact O-CG1 3.45Å; C715-I719 PolarHBondContact O-N 2.98Å; C715-I719 VanDerWaalsContact O-N 3.12Å; T716-I719 PolarHBondContact O-N 3.08Å; I719-N721 PolarHBondContact O-N 2.94Å; I719-M724 VanDerWaalsContact O-CB 3.29Å; I719-M724 WeakPolarHBondContact O-CB 3.24Å; I719-W729 HydrophobicContact CG2-CZ2 3.88Å; I719-W729 PolarHBondContact O-NE1 3.28Å; I719-L742 HydrophobicContact CG2-CD2 3.59Å; I719-L742 HydrophobicContact CG2-CG 4.38Å; I719-I746 HydrophobicContact CB-CD1 4.49Å; I719-I746 HydrophobicContact CD1-CD1 3.64Å; I719-I746 HydrophobicContact CD1-CG1 4.35Å; I719-I746 HydrophobicContact CG2-CD1 4.4Å
720	I	88.4	Confident	87.9	Confident	51 Å²	51	48 Å²	48	26%	0.262	26%	0.259	S	S	.	.	S	Bend	trans	-103.2	70.7	179.2	-47.8	175.3	0	0	0	107.8	T716 K739	T716-I720 WeakPolarHBondContact O-CA 3.35Å; T716-I720 WeakPolarHBondContact O-CB 3.26Å; T716-I720 PolarHBondContact O-N 3.5Å; I720-K739 HydrophobicContact CD1-CB 4.49Å; I720-K739 HydrophobicContact CG2-CD 4.44Å
721	N	86.5	Confident	87.9	Confident	39 Å²	39	52.3 Å²	52.3	21%	0.209	28%	0.28	C	S	.	.			trans	-112.1	141.3	175.7	-179	-31.3	0	0	0	107.6	H699 I719 K723 M724 D725	H699-N721 PolarHBondContact NE2-ND2 2.95Å; I719-N721 PolarHBondContact O-N 2.94Å; N721-K723 PolarHBondContact O-N 3.4Å; N721-K723 PolarHBondContact OD1-N 3.34Å; N721-M724 HydrophobicContact CB-CB 4.44Å; N721-M724 HydrophobicContact CB-CG 4.28Å; N721-M724 WeakPolarHBondContact O-CA 3.23Å; N721-M724 WeakPolarHBondContact O-CB 3.33Å; N721-M724 PolarHBondContact O-N 2.92Å; N721-D725 PolarHBondContact O-N 3.26Å
722	P	84.6	Confident	87.4	Confident	105 Å²	105	49.2 Å²	49.2	68%	0.682	26%	0.263	S	S	*	.	H	α-helix	trans	-49.3	-28.9	172.5	17	-32	0	0	0	114.5	A726	P722-A726 WeakPolarHBondContact O-CB 3.14Å; P722-A726 PolarHBondContact O-N 3.39Å
723	K	84.6	Confident	86.7	Confident	91 Å²	91	49.2 Å²	49.2	40%	0.396	26%	0.264	S	S	.	.	H	α-helix	trans	-66	-36.8	171.4	-70.9	-169.3	178.8	-174.6	0	113.6	E694 N721 K727	E694-K723 IonicContact OE1-NZ 2.79Å; E694-K723 PolarHBondContact OE1-NZ 3.37Å; N721-K723 PolarHBondContact O-N 3.4Å; N721-K723 PolarHBondContact OD1-N 3.34Å; K723-K727 WeakPolarHBondContact O-CG 3.46Å
724	M	82.8	Confident	86.1	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-81.5	-39	179.3	-70.2	-66.2	-74.8	0	0	111.3	C647 P696 H699 I719 N721 K727 I728 W729	C647-M724 VanDerWaalsContact SG-CE 3.57Å; P696-M724 HydrophobicContact CB-CE 4.01Å; P696-M724 HydrophobicContact CB-SD 3.83Å; H699-M724 HydrophobicContact CB-CE 4.18Å; H699-M724 HydrophobicContact CB-CG 4.12Å; H699-M724 HydrophobicContact CB-SD 3.74Å; I719-M724 VanDerWaalsContact O-CB 3.29Å; I719-M724 WeakPolarHBondContact O-CB 3.24Å; N721-M724 HydrophobicContact CB-CB 4.44Å; N721-M724 HydrophobicContact CB-CG 4.28Å; N721-M724 WeakPolarHBondContact O-CA 3.23Å; N721-M724 WeakPolarHBondContact O-CB 3.33Å; N721-M724 PolarHBondContact O-N 2.92Å; M724-K727 PolarHBondContact O-N 3.35Å; M724-I728 HydrophobicContact CE-CD1 3.68Å; M724-I728 WeakPolarHBondContact O-CB 3.16Å; M724-I728 PolarHBondContact O-N 2.9Å; M724-I728 HydrophobicContact SD-CD1 4.13Å; M724-W729 PolarHBondContact O-N 3.5Å
725	D	83.7	Confident	85.6	Confident	32 Å²	32	44.8 Å²	44.8	17%	0.171	24%	0.242	C	C	.	.	H	α-helix	trans	-53.6	-58.9	174.7	-78.9	9.2	0	0	0	110.6	N721 K727 I728 W729 D730 K739	N721-D725 PolarHBondContact O-N 3.26Å; D725-K727 VanDerWaalsContact C-N 3.27Å; D725-K727 PolarHBondContact O-N 3.28Å; D725-I728 PolarHBondContact O-N 2.93Å; D725-W729 PolarHBondContact O-N 2.94Å; D725-W729 VanDerWaalsContact O-N 3.14Å; D725-W729 VanDerWaalsContact OD1-CD1 3.23Å; D725-D730 WeakPolarHBondContact O-CB 3.3Å; D725-D730 PolarHBondContact O-N 3.19Å; D725-K739 VanDerWaalsContact OD1-CE 3.25Å; D725-K739 WeakPolarHBondContact OD1-CE 3.44Å; D725-K739 IonicContact OD1-NZ 3.82Å; D725-K739 PolarHBondContact OD1-NZ 3.38Å; D725-K739 IonicContact OD2-NZ 3.56Å; D725-K739 PolarHBondContact OD2-NZ 2.94Å
726	A	80.2	Confident	85.2	Confident	71 Å²	71	50.1 Å²	50.1	59%	0.587	27%	0.271	S	S	*	.	H	α-helix	trans	-64.5	-24.6	-177.4	0	0	0	0	0	114.7	P722	P722-A726 WeakPolarHBondContact O-CB 3.14Å; P722-A726 PolarHBondContact O-N 3.39Å
727	K	83.8	Confident	85	Confident	98 Å²	98	53.3 Å²	53.3	43%	0.426	28%	0.283	S	S	.	.	H	α-helix	trans	-89.8	-32.5	-179.8	-76.1	-176.3	177.6	-175.8	0	113.7	E694 K723 M724 D725 L731	E694-K727 PolarHBondContact O-NZ 2.96Å; K723-K727 WeakPolarHBondContact O-CG 3.46Å; M724-K727 PolarHBondContact O-N 3.35Å; D725-K727 VanDerWaalsContact C-N 3.27Å; D725-K727 PolarHBondContact O-N 3.28Å; K727-L731 VanDerWaalsContact O-CD1 3.27Å; K727-L731 WeakPolarHBondContact O-CD1 3.38Å
728	I	86.3	Confident	84.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.4	-59.9	-161.7	-68.1	164.4	0	0	0	110.9	L644 C647 P696 M724 D725 D730 L731	L644-I728 HydrophobicContact CD1-CG2 3.6Å; C647-I728 HydrophobicContact CB-CD1 3.56Å; C647-I728 HydrophobicContact CB-CG1 4.45Å; C647-I728 HydrophobicContact CB-CG2 4.4Å; P696-I728 HydrophobicContact CB-CD1 3.4Å; P696-I728 VanDerWaalsContact CB-CD1 3.4Å; P696-I728 HydrophobicContact CG-CD1 4.25Å; M724-I728 HydrophobicContact CE-CD1 3.68Å; M724-I728 WeakPolarHBondContact O-CB 3.16Å; M724-I728 PolarHBondContact O-N 2.9Å; M724-I728 HydrophobicContact SD-CD1 4.13Å; D725-I728 PolarHBondContact O-N 2.93Å; I728-D730 VanDerWaalsContact C-N 3.35Å; I728-D730 PolarHBondContact O-N 2.72Å; I728-L731 WeakPolarHBondContact O-CB 3.41Å; I728-L731 PolarHBondContact O-N 3.36Å
729	W	86.8	Confident	84.8	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.008	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-73.3	-28.4	-168.2	-52.5	122.5	0	0	0	113.1	F584 V651 I719 M724 D725 L731 L732 S735 V738 L742	F584-W729 HydrophobicContact CE1-CH2 4.17Å; F584-W729 AromaticContact CE1-CZ3 3.71Å; F584-W729 HydrophobicContact CE1-CZ3 3.71Å; F584-W729 HydrophobicContact CZ-CH2 4.05Å; F584-W729 HydrophobicContact CZ-CZ3 4.07Å; V651-W729 HydrophobicContact CG2-CH2 4.45Å; I719-W729 HydrophobicContact CG2-CZ2 3.88Å; I719-W729 PolarHBondContact O-NE1 3.28Å; M724-W729 PolarHBondContact O-N 3.5Å; D725-W729 PolarHBondContact O-N 2.94Å; D725-W729 VanDerWaalsContact O-N 3.14Å; D725-W729 VanDerWaalsContact OD1-CD1 3.23Å; W729-L731 PolarHBondContact O-N 3.27Å; W729-L732 HydrophobicContact CE3-CD1 3.93Å; W729-L732 HydrophobicContact CZ3-CD1 4.15Å; W729-L732 PolarHBondContact O-N 3.39Å; W729-S735 VanDerWaalsContact O-CB 3.25Å; W729-S735 WeakPolarHBondContact O-CB 3.39Å; W729-S735 PolarHBondContact O-OG 3Å; W729-V738 HydrophobicContact CE3-CG1 4.5Å; W729-L742 HydrophobicContact CH2-CD2 3.77Å; W729-L742 HydrophobicContact CZ2-CD2 3.82Å; W729-L742 HydrophobicContact CZ3-CD2 4.43Å
730	D	85.3	Confident	84.8	Confident	97 Å²	97	52.3 Å²	52.3	52%	0.519	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-78	-10.4	178.1	-60.2	-11.3	0	0	0	112.2	D725 I728 K739	D725-D730 WeakPolarHBondContact O-CB 3.3Å; D725-D730 PolarHBondContact O-N 3.19Å; I728-D730 VanDerWaalsContact C-N 3.35Å; I728-D730 PolarHBondContact O-N 2.72Å; D730-K739 IonicContact OD1-NZ 3.3Å; D730-K739 PolarHBondContact OD1-NZ 3.15Å
731	L	84.7	Confident	84.9	Confident	99 Å²	99	52.3 Å²	52.3	52%	0.518	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-82	-13.9	171.1	-56.1	179.2	0	0	0	112.9	N641 L644 K727 I728 W729	N641-L731 HydrophobicContact CB-CD1 4.23Å; N641-L731 WeakPolarHBondContact ND2-CD1 3.28Å; L644-L731 HydrophobicContact CD2-CB 4.44Å; K727-L731 VanDerWaalsContact O-CD1 3.27Å; K727-L731 WeakPolarHBondContact O-CD1 3.38Å; I728-L731 WeakPolarHBondContact O-CB 3.41Å; I728-L731 PolarHBondContact O-N 3.36Å; W729-L731 PolarHBondContact O-N 3.27Å
732	L	81.7	Confident	85.2	Confident	17 Å²	17	50.8 Å²	50.8	9%	0.089	27%	0.268	C	S	.	.	S	Bend	trans	-93.4	135.2	-178.7	-69.4	-179.5	0	0	0	111.8	L644 W729 S735 V738	L644-L732 HydrophobicContact CD1-CD1 4.22Å; L644-L732 HydrophobicContact CD1-CD2 3.99Å; L644-L732 HydrophobicContact CD1-CG 4.01Å; L644-L732 HydrophobicContact CD2-CD2 4.02Å; W729-L732 HydrophobicContact CE3-CD1 3.93Å; W729-L732 HydrophobicContact CZ3-CD1 4.15Å; W729-L732 PolarHBondContact O-N 3.39Å; L732-S735 PolarHBondContact O-N 2.62Å; L732-V738 HydrophobicContact CD1-CG1 4.23Å
733	F	78.3	Confident	85.6	Confident	21 Å²	21	48.9 Å²	48.9	9%	0.092	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	138.5	166.8	175.5	-130.6	0	0	0	111.5	F486 W490 G491 V494 E495	F486-F733 HydrophobicContact CE1-CB 4.2Å; F486-F733 AromaticContact CE1-CD2 3.76Å; F486-F733 HydrophobicContact CE1-CD2 3.76Å; F486-F733 HydrophobicContact CE1-CE2 4.35Å; F486-F733 AromaticContact CE1-CG 3.94Å; F486-F733 HydrophobicContact CE1-CG 3.94Å; F486-F733 AromaticContact CE2-CD1 3.94Å; F486-F733 HydrophobicContact CE2-CD1 3.94Å; F486-F733 HydrophobicContact CE2-CD2 4.43Å; F486-F733 HydrophobicContact CE2-CE1 4.26Å; F486-F733 HydrophobicContact CE2-CG 4.04Å; F486-F733 HydrophobicContact CZ-CB 4Å; F486-F733 AromaticContact CZ-CD1 3.66Å; F486-F733 HydrophobicContact CZ-CD1 3.66Å; F486-F733 AromaticContact CZ-CD2 3.38Å; F486-F733 HydrophobicContact CZ-CD2 3.38Å; F486-F733 AromaticContact CZ-CE1 3.95Å; F486-F733 HydrophobicContact CZ-CE1 3.95Å; F486-F733 AromaticContact CZ-CE2 3.73Å; F486-F733 HydrophobicContact CZ-CE2 3.73Å; F486-F733 AromaticContact CZ-CG 3.37Å; F486-F733 HydrophobicContact CZ-CG 3.37Å; F486-F733 AromaticContact CZ-CZ 3.99Å; F486-F733 HydrophobicContact CZ-CZ 3.99Å; W490-F733 HydrophobicContact CE3-CZ 4.46Å; W490-F733 AromaticContact CZ3-CE1 3.92Å; W490-F733 HydrophobicContact CZ3-CE1 3.92Å; W490-F733 AromaticContact CZ3-CZ 3.88Å; W490-F733 HydrophobicContact CZ3-CZ 3.88Å; G491-F733 WeakPolarHBondContact O-CE2 3.46Å; V494-F733 HydrophobicContact CB-CZ 4.05Å; V494-F733 HydrophobicContact CG1-CZ 3.85Å; E495-F733 HydrophobicContact CG-CE2 4.06Å
734	E	79.1	Confident	85.9	Confident	15 Å²	15	47.6 Å²	47.6	7%	0.07	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	36.6	-172.1	-55.2	-175.6	139.6	0	0	113.7	E495 N543 N736 K737 V738	E495-E734 HydrophobicContact CG-CG 4.25Å; E495-E734 VanDerWaalsContact OE1-CA 3.24Å; E495-E734 WeakPolarHBondContact OE1-CA 3.3Å; E495-E734 PolarHBondContact OE1-N 3.13Å; N543-E734 PolarHBondContact ND2-OE2 2.99Å; E734-N736 VanDerWaalsContact C-N 3.27Å; E734-N736 PolarHBondContact O-N 3.26Å; E734-N736 VanDerWaalsContact O-N 3.07Å; E734-K737 HydrophobicContact CB-CB 4.06Å; E734-K737 HydrophobicContact CB-CD 4.12Å; E734-K737 VanDerWaalsContact CD-NZ 3.3Å; E734-K737 HydrophobicContact CG-CD 4.48Å; E734-K737 WeakPolarHBondContact O-CB 3.45Å; E734-K737 PolarHBondContact O-N 3.4Å; E734-K737 IonicContact OE1-NZ 2.67Å; E734-K737 PolarHBondContact OE1-NZ 2.88Å; E734-K737 WeakPolarHBondContact OE2-CD 3.35Å; E734-K737 IonicContact OE2-NZ 3.14Å; E734-K737 PolarHBondContact OE2-NZ 3.4Å; E734-V738 PolarHBondContact O-N 3.22Å
