A0A077ZF17_TRITR Loading...

CCAAT:enhancer binding protein zeta

AlphaFold DB , UniProt , Accession A0A077ZF17, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 809 aa.

						>A0A077ZF17_TRITR|A0A077ZF17
MGTYVSGGSVFGKSQANLLRDGNKVSIRKRKEKNSSNRIDDQSSEVDTALLGQSTAVDRPKWFEDKSCSLIDSSNKDDQRVAELEAMADQLLQNECNAFQAALWNEVNAESSNASGSRAAWLDTIALSGTLSDRMAALGALISRNPVCNLKALDSLLHRVSKKSRREALIAAETAKELFIHALLPDRKLIPFKCLCCELSLPLQRPLEKFGQSYNSIAKSKSRKLILWKFEGDLKSRYAGYVRALQDISFDTLAEIRIKACRLMADLLIAKAEQEEALLSALVNKLGDTEPRVATKVVGYLELVDHNHPAMKGELISETEKLIYRQNISSRAQFYALCFLIHLPLTSSDKDLAAKLLNIYFELFKIVLQNQDVVEERRLTRHILVGINKVLPYAKARAIKDARSYIFPPTDKTNDIMKEVDKLYKMAATSSLHISLQTLALLCQLLDISQDMDDRFYRSFYRRMLDPTLRSSSRVHGLFFHLLYKALCRDTQSGRTRAISKRLLQICLTAPASFACAALLILSRVQQTIKSLPAKGCHWDSDDDDEEAAQEGVNGVKSNTETYDTSARNPLYARADMEPLVELLLLKKHYHPTVALFAHRLLEVTGTAPFQDSEIKLPCFQGQKIDYSGDPLEDFSTSRFLERFVFKNPKKSVAEQPERGDPSVSKGRRKAYDPWTVRSIPVNSKQYADKDENEIPPEESYLHTCARPYLFTSTSKEVKCLKRKKRSNDVESNEEIWDSSSEEDEDEEEEEEMVELKRKTKRHPPNLYDEEFNTAEEFAELLEEAEDEQRPDKERKKKDKMRKRKARRR
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	33.9	Very low	255 Å²	255	138.8 Å²	138.8	100%	1.256	85%	0.849	S	S	*	*				0	126.4	0	-43.2	178.8	-162.5	0	0	107
2	G	39.3	Very low	33.6	Very low	66 Å²	66	133.8 Å²	133.8	68%	0.68	85%	0.846	S	S	*	*			cis	-161.1	125.4	-17.8	0	0	0	0	0	109.5
3	T	38.1	Very low	33.2	Very low	126 Å²	126	138.6 Å²	138.6	77%	0.773	85%	0.846	S	S	*	*			trans	28.5	113.6	133.9	52.2	0	0	0	0	119.4
4	Y	36.2	Very low	33	Very low	229 Å²	229	136.4 Å²	136.4	90%	0.898	84%	0.84	S	S	*	*				80.9	136.1	83.2	-95.5	-74.7	0	0	0	115.7
5	V	35.2	Very low	32.8	Very low	138 Å²	138	139.8 Å²	139.8	84%	0.836	84%	0.842	S	S	*	*				166.8	146.1	124.9	156.4	0	0	0	0	110.9
6	S	34.3	Very low	32.6	Very low	118 Å²	118	135.8 Å²	135.8	83%	0.825	83%	0.828	S	S	*	*			trans	-113.1	172.3	175.5	62.1	0	0	0	0	112.1
7	G	34.4	Very low	32.6	Very low	80 Å²	80	136.5 Å²	136.5	83%	0.825	83%	0.826	S	S	*	*			trans	-167.4	147	169.1	0	0	0	0	0	113.2
8	G	28.4	Very low	32.5	Very low	83 Å²	83	136.2 Å²	136.2	86%	0.856	82%	0.819	S	S	*	*			trans	-166.4	162.5	176.8	0	0	0	0	0	113.2
9	S	31.2	Very low	32.5	Very low	110 Å²	110	136.8 Å²	136.8	77%	0.769	82%	0.816	S	S	*	*			trans	-176.4	134.5	171.3	-170.9	0	0	0	0	106.5
10	V	32.5	Very low	32.5	Very low	126 Å²	126	140.4 Å²	140.4	76%	0.764	82%	0.815	S	S	*	*			cis	89.8	96.5	40	-176.5	0	0	0	0	115.1
11	F	29.9	Very low	32.5	Very low	196 Å²	196	140.2 Å²	140.2	86%	0.86	81%	0.81	S	S	*	*			trans	37.8	135	148.5	-81.3	-83.5	0	0	0	124.6
12	G	30.6	Very low	32.5	Very low	78 Å²	78	131.7 Å²	131.7	80%	0.804	79%	0.788	S	S	*	*			trans	-156.3	149.2	155.6	0	0	0	0	0	112.1
13	K	27.9	Very low	32.1	Very low	197 Å²	197	135.6 Å²	135.6	86%	0.857	79%	0.794	S	S	*	*			trans	-129.7	149.6	-174.2	-68.7	175.8	175.5	174.8	0	112.9
14	S	31.1	Very low	31.9	Very low	108 Å²	108	138.5 Å²	138.5	76%	0.755	80%	0.795	S	S	*	*			trans	158.3	125	137.2	-105.9	0	0	0	0	110.6
15	Q	29.3	Very low	31.6	Very low	187 Å²	187	133.4 Å²	133.4	87%	0.874	79%	0.788	S	S	*	*				59.9	142.6	89.1	-71.5	-158.8	4.1	0	0	115.8
16	A	30.8	Very low	31.1	Very low	75 Å²	75	132.3 Å²	132.3	62%	0.62	79%	0.786	S	S	*	*			cis	-172.6	170.3	-13.2	0	0	0	0	0	109.6
17	N	32	Very low	31	Very low	149 Å²	149	134.2 Å²	134.2	80%	0.797	79%	0.786	S	S	*	*			trans	141.3	147.1	154.4	-78	-7.6	0	0	0	113.1
18	L	31.2	Very low	30.5	Very low	131 Å²	131	141.7 Å²	141.7	69%	0.686	79%	0.789	S	S	*	*			cis	-167.3	162.3	-23.1	-150.2	79.4	0	0	0	109.1
19	L	31.8	Very low	30.6	Very low	147 Å²	147	147.8 Å²	147.8	77%	0.77	79%	0.792	S	S	*	*			trans	76.4	146.5	162	-56.6	154	0	0	0	117.2
20	R	33.5	Very low	30.2	Very low	209 Å²	209	153.4 Å²	153.4	79%	0.789	80%	0.796	S	S	*	*			cis	-155	142.3	16.1	-162.2	168.2	-179.7	176.6	5.8	115.5
21	D	32.8	Very low	29.8	Very low	136 Å²	136	154.7 Å²	154.7	73%	0.727	79%	0.791	S	S	*	*			trans	34.6	138.1	152.7	-52.1	-29.5	0	0	0	123.9
22	G	32.4	Very low	29.6	Very low	76 Å²	76	151.8 Å²	151.8	78%	0.784	78%	0.781	S	S	*	*			trans	-174.1	-2	173.2	0	0	0	0	0	121
23	N	30.8	Very low	29.4	Very low	149 Å²	149	157.4 Å²	157.4	80%	0.797	78%	0.783	S	S	*	*			trans	41.5	131.2	156.7	-137.1	-5	0	0	0	123.2
24	K	33.2	Very low	29.4	Very low	186 Å²	186	156 Å²	156	81%	0.809	79%	0.785	S	S	*	*			trans	101.6	141.9	161.6	-59.2	173.2	-172.7	-180	0	116.4
25	V	30.9	Very low	29	Very low	122 Å²	122	156 Å²	156	74%	0.739	79%	0.785	S	S	*	*			cis	-154.6	165.4	-21.7	120.1	0	0	0	0	107.9
26	S	24.7	Very low	28.9	Very low	115 Å²	115	152.6 Å²	152.6	80%	0.804	78%	0.781	S	S	*	*			trans	-129	137.8	171.7	-98.4	0	0	0	0	112.3
27	I	30.8	Very low	28.6	Very low	159 Å²	159	156.2 Å²	156.2	82%	0.815	79%	0.79	S	S	*	*			trans	-130.7	117.5	161	-62.9	-178.1	0	0	0	108.7
28	R	25.4	Very low	28.4	Very low	237 Å²	237	160.4 Å²	160.4	89%	0.894	80%	0.795	S	S	*	*			trans	-99.7	140.1	163.1	-74.9	176.5	169.1	171.3	-3.7	108.7
29	K	29.2	Very low	28.2	Very low	211 Å²	211	161.4 Å²	161.4	92%	0.917	80%	0.8	S	S	*	*			trans	-156.3	145.1	145.1	-113.5	168.1	-173.1	-179.6	0	112.9
30	R	23.9	Very low	27.9	Very low	227 Å²	227	161.7 Å²	161.7	86%	0.857	80%	0.802	S	S	*	*			trans	-62.3	167.7	168.2	-72.2	168.8	160.5	161	-8.2	110.3
31	K	24.6	Very low	27.5	Very low	153 Å²	153	158.2 Å²	158.2	67%	0.665	80%	0.799	S	S	*	*			cis	-168.3	170.4	13.4	-136.2	172.8	167.4	-145.5	0	110.5
32	E	25.4	Very low	27.1	Very low	136 Å²	136	161.1 Å²	161.1	64%	0.636	81%	0.808	S	S	*	*			trans	75	111.9	145.9	-85.1	152.9	-162.5	0	0	123.4
33	K	25	Very low	26.7	Very low	195 Å²	195	161.1 Å²	161.1	85%	0.848	80%	0.796	S	S	*	*			trans	43.3	116.4	131.1	-64.1	-177.3	176.2	-176.8	0	119.9
34	N	28.2	Very low	26.4	Very low	168 Å²	168	158.9 Å²	158.9	90%	0.898	79%	0.792	S	S	*	*				-152.7	160.1	110.3	-122.2	-6.7	0	0	0	112.7
35	S	24.1	Very low	26.2	Very low	109 Å²	109	159.4 Å²	159.4	76%	0.762	80%	0.798	S	S	*	*			trans	-100	136.5	-169.7	51.3	0	0	0	0	114.1
36	S	27.3	Very low	26.1	Very low	114 Å²	114	159.6 Å²	159.6	80%	0.797	80%	0.799	S	S	*	*			trans	-162.2	124.2	142.9	66.4	0	0	0	0	113.5
37	N	23.8	Very low	26.6	Very low	151 Å²	151	161 Å²	161	81%	0.807	80%	0.797	S	S	*	*			trans	8.1	123.1	154.2	-56.8	-5.8	0	0	0	120.6
38	R	28	Very low	27.2	Very low	238 Å²	238	158.3 Å²	158.3	90%	0.898	79%	0.788	S	S	*	*			trans	-162.8	98.5	136.8	-98.8	163.2	-169.1	-148.1	0.8	105.1
39	I	27.6	Very low	28.6	Very low	152 Å²	152	147.8 Å²	147.8	78%	0.779	75%	0.752	S	S	*	*				60.8	117.5	90.1	-62.6	175.2	0	0	0	110.7
40	D	23.9	Very low	30	Very low	153 Å²	153	139.7 Å²	139.7	82%	0.818	72%	0.719	S	S	*	*			trans	-58.2	130.4	-178.1	-57.3	-81.4	0	0	0	112.4
41	D	25.8	Very low	31.6	Very low	136 Å²	136	130.2 Å²	130.2	73%	0.727	69%	0.685	S	S	*	*			trans	-117.8	88.9	171.3	-148.9	-34.4	0	0	0	108.5	S43	D41-S43 VanDerWaalsContact C-N 3.29Å; D41-S43 PolarHBondContact O-N 3.12Å; D41-S43 VanDerWaalsContact O-N 3.12Å; D41-S43 WeakPolarHBondContact OD1-CB 3.49Å; D41-S43 PolarHBondContact OD1-OG 3.45Å
42	Q	24.4	Very low	32.8	Very low	196 Å²	196	124.4 Å²	124.4	92%	0.916	67%	0.669	S	S	*	*			trans	-78.7	79.4	170.3	-71.5	-176	-1.9	0	0	109
43	S	24.1	Very low	33.5	Very low	77 Å²	77	125 Å²	125	54%	0.538	67%	0.672	S	S	.	*			trans	-119.6	103.5	179.5	31.1	0	0	0	0	112.7	D41	D41-S43 VanDerWaalsContact C-N 3.29Å; D41-S43 PolarHBondContact O-N 3.12Å; D41-S43 VanDerWaalsContact O-N 3.12Å; D41-S43 WeakPolarHBondContact OD1-CB 3.49Å; D41-S43 PolarHBondContact OD1-OG 3.45Å
44	S	25	Very low	33.9	Very low	102 Å²	102	119.8 Å²	119.8	71%	0.713	66%	0.66	S	S	*	*			trans	49.1	101.8	158.7	57.5	0	0	0	0	119.1	V46	S44-V46 PolarHBondContact O-N 2.71Å
45	E	27.7	Very low	34.3	Very low	197 Å²	197	117.3 Å²	117.3	92%	0.921	65%	0.651	S	S	*	*			trans	-58.4	129.1	142.6	-72.9	-171.6	132.4	0	0	108.7	D47	E45-D47 PolarHBondContact O-N 2.81Å
46	V	29.7	Very low	35.2	Very low	125 Å²	125	115.8 Å²	115.8	76%	0.758	64%	0.644	S	S	*	*			trans	-76.3	116.3	180	177.8	0	0	0	0	109.7	S44 T48	S44-V46 PolarHBondContact O-N 2.71Å; V46-T48 PolarHBondContact O-N 2.9Å; V46-T48 PolarHBondContact O-OG1 2.72Å; V46-T48 VanDerWaalsContact O-OG1 3.06Å
47	D	34.4	Very low	35.9	Very low	146 Å²	146	116.3 Å²	116.3	78%	0.781	64%	0.642	S	S	*	*			trans	-49.9	100.3	-176.6	-83.4	-51	0	0	0	113.1	E45 A49	E45-D47 PolarHBondContact O-N 2.81Å; D47-A49 PolarHBondContact O-N 3.45Å
48	T	43.4	Very low	37	Very low	101 Å²	101	116 Å²	116	62%	0.62	64%	0.641	S	S	*	*			trans	-88.9	96.6	-178.4	-51.6	0	0	0	0	109.9	V46 K219	V46-T48 PolarHBondContact O-N 2.9Å; V46-T48 PolarHBondContact O-OG1 2.72Å; V46-T48 VanDerWaalsContact O-OG1 3.06Å; T48-K219 PolarHBondContact O-NZ 2.84Å
49	A	54.6	Low	38.4	Very low	17 Å²	17	109 Å²	109	14%	0.14	61%	0.614	C	S	.	*			trans	-28.7	132.5	-175.4	0	0	0	0	0	115.9	D47 L51 G52 Q53	D47-A49 PolarHBondContact O-N 3.45Å; A49-L51 VanDerWaalsContact C-N 3.33Å; A49-L51 PolarHBondContact O-N 3.43Å; A49-G52 PolarHBondContact O-N 3.33Å; A49-Q53 HydrophobicContact CB-CG 4.48Å