735	S	82.7	Confident	86.4	Confident	14 Å²	14	50.3 Å²	50.3	10%	0.098	26%	0.262	C	S	.	.	H	α-helix	trans	-43.9	-46.3	-176.3	-171.5	0	0	0	0	114.3	W729 L732 K737 V738 K739	W729-S735 VanDerWaalsContact O-CB 3.25Å; W729-S735 WeakPolarHBondContact O-CB 3.39Å; W729-S735 PolarHBondContact O-OG 3Å; L732-S735 PolarHBondContact O-N 2.62Å; S735-K737 PolarHBondContact O-N 2.86Å; S735-V738 PolarHBondContact O-N 3.03Å; S735-K739 WeakPolarHBondContact O-CG 3.1Å; S735-K739 PolarHBondContact O-N 2.87Å; S735-K739 WeakPolarHBondContact OG-CE 3.38Å
736	N	84.7	Confident	86.9	Confident	112 Å²	112	48.8 Å²	48.8	60%	0.599	25%	0.253	S	S	*	.	H	α-helix	trans	-61.4	-39.9	179.1	-68.8	-36	0	0	0	113.4	E734 K739 Q740	E734-N736 VanDerWaalsContact C-N 3.27Å; E734-N736 PolarHBondContact O-N 3.26Å; E734-N736 VanDerWaalsContact O-N 3.07Å; N736-K739 PolarHBondContact O-N 2.88Å; N736-Q740 VanDerWaalsContact O-CG 3.3Å; N736-Q740 WeakPolarHBondContact O-CG 3.34Å; N736-Q740 PolarHBondContact O-N 3.21Å
737	K	87.5	Confident	87.5	Confident	78 Å²	78	46 Å²	46	34%	0.339	23%	0.228	S	C	.	.	H	α-helix	trans	-71.1	-38.6	178.4	-173.9	-169.8	-177.8	-179.4	0	110.8	E734 S735 Q740 N741	E734-K737 HydrophobicContact CB-CB 4.06Å; E734-K737 HydrophobicContact CB-CD 4.12Å; E734-K737 VanDerWaalsContact CD-NZ 3.3Å; E734-K737 HydrophobicContact CG-CD 4.48Å; E734-K737 WeakPolarHBondContact O-CB 3.45Å; E734-K737 PolarHBondContact O-N 3.4Å; E734-K737 IonicContact OE1-NZ 2.67Å; E734-K737 PolarHBondContact OE1-NZ 2.88Å; E734-K737 WeakPolarHBondContact OE2-CD 3.35Å; E734-K737 IonicContact OE2-NZ 3.14Å; E734-K737 PolarHBondContact OE2-NZ 3.4Å; S735-K737 PolarHBondContact O-N 2.86Å; K737-Q740 PolarHBondContact O-N 3.3Å; K737-N741 VanDerWaalsContact O-CB 3.29Å; K737-N741 WeakPolarHBondContact O-CB 3.35Å; K737-N741 PolarHBondContact O-N 2.96Å; K737-N741 PolarHBondContact O-ND2 3.42Å
738	V	89.2	Confident	87.9	Confident	6 Å²	6	42.7 Å²	42.7	4%	0.036	21%	0.214	C	C	.	.	H	α-helix	trans	-62.3	-46.3	172.9	-178.6	0	0	0	0	110.5	F584 R585 W729 L732 E734 S735 Q740 N741 L742	F584-V738 HydrophobicContact CD1-CG1 4.3Å; F584-V738 HydrophobicContact CE1-CG1 3.79Å; R585-V738 HydrophobicContact CB-CG2 4.31Å; R585-V738 HydrophobicContact CG-CG2 3.84Å; W729-V738 HydrophobicContact CE3-CG1 4.5Å; L732-V738 HydrophobicContact CD1-CG1 4.23Å; E734-V738 PolarHBondContact O-N 3.22Å; S735-V738 PolarHBondContact O-N 3.03Å; V738-Q740 PolarHBondContact O-N 3.44Å; V738-N741 PolarHBondContact O-N 2.95Å; V738-L742 WeakPolarHBondContact O-CB 3.48Å; V738-L742 PolarHBondContact O-N 3.45Å
739	K	89.8	Confident	88.2	Confident	25 Å²	25	44.4 Å²	44.4	11%	0.109	22%	0.222	C	C	.	.	H	α-helix	trans	-58.9	-46.1	175.8	-71	172.5	-171.7	176.8	0	111.7	I720 D725 D730 S735 N736 L742 E743	I720-K739 HydrophobicContact CD1-CB 4.49Å; I720-K739 HydrophobicContact CG2-CD 4.44Å; D725-K739 VanDerWaalsContact OD1-CE 3.25Å; D725-K739 WeakPolarHBondContact OD1-CE 3.44Å; D725-K739 IonicContact OD1-NZ 3.82Å; D725-K739 PolarHBondContact OD1-NZ 3.38Å; D725-K739 IonicContact OD2-NZ 3.56Å; D725-K739 PolarHBondContact OD2-NZ 2.94Å; D730-K739 IonicContact OD1-NZ 3.3Å; D730-K739 PolarHBondContact OD1-NZ 3.15Å; S735-K739 WeakPolarHBondContact O-CG 3.1Å; S735-K739 PolarHBondContact O-N 2.87Å; S735-K739 WeakPolarHBondContact OG-CE 3.38Å; N736-K739 PolarHBondContact O-N 2.88Å; K739-L742 PolarHBondContact O-N 2.91Å; K739-E743 WeakPolarHBondContact O-CB 3.28Å; K739-E743 PolarHBondContact O-N 3.28Å
740	Q	90.6	Very high	88.5	Confident	125 Å²	125	44.3 Å²	44.3	58%	0.584	22%	0.222	S	C	*	.	H	α-helix	trans	-62.8	-48.2	176.1	-73.5	171.7	6.1	0	0	112.9	N736 K737 V738 L742 E743 V744	N736-Q740 VanDerWaalsContact O-CG 3.3Å; N736-Q740 WeakPolarHBondContact O-CG 3.34Å; N736-Q740 PolarHBondContact O-N 3.21Å; K737-Q740 PolarHBondContact O-N 3.3Å; V738-Q740 PolarHBondContact O-N 3.44Å; Q740-L742 VanDerWaalsContact C-N 3.29Å; Q740-L742 PolarHBondContact O-N 3.21Å; Q740-E743 PolarHBondContact O-N 3.43Å; Q740-V744 WeakPolarHBondContact O-CG2 3.12Å; Q740-V744 PolarHBondContact O-N 3.33Å
741	N	90.3	Very high	88.8	Confident	50 Å²	50	39.7 Å²	39.7	27%	0.267	20%	0.197	S	C	.	.	H	α-helix	trans	-59.1	-42.6	176.9	-76.8	-16.4	0	0	0	111.5	S587 K737 V738 V744 K745	S587-N741 VanDerWaalsContact OG-CB 3.32Å; S587-N741 WeakPolarHBondContact OG-CB 3.36Å; S587-N741 VanDerWaalsContact OG-CG 3.28Å; S587-N741 PolarHBondContact OG-ND2 2.91Å; K737-N741 VanDerWaalsContact O-CB 3.29Å; K737-N741 WeakPolarHBondContact O-CB 3.35Å; K737-N741 PolarHBondContact O-N 2.96Å; K737-N741 PolarHBondContact O-ND2 3.42Å; V738-N741 PolarHBondContact O-N 2.95Å; N741-V744 PolarHBondContact O-N 3.39Å; N741-K745 VanDerWaalsContact O-CG 3.3Å; N741-K745 WeakPolarHBondContact O-CG 3.49Å; N741-K745 PolarHBondContact O-N 2.93Å
742	L	91.9	Very high	89.2	Confident	8 Å²	8	36.6 Å²	36.6	4%	0.042	18%	0.179	C	C	.	.	H	α-helix	trans	-67.3	-40	178.4	-175.2	56	0	0	0	111.7	F584 V651 L655 I719 W729 V738 K739 Q740 K745 I746	F584-L742 HydrophobicContact CZ-CD1 4.42Å; F584-L742 HydrophobicContact CZ-CD2 4.41Å; V651-L742 HydrophobicContact CG1-CD1 3.66Å; V651-L742 HydrophobicContact CG1-CD2 4.33Å; L655-L742 HydrophobicContact CD1-CD1 3.9Å; I719-L742 HydrophobicContact CG2-CD2 3.59Å; I719-L742 HydrophobicContact CG2-CG 4.38Å; W729-L742 HydrophobicContact CH2-CD2 3.77Å; W729-L742 HydrophobicContact CZ2-CD2 3.82Å; W729-L742 HydrophobicContact CZ3-CD2 4.43Å; V738-L742 WeakPolarHBondContact O-CB 3.48Å; V738-L742 PolarHBondContact O-N 3.45Å; K739-L742 PolarHBondContact O-N 2.91Å; Q740-L742 VanDerWaalsContact C-N 3.29Å; Q740-L742 PolarHBondContact O-N 3.21Å; L742-K745 PolarHBondContact O-N 2.96Å; L742-I746 HydrophobicContact CD1-CD1 4.17Å; L742-I746 HydrophobicContact CD1-CG1 4.29Å; L742-I746 HydrophobicContact CG-CD1 3.89Å; L742-I746 HydrophobicContact CG-CG1 4.49Å; L742-I746 WeakPolarHBondContact O-CB 3.21Å; L742-I746 WeakPolarHBondContact O-CD1 3.47Å; L742-I746 WeakPolarHBondContact O-CG1 3.32Å; L742-I746 PolarHBondContact O-N 2.89Å
743	E	93	Very high	89.6	Confident	64 Å²	64	35.8 Å²	35.8	30%	0.299	17%	0.174	S	C	.	.	H	α-helix	trans	-59.6	-47.4	173.3	-166.8	-162.2	142.4	0	0	111.7	T716 K739 Q740 K745 I746 K747	T716-E743 HydrophobicContact CG2-CG 4.01Å; K739-E743 WeakPolarHBondContact O-CB 3.28Å; K739-E743 PolarHBondContact O-N 3.28Å; Q740-E743 PolarHBondContact O-N 3.43Å; E743-K745 VanDerWaalsContact C-N 3.32Å; E743-K745 PolarHBondContact O-N 3.34Å; E743-I746 PolarHBondContact O-N 2.78Å; E743-K747 HydrophobicContact CG-CD 4.41Å; E743-K747 WeakPolarHBondContact O-CB 3.45Å; E743-K747 WeakPolarHBondContact O-CG 3.5Å; E743-K747 PolarHBondContact O-N 3.37Å; E743-K747 VanDerWaalsContact OE1-CE 3.28Å; E743-K747 WeakPolarHBondContact OE1-CE 3.35Å; E743-K747 IonicContact OE1-NZ 2.86Å; E743-K747 PolarHBondContact OE1-NZ 3.04Å
744	V	92.7	Very high	90.2	Very high	64 Å²	64	36.8 Å²	36.8	39%	0.388	18%	0.179	S	C	.	.	H	α-helix	trans	-60	-42.9	176.2	173.6	0	0	0	0	111	Q740 N741 K747 E748	Q740-V744 WeakPolarHBondContact O-CG2 3.12Å; Q740-V744 PolarHBondContact O-N 3.33Å; N741-V744 PolarHBondContact O-N 3.39Å; V744-K747 WeakPolarHBondContact O-CB 3.37Å; V744-K747 PolarHBondContact O-N 2.76Å; V744-E748 WeakPolarHBondContact O-CG 3.33Å; V744-E748 PolarHBondContact O-N 3.5Å
745	K	91.9	Very high	90.7	Very high	58 Å²	58	36.1 Å²	36.1	25%	0.252	18%	0.176	S	C	.	.	H	α-helix	trans	-70	-37.5	179.2	-69.6	-71.5	165.2	-154.2	0	113.3	I589 L655 N741 L742 E743 K747 E748 E749	I589-K745 HydrophobicContact CD1-CB 3.95Å; I589-K745 HydrophobicContact CD1-CD 3.79Å; I589-K745 HydrophobicContact CD1-CG 3.73Å; L655-K745 HydrophobicContact CD1-CB 4.33Å; N741-K745 VanDerWaalsContact O-CG 3.3Å; N741-K745 WeakPolarHBondContact O-CG 3.49Å; N741-K745 PolarHBondContact O-N 2.93Å; L742-K745 PolarHBondContact O-N 2.96Å; E743-K745 VanDerWaalsContact C-N 3.32Å; E743-K745 PolarHBondContact O-N 3.34Å; K745-K747 VanDerWaalsContact C-N 3.33Å; K745-E748 WeakPolarHBondContact CD-OE2 3.39Å; K745-E748 IonicContact NZ-OE1 4Å; K745-E748 IonicContact NZ-OE2 2.74Å; K745-E748 PolarHBondContact NZ-OE2 2.74Å; K745-E748 PolarHBondContact O-N 3.28Å; K745-E749 PolarHBondContact O-N 3.43Å
746	I	94.1	Very high	90.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.3	-43.9	170.5	-69.5	161.4	0	0	0	109.8	L655 W712 C715 T716 I719 L742 E743 S750	L655-I746 HydrophobicContact CD2-CG1 4.04Å; W712-I746 HydrophobicContact CB-CG2 4.41Å; C715-I746 HydrophobicContact CB-CG2 3.99Å; T716-I746 HydrophobicContact CG2-CB 4.36Å; T716-I746 HydrophobicContact CG2-CD1 4.15Å; T716-I746 HydrophobicContact CG2-CG2 3.94Å; I719-I746 HydrophobicContact CB-CD1 4.49Å; I719-I746 HydrophobicContact CD1-CD1 3.64Å; I719-I746 HydrophobicContact CD1-CG1 4.35Å; I719-I746 HydrophobicContact CG2-CD1 4.4Å; L742-I746 HydrophobicContact CD1-CD1 4.17Å; L742-I746 HydrophobicContact CD1-CG1 4.29Å; L742-I746 HydrophobicContact CG-CD1 3.89Å; L742-I746 HydrophobicContact CG-CG1 4.49Å; L742-I746 WeakPolarHBondContact O-CB 3.21Å; L742-I746 WeakPolarHBondContact O-CD1 3.47Å; L742-I746 WeakPolarHBondContact O-CG1 3.32Å; L742-I746 PolarHBondContact O-N 2.89Å; E743-I746 PolarHBondContact O-N 2.78Å; I746-S750 WeakPolarHBondContact O-CB 3.4Å; I746-S750 PolarHBondContact O-N 2.88Å; I746-S750 PolarHBondContact O-OG 2.94Å
747	K	93.6	Very high	91	Very high	14 Å²	14	33 Å²	33	6%	0.061	16%	0.158	C	C	.	.	H	α-helix	trans	-62.3	-44	176.3	-75.4	171.6	164.5	174.9	0	112.6	W712 E743 V744 K745 S750 L751 F774 E775 L776	W712-K747 HydrophobicContact CD2-CG 4.03Å; W712-K747 HydrophobicContact CE3-CD 4.44Å; W712-K747 HydrophobicContact CE3-CG 3.97Å; W712-K747 HydrophobicContact CG-CG 4.38Å; W712-K747 HydrophobicContact CZ3-CD 4.41Å; W712-K747 HydrophobicContact CZ3-CG 4.43Å; E743-K747 HydrophobicContact CG-CD 4.41Å; E743-K747 WeakPolarHBondContact O-CB 3.45Å; E743-K747 WeakPolarHBondContact O-CG 3.5Å; E743-K747 PolarHBondContact O-N 3.37Å; E743-K747 VanDerWaalsContact OE1-CE 3.28Å; E743-K747 WeakPolarHBondContact OE1-CE 3.35Å; E743-K747 IonicContact OE1-NZ 2.86Å; E743-K747 PolarHBondContact OE1-NZ 3.04Å; V744-K747 WeakPolarHBondContact O-CB 3.37Å; V744-K747 PolarHBondContact O-N 2.76Å; K745-K747 VanDerWaalsContact C-N 3.33Å; K747-S750 WeakPolarHBondContact CA-OG 3.48Å; K747-S750 PolarHBondContact O-OG 3.42Å; K747-S750 VanDerWaalsContact O-OG 3.13Å; K747-L751 WeakPolarHBondContact O-CB 3.27Å; K747-L751 PolarHBondContact O-N 3.39Å; K747-L751 VanDerWaalsContact O-N 3.11Å; K747-F774 WeakPolarHBondContact CD-O 3.47Å; K747-F774 WeakPolarHBondContact CE-O 3.38Å; K747-E775 IonicContact NZ-OE2 3.3Å; K747-L776 HydrophobicContact CB-CD1 3.89Å; K747-L776 HydrophobicContact CB-CD2 3.88Å; K747-L776 HydrophobicContact CB-CG 3.9Å; K747-L776 HydrophobicContact CD-CD2 4.11Å; K747-L776 HydrophobicContact CD-CG 4.4Å