50	L	58.4	Low	40.2	Very low	41 Å²	41	106.3 Å²	106.3	22%	0.215	61%	0.607	C	S	.	*	T	Hydrogen-bonded Turn	trans	-68.7	-29.2	-174.6	-69.6	160.6	0	0	0	113.1	L91 E95 K219 I226	L50-L91 HydrophobicContact CD1-CD2 4.48Å; L50-E95 WeakPolarHBondContact CB-OE2 3.41Å; L50-E95 PolarHBondContact N-OE1 3.4Å; L50-E95 PolarHBondContact N-OE2 2.92Å; L50-K219 HydrophobicContact CD2-CB 4.45Å; L50-K219 HydrophobicContact CD2-CD 4.21Å; L50-K219 HydrophobicContact CD2-CG 3.37Å; L50-I226 HydrophobicContact CB-CD1 4.32Å; L50-I226 HydrophobicContact CD1-CD1 3.58Å
51	L	59.3	Low	42.8	Very low	27 Å²	27	103.3 Å²	103.3	14%	0.141	59%	0.586	C	S	.	*	T	Hydrogen-bonded Turn	trans	-88.8	-8.9	179.4	-65.2	172.4	0	0	0	113.8	A49 E95 V147 R223 L227	A49-L51 VanDerWaalsContact C-N 3.33Å; A49-L51 PolarHBondContact O-N 3.43Å; L51-E95 VanDerWaalsContact CB-OE1 3.29Å; L51-E95 WeakPolarHBondContact CB-OE1 3.24Å; L51-E95 HydrophobicContact CD1-CG 3.87Å; L51-E95 HydrophobicContact CG-CG 4.15Å; L51-E95 WeakPolarHBondContact CG-OE1 3.23Å; L51-E95 PolarHBondContact N-OE1 2.92Å; L51-V147 HydrophobicContact CD1-CB 4.22Å; L51-V147 HydrophobicContact CD1-CG1 4.05Å; L51-V147 HydrophobicContact CD1-CG2 4.35Å; L51-R223 HydrophobicContact CD2-CG 4.2Å; L51-L227 HydrophobicContact CD2-CD2 4.27Å
52	G	48	Very low	45.6	Very low	32 Å²	32	97.8 Å²	97.8	33%	0.33	56%	0.556	S	S	.	*			trans	87.2	131.5	176.6	0	0	0	0	0	114.3	A49 S54 R59	A49-G52 PolarHBondContact O-N 3.33Å; G52-S54 PolarHBondContact O-N 3.06Å; G52-R59 PolarHBondContact O-NH2 2.9Å
53	Q	41	Very low	48.3	Very low	149 Å²	149	90.4 Å²	90.4	70%	0.696	52%	0.52	S	S	*	.			trans	-82.9	106.2	168.7	-67.1	174.1	3.3	0	0	108.6	A49	A49-Q53 HydrophobicContact CB-CG 4.48Å
54	S	32.8	Very low	50.8	Low	85 Å²	85	91.7 Å²	91.7	59%	0.594	52%	0.518	S	S	*	.			trans	-145.2	147.3	168.3	-168.2	0	0	0	0	109.2	G52	G52-S54 PolarHBondContact O-N 3.06Å
55	T	36.6	Very low	52.5	Low	116 Å²	116	89.7 Å²	89.7	71%	0.712	50%	0.499	S	S	*	.			trans	-57.9	145.6	-169.9	45.8	0	0	0	0	112.9	V57	T55-V57 PolarHBondContact O-N 2.9Å
56	A	43	Very low	53.9	Low	76 Å²	76	90.1 Å²	90.1	63%	0.628	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	13.2	-161.4	0	0	0	0	0	118.1
57	V	42.7	Very low	55	Low	125 Å²	125	84.6 Å²	84.6	76%	0.758	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-36.3	-173.3	-175.6	0	0	0	0	112.8	T55	T55-V57 PolarHBondContact O-N 2.9Å
58	D	46.3	Very low	55.8	Low	144 Å²	144	79 Å²	79	77%	0.77	44%	0.437	S	S	*	.			trans	-132.2	56.7	-175.4	-71.7	-57.8	0	0	0	112.5
59	R	57.2	Low	56.2	Low	92 Å²	92	76.9 Å²	76.9	35%	0.347	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-82.7	122.9	163.6	-97	-172.2	172.5	-170.1	-3	109	G52 N145	G52-R59 PolarHBondContact O-NH2 2.9Å; R59-N145 PolarHBondContact NH1-ND2 3.31Å
60	P	64.9	Low	56	Low	95 Å²	95	82.1 Å²	82.1	62%	0.617	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-59.3	145.5	169.5	26.5	-33.7	0	0	0	109.4	E64	P60-E64 VanDerWaalsContact CA-OE2 3.24Å; P60-E64 WeakPolarHBondContact CA-OE2 3.48Å; P60-E64 HydrophobicContact CB-CB 4.44Å; P60-E64 VanDerWaalsContact CB-OE2 3.3Å; P60-E64 WeakPolarHBondContact CB-OE2 3.22Å
61	K	79.6	Confident	55.5	Low	90 Å²	90	83 Å²	83	39%	0.391	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-62	147.9	-178.9	-59.8	-175.4	-172.5	-171.3	0	109.3	F63 E64 H181	K61-F63 HydrophobicContact CB-CD1 4.33Å; K61-F63 HydrophobicContact CB-CD2 4.24Å; K61-F63 HydrophobicContact CB-CE1 4.05Å; K61-F63 HydrophobicContact CB-CE2 3.97Å; K61-F63 HydrophobicContact CB-CG 4.42Å; K61-F63 HydrophobicContact CB-CZ 3.88Å; K61-F63 HydrophobicContact CD-CE1 4Å; K61-F63 HydrophobicContact CD-CE2 3.83Å; K61-F63 HydrophobicContact CD-CZ 3.33Å; K61-F63 HydrophobicContact CG-CZ 4.24Å; K61-F63 PolarHBondContact O-N 3.32Å; K61-E64 HydrophobicContact CB-CG 4.03Å; K61-E64 WeakPolarHBondContact CG-OE1 3.23Å; K61-E64 PolarHBondContact N-OE2 3.35Å; K61-E64 WeakPolarHBondContact O-CB 3.46Å; K61-E64 PolarHBondContact O-N 2.81Å; K61-H181 PolarHBondContact NZ-O 3.39Å