748	E	92.5	Very high	90.9	Very high	27 Å²	27	32 Å²	32	13%	0.126	15%	0.154	C	C	.	.	H	α-helix	trans	-63.3	-48.5	177.1	-75	178.9	173.4	0	0	112.8	V744 K745 L751 R752 L776 V780 V784	V744-E748 WeakPolarHBondContact O-CG 3.33Å; V744-E748 PolarHBondContact O-N 3.5Å; K745-E748 WeakPolarHBondContact CD-OE2 3.39Å; K745-E748 IonicContact NZ-OE1 4Å; K745-E748 IonicContact NZ-OE2 2.74Å; K745-E748 PolarHBondContact NZ-OE2 2.74Å; K745-E748 PolarHBondContact O-N 3.28Å; E748-L751 WeakPolarHBondContact O-CB 3.47Å; E748-L751 PolarHBondContact O-N 2.83Å; E748-R752 PolarHBondContact O-N 3.44Å; E748-R752 VanDerWaalsContact O-N 3.16Å; E748-L776 HydrophobicContact CG-CD1 4.4Å; E748-V780 HydrophobicContact CG-CG1 4.13Å; E748-V784 HydrophobicContact CG-CG2 4.4Å
749	E	92.1	Very high	90.7	Very high	37 Å²	37	32.7 Å²	32.7	17%	0.173	16%	0.159	C	C	.	.	H	α-helix	trans	-81.7	-24.5	-175.2	-64.2	-63	167.2	0	0	112.9	L655 P659 M707 K745 R752 S753	L655-E749 HydrophobicContact CD2-CB 4.32Å; L655-E749 HydrophobicContact CD2-CG 4.49Å; P659-E749 HydrophobicContact CG-CB 3.93Å; P659-E749 HydrophobicContact CG-CG 4.41Å; P659-E749 WeakPolarHBondContact CG-OE2 3.31Å; M707-E749 HydrophobicContact CE-CB 3.31Å; K745-E749 PolarHBondContact O-N 3.43Å; E749-R752 PolarHBondContact O-N 2.91Å; E749-R752 IonicContact OE1-NE 2.64Å; E749-R752 WeakPolarHBondContact OE2-CD 3.47Å; E749-R752 IonicContact OE2-NE 2.69Å; E749-R752 PolarHBondContact OE2-NE 3.45Å; E749-S753 WeakPolarHBondContact O-CB 3.23Å; E749-S753 PolarHBondContact O-N 3.16Å; E749-S753 PolarHBondContact O-OG 2.83Å
750	S	93.2	Very high	90.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-72.4	-33.8	169	60.2	0	0	0	0	112.3	W712 I746 K747 S753 F754	W712-S750 VanDerWaalsContact CB-OG 3.28Å; W712-S750 WeakPolarHBondContact CB-OG 3.21Å; I746-S750 WeakPolarHBondContact O-CB 3.4Å; I746-S750 PolarHBondContact O-N 2.88Å; I746-S750 PolarHBondContact O-OG 2.94Å; K747-S750 WeakPolarHBondContact CA-OG 3.48Å; K747-S750 PolarHBondContact O-OG 3.42Å; K747-S750 VanDerWaalsContact O-OG 3.13Å; S750-S753 PolarHBondContact O-N 3.22Å; S750-F754 VanDerWaalsContact O-CB 3.23Å; S750-F754 WeakPolarHBondContact O-CB 3.34Å; S750-F754 PolarHBondContact O-N 2.65Å
751	L	92.4	Very high	90.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.9	-45.5	168	169.7	66.6	0	0	0	110.9	K747 E748 F754 L755 L770 F774 I781 V784	K747-L751 WeakPolarHBondContact O-CB 3.27Å; K747-L751 PolarHBondContact O-N 3.39Å; K747-L751 VanDerWaalsContact O-N 3.11Å; E748-L751 WeakPolarHBondContact O-CB 3.47Å; E748-L751 PolarHBondContact O-N 2.83Å; L751-F754 PolarHBondContact O-N 3.29Å; L751-L755 HydrophobicContact CD1-CD1 3.99Å; L751-L755 HydrophobicContact CD1-CG 4.18Å; L751-L755 HydrophobicContact CG-CD1 4.17Å; L751-L755 WeakPolarHBondContact O-CB 3.35Å; L751-L755 WeakPolarHBondContact O-CG 3.4Å; L751-L755 PolarHBondContact O-N 2.99Å; L751-L770 HydrophobicContact CD1-CD1 4.46Å; L751-L770 HydrophobicContact CD1-CD2 4Å; L751-F774 HydrophobicContact CB-CD1 4.06Å; L751-F774 HydrophobicContact CB-CD2 4.39Å; L751-F774 HydrophobicContact CB-CE1 4.13Å; L751-F774 HydrophobicContact CB-CE2 4.45Å; L751-F774 HydrophobicContact CB-CG 4.21Å; L751-F774 HydrophobicContact CB-CZ 4.33Å; L751-F774 HydrophobicContact CD1-CD2 3.75Å; L751-F774 HydrophobicContact CD1-CE2 3.7Å; L751-F774 HydrophobicContact CD1-CG 4.36Å; L751-F774 HydrophobicContact CD1-CZ 4.28Å; L751-I781 HydrophobicContact CD2-CB 4.41Å; L751-I781 HydrophobicContact CD2-CG1 4.04Å; L751-I781 HydrophobicContact CD2-CG2 4.17Å; L751-V784 HydrophobicContact CD2-CG1 4.34Å
752	R	91.5	Very high	90	Very high	34 Å²	34	34.9 Å²	34.9	13%	0.128	18%	0.182	C	C	.	.	H	α-helix	trans	-59.8	-49.1	174.9	-73.2	170.7	49.7	74.5	4	111.5	P659 E748 E749 F754 L755 F756 V784 M788 E793	P659-R752 HydrophobicContact CB-CB 4.39Å; E748-R752 PolarHBondContact O-N 3.44Å; E748-R752 VanDerWaalsContact O-N 3.16Å; E749-R752 PolarHBondContact O-N 2.91Å; E749-R752 IonicContact OE1-NE 2.64Å; E749-R752 WeakPolarHBondContact OE2-CD 3.47Å; E749-R752 IonicContact OE2-NE 2.69Å; E749-R752 PolarHBondContact OE2-NE 3.45Å; R752-F754 VanDerWaalsContact C-N 3.34Å; R752-F754 PolarHBondContact O-N 3.36Å; R752-L755 PolarHBondContact O-N 3.49Å; R752-F756 HydrophobicContact CB-CE2 4.25Å; R752-F756 WeakPolarHBondContact O-CD2 3.32Å; R752-F756 WeakPolarHBondContact O-CG 3.09Å; R752-F756 PolarHBondContact O-N 3.2Å; R752-V784 HydrophobicContact CG-CG1 3.6Å; R752-M788 HydrophobicContact CB-CE 4.48Å; R752-M788 HydrophobicContact CB-SD 4.49Å; R752-M788 HydrophobicContact CG-CE 4.44Å; R752-M788 HydrophobicContact CG-CG 4.5Å; R752-M788 HydrophobicContact CG-SD 3.85Å; R752-E793 IonicContact CZ-OE2 2.67Å; R752-E793 VanDerWaalsContact CZ-OE2 3.3Å; R752-E793 IonicContact NH1-OE2 2.83Å; R752-E793 PolarHBondContact NH1-OE2 3.13Å; R752-E793 IonicContact NH2-OE1 2.77Å; R752-E793 IonicContact NH2-OE2 2.9Å; R752-E793 PolarHBondContact NH2-OE2 3.01Å
753	S	90.2	Very high	89.8	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.3	-39.5	178.1	-53.9	0	0	0	0	112.6	E749 S750 F756 T757	E749-S753 WeakPolarHBondContact O-CB 3.23Å; E749-S753 PolarHBondContact O-N 3.16Å; E749-S753 PolarHBondContact O-OG 2.83Å; S750-S753 PolarHBondContact O-N 3.22Å; S753-F756 PolarHBondContact O-N 3.5Å; S753-T757 WeakPolarHBondContact O-CG2 3.4Å; S753-T757 PolarHBondContact O-N 3.11Å; S753-T757 PolarHBondContact O-OG1 3.19Å
754	F	91	Very high	89.6	Confident	41 Å²	41	39.6 Å²	39.6	18%	0.18	22%	0.216	C	C	.	.	H	α-helix	trans	-63.2	-46.5	173.9	179.1	-83.9	0	0	0	111.6	S750 L751 R752 F756 T757 F758 M765 F774	S750-F754 VanDerWaalsContact O-CB 3.23Å; S750-F754 WeakPolarHBondContact O-CB 3.34Å; S750-F754 PolarHBondContact O-N 2.65Å; L751-F754 PolarHBondContact O-N 3.29Å; R752-F754 VanDerWaalsContact C-N 3.34Å; R752-F754 PolarHBondContact O-N 3.36Å; F754-F756 VanDerWaalsContact C-N 3.33Å; F754-F756 PolarHBondContact O-N 3.28Å; F754-T757 PolarHBondContact O-N 3.44Å; F754-T757 PolarHBondContact O-OG1 3.09Å; F754-F758 HydrophobicContact CD1-CD2 4.34Å; F754-F758 AromaticContact CD2-CD2 3.39Å; F754-F758 HydrophobicContact CD2-CD2 3.39Å; F754-F758 AromaticContact CD2-CE2 3.65Å; F754-F758 HydrophobicContact CD2-CE2 3.65Å; F754-F758 HydrophobicContact CE1-CB 4.32Å; F754-F758 HydrophobicContact CE1-CD2 4.28Å; F754-F758 AromaticContact CE2-CD2 3.36Å; F754-F758 HydrophobicContact CE2-CD2 3.36Å; F754-F758 AromaticContact CE2-CE2 3.71Å; F754-F758 HydrophobicContact CE2-CE2 3.71Å; F754-F758 HydrophobicContact CE2-CG 4.19Å; F754-F758 AromaticContact CG-CD2 3.9Å; F754-F758 HydrophobicContact CG-CD2 3.9Å; F754-F758 HydrophobicContact CG-CE2 4.48Å; F754-F758 HydrophobicContact CZ-CB 4.26Å; F754-F758 AromaticContact CZ-CD2 3.81Å; F754-F758 HydrophobicContact CZ-CD2 3.81Å; F754-F758 HydrophobicContact CZ-CG 4.27Å; F754-F758 WeakPolarHBondContact O-CB 3.49Å; F754-F758 WeakPolarHBondContact O-CD2 3.33Å; F754-F758 PolarHBondContact O-N 2.99Å; F754-M765 HydrophobicContact CE1-CE 3.82Å; F754-M765 HydrophobicContact CE1-SD 4.46Å; F754-M765 HydrophobicContact CZ-CE 4.44Å; F754-F774 HydrophobicContact CB-CZ 3.75Å; F754-F774 HydrophobicContact CD1-CE2 4.4Å; F754-F774 HydrophobicContact CD1-CZ 4.36Å; F754-F774 HydrophobicContact CD2-CZ 4.25Å; F754-F774 HydrophobicContact CG-CE2 4.32Å; F754-F774 AromaticContact CG-CZ 3.84Å; F754-F774 HydrophobicContact CG-CZ 3.84Å
755	L	89.3	Confident	89.4	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-64.8	-35.9	179.5	-73	172.2	0	0	0	112.1	L751 R752 S759 M765 I785 M788 L805 M807	L751-L755 HydrophobicContact CD1-CD1 3.99Å; L751-L755 HydrophobicContact CD1-CG 4.18Å; L751-L755 HydrophobicContact CG-CD1 4.17Å; L751-L755 WeakPolarHBondContact O-CB 3.35Å; L751-L755 WeakPolarHBondContact O-CG 3.4Å; L751-L755 PolarHBondContact O-N 2.99Å; R752-L755 PolarHBondContact O-N 3.49Å; L755-S759 WeakPolarHBondContact O-CB 3.5Å; L755-S759 PolarHBondContact O-N 3.44Å; L755-S759 VanDerWaalsContact O-N 3.08Å; L755-M765 HydrophobicContact CD2-SD 4.04Å; L755-I785 HydrophobicContact CD1-CD1 4.35Å; L755-I785 HydrophobicContact CD1-CG1 3.88Å; L755-M788 HydrophobicContact CB-CE 3.88Å; L755-M788 HydrophobicContact CD1-CE 4.22Å; L755-M788 HydrophobicContact CD1-SD 3.91Å; L755-L805 HydrophobicContact CD2-CD2 4.12Å; L755-M807 HydrophobicContact CD2-CE 4.17Å
756	F	87.7	Confident	89.4	Confident	23 Å²	23	38.3 Å²	38.3	10%	0.101	21%	0.211	C	C	.	.	H	α-helix	trans	-70.6	-40.3	174.5	-66.4	-48.3	0	0	0	113.6	P659 A662 A663 R752 S753 F754 S759 M788 E793	P659-F756 HydrophobicContact CB-CE2 4.3Å; P659-F756 WeakPolarHBondContact O-CD2 3.27Å; P659-F756 WeakPolarHBondContact O-CE2 3.45Å; A662-F756 HydrophobicContact CB-CB 3.88Å; A662-F756 HydrophobicContact CB-CD2 4.32Å; A663-F756 HydrophobicContact CB-CD1 3.96Å; A663-F756 HydrophobicContact CB-CD2 3.96Å; A663-F756 HydrophobicContact CB-CE1 3.95Å; A663-F756 HydrophobicContact CB-CE2 3.94Å; A663-F756 HydrophobicContact CB-CG 3.98Å; A663-F756 HydrophobicContact CB-CZ 3.94Å; R752-F756 HydrophobicContact CB-CE2 4.25Å; R752-F756 WeakPolarHBondContact O-CD2 3.32Å; R752-F756 WeakPolarHBondContact O-CG 3.09Å; R752-F756 PolarHBondContact O-N 3.2Å; S753-F756 PolarHBondContact O-N 3.5Å; F754-F756 VanDerWaalsContact C-N 3.33Å; F754-F756 PolarHBondContact O-N 3.28Å; F756-S759 PolarHBondContact O-OG 2.82Å; F756-M788 HydrophobicContact CD1-CE 4Å; F756-M788 HydrophobicContact CD2-CE 4.44Å; F756-M788 HydrophobicContact CE1-CE 3.48Å; F756-M788 VanDerWaalsContact CE1-CE 3.48Å; F756-M788 HydrophobicContact CE2-CE 4Å; F756-M788 HydrophobicContact CG-CE 4.44Å; F756-M788 HydrophobicContact CZ-CE 3.49Å; F756-M788 VanDerWaalsContact CZ-CE 3.49Å; F756-E793 HydrophobicContact CE1-CB 3.83Å; F756-E793 HydrophobicContact CZ-CB 3.9Å
757	T	85.9	Confident	89.1	Confident	37 Å²	37	38.4 Å²	38.4	23%	0.227	21%	0.212	C	C	.	.	H	α-helix	trans	-78.2	-27	-177.6	46.8	0	0	0	0	113.7	A662 S753 F754	A662-T757 HydrophobicContact CB-CG2 4.06Å; S753-T757 WeakPolarHBondContact O-CG2 3.4Å; S753-T757 PolarHBondContact O-N 3.11Å; S753-T757 PolarHBondContact O-OG1 3.19Å; F754-T757 PolarHBondContact O-N 3.44Å; F754-T757 PolarHBondContact O-OG1 3.09Å
758	F	86.7	Confident	89	Confident	58 Å²	58	40.8 Å²	40.8	25%	0.254	23%	0.225	S	C	.	.	H	α-helix	trans	-116.1	6.6	-175.7	-58.8	-67.9	0	0	0	114.8	F754 A760 I761 H762	F754-F758 HydrophobicContact CD1-CD2 4.34Å; F754-F758 AromaticContact CD2-CD2 3.39Å; F754-F758 HydrophobicContact CD2-CD2 3.39Å; F754-F758 AromaticContact CD2-CE2 3.65Å; F754-F758 HydrophobicContact CD2-CE2 3.65Å; F754-F758 HydrophobicContact CE1-CB 4.32Å; F754-F758 HydrophobicContact CE1-CD2 4.28Å; F754-F758 AromaticContact CE2-CD2 3.36Å; F754-F758 HydrophobicContact CE2-CD2 3.36Å; F754-F758 AromaticContact CE2-CE2 3.71Å; F754-F758 HydrophobicContact CE2-CE2 3.71Å; F754-F758 HydrophobicContact CE2-CG 4.19Å; F754-F758 AromaticContact CG-CD2 3.9Å; F754-F758 HydrophobicContact CG-CD2 3.9Å; F754-F758 HydrophobicContact CG-CE2 4.48Å; F754-F758 HydrophobicContact CZ-CB 4.26Å; F754-F758 AromaticContact CZ-CD2 3.81Å; F754-F758 HydrophobicContact CZ-CD2 3.81Å; F754-F758 HydrophobicContact CZ-CG 4.27Å; F754-F758 WeakPolarHBondContact O-CB 3.49Å; F754-F758 WeakPolarHBondContact O-CD2 3.33Å; F754-F758 PolarHBondContact O-N 2.99Å; F758-A760 PolarHBondContact O-N 3.08Å; F758-I761 HydrophobicContact CD1-CD1 4.11Å; F758-I761 PolarHBondContact O-N 2.98Å; F758-H762 PolarHBondContact O-CD2 3.11Å; F758-H762 PolarHBondContact O-N 3.09Å
759	S	85.4	Confident	88.9	Confident	20 Å²	20	46.9 Å²	46.9	14%	0.14	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-55.3	-37.8	173	52.3	0	0	0	0	112.5	L755 F756 I761 H762 E811	L755-S759 WeakPolarHBondContact O-CB 3.5Å; L755-S759 PolarHBondContact O-N 3.44Å; L755-S759 VanDerWaalsContact O-N 3.08Å; F756-S759 PolarHBondContact O-OG 2.82Å; S759-I761 PolarHBondContact O-N 3.09Å; S759-I761 VanDerWaalsContact O-N 3.11Å; S759-H762 PolarHBondContact O-N 2.93Å; S759-E811 VanDerWaalsContact C-OE1 3.27Å; S759-E811 WeakPolarHBondContact CB-OE1 3.32Å; S759-E811 PolarHBondContact OG-OE1 3.35Å
760	A	81.7	Confident	88.9	Confident	67 Å²	67	45.2 Å²	45.2	55%	0.554	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-56.9	-27.3	179.7	0	0	0	0	0	114.7	F758 E811	F758-A760 PolarHBondContact O-N 3.08Å; A760-E811 WeakPolarHBondContact CA-OE1 3.41Å; A760-E811 WeakPolarHBondContact CA-OE2 3.42Å; A760-E811 WeakPolarHBondContact CB-OE2 3.28Å; A760-E811 PolarHBondContact N-OE1 3.16Å
761	I	86.7	Confident	88.8	Confident	118 Å²	118	46.7 Å²	46.7	61%	0.605	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-105.7	-21.8	-166.5	-47.3	-173.3	0	0	0	111.5	F758 S759	F758-I761 HydrophobicContact CD1-CD1 4.11Å; F758-I761 PolarHBondContact O-N 2.98Å; S759-I761 PolarHBondContact O-N 3.09Å; S759-I761 VanDerWaalsContact O-N 3.11Å
762	H	87.6	Confident	88.8	Confident	62 Å²	62	53.1 Å²	53.1	29%	0.287	28%	0.281	S	S	.	.			trans	-106.5	109.9	-172.2	-68.5	-47.4	0	0	0	112.3	F758 S759 M765 M807	F758-H762 PolarHBondContact O-CD2 3.11Å; F758-H762 PolarHBondContact O-N 3.09Å; S759-H762 PolarHBondContact O-N 2.93Å; H762-M765 HydrophobicContact CB-CG 3.82Å; H762-M765 HydrophobicContact CB-SD 4.03Å; H762-M807 VanDerWaalsContact O-CB 3.28Å; H762-M807 WeakPolarHBondContact O-CB 2.94Å; H762-M807 WeakPolarHBondContact O-CG 3.28Å
763	D	87.6	Confident	88.7	Confident	91 Å²	91	54.1 Å²	54.1	49%	0.487	29%	0.293	S	S	.	.	S	Bend	trans	-64.9	-43.3	173.4	-73.4	20.1	0	0	0	112.3	M807 K809	D763-M807 PolarHBondContact O-N 3.47Å; D763-K809 WeakPolarHBondContact OD1-CE 3.37Å; D763-K809 IonicContact OD1-NZ 3.57Å; D763-K809 PolarHBondContact OD1-NZ 3.17Å; D763-K809 VanDerWaalsContact OD2-CE 3.22Å; D763-K809 WeakPolarHBondContact OD2-CE 3.43Å; D763-K809 IonicContact OD2-NZ 2.71Å; D763-K809 PolarHBondContact OD2-NZ 3.34Å
764	S	88.9	Confident	88.7	Confident	80 Å²	80	54.4 Å²	54.4	56%	0.559	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.3	151.1	175.4	62.4	0	0	0	0	112.2	L805	S764-L805 CarbonylContact C-O 3.54Å; S764-L805 WeakPolarHBondContact CA-O 3.39Å
765	M	88.4	Confident	88.7	Confident	25 Å²	25	57.2 Å²	57.2	12%	0.123	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	130.9	-178.7	-58.1	-166	78.3	0	0	110.4	F754 L755 H762 L770 L805	F754-M765 HydrophobicContact CE1-CE 3.82Å; F754-M765 HydrophobicContact CE1-SD 4.46Å; F754-M765 HydrophobicContact CZ-CE 4.44Å; L755-M765 HydrophobicContact CD2-SD 4.04Å; H762-M765 HydrophobicContact CB-CG 3.82Å; H762-M765 HydrophobicContact CB-SD 4.03Å; M765-L770 HydrophobicContact CE-CD2 3.77Å; M765-L770 HydrophobicContact SD-CD2 4.48Å; M765-L805 HydrophobicContact CB-CB 4.44Å; M765-L805 PolarHBondContact N-O 3.44Å; M765-L805 PolarHBondContact O-N 3.16Å
766	T	90.7	Very high	88.8	Confident	69 Å²	69	57.7 Å²	57.7	42%	0.423	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	138.2	173.9	54.6	0	0	0	0	111.5	D768 R769 L770 D803	T766-D768 PolarHBondContact O-N 3.47Å; T766-R769 PolarHBondContact O-N 3.08Å; T766-R769 WeakPolarHBondContact OG1-CB 3.4Å; T766-L770 PolarHBondContact O-N 3.47Å; T766-D803 CarbonylContact C-O 3.49Å; T766-D803 WeakPolarHBondContact CA-O 3.18Å
767	L	88.8	Confident	89	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.016	33%	0.328	C	S	.	.	H	α-helix	trans	-59.3	-33.7	175.8	-64.6	-178.5	0	0	0	111.3	R769 L770 S771 I781 Y782 I785 L798 D803	L767-R769 VanDerWaalsContact C-N 3.32Å; L767-R769 PolarHBondContact O-N 3.27Å; L767-L770 HydrophobicContact CD2-CD1 4.49Å; L767-L770 PolarHBondContact O-N 3.39Å; L767-S771 VanDerWaalsContact O-CB 3.3Å; L767-S771 WeakPolarHBondContact O-CB 3.1Å; L767-S771 PolarHBondContact O-N 2.97Å; L767-I781 HydrophobicContact CD2-CG2 3.97Å; L767-Y782 HydrophobicContact CD1-CD2 4.23Å; L767-I785 HydrophobicContact CD2-CD1 3.62Å; L767-L798 HydrophobicContact CD1-CD1 4.19Å; L767-L798 HydrophobicContact CD2-CD1 4.22Å; L767-L798 HydrophobicContact CG-CD1 4.32Å; L767-D803 HydrophobicContact CB-CB 4.29Å; L767-D803 HydrophobicContact CD1-CB 4.29Å; L767-D803 HydrophobicContact CG-CB 4.46Å; L767-D803 WeakPolarHBondContact CG-O 2.9Å; L767-D803 PolarHBondContact N-O 2.99Å
768	D	90.6	Very high	89.2	Confident	64 Å²	64	62.1 Å²	62.1	34%	0.342	33%	0.334	S	S	.	.	H	α-helix	trans	-59.3	-41	174	-67	54.6	0	0	0	112	T766 S771 M772 K778	T766-D768 PolarHBondContact O-N 3.47Å; D768-S771 PolarHBondContact O-N 3.37Å; D768-M772 WeakPolarHBondContact O-CG 3.35Å; D768-M772 PolarHBondContact O-N 3Å; D768-K778 WeakPolarHBondContact OD1-CE 3.44Å; D768-K778 IonicContact OD1-NZ 3.71Å; D768-K778 PolarHBondContact OD1-NZ 3.11Å; D768-K778 VanDerWaalsContact OD2-CE 3.23Å; D768-K778 WeakPolarHBondContact OD2-CE 3.28Å; D768-K778 IonicContact OD2-NZ 3.54Å; D768-K778 PolarHBondContact OD2-NZ 3.17Å
769	R	90.8	Very high	89.4	Confident	154 Å²	154	63.4 Å²	63.4	58%	0.581	35%	0.35	S	S	*	.	H	α-helix	trans	-69.9	-41	177.5	-174.3	57.8	176.1	-172.2	1.5	111.3	T766 L767 S771 M772 C773	T766-R769 PolarHBondContact O-N 3.08Å; T766-R769 WeakPolarHBondContact OG1-CB 3.4Å; L767-R769 VanDerWaalsContact C-N 3.32Å; L767-R769 PolarHBondContact O-N 3.27Å; R769-S771 VanDerWaalsContact C-N 3.35Å; R769-M772 PolarHBondContact O-N 3.44Å; R769-C773 WeakPolarHBondContact O-CB 3.48Å; R769-C773 PolarHBondContact O-N 2.74Å; R769-C773 PolarHBondContact O-SG 3.43Å
770	L	91	Very high	89.8	Confident	3 Å²	3	64.1 Å²	64.1	2%	0.016	35%	0.354	C	S	.	.	H	α-helix	trans	-62.5	-41.7	174.2	-67.4	174.5	0	0	0	111.6	L751 M765 T766 L767 M772 C773 F774 I781 I785	L751-L770 HydrophobicContact CD1-CD1 4.46Å; L751-L770 HydrophobicContact CD1-CD2 4Å; M765-L770 HydrophobicContact CE-CD2 3.77Å; M765-L770 HydrophobicContact SD-CD2 4.48Å; T766-L770 PolarHBondContact O-N 3.47Å; L767-L770 HydrophobicContact CD2-CD1 4.49Å; L767-L770 PolarHBondContact O-N 3.39Å; L770-M772 PolarHBondContact O-N 2.9Å; L770-C773 PolarHBondContact O-N 2.75Å; L770-F774 HydrophobicContact CD2-CD2 4.49Å; L770-F774 HydrophobicContact CD2-CE2 4.25Å; L770-F774 PolarHBondContact O-N 3.25Å; L770-I781 HydrophobicContact CB-CD1 4.23Å; L770-I781 HydrophobicContact CB-CG2 4.21Å; L770-I781 HydrophobicContact CD1-CG2 4.31Å; L770-I785 HydrophobicContact CD1-CD1 3.85Å
771	S	92	Very high	90.3	Very high	31 Å²	31	61 Å²	61	22%	0.217	33%	0.327	C	S	.	.	H	α-helix	trans	-58.4	-46.1	174.5	179.8	0	0	0	0	112.1	L767 D768 R769 E775 L776	L767-S771 VanDerWaalsContact O-CB 3.3Å; L767-S771 WeakPolarHBondContact O-CB 3.1Å; L767-S771 PolarHBondContact O-N 2.97Å; D768-S771 PolarHBondContact O-N 3.37Å; R769-S771 VanDerWaalsContact C-N 3.35Å; S771-E775 WeakPolarHBondContact O-CA 3.41Å; S771-E775 PolarHBondContact O-N 3.4Å; S771-L776 PolarHBondContact OG-O 3.42Å; S771-L776 VanDerWaalsContact OG-O 3.08Å
772	M	91.7	Very high	90.5	Very high	134 Å²	134	60.1 Å²	60.1	66%	0.66	32%	0.318	S	S	*	.	H	α-helix	trans	-66.8	-35.3	174.7	-69.5	178.2	-174.7	0	0	113.6	D768 R769 L770	D768-M772 WeakPolarHBondContact O-CG 3.35Å; D768-M772 PolarHBondContact O-N 3Å; R769-M772 PolarHBondContact O-N 3.44Å; L770-M772 PolarHBondContact O-N 2.9Å
773	C	90	Very high	90.7	Very high	56 Å²	56	59.6 Å²	59.6	38%	0.378	32%	0.321	S	S	.	.	H	α-helix	trans	-76.5	-39.2	-177.8	-75.2	0	0	0	0	113.3	W712 R769 L770	W712-C773 PolarHBondContact NE1-O 2.93Å; R769-C773 WeakPolarHBondContact O-CB 3.48Å; R769-C773 PolarHBondContact O-N 2.74Å; R769-C773 PolarHBondContact O-SG 3.43Å; L770-C773 PolarHBondContact O-N 2.75Å
774	F	90.6	Very high	90.9	Very high	6 Å²	6	55.5 Å²	55.5	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-100.8	-6	-176.2	-70.1	-84.6	0	0	0	114.2	W712 K747 L751 F754 L770 L776	W712-F774 AromaticContact CD1-CD1 3.52Å; W712-F774 AromaticContact CD1-CE1 3.9Å; W712-F774 HydrophobicContact CG-CD1 4.28Å; K747-F774 WeakPolarHBondContact CD-O 3.47Å; K747-F774 WeakPolarHBondContact CE-O 3.38Å; L751-F774 HydrophobicContact CB-CD1 4.06Å; L751-F774 HydrophobicContact CB-CD2 4.39Å; L751-F774 HydrophobicContact CB-CE1 4.13Å; L751-F774 HydrophobicContact CB-CE2 4.45Å; L751-F774 HydrophobicContact CB-CG 4.21Å; L751-F774 HydrophobicContact CB-CZ 4.33Å; L751-F774 HydrophobicContact CD1-CD2 3.75Å; L751-F774 HydrophobicContact CD1-CE2 3.7Å; L751-F774 HydrophobicContact CD1-CG 4.36Å; L751-F774 HydrophobicContact CD1-CZ 4.28Å; F754-F774 HydrophobicContact CB-CZ 3.75Å; F754-F774 HydrophobicContact CD1-CE2 4.4Å; F754-F774 HydrophobicContact CD1-CZ 4.36Å; F754-F774 HydrophobicContact CD2-CZ 4.25Å; F754-F774 HydrophobicContact CG-CE2 4.32Å; F754-F774 AromaticContact CG-CZ 3.84Å; F754-F774 HydrophobicContact CG-CZ 3.84Å; L770-F774 HydrophobicContact CD2-CD2 4.49Å; L770-F774 HydrophobicContact CD2-CE2 4.25Å; L770-F774 PolarHBondContact O-N 3.25Å; F774-L776 HydrophobicContact CB-CD1 4.37Å; F774-L776 HydrophobicContact CB-CG 4.37Å; F774-L776 PolarHBondContact O-N 3.25Å