62	W	84.1	Confident	54.8	Low	21 Å²	21	88.1 Å²	88.1	8%	0.08	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-25.2	-174.2	71.5	-93.1	0	0	0	113.4	V147 L183 L189 L227 F230 E231 L234	W62-V147 HydrophobicContact CB-CG2 4.44Å; W62-L183 WeakPolarHBondContact CZ2-O 3.42Å; W62-L183 PolarHBondContact NE1-O 3.02Å; W62-L189 HydrophobicContact CH2-CD2 3.86Å; W62-L189 HydrophobicContact CZ2-CD2 3.97Å; W62-L227 HydrophobicContact CB-CD2 4.26Å; W62-F230 AromaticContact CD1-CE1 3.8Å; W62-F230 AromaticContact CD2-CD1 3.85Å; W62-F230 HydrophobicContact CD2-CD1 3.85Å; W62-F230 AromaticContact CD2-CE1 3.61Å; W62-F230 HydrophobicContact CD2-CE1 3.61Å; W62-F230 AromaticContact CE2-CE1 3.59Å; W62-F230 HydrophobicContact CE3-CD1 4Å; W62-F230 HydrophobicContact CE3-CE1 4.22Å; W62-F230 HydrophobicContact CG-CD1 4.21Å; W62-F230 AromaticContact CG-CE1 3.77Å; W62-F230 HydrophobicContact CG-CE1 3.77Å; W62-F230 HydrophobicContact CZ2-CE1 4.19Å; W62-F230 HydrophobicContact CZ3-CD1 4.47Å; W62-F230 AromaticContact NE1-CE1 3.67Å; W62-E231 HydrophobicContact CH2-CB 3.88Å; W62-E231 HydrophobicContact CH2-CG 3.7Å; W62-E231 HydrophobicContact CZ3-CB 3.76Å; W62-E231 HydrophobicContact CZ3-CG 3.98Å; W62-L234 HydrophobicContact CZ2-CD2 3.66Å
63	F	81.8	Confident	54.9	Low	41 Å²	41	90 Å²	90	18%	0.18	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-3.5	178.6	57	-112.2	0	0	0	115.4	K61 D65 P185	K61-F63 HydrophobicContact CB-CD1 4.33Å; K61-F63 HydrophobicContact CB-CD2 4.24Å; K61-F63 HydrophobicContact CB-CE1 4.05Å; K61-F63 HydrophobicContact CB-CE2 3.97Å; K61-F63 HydrophobicContact CB-CG 4.42Å; K61-F63 HydrophobicContact CB-CZ 3.88Å; K61-F63 HydrophobicContact CD-CE1 4Å; K61-F63 HydrophobicContact CD-CE2 3.83Å; K61-F63 HydrophobicContact CD-CZ 3.33Å; K61-F63 HydrophobicContact CG-CZ 4.24Å; K61-F63 PolarHBondContact O-N 3.32Å; F63-D65 VanDerWaalsContact C-N 3.3Å; F63-P185 HydrophobicContact CB-CB 3.91Å; F63-P185 HydrophobicContact CB-CG 4.22Å; F63-P185 HydrophobicContact CD1-CB 3.95Å; F63-P185 HydrophobicContact CD1-CG 4.31Å; F63-P185 HydrophobicContact CD2-CB 3.88Å; F63-P185 HydrophobicContact CE1-CB 4.4Å; F63-P185 HydrophobicContact CE2-CB 4.33Å; F63-P185 HydrophobicContact CG-CB 3.66Å; F63-P185 HydrophobicContact CG-CG 4.28Å
64	E	75.5	Confident	55.1	Low	104 Å²	104	87.7 Å²	87.7	49%	0.486	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-16.2	174.9	-72.3	164.2	-172.4	0	0	112.1	P60 K61 K66	P60-E64 VanDerWaalsContact CA-OE2 3.24Å; P60-E64 WeakPolarHBondContact CA-OE2 3.48Å; P60-E64 HydrophobicContact CB-CB 4.44Å; P60-E64 VanDerWaalsContact CB-OE2 3.3Å; P60-E64 WeakPolarHBondContact CB-OE2 3.22Å; K61-E64 HydrophobicContact CB-CG 4.03Å; K61-E64 WeakPolarHBondContact CG-OE1 3.23Å; K61-E64 PolarHBondContact N-OE2 3.35Å; K61-E64 WeakPolarHBondContact O-CB 3.46Å; K61-E64 PolarHBondContact O-N 2.81Å; E64-K66 PolarHBondContact O-N 2.89Å
65	D	62.2	Low	55.7	Low	60 Å²	60	91 Å²	91	32%	0.321	50%	0.503	S	S	.	.	S	Bend	trans	-67.5	121.2	170.7	-155	-17.2	0	0	0	109.4	F63 S67 R223 L227	F63-D65 VanDerWaalsContact C-N 3.3Å; D65-S67 PolarHBondContact O-N 3.13Å; D65-S67 PolarHBondContact O-OG 3.44Å; D65-R223 IonicContact OD2-CZ 2.73Å; D65-R223 IonicContact OD2-NE 3.19Å; D65-R223 PolarHBondContact OD2-NE 2.84Å; D65-R223 IonicContact OD2-NH2 3.28Å; D65-R223 PolarHBondContact OD2-NH2 2.77Å; D65-L227 HydrophobicContact CB-CD1 4.29Å
66	K	55.9	Low	56.6	Low	205 Å²	205	88.9 Å²	88.9	89%	0.891	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	23.2	-172.9	-65.9	-175.4	178	179.7	0	113.6	E64	E64-K66 PolarHBondContact O-N 2.89Å
67	S	54	Low	57.7	Low	9 Å²	9	89.9 Å²	89.9	6%	0.063	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-12.5	-172.6	42.7	0	0	0	0	115.6	D65 K224 W228	D65-S67 PolarHBondContact O-N 3.13Å; D65-S67 PolarHBondContact O-OG 3.44Å; S67-K224 PolarHBondContact O-NZ 3.09Å; S67-W228 PolarHBondContact O-NE1 2.97Å
68	C	50.3	Low	59.4	Low	28 Å²	28	88.1 Å²	88.1	19%	0.189	47%	0.465	C	S	.	.			trans	-105.1	82.1	-177.1	-63.5	0	0	0	0	112.3	I190 L195 W228 E231	C68-I190 HydrophobicContact CB-CD1 4.43Å; C68-L195 HydrophobicContact CB-CD2 4.17Å; C68-W228 VanDerWaalsContact SG-CD1 3.54Å; C68-E231 PolarHBondContact SG-OE2 3.04Å; C68-E231 VanDerWaalsContact SG-OE2 3.42Å
69	S	51.2	Low	61	Low	58 Å²	58	88.2 Å²	88.2	41%	0.406	46%	0.46	S	S	.	.			trans	-86.2	142.3	164.6	-10.7	0	0	0	0	110.2	E198	S69-E198 VanDerWaalsContact CB-OE1 3.27Å; S69-E198 WeakPolarHBondContact CB-OE1 3.43Å; S69-E198 PolarHBondContact OG-OE1 3.17Å
70	L	50.2	Low	61.8	Low	126 Å²	126	88.7 Å²	88.7	66%	0.66	46%	0.462	S	S	*	.			trans	-75.8	132	170.3	-151.5	87.2	0	0	0	109.2	I190	L70-I190 HydrophobicContact CD1-CD1 3.86Å; L70-I190 HydrophobicContact CD1-CG1 3.86Å; L70-I190 HydrophobicContact CD1-CG2 3.85Å
71	I	49.8	Very low	62.5	Low	61 Å²	61	84.9 Å²	84.9	31%	0.313	44%	0.437	S	S	.	.			trans	-122.7	139.2	169.7	-68.3	-161.9	0	0	0	109.7	C197 E198	I71-C197 HydrophobicContact CB-CB 4.39Å; I71-C197 HydrophobicContact CG2-CB 4.09Å; I71-E198 HydrophobicContact CD1-CB 4.21Å; I71-E198 HydrophobicContact CD1-CG 3.34Å; I71-E198 HydrophobicContact CG1-CG 3.99Å