775	E	91.8	Very high	91.1	Very high	100 Å²	100	51.7 Å²	51.7	47%	0.467	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	40.2	-178.3	-63	169.6	-159.6	0	0	112	W712 K713 K747 S771	W712-E775 HydrophobicContact CH2-CB 4.49Å; W712-E775 HydrophobicContact CH2-CG 4.49Å; W712-E775 VanDerWaalsContact CH2-OE2 3.27Å; W712-E775 WeakPolarHBondContact CH2-OE2 3.36Å; W712-E775 HydrophobicContact CZ2-CB 4.08Å; W712-E775 VanDerWaalsContact CZ2-CD 3.46Å; W712-E775 HydrophobicContact CZ2-CG 3.93Å; K713-E775 VanDerWaalsContact CE-OE1 3.26Å; K713-E775 WeakPolarHBondContact CE-OE1 3.49Å; K713-E775 IonicContact NZ-OE1 3.46Å; K713-E775 PolarHBondContact NZ-OE1 2.76Å; K747-E775 IonicContact NZ-OE2 3.3Å; S771-E775 WeakPolarHBondContact O-CA 3.41Å; S771-E775 PolarHBondContact O-N 3.4Å
776	L	90.9	Very high	91.2	Very high	11 Å²	11	51.9 Å²	51.9	6%	0.058	28%	0.276	C	S	.	.			trans	-114.9	145.9	178.8	-75.2	179.2	0	0	0	111.1	K747 E748 S771 F774 I781	K747-L776 HydrophobicContact CB-CD1 3.89Å; K747-L776 HydrophobicContact CB-CD2 3.88Å; K747-L776 HydrophobicContact CB-CG 3.9Å; K747-L776 HydrophobicContact CD-CD2 4.11Å; K747-L776 HydrophobicContact CD-CG 4.4Å; E748-L776 HydrophobicContact CG-CD1 4.4Å; S771-L776 PolarHBondContact OG-O 3.42Å; S771-L776 VanDerWaalsContact OG-O 3.08Å; F774-L776 HydrophobicContact CB-CD1 4.37Å; F774-L776 HydrophobicContact CB-CG 4.37Å; F774-L776 PolarHBondContact O-N 3.25Å; L776-I781 HydrophobicContact CB-CD1 3.96Å; L776-I781 HydrophobicContact CB-CG1 3.85Å; L776-I781 HydrophobicContact CD1-CG1 4.42Å
777	P	92.5	Very high	91.2	Very high	73 Å²	73	55.3 Å²	55.3	47%	0.474	28%	0.281	S	S	.	.			trans	-58.7	141.5	173.6	-22.4	33	0	0	0	112.4	S779 V780 I781	P777-S779 PolarHBondContact O-N 2.94Å; P777-S779 VanDerWaalsContact O-N 3.09Å; P777-V780 HydrophobicContact CB-CG2 4.23Å; P777-V780 HydrophobicContact CG-CG2 4.2Å; P777-V780 PolarHBondContact O-N 3.42Å; P777-I781 PolarHBondContact O-N 3.12Å
778	K	89.4	Confident	91.2	Very high	79 Å²	79	55.2 Å²	55.2	34%	0.343	28%	0.28	S	S	.	.	H	α-helix	trans	-49.8	-37.9	176	-70.9	-169.2	173.9	-163.3	0	112.8	D768 I781 Y782 D803	D768-K778 WeakPolarHBondContact OD1-CE 3.44Å; D768-K778 IonicContact OD1-NZ 3.71Å; D768-K778 PolarHBondContact OD1-NZ 3.11Å; D768-K778 VanDerWaalsContact OD2-CE 3.23Å; D768-K778 WeakPolarHBondContact OD2-CE 3.28Å; D768-K778 IonicContact OD2-NZ 3.54Å; D768-K778 PolarHBondContact OD2-NZ 3.17Å; K778-I781 PolarHBondContact O-N 3.44Å; K778-Y782 VanDerWaalsContact O-CB 3.22Å; K778-Y782 WeakPolarHBondContact O-CB 3.4Å; K778-Y782 PolarHBondContact O-N 2.86Å; K778-D803 IonicContact NZ-OD2 3.77Å; K778-D803 PolarHBondContact NZ-OD2 3.04Å
779	S	91.8	Very high	91.2	Very high	86 Å²	86	54.4 Å²	54.4	60%	0.601	28%	0.275	S	S	*	.	H	α-helix	trans	-62.9	-40.5	178.4	50.7	0	0	0	0	113.5	P777 S783	P777-S779 PolarHBondContact O-N 2.94Å; P777-S779 VanDerWaalsContact O-N 3.09Å; S779-S783 WeakPolarHBondContact O-CB 3.3Å; S779-S783 PolarHBondContact O-N 3.45Å
780	V	92.4	Very high	91.2	Very high	35 Å²	35	53.3 Å²	53.3	21%	0.212	28%	0.28	C	S	.	.	H	α-helix	trans	-67.6	-49.4	177.1	178.9	0	0	0	0	109.3	E748 P777 Y782 S783 V784	E748-V780 HydrophobicContact CG-CG1 4.13Å; P777-V780 HydrophobicContact CB-CG2 4.23Å; P777-V780 HydrophobicContact CG-CG2 4.2Å; P777-V780 PolarHBondContact O-N 3.42Å; V780-Y782 PolarHBondContact O-N 3.42Å; V780-S783 PolarHBondContact O-N 2.72Å; V780-S783 VanDerWaalsContact O-N 3.08Å; V780-S783 PolarHBondContact O-OG 3.02Å; V780-V784 HydrophobicContact CG1-CG2 4.43Å; V780-V784 WeakPolarHBondContact O-CG2 3.23Å; V780-V784 PolarHBondContact O-N 2.9Å
781	I	92.3	Very high	91.1	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-57	-48.5	177.9	-64.7	174.5	0	0	0	111	L751 L767 L770 L776 P777 K778 S783 V784 I785	L751-I781 HydrophobicContact CD2-CB 4.41Å; L751-I781 HydrophobicContact CD2-CG1 4.04Å; L751-I781 HydrophobicContact CD2-CG2 4.17Å; L767-I781 HydrophobicContact CD2-CG2 3.97Å; L770-I781 HydrophobicContact CB-CD1 4.23Å; L770-I781 HydrophobicContact CB-CG2 4.21Å; L770-I781 HydrophobicContact CD1-CG2 4.31Å; L776-I781 HydrophobicContact CB-CD1 3.96Å; L776-I781 HydrophobicContact CB-CG1 3.85Å; L776-I781 HydrophobicContact CD1-CG1 4.42Å; P777-I781 PolarHBondContact O-N 3.12Å; K778-I781 PolarHBondContact O-N 3.44Å; I781-S783 VanDerWaalsContact C-N 3.33Å; I781-S783 PolarHBondContact O-N 2.81Å; I781-V784 PolarHBondContact O-N 3.29Å; I781-I785 HydrophobicContact CG2-CD1 3.6Å; I781-I785 HydrophobicContact CG2-CG1 4.41Å; I781-I785 WeakPolarHBondContact O-CB 3.42Å; I781-I785 WeakPolarHBondContact O-CG1 3.12Å; I781-I785 PolarHBondContact O-N 2.97Å
782	Y	91.7	Very high	90.7	Very high	101 Å²	101	64.3 Å²	64.3	40%	0.396	33%	0.331	S	S	.	.	H	α-helix	trans	-54.5	-48.2	174.3	-176.5	-78.7	0	0	0	111.1	L767 K778 V780 V784 I785 C786 L798	L767-Y782 HydrophobicContact CD1-CD2 4.23Å; K778-Y782 VanDerWaalsContact O-CB 3.22Å; K778-Y782 WeakPolarHBondContact O-CB 3.4Å; K778-Y782 PolarHBondContact O-N 2.86Å; V780-Y782 PolarHBondContact O-N 3.42Å; Y782-V784 PolarHBondContact O-N 2.67Å; Y782-I785 PolarHBondContact O-N 3.01Å; Y782-C786 WeakPolarHBondContact CE1-SG 3.24Å; Y782-C786 WeakPolarHBondContact O-CB 3.28Å; Y782-C786 PolarHBondContact O-N 2.76Å; Y782-C786 PolarHBondContact O-SG 2.89Å; Y782-C786 VanDerWaalsContact O-SG 3.33Å; Y782-L798 HydrophobicContact CD2-CD2 3.55Å; Y782-L798 HydrophobicContact CE2-CD2 3.29Å; Y782-L798 HydrophobicContact CG-CD2 4.44Å
783	S	92.1	Very high	90.3	Very high	51 Å²	51	61.3 Å²	61.3	36%	0.357	32%	0.315	S	S	.	.	H	α-helix	trans	-64.5	-36.4	-179.5	80.1	0	0	0	0	113.7	S779 V780 I781 R787	S779-S783 WeakPolarHBondContact O-CB 3.3Å; S779-S783 PolarHBondContact O-N 3.45Å; V780-S783 PolarHBondContact O-N 2.72Å; V780-S783 VanDerWaalsContact O-N 3.08Å; V780-S783 PolarHBondContact O-OG 3.02Å; I781-S783 VanDerWaalsContact C-N 3.33Å; I781-S783 PolarHBondContact O-N 2.81Å; S783-R787 WeakPolarHBondContact O-CB 3.22Å; S783-R787 PolarHBondContact O-N 3.08Å; S783-R787 VanDerWaalsContact O-N 3.12Å
784	V	91.9	Very high	89.9	Confident	4 Å²	4	59.2 Å²	59.2	2%	0.024	30%	0.3	C	S	.	.	H	α-helix	trans	-69.9	-47.7	177.6	171.1	0	0	0	0	110.3	E748 L751 R752 V780 I781 Y782 R787 M788	E748-V784 HydrophobicContact CG-CG2 4.4Å; L751-V784 HydrophobicContact CD2-CG1 4.34Å; R752-V784 HydrophobicContact CG-CG1 3.6Å; V780-V784 HydrophobicContact CG1-CG2 4.43Å; V780-V784 WeakPolarHBondContact O-CG2 3.23Å; V780-V784 PolarHBondContact O-N 2.9Å; I781-V784 PolarHBondContact O-N 3.29Å; Y782-V784 PolarHBondContact O-N 2.67Å; V784-R787 WeakPolarHBondContact O-CB 3.44Å; V784-R787 PolarHBondContact O-N 2.83Å; V784-M788 HydrophobicContact CG1-SD 4.3Å; V784-M788 WeakPolarHBondContact O-CG 3.27Å; V784-M788 PolarHBondContact O-N 2.77Å
785	I	91.7	Very high	89.7	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64.8	-45.9	179.1	-68.5	170.8	0	0	0	111	L755 L767 L770 I781 Y782 R787 M788 I789 L805	L755-I785 HydrophobicContact CD1-CD1 4.35Å; L755-I785 HydrophobicContact CD1-CG1 3.88Å; L767-I785 HydrophobicContact CD2-CD1 3.62Å; L770-I785 HydrophobicContact CD1-CD1 3.85Å; I781-I785 HydrophobicContact CG2-CD1 3.6Å; I781-I785 HydrophobicContact CG2-CG1 4.41Å; I781-I785 WeakPolarHBondContact O-CB 3.42Å; I781-I785 WeakPolarHBondContact O-CG1 3.12Å; I781-I785 PolarHBondContact O-N 2.97Å; Y782-I785 PolarHBondContact O-N 3.01Å; I785-R787 VanDerWaalsContact C-N 3.26Å; I785-R787 PolarHBondContact O-N 2.96Å; I785-M788 WeakPolarHBondContact O-CB 3.41Å; I785-M788 PolarHBondContact O-N 2.87Å; I785-M788 VanDerWaalsContact O-N 3.13Å; I785-I789 HydrophobicContact CG2-CD1 3.8Å; I785-I789 HydrophobicContact CG2-CG1 4.46Å; I785-I789 WeakPolarHBondContact O-CG1 3.13Å; I785-I789 PolarHBondContact O-N 3.01Å; I785-L805 HydrophobicContact CD1-CD2 4.38Å; I785-L805 HydrophobicContact CG2-CD1 3.7Å; I785-L805 HydrophobicContact CG2-CD2 4.37Å
786	C	90.6	Very high	89.5	Confident	29 Å²	29	56.9 Å²	56.9	20%	0.196	30%	0.299	C	S	.	.	H	α-helix	trans	-60	-37.1	175.6	-73	0	0	0	0	112	Y782 I789 I790	Y782-C786 WeakPolarHBondContact CE1-SG 3.24Å; Y782-C786 WeakPolarHBondContact O-CB 3.28Å; Y782-C786 PolarHBondContact O-N 2.76Å; Y782-C786 PolarHBondContact O-SG 2.89Å; Y782-C786 VanDerWaalsContact O-SG 3.33Å; C786-I789 PolarHBondContact O-N 2.57Å; C786-I790 WeakPolarHBondContact O-CB 3.03Å; C786-I790 WeakPolarHBondContact O-CD1 3.39Å; C786-I790 WeakPolarHBondContact O-CG1 3.47Å; C786-I790 PolarHBondContact O-N 3.39Å
787	R	91.9	Very high	89.3	Confident	142 Å²	142	58.4 Å²	58.4	54%	0.536	31%	0.311	S	S	.	.	H	α-helix	trans	-64.7	-42.3	174.5	-169.5	-179.7	-63.1	148.2	4	111.9	S783 V784 I785 I789 I790 N791	S783-R787 WeakPolarHBondContact O-CB 3.22Å; S783-R787 PolarHBondContact O-N 3.08Å; S783-R787 VanDerWaalsContact O-N 3.12Å; V784-R787 WeakPolarHBondContact O-CB 3.44Å; V784-R787 PolarHBondContact O-N 2.83Å; I785-R787 VanDerWaalsContact C-N 3.26Å; I785-R787 PolarHBondContact O-N 2.96Å; R787-I789 PolarHBondContact O-N 3.46Å; R787-I790 PolarHBondContact O-N 3.19Å; R787-N791 VanDerWaalsContact O-CB 3.32Å; R787-N791 WeakPolarHBondContact O-CB 3.39Å; R787-N791 PolarHBondContact O-N 2.93Å; R787-N791 PolarHBondContact O-OD1 3.35Å
788	M	88.3	Confident	89.1	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60.6	-42.7	174.7	-68.5	169	82	0	0	112.3	R752 L755 F756 V784 I785 Q792 E793 L794	R752-M788 HydrophobicContact CB-CE 4.48Å; R752-M788 HydrophobicContact CB-SD 4.49Å; R752-M788 HydrophobicContact CG-CE 4.44Å; R752-M788 HydrophobicContact CG-CG 4.5Å; R752-M788 HydrophobicContact CG-SD 3.85Å; L755-M788 HydrophobicContact CB-CE 3.88Å; L755-M788 HydrophobicContact CD1-CE 4.22Å; L755-M788 HydrophobicContact CD1-SD 3.91Å; F756-M788 HydrophobicContact CD1-CE 4Å; F756-M788 HydrophobicContact CD2-CE 4.44Å; F756-M788 HydrophobicContact CE1-CE 3.48Å; F756-M788 VanDerWaalsContact CE1-CE 3.48Å; F756-M788 HydrophobicContact CE2-CE 4Å; F756-M788 HydrophobicContact CG-CE 4.44Å; F756-M788 HydrophobicContact CZ-CE 3.49Å; F756-M788 VanDerWaalsContact CZ-CE 3.49Å; V784-M788 HydrophobicContact CG1-SD 4.3Å; V784-M788 WeakPolarHBondContact O-CG 3.27Å; V784-M788 PolarHBondContact O-N 2.77Å; I785-M788 WeakPolarHBondContact O-CB 3.41Å; I785-M788 PolarHBondContact O-N 2.87Å; I785-M788 VanDerWaalsContact O-N 3.13Å; M788-Q792 PolarHBondContact O-N 2.76Å; M788-E793 HydrophobicContact CB-CB 4.42Å; M788-E793 PolarHBondContact O-N 3.49Å; M788-L794 HydrophobicContact CB-CB 4.01Å; M788-L794 HydrophobicContact CE-CB 4.28Å; M788-L794 HydrophobicContact CE-CD2 4.33Å; M788-L794 PolarHBondContact O-N 3.44Å
789	I	89.9	Confident	89	Confident	47 Å²	47	57 Å²	57	24%	0.241	30%	0.3	C	S	.	.	H	α-helix	trans	-67.9	-44.6	179.1	-64.6	167.5	0	0	0	110.9	I785 C786 R787 N791 Q792 L805	I785-I789 HydrophobicContact CG2-CD1 3.8Å; I785-I789 HydrophobicContact CG2-CG1 4.46Å; I785-I789 WeakPolarHBondContact O-CG1 3.13Å; I785-I789 PolarHBondContact O-N 3.01Å; C786-I789 PolarHBondContact O-N 2.57Å; R787-I789 PolarHBondContact O-N 3.46Å; I789-N791 VanDerWaalsContact C-N 3.35Å; I789-N791 PolarHBondContact O-N 3.23Å; I789-Q792 PolarHBondContact O-N 2.97Å; I789-Q792 VanDerWaalsContact O-N 3.08Å; I789-L805 HydrophobicContact CD1-CD1 4.17Å
790	I	91.8	Very high	88.5	Confident	131 Å²	131	57.7 Å²	57.7	67%	0.672	30%	0.3	S	S	*	.	H	α-helix	trans	-63.2	-41	178.2	-70.4	165	0	0	0	111.4	C786 R787 Q792	C786-I790 WeakPolarHBondContact O-CB 3.03Å; C786-I790 WeakPolarHBondContact O-CD1 3.39Å; C786-I790 WeakPolarHBondContact O-CG1 3.47Å; C786-I790 PolarHBondContact O-N 3.39Å; R787-I790 PolarHBondContact O-N 3.19Å; I790-Q792 PolarHBondContact O-N 3.41Å
791	N	88.6	Confident	88	Confident	90 Å²	90	61.9 Å²	61.9	48%	0.481	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-2.7	176.7	-69.5	0.7	0	0	0	113.4	R787 I789 E793	R787-N791 VanDerWaalsContact O-CB 3.32Å; R787-N791 WeakPolarHBondContact O-CB 3.39Å; R787-N791 PolarHBondContact O-N 2.93Å; R787-N791 PolarHBondContact O-OD1 3.35Å; I789-N791 VanDerWaalsContact C-N 3.35Å; I789-N791 PolarHBondContact O-N 3.23Å; N791-E793 HydrophobicContact CB-CG 3.72Å; N791-E793 VanDerWaalsContact CB-OE1 3.28Å; N791-E793 WeakPolarHBondContact CB-OE1 3.18Å; N791-E793 PolarHBondContact ND2-OE1 3.47Å; N791-E793 PolarHBondContact O-N 2.97Å
792	Q	82.8	Confident	87.4	Confident	176 Å²	176	64.8 Å²	64.8	82%	0.822	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	21.3	-173.8	-52.1	-179.3	3.5	0	0	113.8	M788 I789 I790	M788-Q792 PolarHBondContact O-N 2.76Å; I789-Q792 PolarHBondContact O-N 2.97Å; I789-Q792 VanDerWaalsContact O-N 3.08Å; I790-Q792 PolarHBondContact O-N 3.41Å
793	E	83	Confident	87.1	Confident	71 Å²	71	62.5 Å²	62.5	33%	0.332	34%	0.343	S	S	.	.	S	Bend	trans	-72.7	-32.8	176.4	-65.7	169.1	-155.5	0	0	111.3	R752 F756 M788 N791	R752-E793 IonicContact CZ-OE2 2.67Å; R752-E793 VanDerWaalsContact CZ-OE2 3.3Å; R752-E793 IonicContact NH1-OE2 2.83Å; R752-E793 PolarHBondContact NH1-OE2 3.13Å; R752-E793 IonicContact NH2-OE1 2.77Å; R752-E793 IonicContact NH2-OE2 2.9Å; R752-E793 PolarHBondContact NH2-OE2 3.01Å; F756-E793 HydrophobicContact CE1-CB 3.83Å; F756-E793 HydrophobicContact CZ-CB 3.9Å; M788-E793 HydrophobicContact CB-CB 4.42Å; M788-E793 PolarHBondContact O-N 3.49Å; N791-E793 HydrophobicContact CB-CG 3.72Å; N791-E793 VanDerWaalsContact CB-OE1 3.28Å; N791-E793 WeakPolarHBondContact CB-OE1 3.18Å; N791-E793 PolarHBondContact ND2-OE1 3.47Å; N791-E793 PolarHBondContact O-N 2.97Å
794	L	83.3	Confident	86.9	Confident	11 Å²	11	60.7 Å²	60.7	6%	0.058	33%	0.331	C	S	.	.	S	Bend	trans	-125.9	121.4	-177.6	-174.4	69.7	0	0	0	110.9	M788 A796 L805 M807	M788-L794 HydrophobicContact CB-CB 4.01Å; M788-L794 HydrophobicContact CE-CB 4.28Å; M788-L794 HydrophobicContact CE-CD2 4.33Å; M788-L794 PolarHBondContact O-N 3.44Å; L794-A796 HydrophobicContact CD2-CB 3.9Å; L794-A796 HydrophobicContact CG-CB 3.88Å; L794-A796 PolarHBondContact O-N 3.47Å; L794-L805 HydrophobicContact CD2-CD2 4.24Å; L794-M807 HydrophobicContact CD1-CE 3.99Å; L794-M807 HydrophobicContact CD1-SD 4.4Å; L794-M807 HydrophobicContact CD2-CE 4.2Å; L794-M807 HydrophobicContact CD2-SD 4.34Å
795	A	84.7	Confident	86.7	Confident	51 Å²	51	60.5 Å²	60.5	42%	0.421	33%	0.33	S	S	.	.			trans	-77.5	70.7	175.8	0	0	0	0	0	111.2	H808 T810	A795-H808 WeakPolarHBondContact O-CB 3.45Å; A795-H808 PolarHBondContact O-N 3.02Å; A795-T810 WeakPolarHBondContact CB-OG1 3.21Å
796	A	87.5	Confident	86.6	Confident	7 Å²	7	63.6 Å²	63.6	6%	0.058	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	158.3	-178.8	0	0	0	0	0	112.7	L794 L805 I806 M807	L794-A796 HydrophobicContact CD2-CB 3.9Å; L794-A796 HydrophobicContact CG-CB 3.88Å; L794-A796 PolarHBondContact O-N 3.47Å; A796-L805 HydrophobicContact CB-CD1 3.53Å; A796-L805 HydrophobicContact CB-CG 4.11Å; A796-I806 WeakPolarHBondContact CA-O 3.48Å; A796-M807 HydrophobicContact CB-SD 3.48Å; A796-M807 WeakPolarHBondContact CB-SD 3.38Å
797	S	87.6	Confident	86.4	Confident	43 Å²	43	63 Å²	63	30%	0.301	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	146	173	50.6	0	0	0	0	109.7	I806 H808	S797-I806 PolarHBondContact N-O 3.31Å; S797-I806 PolarHBondContact O-N 3.31Å; S797-H808 WeakPolarHBondContact CB-NE2 3.17Å; S797-H808 PolarHBondContact OG-CE1 2.85Å; S797-H808 PolarHBondContact OG-NE2 3.08Å
798	L	88	Confident	86.1	Confident	36 Å²	36	60.4 Å²	60.4	19%	0.188	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	116.4	-178.7	-172.7	66.2	0	0	0	110.2	L767 Y782 V800 L805	L767-L798 HydrophobicContact CD1-CD1 4.19Å; L767-L798 HydrophobicContact CD2-CD1 4.22Å; L767-L798 HydrophobicContact CG-CD1 4.32Å; Y782-L798 HydrophobicContact CD2-CD2 3.55Å; Y782-L798 HydrophobicContact CE2-CD2 3.29Å; Y782-L798 HydrophobicContact CG-CD2 4.44Å; L798-V800 PolarHBondContact O-N 2.81Å; L798-L805 HydrophobicContact CD1-CB 4.36Å; L798-L805 HydrophobicContact CD1-CD1 4.47Å
799	E	88.3	Confident	85.5	Confident	87 Å²	87	67.9 Å²	67.9	41%	0.407	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	100.4	175.6	-176.4	172.5	-134.4	0	0	110	S802 D803 A804 I806	E799-S802 PolarHBondContact O-N 2.86Å; E799-S802 WeakPolarHBondContact OE2-CB 3.32Å; E799-S802 PolarHBondContact OE2-OG 3.32Å; E799-D803 PolarHBondContact O-N 2.87Å; E799-A804 PolarHBondContact N-O 3.2Å; E799-A804 PolarHBondContact O-N 3.44Å; E799-I806 HydrophobicContact CB-CD1 4.09Å
800	V	80.5	Confident	84.7	Confident	100 Å²	100	70.3 Å²	70.3	61%	0.606	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-57.3	-40	-176.8	-177.9	0	0	0	0	113.7	L798 S802	L798-V800 PolarHBondContact O-N 2.81Å; V800-S802 VanDerWaalsContact C-N 3.31Å; V800-S802 PolarHBondContact O-N 3.17Å
801	P	82.5	Confident	83.6	Confident	122 Å²	122	68.5 Å²	68.5	79%	0.792	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-67	-26.7	177.2	-24.8	35.9	0	0	0	115.4
802	S	78.1	Confident	83	Confident	61 Å²	61	71 Å²	71	43%	0.427	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-103.8	-4.3	-170.5	-59.6	0	0	0	0	113.8	E799 V800 A804	E799-S802 PolarHBondContact O-N 2.86Å; E799-S802 WeakPolarHBondContact OE2-CB 3.32Å; E799-S802 PolarHBondContact OE2-OG 3.32Å; V800-S802 VanDerWaalsContact C-N 3.31Å; V800-S802 PolarHBondContact O-N 3.17Å; S802-A804 PolarHBondContact O-N 3.33Å
803	D	85.3	Confident	83	Confident	54 Å²	54	66 Å²	66	29%	0.289	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.2	38.7	-166.1	-89.3	-8.9	0	0	0	111.3	T766 L767 K778 E799	T766-D803 CarbonylContact C-O 3.49Å; T766-D803 WeakPolarHBondContact CA-O 3.18Å; L767-D803 HydrophobicContact CB-CB 4.29Å; L767-D803 HydrophobicContact CD1-CB 4.29Å; L767-D803 HydrophobicContact CG-CB 4.46Å; L767-D803 WeakPolarHBondContact CG-O 2.9Å; L767-D803 PolarHBondContact N-O 2.99Å; K778-D803 IonicContact NZ-OD2 3.77Å; K778-D803 PolarHBondContact NZ-OD2 3.04Å; E799-D803 PolarHBondContact O-N 2.87Å
804	A	88	Confident	83	Confident	12 Å²	12	72.4 Å²	72.4	10%	0.099	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.1	-171.5	0	0	0	0	0	112.1	E799 S802	E799-A804 PolarHBondContact N-O 3.2Å; E799-A804 PolarHBondContact O-N 3.44Å; S802-A804 PolarHBondContact O-N 3.33Å
805	L	89	Confident	83.3	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	121.5	166.8	-176.7	65.5	0	0	0	108.5	L755 S764 M765 I785 I789 L794 A796 L798 M807	L755-L805 HydrophobicContact CD2-CD2 4.12Å; S764-L805 CarbonylContact C-O 3.54Å; S764-L805 WeakPolarHBondContact CA-O 3.39Å; M765-L805 HydrophobicContact CB-CB 4.44Å; M765-L805 PolarHBondContact N-O 3.44Å; M765-L805 PolarHBondContact O-N 3.16Å; I785-L805 HydrophobicContact CD1-CD2 4.38Å; I785-L805 HydrophobicContact CG2-CD1 3.7Å; I785-L805 HydrophobicContact CG2-CD2 4.37Å; I789-L805 HydrophobicContact CD1-CD1 4.17Å; L794-L805 HydrophobicContact CD2-CD2 4.24Å; A796-L805 HydrophobicContact CB-CD1 3.53Å; A796-L805 HydrophobicContact CB-CG 4.11Å; L798-L805 HydrophobicContact CD1-CB 4.36Å; L798-L805 HydrophobicContact CD1-CD1 4.47Å; L805-M807 HydrophobicContact CD2-CE 3.88Å; L805-M807 HydrophobicContact CD2-SD 3.82Å; L805-M807 HydrophobicContact CG-SD 3.91Å
806	I	89.8	Confident	83.5	Confident	65 Å²	65	81 Å²	81	33%	0.333	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	115.7	177.4	-58.2	173.6	0	0	0	107.5	A796 S797 E799	A796-I806 WeakPolarHBondContact CA-O 3.48Å; S797-I806 PolarHBondContact N-O 3.31Å; S797-I806 PolarHBondContact O-N 3.31Å; E799-I806 HydrophobicContact CB-CD1 4.09Å
807	M	86.4	Confident	83.4	Confident	16 Å²	16	81.1 Å²	81.1	8%	0.079	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	133.9	178.2	-56.2	-52.6	-143.5	0	0	109.9	L755 H762 D763 L794 A796 L805	L755-M807 HydrophobicContact CD2-CE 4.17Å; H762-M807 VanDerWaalsContact O-CB 3.28Å; H762-M807 WeakPolarHBondContact O-CB 2.94Å; H762-M807 WeakPolarHBondContact O-CG 3.28Å; D763-M807 PolarHBondContact O-N 3.47Å; L794-M807 HydrophobicContact CD1-CE 3.99Å; L794-M807 HydrophobicContact CD1-SD 4.4Å; L794-M807 HydrophobicContact CD2-CE 4.2Å; L794-M807 HydrophobicContact CD2-SD 4.34Å; A796-M807 HydrophobicContact CB-SD 3.48Å; A796-M807 WeakPolarHBondContact CB-SD 3.38Å; L805-M807 HydrophobicContact CD2-CE 3.88Å; L805-M807 HydrophobicContact CD2-SD 3.82Å; L805-M807 HydrophobicContact CG-SD 3.91Å
808	H	84.4	Confident	83.3	Confident	89 Å²	89	83.1 Å²	83.1	41%	0.412	42%	0.423	S	S	.	.			trans	-80	124.5	168.8	-60.5	-68.4	0	0	0	108.4	A795 S797 T810	A795-H808 WeakPolarHBondContact O-CB 3.45Å; A795-H808 PolarHBondContact O-N 3.02Å; S797-H808 WeakPolarHBondContact CB-NE2 3.17Å; S797-H808 PolarHBondContact OG-CE1 2.85Å; S797-H808 PolarHBondContact OG-NE2 3.08Å; H808-T810 HydrophobicContact CB-CG2 4.14Å; H808-T810 PolarHBondContact O-N 2.97Å; H808-T810 PolarHBondContact O-OG1 3.25Å
809	K	75.4	Confident	83.5	Confident	157 Å²	157	84 Å²	84	68%	0.683	44%	0.436	S	S	*	.	S	Bend	trans	-73.1	44.2	176.6	-60.5	-168.9	-179.8	-167.7	0	113	D763 E811	D763-K809 WeakPolarHBondContact OD1-CE 3.37Å; D763-K809 IonicContact OD1-NZ 3.57Å; D763-K809 PolarHBondContact OD1-NZ 3.17Å; D763-K809 VanDerWaalsContact OD2-CE 3.22Å; D763-K809 WeakPolarHBondContact OD2-CE 3.43Å; D763-K809 IonicContact OD2-NZ 2.71Å; D763-K809 PolarHBondContact OD2-NZ 3.34Å; K809-E811 VanDerWaalsContact C-N 3.32Å
810	T	74.3	Confident	83.4	Confident	98 Å²	98	83.6 Å²	83.6	60%	0.601	44%	0.437	S	S	*	.			trans	-91.3	4.2	178.5	47.1	0	0	0	0	112.6	A795 H808	A795-T810 WeakPolarHBondContact CB-OG1 3.21Å; H808-T810 HydrophobicContact CB-CG2 4.14Å; H808-T810 PolarHBondContact O-N 2.97Å; H808-T810 PolarHBondContact O-OG1 3.25Å