72	D	43.8	Very low	62.8	Low	133 Å²	133	83.4 Å²	83.4	71%	0.711	44%	0.441	S	S	*	.			trans	-60.1	138.2	-177.4	-86.4	-39.8	0	0	0	113.1	S74	D72-S74 PolarHBondContact O-N 2.95Å
73	S	49.3	Very low	62.8	Low	72 Å²	72	86.8 Å²	86.8	50%	0.503	46%	0.458	S	S	.	.			trans	-81.3	22.6	-168.6	50.4	0	0	0	0	115.1	K76	S73-K76 VanDerWaalsContact CB-CE 3.43Å; S73-K76 WeakPolarHBondContact O-CE 3.21Å
74	S	44.9	Very low	62.9	Low	101 Å²	101	85.2 Å²	85.2	71%	0.706	45%	0.452	S	S	*	.	S	Bend	trans	-85.7	-5.9	-159.6	57.3	0	0	0	0	116.9	D72	D72-S74 PolarHBondContact O-N 2.95Å
75	N	45.5	Very low	63.4	Low	154 Å²	154	83.2 Å²	83.2	82%	0.824	44%	0.442	S	S	*	.			trans	-145.5	119.9	166.5	-95.6	-40.3	0	0	0	109.4
76	K	55.8	Low	64.7	Low	72 Å²	72	82.9 Å²	82.9	31%	0.313	45%	0.448	S	S	.	.			trans	-129.1	115.7	-178.2	-60.4	-163.5	-175.8	-164.2	0	111.1	S73 D78 K193	S73-K76 VanDerWaalsContact CB-CE 3.43Å; S73-K76 WeakPolarHBondContact O-CE 3.21Å; K76-D78 PolarHBondContact O-N 2.72Å; K76-K193 HydrophobicContact CD-CG 4.1Å; K76-K193 PolarHBondContact NZ-O 2.93Å
77	D	67.3	Low	66.2	Low	97 Å²	97	77.8 Å²	77.8	52%	0.519	43%	0.429	S	S	.	.			trans	-85.9	94.9	160.2	-177.4	-11.4	0	0	0	107.4	Q79 R80 V81	D77-Q79 PolarHBondContact O-N 3.38Å; D77-Q79 PolarHBondContact OD1-N 3.18Å; D77-R80 HydrophobicContact CB-CB 3.98Å; D77-R80 PolarHBondContact O-N 2.64Å; D77-R80 PolarHBondContact OD1-N 3.33Å; D77-V81 PolarHBondContact O-N 3.43Å; D77-V81 VanDerWaalsContact O-N 3.12Å
78	D	76.8	Confident	67.8	Low	88 Å²	88	77.3 Å²	77.3	47%	0.471	43%	0.426	S	S	.	.	H	α-helix	trans	-60.9	-28	-174.2	-86.8	4.2	0	0	0	112.7	K76 V81 A82 K193	K76-D78 PolarHBondContact O-N 2.72Å; D78-V81 PolarHBondContact O-N 3.28Å; D78-A82 PolarHBondContact O-N 3.36Å; D78-K193 WeakPolarHBondContact OD1-CE 3.35Å; D78-K193 IonicContact OD1-NZ 2.69Å; D78-K193 PolarHBondContact OD1-NZ 3.33Å; D78-K193 IonicContact OD2-NZ 3.45Å; D78-K193 PolarHBondContact OD2-NZ 2.87Å
79	Q	80.1	Confident	69.7	Low	145 Å²	145	79.3 Å²	79.3	68%	0.678	43%	0.434	S	S	*	.	H	α-helix	trans	-69	-41.8	175.4	-172.7	165.5	-14	0	0	110.7	D77 V81 A82 E83	D77-Q79 PolarHBondContact O-N 3.38Å; D77-Q79 PolarHBondContact OD1-N 3.18Å; Q79-V81 VanDerWaalsContact C-N 3.32Å; Q79-V81 PolarHBondContact O-N 3.04Å; Q79-A82 PolarHBondContact O-N 2.88Å; Q79-E83 WeakPolarHBondContact O-CG 3.02Å; Q79-E83 PolarHBondContact O-N 3.34Å
80	R	74.3	Confident	71.6	Confident	103 Å²	103	83 Å²	83	39%	0.389	45%	0.445	S	S	.	.	H	α-helix	trans	-67.2	-31.1	176	-169.4	53.4	169.4	170.3	-2.5	113.3	D77 E83 L84	D77-R80 HydrophobicContact CB-CB 3.98Å; D77-R80 PolarHBondContact O-N 2.64Å; D77-R80 PolarHBondContact OD1-N 3.33Å; R80-E83 WeakPolarHBondContact CD-OE2 3.44Å; R80-E83 IonicContact CZ-OE2 3.9Å; R80-E83 IonicContact NE-OE2 2.63Å; R80-E83 IonicContact NH1-OE2 3.64Å; R80-E83 PolarHBondContact NH1-OE2 3.09Å; R80-L84 WeakPolarHBondContact O-CG 3.38Å; R80-L84 PolarHBondContact O-N 2.94Å; R80-L84 VanDerWaalsContact O-N 3.17Å
81	V	80.5	Confident	73.5	Confident	15 Å²	15	78.5 Å²	78.5	9%	0.091	42%	0.422	C	S	.	.	H	α-helix	trans	-63.9	-46.4	171.6	178.7	0	0	0	0	110.7	D77 D78 Q79 E83 L84 E85 F192 K193	D77-V81 PolarHBondContact O-N 3.43Å; D77-V81 VanDerWaalsContact O-N 3.12Å; D78-V81 PolarHBondContact O-N 3.28Å; Q79-V81 VanDerWaalsContact C-N 3.32Å; Q79-V81 PolarHBondContact O-N 3.04Å; V81-E83 PolarHBondContact O-N 3.46Å; V81-L84 PolarHBondContact O-N 3.3Å; V81-E85 PolarHBondContact O-N 2.79Å; V81-F192 HydrophobicContact CG1-CD1 4.42Å; V81-K193 HydrophobicContact CG1-CB 4.16Å; V81-K193 HydrophobicContact CG1-CG 4.11Å
82	A	84.7	Confident	75.3	Confident	58 Å²	58	76.2 Å²	76.2	48%	0.479	41%	0.41	S	S	.	.	H	α-helix	trans	-63.2	-39.2	179.3	0	0	0	0	0	112.7	D78 Q79 E85 A86	D78-A82 PolarHBondContact O-N 3.36Å; Q79-A82 PolarHBondContact O-N 2.88Å; A82-E85 PolarHBondContact O-N 3.4Å; A82-A86 WeakPolarHBondContact O-CB 3.15Å; A82-A86 PolarHBondContact O-N 2.93Å
83	E	85	Confident	77.5	Confident	93 Å²	93	75 Å²	75	44%	0.435	40%	0.4	S	S	.	.	H	α-helix	trans	-61.5	-43.2	173.3	-71.4	175.3	178.1	0	0	112.6	Q79 R80 V81 E85 M87	Q79-E83 WeakPolarHBondContact O-CG 3.02Å; Q79-E83 PolarHBondContact O-N 3.34Å; R80-E83 WeakPolarHBondContact CD-OE2 3.44Å; R80-E83 IonicContact CZ-OE2 3.9Å; R80-E83 IonicContact NE-OE2 2.63Å; R80-E83 IonicContact NH1-OE2 3.64Å; R80-E83 PolarHBondContact NH1-OE2 3.09Å; V81-E83 PolarHBondContact O-N 3.46Å; E83-E85 VanDerWaalsContact C-N 3.34Å; E83-M87 WeakPolarHBondContact O-CB 3.18Å; E83-M87 PolarHBondContact O-N 3.29Å