811	E	68.8	Low	83.6	Confident	93 Å²	93	80.8 Å²	80.8	44%	0.435	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-60.9	141.1	174.8	-69.2	-166.1	-173.3	0	0	112	S759 A760 K809	S759-E811 VanDerWaalsContact C-OE1 3.27Å; S759-E811 WeakPolarHBondContact CB-OE1 3.32Å; S759-E811 PolarHBondContact OG-OE1 3.35Å; A760-E811 WeakPolarHBondContact CA-OE1 3.41Å; A760-E811 WeakPolarHBondContact CA-OE2 3.42Å; A760-E811 WeakPolarHBondContact CB-OE2 3.28Å; A760-E811 PolarHBondContact N-OE1 3.16Å; K809-E811 VanDerWaalsContact C-N 3.32Å
812	R	75.7	Confident	84	Confident	143 Å²	143	80.1 Å²	80.1	54%	0.54	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-80.4	128.8	-173.3	-65	159	179.1	172.1	1.9	108.9	Q816 L820	R812-Q816 HydrophobicContact CB-CB 4.11Å; R812-L820 HydrophobicContact CG-CD1 4.4Å
813	S	83.5	Confident	84.7	Confident	71 Å²	71	80 Å²	80	50%	0.497	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-54.5	148.3	165.5	177	0	0	0	0	110	L815 Q816 A817	S813-L815 PolarHBondContact O-N 3.43Å; S813-Q816 CarbonylContact O-C 3.59Å; S813-Q816 WeakPolarHBondContact O-CA 3.3Å; S813-Q816 WeakPolarHBondContact O-CB 3.5Å; S813-Q816 PolarHBondContact O-N 3.16Å; S813-A817 PolarHBondContact O-N 2.85Å
814	R	82.4	Confident	84.8	Confident	205 Å²	205	80.3 Å²	80.3	77%	0.774	41%	0.407	S	S	*	.	H	α-helix	trans	-49.7	-34.5	175.6	-177.4	173.6	176.8	152	0.2	112.7	L818	R814-L818 HydrophobicContact CG-CD1 4.17Å; R814-L818 WeakPolarHBondContact O-CB 3.26Å; R814-L818 VanDerWaalsContact O-CG 3.24Å; R814-L818 WeakPolarHBondContact O-CG 3.29Å; R814-L818 PolarHBondContact O-N 3.29Å
815	L	89.8	Confident	84.9	Confident	132 Å²	132	85.2 Å²	85.2	69%	0.691	43%	0.426	S	S	*	.	H	α-helix	trans	-66.6	-41.6	174.6	-174	69.3	0	0	0	112.5	S813 A819	S813-L815 PolarHBondContact O-N 3.43Å; L815-A819 VanDerWaalsContact O-CB 3.28Å; L815-A819 WeakPolarHBondContact O-CB 3.44Å; L815-A819 PolarHBondContact O-N 2.86Å
816	Q	88.7	Confident	85.2	Confident	109 Å²	109	88.7 Å²	88.7	51%	0.509	45%	0.447	S	S	.	.	H	α-helix	trans	-68.7	-39	176.9	-67.1	168.3	-27.8	0	0	111.3	R812 S813 A819 L820	R812-Q816 HydrophobicContact CB-CB 4.11Å; S813-Q816 CarbonylContact O-C 3.59Å; S813-Q816 WeakPolarHBondContact O-CA 3.3Å; S813-Q816 WeakPolarHBondContact O-CB 3.5Å; S813-Q816 PolarHBondContact O-N 3.16Å; Q816-A819 PolarHBondContact O-N 3.3Å; Q816-L820 WeakPolarHBondContact O-CB 3.49Å; Q816-L820 WeakPolarHBondContact O-CG 3.39Å; Q816-L820 PolarHBondContact O-N 3.41Å
817	A	84.2	Confident	85.3	Confident	11 Å²	11	89.2 Å²	89.2	9%	0.091	45%	0.45	C	S	.	.	H	α-helix	trans	-61.4	-50.9	172.8	0	0	0	0	0	111.2	S813 A819 L820 Q821	S813-A817 PolarHBondContact O-N 2.85Å; A817-A819 VanDerWaalsContact C-N 3.3Å; A817-A819 PolarHBondContact O-N 2.82Å; A817-L820 PolarHBondContact O-N 3.19Å; A817-Q821 VanDerWaalsContact O-CG 3.27Å; A817-Q821 WeakPolarHBondContact O-CG 3.24Å; A817-Q821 PolarHBondContact O-N 3.45Å
818	L	87.3	Confident	85.6	Confident	84 Å²	84	90.8 Å²	90.8	44%	0.44	46%	0.463	S	S	.	.	H	α-helix	trans	-59.5	-37.9	175	-71.9	170.4	0	0	0	112.5	R814 Q821 L822	R814-L818 HydrophobicContact CG-CD1 4.17Å; R814-L818 WeakPolarHBondContact O-CB 3.26Å; R814-L818 VanDerWaalsContact O-CG 3.24Å; R814-L818 WeakPolarHBondContact O-CG 3.29Å; R814-L818 PolarHBondContact O-N 3.29Å; L818-Q821 PolarHBondContact O-N 2.8Å; L818-L822 WeakPolarHBondContact O-CB 3.47Å; L818-L822 PolarHBondContact O-N 3.19Å
819	A	91.2	Very high	86	Confident	56 Å²	56	90.9 Å²	90.9	46%	0.463	47%	0.465	S	S	.	.	H	α-helix	trans	-67.4	-37.8	176.6	0	0	0	0	0	112.6	L815 Q816 A817 L822 S823	L815-A819 VanDerWaalsContact O-CB 3.28Å; L815-A819 WeakPolarHBondContact O-CB 3.44Å; L815-A819 PolarHBondContact O-N 2.86Å; Q816-A819 PolarHBondContact O-N 3.3Å; A817-A819 VanDerWaalsContact C-N 3.3Å; A817-A819 PolarHBondContact O-N 2.82Å; A819-L822 PolarHBondContact O-N 3.43Å; A819-S823 WeakPolarHBondContact O-CB 3.34Å; A819-S823 PolarHBondContact O-N 3.18Å
820	L	86.7	Confident	87	Confident	78 Å²	78	86.6 Å²	86.6	41%	0.408	45%	0.453	S	S	.	.	H	α-helix	trans	-68.9	-43.6	173.6	-75.2	163.9	0	0	0	111.7	R812 Q816 A817 L822 S823 D824	R812-L820 HydrophobicContact CG-CD1 4.4Å; Q816-L820 WeakPolarHBondContact O-CB 3.49Å; Q816-L820 WeakPolarHBondContact O-CG 3.39Å; Q816-L820 PolarHBondContact O-N 3.41Å; A817-L820 PolarHBondContact O-N 3.19Å; L820-L822 VanDerWaalsContact C-N 3.28Å; L820-L822 PolarHBondContact O-N 2.98Å; L820-S823 WeakPolarHBondContact O-CB 3.45Å; L820-S823 PolarHBondContact O-N 3.25Å; L820-D824 PolarHBondContact O-N 3.45Å
821	Q	84.9	Confident	87.9	Confident	40 Å²	40	87 Å²	87	19%	0.187	45%	0.447	C	S	.	.	H	α-helix	trans	-58.8	-39.9	172.5	-67.9	170.4	7.6	0	0	111.8	T666 L668 A817 L818 K825	T666-Q821 PolarHBondContact O-NE2 2.86Å; L668-Q821 VanDerWaalsContact CD1-CD 3.44Å; L668-Q821 HydrophobicContact CD1-CG 3.94Å; A817-Q821 VanDerWaalsContact O-CG 3.27Å; A817-Q821 WeakPolarHBondContact O-CG 3.24Å; A817-Q821 PolarHBondContact O-N 3.45Å; L818-Q821 PolarHBondContact O-N 2.8Å; Q821-K825 WeakPolarHBondContact O-CG 3.41Å; Q821-K825 PolarHBondContact O-N 3.49Å
822	L	90.6	Very high	89	Confident	109 Å²	109	87.8 Å²	87.8	57%	0.571	45%	0.452	S	S	*	.	H	α-helix	trans	-68.2	-41.5	175.2	-176	63.6	0	0	0	111.4	L818 A819 L820 D824 K825 V826	L818-L822 WeakPolarHBondContact O-CB 3.47Å; L818-L822 PolarHBondContact O-N 3.19Å; A819-L822 PolarHBondContact O-N 3.43Å; L820-L822 VanDerWaalsContact C-N 3.28Å; L820-L822 PolarHBondContact O-N 2.98Å; L822-D824 VanDerWaalsContact C-N 3.33Å; L822-D824 PolarHBondContact O-N 2.91Å; L822-K825 PolarHBondContact O-N 2.88Å; L822-V826 HydrophobicContact CD1-CG2 4.46Å; L822-V826 HydrophobicContact CG-CG2 4.46Å; L822-V826 WeakPolarHBondContact O-CB 3.41Å; L822-V826 VanDerWaalsContact O-CG2 3.29Å; L822-V826 WeakPolarHBondContact O-CG2 3.32Å; L822-V826 PolarHBondContact O-N 2.88Å
823	S	92.1	Very high	89.9	Confident	59 Å²	59	84.8 Å²	84.8	41%	0.413	45%	0.447	S	S	.	.	H	α-helix	trans	-58.6	-44.7	174.1	-170.1	0	0	0	0	111.5	A819 L820 V826 N827	A819-S823 WeakPolarHBondContact O-CB 3.34Å; A819-S823 PolarHBondContact O-N 3.18Å; L820-S823 WeakPolarHBondContact O-CB 3.45Å; L820-S823 PolarHBondContact O-N 3.25Å; S823-V826 PolarHBondContact O-N 3.27Å; S823-N827 WeakPolarHBondContact O-CB 3.46Å; S823-N827 VanDerWaalsContact O-CG 3.24Å; S823-N827 PolarHBondContact O-N 2.94Å; S823-N827 PolarHBondContact O-ND2 3.47Å
824	D	88.1	Confident	90.3	Very high	60 Å²	60	85.4 Å²	85.4	32%	0.321	45%	0.445	S	S	.	.	H	α-helix	trans	-63.3	-42.1	174.8	-89.1	-14.1	0	0	0	112.8	R669 L820 L822 N827 S828	R669-D824 IonicContact CZ-OD1 2.72Å; R669-D824 IonicContact CZ-OD2 3.52Å; R669-D824 VanDerWaalsContact NE-CG 3.31Å; R669-D824 IonicContact NE-OD1 3.16Å; R669-D824 IonicContact NE-OD2 2.68Å; R669-D824 PolarHBondContact NE-OD2 3.48Å; R669-D824 IonicContact NH2-OD1 2.71Å; R669-D824 PolarHBondContact NH2-OD1 2.87Å; R669-D824 IonicContact NH2-OD2 3.54Å; L820-D824 PolarHBondContact O-N 3.45Å; L822-D824 VanDerWaalsContact C-N 3.33Å; L822-D824 PolarHBondContact O-N 2.91Å; D824-N827 PolarHBondContact O-N 2.8Å; D824-S828 WeakPolarHBondContact O-CB 3.28Å; D824-S828 PolarHBondContact O-N 2.72Å
825	K	89.8	Confident	90.8	Very high	115 Å²	115	81.9 Å²	81.9	50%	0.5	44%	0.435	S	S	.	.	H	α-helix	trans	-64.1	-41.3	173.6	-76.3	-176.2	178.1	-174.1	0	112	L668 Q821 L822 S828 I829	L668-K825 VanDerWaalsContact CD2-CE 3.41Å; Q821-K825 WeakPolarHBondContact O-CG 3.41Å; Q821-K825 PolarHBondContact O-N 3.49Å; L822-K825 PolarHBondContact O-N 2.88Å; K825-S828 PolarHBondContact O-N 3.39Å; K825-I829 WeakPolarHBondContact O-CB 3.37Å; K825-I829 WeakPolarHBondContact O-CD1 3.38Å; K825-I829 VanDerWaalsContact O-CG1 3.24Å; K825-I829 WeakPolarHBondContact O-CG1 3.39Å; K825-I829 PolarHBondContact O-N 3.49Å
826	V	94.4	Very high	90.9	Very high	72 Å²	72	80.2 Å²	80.2	44%	0.436	43%	0.427	S	S	.	.	H	α-helix	trans	-63.3	-44.5	175.8	168.4	0	0	0	0	110.4	L822 S823 S828 I829 V830	L822-V826 HydrophobicContact CD1-CG2 4.46Å; L822-V826 HydrophobicContact CG-CG2 4.46Å; L822-V826 WeakPolarHBondContact O-CB 3.41Å; L822-V826 VanDerWaalsContact O-CG2 3.29Å; L822-V826 WeakPolarHBondContact O-CG2 3.32Å; L822-V826 PolarHBondContact O-N 2.88Å; S823-V826 PolarHBondContact O-N 3.27Å; V826-S828 VanDerWaalsContact C-N 3.35Å; V826-S828 PolarHBondContact O-N 3.37Å; V826-I829 PolarHBondContact O-N 2.89Å; V826-V830 HydrophobicContact CG1-CG2 4.48Å; V826-V830 WeakPolarHBondContact O-CG2 3.39Å; V826-V830 PolarHBondContact O-N 2.9Å
827	N	93.4	Very high	90.9	Very high	76 Å²	76	79.7 Å²	79.7	41%	0.406	43%	0.426	S	S	.	.	H	α-helix	trans	-59.8	-44.1	173.9	-69.4	-26.9	0	0	0	111.6	S823 D824 I829 V830 E831	S823-N827 WeakPolarHBondContact O-CB 3.46Å; S823-N827 VanDerWaalsContact O-CG 3.24Å; S823-N827 PolarHBondContact O-N 2.94Å; S823-N827 PolarHBondContact O-ND2 3.47Å; D824-N827 PolarHBondContact O-N 2.8Å; N827-I829 VanDerWaalsContact C-N 3.33Å; N827-I829 PolarHBondContact O-N 3.33Å; N827-V830 PolarHBondContact O-N 3.08Å; N827-E831 WeakPolarHBondContact O-CG 3.49Å; N827-E831 PolarHBondContact O-N 2.99Å
828	S	91.8	Very high	91.1	Very high	49 Å²	49	85.6 Å²	85.6	34%	0.343	45%	0.452	S	S	.	.	H	α-helix	trans	-63.6	-36.5	175.6	-175.5	0	0	0	0	112.8	D824 K825 V826 E831 M832	D824-S828 WeakPolarHBondContact O-CB 3.28Å; D824-S828 PolarHBondContact O-N 2.72Å; K825-S828 PolarHBondContact O-N 3.39Å; V826-S828 VanDerWaalsContact C-N 3.35Å; V826-S828 PolarHBondContact O-N 3.37Å; S828-E831 PolarHBondContact O-N 2.84Å; S828-M832 VanDerWaalsContact O-CG 3.28Å; S828-M832 WeakPolarHBondContact O-CG 3.41Å; S828-M832 PolarHBondContact O-N 2.77Å
829	I	93.9	Very high	91	Very high	91 Å²	91	85.5 Å²	85.5	47%	0.467	46%	0.458	S	S	.	.	H	α-helix	trans	-68.9	-37.6	173.8	-70.7	161	0	0	0	110.9	K825 V826 N827 M832 N833	K825-I829 WeakPolarHBondContact O-CB 3.37Å; K825-I829 WeakPolarHBondContact O-CD1 3.38Å; K825-I829 VanDerWaalsContact O-CG1 3.24Å; K825-I829 WeakPolarHBondContact O-CG1 3.39Å; K825-I829 PolarHBondContact O-N 3.49Å; V826-I829 PolarHBondContact O-N 2.89Å; N827-I829 VanDerWaalsContact C-N 3.33Å; N827-I829 PolarHBondContact O-N 3.33Å; I829-M832 PolarHBondContact O-N 3.23Å; I829-N833 WeakPolarHBondContact O-CB 3.5Å; I829-N833 PolarHBondContact O-N 2.88Å; I829-N833 PolarHBondContact O-ND2 2.94Å
830	V	94.8	Very high	90.3	Very high	68 Å²	68	92.2 Å²	92.2	41%	0.412	47%	0.471	S	S	.	.	H	α-helix	trans	-63.4	-47.3	172.9	171.1	0	0	0	0	110.3	V826 N827 M832 N833 D834	V826-V830 HydrophobicContact CG1-CG2 4.48Å; V826-V830 WeakPolarHBondContact O-CG2 3.39Å; V826-V830 PolarHBondContact O-N 2.9Å; N827-V830 PolarHBondContact O-N 3.08Å; V830-M832 VanDerWaalsContact C-N 3.29Å; V830-M832 PolarHBondContact O-N 3.3Å; V830-N833 CarbonylContact O-C 3.55Å; V830-N833 WeakPolarHBondContact O-CB 3.22Å; V830-N833 PolarHBondContact O-N 2.91Å; V830-N833 VanDerWaalsContact O-N 3.08Å; V830-D834 PolarHBondContact O-N 2.71Å