84	L	83.7	Confident	79.4	Confident	7 Å²	7	76.3 Å²	76.3	4%	0.037	40%	0.401	C	S	.	.	H	α-helix	trans	-68.9	-33.1	177.1	-71.7	172.6	0	0	0	112	R80 V81 A88 F192 C196 L199 L225	R80-L84 WeakPolarHBondContact O-CG 3.38Å; R80-L84 PolarHBondContact O-N 2.94Å; R80-L84 VanDerWaalsContact O-N 3.17Å; V81-L84 PolarHBondContact O-N 3.3Å; L84-A88 VanDerWaalsContact O-CB 3.31Å; L84-A88 WeakPolarHBondContact O-CB 3.38Å; L84-A88 PolarHBondContact O-N 2.78Å; L84-F192 HydrophobicContact CB-CE1 4.5Å; L84-F192 HydrophobicContact CB-CZ 4.44Å; L84-C196 HydrophobicContact CD1-CB 4.13Å; L84-L199 HydrophobicContact CD1-CB 4.46Å; L84-L225 HydrophobicContact CB-CD2 4.37Å; L84-L225 HydrophobicContact CD2-CD2 4.33Å
85	E	86.8	Confident	81.4	Confident	62 Å²	62	72.1 Å²	72.1	29%	0.29	37%	0.37	S	S	.	.	H	α-helix	trans	-67.9	-47.9	174.8	-164.4	160.8	-173.1	0	0	111.1	V81 A82 E83 M87 A88 D89 F192 K229	V81-E85 PolarHBondContact O-N 2.79Å; A82-E85 PolarHBondContact O-N 3.4Å; E83-E85 VanDerWaalsContact C-N 3.34Å; E85-M87 VanDerWaalsContact C-N 3.31Å; E85-M87 PolarHBondContact O-N 3.45Å; E85-A88 CarbonylContact O-C 3.55Å; E85-A88 WeakPolarHBondContact O-CA 3.14Å; E85-A88 WeakPolarHBondContact O-CB 3.41Å; E85-A88 PolarHBondContact O-N 3.31Å; E85-D89 PolarHBondContact O-N 2.86Å; E85-F192 VanDerWaalsContact CA-CE1 3.47Å; E85-F192 HydrophobicContact CB-CD1 3.92Å; E85-F192 HydrophobicContact CB-CE1 3.46Å; E85-F192 VanDerWaalsContact CB-CE1 3.46Å; E85-F192 HydrophobicContact CB-CZ 4.08Å; E85-F192 HydrophobicContact CG-CD1 3.96Å; E85-F192 HydrophobicContact CG-CE1 3.9Å; E85-F192 HydrophobicContact CG-CZ 4.4Å; E85-K229 HydrophobicContact CG-CD 4.15Å; E85-K229 IonicContact OE1-NZ 2.94Å; E85-K229 PolarHBondContact OE1-NZ 3.02Å
86	A	88.8	Confident	83.4	Confident	54 Å²	54	65.9 Å²	65.9	45%	0.446	34%	0.339	S	S	.	.	H	α-helix	trans	-60.9	-37.6	176.2	0	0	0	0	0	112.9	A82 Q90	A82-A86 WeakPolarHBondContact O-CB 3.15Å; A82-A86 PolarHBondContact O-N 2.93Å; A86-Q90 WeakPolarHBondContact O-CG 3.41Å; A86-Q90 PolarHBondContact O-N 3.42Å; A86-Q90 VanDerWaalsContact O-N 3.17Å
87	M	87	Confident	84.9	Confident	97 Å²	97	66.1 Å²	66.1	48%	0.478	34%	0.343	S	S	.	.	H	α-helix	trans	-66	-41.3	171.8	177.7	175.3	-78.4	0	0	111.8	E83 E85 Q90 L91 L225	E83-M87 WeakPolarHBondContact O-CB 3.18Å; E83-M87 PolarHBondContact O-N 3.29Å; E85-M87 VanDerWaalsContact C-N 3.31Å; E85-M87 PolarHBondContact O-N 3.45Å; M87-Q90 PolarHBondContact O-N 3.27Å; M87-L91 HydrophobicContact CG-CD1 4.02Å; M87-L91 WeakPolarHBondContact O-CB 3.34Å; M87-L91 VanDerWaalsContact O-CG 3.29Å; M87-L91 WeakPolarHBondContact O-CG 3.47Å; M87-L91 PolarHBondContact O-N 2.86Å; M87-L225 HydrophobicContact CG-CD1 4.39Å; M87-L225 HydrophobicContact SD-CD1 4.11Å
88	A	88.8	Confident	85.8	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-66.3	-38.3	178	0	0	0	0	0	112.1	L84 E85 L91 L92 F192 L225 K229	L84-A88 VanDerWaalsContact O-CB 3.31Å; L84-A88 WeakPolarHBondContact O-CB 3.38Å; L84-A88 PolarHBondContact O-N 2.78Å; E85-A88 CarbonylContact O-C 3.55Å; E85-A88 WeakPolarHBondContact O-CA 3.14Å; E85-A88 WeakPolarHBondContact O-CB 3.41Å; E85-A88 PolarHBondContact O-N 3.31Å; A88-L91 PolarHBondContact O-N 3.07Å; A88-L92 VanDerWaalsContact O-CB 3.25Å; A88-L92 WeakPolarHBondContact O-CB 3.32Å; A88-L92 PolarHBondContact O-N 2.98Å; A88-F192 HydrophobicContact CB-CE2 4Å; A88-F192 HydrophobicContact CB-CZ 4.05Å; A88-L225 HydrophobicContact CB-CB 3.99Å; A88-L225 HydrophobicContact CB-CD2 4.4Å; A88-K229 HydrophobicContact CB-CB 3.78Å; A88-K229 HydrophobicContact CB-CG 4.24Å
89	D	89.9	Confident	86.1	Confident	69 Å²	69	60.4 Å²	60.4	37%	0.369	32%	0.315	S	S	.	.	H	α-helix	trans	-60.7	-47.3	173.4	-83.5	-40.8	0	0	0	111.8	E85 L91 L92 Q93 K229	E85-D89 PolarHBondContact O-N 2.86Å; D89-L91 PolarHBondContact O-N 3.39Å; D89-L92 PolarHBondContact O-N 3.37Å; D89-Q93 VanDerWaalsContact O-CB 3.3Å; D89-Q93 WeakPolarHBondContact O-CB 3.42Å; D89-Q93 PolarHBondContact O-N 2.93Å; D89-K229 VanDerWaalsContact CG-CE 3.49Å; D89-K229 WeakPolarHBondContact OD1-CE 3.3Å; D89-K229 IonicContact OD1-NZ 2.97Å
90	Q	91	Very high	86.2	Confident	137 Å²	137	59 Å²	59	64%	0.64	31%	0.309	S	S	*	.	H	α-helix	trans	-61.2	-43.8	176	-73.5	-177.2	-8.6	0	0	112.2	A86 M87 Q93 N94	A86-Q90 WeakPolarHBondContact O-CG 3.41Å; A86-Q90 PolarHBondContact O-N 3.42Å; A86-Q90 VanDerWaalsContact O-N 3.17Å; M87-Q90 PolarHBondContact O-N 3.27Å; Q90-Q93 PolarHBondContact O-N 3.21Å; Q90-N94 WeakPolarHBondContact O-CB 3.36Å; Q90-N94 PolarHBondContact O-N 3.25Å; Q90-N94 PolarHBondContact O-OD1 3.32Å
91	L	89.6	Confident	86.5	Confident	31 Å²	31	56.5 Å²	56.5	16%	0.162	31%	0.31	C	S	.	.	H	α-helix	trans	-64.7	-42	177.4	-72.3	170.5	0	0	0	112.1	L50 M87 A88 D89 N94 E95 L225 I226	L50-L91 HydrophobicContact CD1-CD2 4.48Å; M87-L91 HydrophobicContact CG-CD1 4.02Å; M87-L91 WeakPolarHBondContact O-CB 3.34Å; M87-L91 VanDerWaalsContact O-CG 3.29Å; M87-L91 WeakPolarHBondContact O-CG 3.47Å; M87-L91 PolarHBondContact O-N 2.86Å; A88-L91 PolarHBondContact O-N 3.07Å; D89-L91 PolarHBondContact O-N 3.39Å; L91-N94 PolarHBondContact O-N 2.95Å; L91-E95 WeakPolarHBondContact O-CB 3.41Å; L91-E95 PolarHBondContact O-N 3.23Å; L91-L225 HydrophobicContact CD1-CB 4.36Å; L91-L225 HydrophobicContact CD1-CD1 4.27Å; L91-I226 HydrophobicContact CB-CD1 4.03Å; L91-I226 HydrophobicContact CB-CG1 3.72Å
92	L	88.5	Confident	86.5	Confident	13 Å²	13	57.2 Å²	57.2	7%	0.068	32%	0.317	C	S	.	.	H	α-helix	trans	-64.1	-45.4	176.1	176.4	63.5	0	0	0	110.6	A88 D89 N94 E95 C96 V147 I226 K229	A88-L92 VanDerWaalsContact O-CB 3.25Å; A88-L92 WeakPolarHBondContact O-CB 3.32Å; A88-L92 PolarHBondContact O-N 2.98Å; D89-L92 PolarHBondContact O-N 3.37Å; L92-N94 VanDerWaalsContact C-N 3.33Å; L92-N94 PolarHBondContact O-N 3Å; L92-E95 PolarHBondContact O-N 2.92Å; L92-C96 PolarHBondContact O-N 3.36Å; L92-C96 PolarHBondContact O-SG 3.36Å; L92-V147 HydrophobicContact CD1-CG1 3.51Å; L92-I226 HydrophobicContact CD1-CG2 3.91Å; L92-K229 HydrophobicContact CD2-CG 4.11Å
93	Q	90.2	Very high	85.9	Confident	106 Å²	106	56 Å²	56	50%	0.495	30%	0.302	S	S	.	.	H	α-helix	trans	-58.8	-44.9	177.1	-167.7	83.7	10.6	0	0	111.1	D89 Q90 C96 N97	D89-Q93 VanDerWaalsContact O-CB 3.3Å; D89-Q93 WeakPolarHBondContact O-CB 3.42Å; D89-Q93 PolarHBondContact O-N 2.93Å; Q90-Q93 PolarHBondContact O-N 3.21Å; Q93-C96 WeakPolarHBondContact O-CB 3.34Å; Q93-C96 PolarHBondContact O-N 2.96Å; Q93-N97 PolarHBondContact O-N 2.92Å; Q93-N97 PolarHBondContact O-ND2 2.88Å; Q93-N97 PolarHBondContact O-OD1 3.44Å
94	N	89.2	Confident	85.3	Confident	100 Å²	100	59.7 Å²	59.7	54%	0.535	31%	0.313	S	S	.	.	H	α-helix	trans	-64.4	-43.6	178	-69.7	-8.1	0	0	0	112	Q90 L91 L92 C96 N97 A98	Q90-N94 WeakPolarHBondContact O-CB 3.36Å; Q90-N94 PolarHBondContact O-N 3.25Å; Q90-N94 PolarHBondContact O-OD1 3.32Å; L91-N94 PolarHBondContact O-N 2.95Å; L92-N94 VanDerWaalsContact C-N 3.33Å; L92-N94 PolarHBondContact O-N 3Å; N94-C96 VanDerWaalsContact C-N 3.33Å; N94-C96 PolarHBondContact O-N 2.91Å; N94-N97 PolarHBondContact O-N 3.3Å; N94-A98 WeakPolarHBondContact O-CB 3.41Å; N94-A98 PolarHBondContact O-N 3.32Å
95	E	86.7	Confident	84.8	Confident	13 Å²	13	63.8 Å²	63.8	6%	0.061	33%	0.334	C	S	.	.	H	α-helix	trans	-64.3	-37	176	-168.4	70.1	-175.4	0	0	111.8	L50 L51 L91 L92 F99 I226	L50-E95 WeakPolarHBondContact CB-OE2 3.41Å; L50-E95 PolarHBondContact N-OE1 3.4Å; L50-E95 PolarHBondContact N-OE2 2.92Å; L51-E95 VanDerWaalsContact CB-OE1 3.29Å; L51-E95 WeakPolarHBondContact CB-OE1 3.24Å; L51-E95 HydrophobicContact CD1-CG 3.87Å; L51-E95 HydrophobicContact CG-CG 4.15Å; L51-E95 WeakPolarHBondContact CG-OE1 3.23Å; L51-E95 PolarHBondContact N-OE1 2.92Å; L91-E95 WeakPolarHBondContact O-CB 3.41Å; L91-E95 PolarHBondContact O-N 3.23Å; L92-E95 PolarHBondContact O-N 2.92Å; E95-F99 WeakPolarHBondContact O-CB 3.3Å; E95-F99 PolarHBondContact O-N 3.25Å; E95-I226 HydrophobicContact CB-CD1 4.17Å; E95-I226 HydrophobicContact CG-CD1 4.46Å
96	C	86.8	Confident	83.9	Confident	24 Å²	24	65.4 Å²	65.4	16%	0.162	34%	0.342	C	S	.	.	H	α-helix	trans	-63	-45.8	172.1	-64.9	0	0	0	0	112.2	L92 Q93 N94 F99 Q100 C148	L92-C96 PolarHBondContact O-N 3.36Å; L92-C96 PolarHBondContact O-SG 3.36Å; Q93-C96 WeakPolarHBondContact O-CB 3.34Å; Q93-C96 PolarHBondContact O-N 2.96Å; N94-C96 VanDerWaalsContact C-N 3.33Å; N94-C96 PolarHBondContact O-N 2.91Å; C96-F99 PolarHBondContact O-N 3.33Å; C96-Q100 PolarHBondContact O-N 3.48Å; C96-C148 HydrophobicContact CB-CB 4.42Å
97	N	87.6	Confident	82.6	Confident	76 Å²	76	64.5 Å²	64.5	41%	0.406	33%	0.331	S	S	.	.	H	α-helix	trans	-63.5	-44.3	178.4	-66.4	-19.7	0	0	0	111	Q93 N94 F99 Q100 A101	Q93-N97 PolarHBondContact O-N 2.92Å; Q93-N97 PolarHBondContact O-ND2 2.88Å; Q93-N97 PolarHBondContact O-OD1 3.44Å; N94-N97 PolarHBondContact O-N 3.3Å; N97-F99 VanDerWaalsContact C-N 3.35Å; N97-F99 PolarHBondContact O-N 2.94Å; N97-Q100 PolarHBondContact O-N 2.88Å; N97-A101 WeakPolarHBondContact O-CB 3.29Å; N97-A101 PolarHBondContact O-N 2.93Å