831	E	93.5	Very high	89.4	Confident	106 Å²	106	92.4 Å²	92.4	50%	0.495	48%	0.476	S	S	.	.	H	α-helix	trans	-59.2	-36.6	174	-71.8	176.2	-158.5	0	0	112.9	N827 S828 K835	N827-E831 WeakPolarHBondContact O-CG 3.49Å; N827-E831 PolarHBondContact O-N 2.99Å; S828-E831 PolarHBondContact O-N 2.84Å; E831-K835 WeakPolarHBondContact O-CD 3.42Å; E831-K835 VanDerWaalsContact O-CG 3.26Å; E831-K835 WeakPolarHBondContact O-CG 3.37Å; E831-K835 PolarHBondContact O-N 2.81Å; E831-K835 VanDerWaalsContact O-N 3.16Å
832	M	93.3	Very high	88.2	Confident	109 Å²	109	93.8 Å²	93.8	54%	0.537	50%	0.501	S	S	.	.	H	α-helix	trans	-68.2	-41.9	173.2	-73	174.3	-176.3	0	0	111.7	S828 I829 V830 K835 L836	S828-M832 VanDerWaalsContact O-CG 3.28Å; S828-M832 WeakPolarHBondContact O-CG 3.41Å; S828-M832 PolarHBondContact O-N 2.77Å; I829-M832 PolarHBondContact O-N 3.23Å; V830-M832 VanDerWaalsContact C-N 3.29Å; V830-M832 PolarHBondContact O-N 3.3Å; M832-K835 PolarHBondContact O-N 2.87Å; M832-L836 WeakPolarHBondContact O-CB 3.17Å; M832-L836 VanDerWaalsContact O-CG 3.3Å; M832-L836 WeakPolarHBondContact O-CG 3.4Å; M832-L836 PolarHBondContact O-N 2.63Å
833	N	93.2	Very high	86.4	Confident	80 Å²	80	92 Å²	92	43%	0.428	51%	0.508	S	S	.	.	H	α-helix	trans	-65.5	-41.4	177.1	-72.1	-25.6	0	0	0	111.7	I829 V830 L836 I837	I829-N833 WeakPolarHBondContact O-CB 3.5Å; I829-N833 PolarHBondContact O-N 2.88Å; I829-N833 PolarHBondContact O-ND2 2.94Å; V830-N833 CarbonylContact O-C 3.55Å; V830-N833 WeakPolarHBondContact O-CB 3.22Å; V830-N833 PolarHBondContact O-N 2.91Å; V830-N833 VanDerWaalsContact O-N 3.08Å; N833-L836 CarbonylContact O-C 3.6Å; N833-L836 PolarHBondContact O-N 3.33Å; N833-L836 VanDerWaalsContact O-N 3.16Å; N833-I837 VanDerWaalsContact O-CG1 3.27Å; N833-I837 WeakPolarHBondContact O-CG1 3.5Å; N833-I837 PolarHBondContact O-N 3.42Å
834	D	93.2	Very high	84.5	Confident	85 Å²	85	96.1 Å²	96.1	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-62.4	-45.2	176.4	-71	-23.6	0	0	0	110.5	V830 L836 I837 E838	V830-D834 PolarHBondContact O-N 2.71Å; D834-L836 VanDerWaalsContact C-N 3.3Å; D834-L836 PolarHBondContact O-N 3.17Å; D834-I837 WeakPolarHBondContact O-CB 3.27Å; D834-I837 PolarHBondContact O-N 3.11Å; D834-I837 VanDerWaalsContact O-N 3.08Å; D834-E838 WeakPolarHBondContact O-CG 3.39Å; D834-E838 PolarHBondContact O-N 3.15Å
835	K	92.3	Very high	82.8	Confident	130 Å²	130	98.9 Å²	98.9	57%	0.565	55%	0.549	S	S	*	.	H	α-helix	trans	-59.5	-37	172.2	-72.9	166.7	-175.5	166.4	0	113.2	E831 M832 S839	E831-K835 WeakPolarHBondContact O-CD 3.42Å; E831-K835 VanDerWaalsContact O-CG 3.26Å; E831-K835 WeakPolarHBondContact O-CG 3.37Å; E831-K835 PolarHBondContact O-N 2.81Å; E831-K835 VanDerWaalsContact O-N 3.16Å; M832-K835 PolarHBondContact O-N 2.87Å; K835-S839 WeakPolarHBondContact O-CB 3.46Å; K835-S839 PolarHBondContact O-N 2.83Å; K835-S839 PolarHBondContact O-OG 3.32Å
836	L	90.7	Very high	80.7	Confident	98 Å²	98	97 Å²	97	51%	0.513	56%	0.563	S	S	.	*	H	α-helix	trans	-72.9	-27.9	175.1	-72.9	169.7	0	0	0	112.9	M832 N833 D834 S839 R840	M832-L836 WeakPolarHBondContact O-CB 3.17Å; M832-L836 VanDerWaalsContact O-CG 3.3Å; M832-L836 WeakPolarHBondContact O-CG 3.4Å; M832-L836 PolarHBondContact O-N 2.63Å; N833-L836 CarbonylContact O-C 3.6Å; N833-L836 PolarHBondContact O-N 3.33Å; N833-L836 VanDerWaalsContact O-N 3.16Å; D834-L836 VanDerWaalsContact C-N 3.3Å; D834-L836 PolarHBondContact O-N 3.17Å; L836-S839 PolarHBondContact O-OG 3.23Å; L836-R840 WeakPolarHBondContact O-CB 3.49Å; L836-R840 VanDerWaalsContact O-CG 3.28Å; L836-R840 WeakPolarHBondContact O-CG 3.42Å; L836-R840 PolarHBondContact O-N 3.41Å
837	I	89.3	Confident	78.4	Confident	97 Å²	97	100.7 Å²	100.7	50%	0.497	58%	0.579	S	S	.	*	H	α-helix	trans	-74.9	-43.7	173	-70.6	163.2	0	0	0	110.1	N833 D834 R840 T841	N833-I837 VanDerWaalsContact O-CG1 3.27Å; N833-I837 WeakPolarHBondContact O-CG1 3.5Å; N833-I837 PolarHBondContact O-N 3.42Å; D834-I837 WeakPolarHBondContact O-CB 3.27Å; D834-I837 PolarHBondContact O-N 3.11Å; D834-I837 VanDerWaalsContact O-N 3.08Å; I837-R840 PolarHBondContact O-N 2.74Å; I837-T841 HydrophobicContact CG2-CG2 4.43Å; I837-T841 WeakPolarHBondContact O-CB 3.4Å; I837-T841 PolarHBondContact O-N 2.94Å; I837-T841 PolarHBondContact O-OG1 3.31Å
838	E	88.8	Confident	75.9	Confident	136 Å²	136	106.6 Å²	106.6	64%	0.636	60%	0.601	S	S	*	*	H	α-helix	trans	-59	-46.3	174.3	-73.3	-179	165.4	0	0	111.5	D834 R840 T841 G842	D834-E838 WeakPolarHBondContact O-CG 3.39Å; D834-E838 PolarHBondContact O-N 3.15Å; E838-R840 PolarHBondContact O-N 3.39Å; E838-T841 PolarHBondContact O-N 2.84Å; E838-T841 PolarHBondContact O-OG1 2.81Å; E838-G842 PolarHBondContact O-N 3.08Å
839	S	84.3	Confident	73.3	Confident	81 Å²	81	107.8 Å²	107.8	57%	0.566	62%	0.621	S	S	*	*	H	α-helix	trans	-66.2	-34.7	177.7	68.6	0	0	0	0	112.9	K835 L836	K835-S839 WeakPolarHBondContact O-CB 3.46Å; K835-S839 PolarHBondContact O-N 2.83Å; K835-S839 PolarHBondContact O-OG 3.32Å; L836-S839 PolarHBondContact O-OG 3.23Å
840	R	76.4	Confident	70.6	Confident	197 Å²	197	108.4 Å²	108.4	74%	0.743	63%	0.633	S	S	*	*	H	α-helix	trans	-72.6	-40.3	173.7	-77.4	-179.4	177.1	-132.4	-0.5	113.5	L836 I837 E838 G843	L836-R840 WeakPolarHBondContact O-CB 3.49Å; L836-R840 VanDerWaalsContact O-CG 3.28Å; L836-R840 WeakPolarHBondContact O-CG 3.42Å; L836-R840 PolarHBondContact O-N 3.41Å; I837-R840 PolarHBondContact O-N 2.74Å; E838-R840 PolarHBondContact O-N 3.39Å; R840-G843 PolarHBondContact O-N 2.82Å
841	T	69.1	Low	67.9	Low	83 Å²	83	113.9 Å²	113.9	51%	0.509	65%	0.654	S	S	.	*	H	α-helix	trans	-74.5	-27.7	180	45.6	0	0	0	0	112.5	I837 E838 G843 L844	I837-T841 HydrophobicContact CG2-CG2 4.43Å; I837-T841 WeakPolarHBondContact O-CB 3.4Å; I837-T841 PolarHBondContact O-N 2.94Å; I837-T841 PolarHBondContact O-OG1 3.31Å; E838-T841 PolarHBondContact O-N 2.84Å; E838-T841 PolarHBondContact O-OG1 2.81Å; T841-G843 PolarHBondContact O-N 3.21Å; T841-G843 VanDerWaalsContact O-N 3.15Å; T841-L844 PolarHBondContact O-N 3.34Å; T841-L844 VanDerWaalsContact O-N 3.11Å
842	G	58.5	Low	65.3	Low	69 Å²	69	113.3 Å²	113.3	71%	0.711	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-26.2	171	0	0	0	0	0	114.5	E838	E838-G842 PolarHBondContact O-N 3.08Å
843	G	54	Low	62.8	Low	70 Å²	70	119.3 Å²	119.3	72%	0.722	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-10.5	177.4	0	0	0	0	0	116.3	R840 T841	R840-G843 PolarHBondContact O-N 2.82Å; T841-G843 PolarHBondContact O-N 3.21Å; T841-G843 VanDerWaalsContact O-N 3.15Å
844	L	52.8	Low	60.2	Low	146 Å²	146	124.9 Å²	124.9	76%	0.764	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.2	-8.2	-165.5	-88	143.9	0	0	0	115.6	T841 G846	T841-L844 PolarHBondContact O-N 3.34Å; T841-L844 VanDerWaalsContact O-N 3.11Å; L844-G846 PolarHBondContact O-N 3.24Å
845	S	51.2	Low	57.6	Low	118 Å²	118	124.6 Å²	124.6	83%	0.825	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	11.3	-178.2	-146.5	0	0	0	0	115
846	G	45	Very low	55.1	Low	76 Å²	76	124.5 Å²	124.5	78%	0.784	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-6.9	-173.7	0	0	0	0	0	116.6	L844	L844-G846 PolarHBondContact O-N 3.24Å
847	L	46	Very low	52.6	Low	149 Å²	149	130.5 Å²	130.5	78%	0.78	75%	0.748	S	S	*	*	S	Bend	trans	-138.6	113.9	-166.9	-85	141.3	0	0	0	114.5
848	K	41.7	Very low	50.2	Low	201 Å²	201	137.3 Å²	137.3	87%	0.874	77%	0.767	S	S	*	*			trans	85.8	129.5	157.5	-56.8	173.1	177.3	174.1	0	119.7
849	G	37.9	Very low	47.6	Very low	73 Å²	73	137.5 Å²	137.5	75%	0.753	78%	0.777	S	S	*	*			trans	95.7	80	152.3	0	0	0	0	0	114.9
850	S	36.2	Very low	45.4	Very low	104 Å²	104	137.3 Å²	137.3	73%	0.727	79%	0.788	S	S	*	*				65.5	117.2	66.5	-164.2	0	0	0	0	114.3
851	Q	38.7	Very low	43.5	Very low	183 Å²	183	133.7 Å²	133.7	86%	0.855	79%	0.788	S	S	*	*			trans	66	135.9	170.9	-58.8	168.6	9.8	0	0	115.3
852	S	38.3	Very low	41.9	Very low	94 Å²	94	140.8 Å²	140.8	66%	0.657	81%	0.805	S	S	*	*			cis	-173.5	138.3	-5.9	47.3	0	0	0	0	108.3
853	Y	41.7	Very low	40.8	Very low	236 Å²	236	147.6 Å²	147.6	93%	0.925	81%	0.811	S	S	*	*			trans	-177.7	125.7	136.9	-106.7	-72.3	0	0	0	110.1
854	Q	38.8	Very low	40.1	Very low	196 Å²	196	150.3 Å²	150.3	92%	0.916	81%	0.814	S	S	*	*			trans	-81.4	135.5	-178.9	-68.6	167.8	-50.6	0	0	111.3
855	G	37.8	Very low	39.4	Very low	80 Å²	80	150.3 Å²	150.3	83%	0.825	81%	0.814	S	S	*	*			trans	-150.6	78.3	174.6	0	0	0	0	0	111.1
856	T	40.4	Very low	38.8	Very low	127 Å²	127	151.6 Å²	151.6	78%	0.779	81%	0.811	S	S	*	*			trans	-69.6	134.2	-171.4	52	0	0	0	0	113.9
857	R	37.7	Very low	38.6	Very low	225 Å²	225	156.8 Å²	156.8	85%	0.849	81%	0.812	S	S	*	*				180	112.3	109	-96.6	174.7	-177.6	-158.6	1.6	115.7
858	R	39	Very low	38.5	Very low	240 Å²	240	158.3 Å²	158.3	91%	0.906	81%	0.813	S	S	*	*			trans	59.5	101.9	132.4	-64.4	-172.1	176.4	-168.5	-2.1	121.1
859	V	35	Very low	38.5	Very low	139 Å²	139	159.7 Å²	159.7	84%	0.842	83%	0.83	S	S	*	*			trans	-36.3	143.6	141.6	177.8	0	0	0	0	113.5
860	G	37.5	Very low	38.5	Very low	77 Å²	77	164.1 Å²	164.1	79%	0.794	83%	0.834	S	S	*	*			trans	-161.3	70.1	175.5	0	0	0	0	0	114
861	T	35.4	Very low	38.7	Very low	121 Å²	121	167.2 Å²	167.2	74%	0.742	84%	0.839	S	S	*	*			trans	-62	132.4	167.6	47.1	0	0	0	0	112
862	R	36	Very low	38.7	Very low	232 Å²	232	166.3 Å²	166.3	88%	0.875	84%	0.839	S	S	*	*			trans	174.5	142.2	134	-97.6	161.3	-168.4	-174	3.6	113.8
863	Y	35.5	Very low	38.7	Very low	212 Å²	212	170.6 Å²	170.6	83%	0.831	85%	0.849	S	S	*	*			trans	-20.6	141	149.3	-58.5	-101.2	0	0	0	116.4
864	T	39.7	Very low	38.5	Very low	127 Å²	127	166.5 Å²	166.5	78%	0.779	85%	0.845	S	S	*	*				171.7	138.3	99.8	42.1	0	0	0	0	113.8
865	L	38.7	Very low	38.5	Very low	147 Å²	147	164.5 Å²	164.5	77%	0.77	84%	0.84	S	S	*	*			trans	38.8	128.7	144.9	-81.8	81	0	0	0	123
866	N	37	Very low	38.5	Very low	144 Å²	144	170.6 Å²	170.6	77%	0.77	84%	0.841	S	S	*	*				30	119.5	124.4	-59.9	-11	0	0	0	119.9
867	K	42.6	Very low	38.4	Very low	186 Å²	186	173.9 Å²	173.9	81%	0.809	85%	0.846	S	S	*	*				177.7	136	99.2	-95.5	-168.5	174.8	-179	0	113.4
868	F	43.4	Very low	38.4	Very low	180 Å²	180	169.7 Å²	169.7	79%	0.789	85%	0.845	S	S	*	*			trans	38.5	114.9	149.8	-69.4	-88	0	0	0	120.7
869	N	41.5	Very low	38.4	Very low	231 Å²	231	163.3 Å²	163.3	100%	1.235	84%	0.84	S	S	*	*				-127.9	0	93.5	-109.1	-12.3	0	0	0	108.9

Retrieved 869 of 869 residues in 337.2 ms (Link to these results)

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