98	A	86	Confident	81.5	Confident	28 Å²	28	63.3 Å²	63.3	23%	0.231	33%	0.327	C	S	.	.	H	α-helix	trans	-62.5	-40	175.9	0	0	0	0	0	112	N94 A101 A102	N94-A98 WeakPolarHBondContact O-CB 3.41Å; N94-A98 PolarHBondContact O-N 3.32Å; A98-A101 PolarHBondContact O-N 3.26Å; A98-A102 WeakPolarHBondContact O-CB 3.33Å; A98-A102 PolarHBondContact O-N 2.73Å
99	F	83.6	Confident	80.3	Confident	38 Å²	38	67 Å²	67	17%	0.167	36%	0.357	C	S	.	.	H	α-helix	trans	-65.1	-43.4	174.3	179.3	-106.8	0	0	0	112.4	E95 C96 N97 A102 L103 N145 C148	E95-F99 WeakPolarHBondContact O-CB 3.3Å; E95-F99 PolarHBondContact O-N 3.25Å; C96-F99 PolarHBondContact O-N 3.33Å; N97-F99 VanDerWaalsContact C-N 3.35Å; N97-F99 PolarHBondContact O-N 2.94Å; F99-A102 PolarHBondContact O-N 2.78Å; F99-L103 WeakPolarHBondContact O-CB 3.46Å; F99-L103 PolarHBondContact O-N 3.29Å; F99-N145 HydrophobicContact CD1-CB 4.44Å; F99-N145 WeakPolarHBondContact CD2-ND2 3.21Å; F99-N145 HydrophobicContact CE1-CB 3.78Å; F99-N145 HydrophobicContact CE2-CB 3.9Å; F99-N145 WeakPolarHBondContact CE2-ND2 3.48Å; F99-N145 WeakPolarHBondContact CG-ND2 3.48Å; F99-N145 HydrophobicContact CZ-CB 3.47Å; F99-N145 VanDerWaalsContact CZ-CB 3.47Å; F99-C148 HydrophobicContact CB-CB 4.31Å; F99-C148 HydrophobicContact CD1-CB 3.62Å; F99-C148 HydrophobicContact CE1-CB 4.27Å; F99-C148 HydrophobicContact CG-CB 4.15Å
100	Q	80.6	Confident	78.3	Confident	116 Å²	116	67.4 Å²	67.4	54%	0.542	36%	0.356	S	S	.	.	H	α-helix	trans	-64.1	-39.9	174.6	-74.7	-169.2	-45.8	0	0	112.3	C96 N97 L103 W104	C96-Q100 PolarHBondContact O-N 3.48Å; N97-Q100 PolarHBondContact O-N 2.88Å; Q100-L103 PolarHBondContact O-N 2.99Å; Q100-W104 WeakPolarHBondContact O-CB 3.46Å; Q100-W104 PolarHBondContact O-N 3.44Å
101	A	80.8	Confident	76.4	Confident	50 Å²	50	65.9 Å²	65.9	41%	0.413	36%	0.361	S	S	.	.	H	α-helix	trans	-64.8	-42.6	176.2	0	0	0	0	0	111.7	N97 A98 W104 N105	N97-A101 WeakPolarHBondContact O-CB 3.29Å; N97-A101 PolarHBondContact O-N 2.93Å; A98-A101 PolarHBondContact O-N 3.26Å; A101-W104 PolarHBondContact O-N 3.47Å; A101-N105 WeakPolarHBondContact O-CB 3.42Å; A101-N105 PolarHBondContact O-N 3.36Å; A101-N105 PolarHBondContact O-ND2 3.47Å
102	A	80.6	Confident	74.4	Confident	29 Å²	29	69 Å²	69	24%	0.24	39%	0.386	C	S	.	.	H	α-helix	trans	-61.4	-43.5	174.1	0	0	0	0	0	112	A98 F99 N105 E106	A98-A102 WeakPolarHBondContact O-CB 3.33Å; A98-A102 PolarHBondContact O-N 2.73Å; F99-A102 PolarHBondContact O-N 2.78Å; A102-N105 PolarHBondContact O-N 2.8Å; A102-E106 PolarHBondContact O-N 3.36Å
103	L	72.4	Confident	72.1	Confident	33 Å²	33	74.6 Å²	74.6	17%	0.173	42%	0.415	C	S	.	.	H	α-helix	trans	-63	-42	176.5	-166	81.2	0	0	0	112	F99 Q100 N105 E106 V107 A119	F99-L103 WeakPolarHBondContact O-CB 3.46Å; F99-L103 PolarHBondContact O-N 3.29Å; Q100-L103 PolarHBondContact O-N 2.99Å; L103-N105 VanDerWaalsContact C-N 3.33Å; L103-E106 PolarHBondContact O-N 2.93Å; L103-V107 WeakPolarHBondContact O-CG2 3.29Å; L103-V107 PolarHBondContact O-N 3.07Å; L103-A119 HydrophobicContact CD1-CB 4Å; L103-A119 HydrophobicContact CD2-CB 4.19Å; L103-A119 HydrophobicContact CG-CB 4.04Å
104	W	71.9	Confident	70.2	Confident	171 Å²	171	74.2 Å²	74.2	65%	0.648	43%	0.43	S	S	*	.	H	α-helix	trans	-66.5	-36.8	177	-169	84.1	0	0	0	111.8	Q100 A101 V107 N108	Q100-W104 WeakPolarHBondContact O-CB 3.46Å; Q100-W104 PolarHBondContact O-N 3.44Å; A101-W104 PolarHBondContact O-N 3.47Å; W104-V107 PolarHBondContact O-N 2.93Å; W104-N108 VanDerWaalsContact CD2-ND2 3.28Å; W104-N108 WeakPolarHBondContact CH2-ND2 3Å; W104-N108 WeakPolarHBondContact CZ2-ND2 3.22Å; W104-N108 WeakPolarHBondContact CZ3-ND2 3.39Å; W104-N108 PolarHBondContact O-N 2.76Å; W104-N108 VanDerWaalsContact O-N 3.09Å; W104-N108 PolarHBondContact O-ND2 2.91Å
105	N	73.1	Confident	68.1	Low	93 Å²	93	72.2 Å²	72.2	50%	0.497	42%	0.424	S	S	.	.	H	α-helix	trans	-68	-40.2	173.2	-69.9	-21.1	0	0	0	112.4	A101 A102 L103 N108 A109	A101-N105 WeakPolarHBondContact O-CB 3.42Å; A101-N105 PolarHBondContact O-N 3.36Å; A101-N105 PolarHBondContact O-ND2 3.47Å; A102-N105 PolarHBondContact O-N 2.8Å; L103-N105 VanDerWaalsContact C-N 3.33Å; N105-N108 PolarHBondContact O-N 3.42Å; N105-A109 VanDerWaalsContact O-CB 3.22Å; N105-A109 WeakPolarHBondContact O-CB 3.35Å; N105-A109 PolarHBondContact O-N 3.18Å
106	E	68.9	Low	66.2	Low	95 Å²	95	72 Å²	72	44%	0.444	43%	0.425	S	S	.	.	H	α-helix	trans	-55.6	-51.8	170.3	-81.9	-175.8	165	0	0	110.6	A102 L103 N108 A109 E110 R144	A102-E106 PolarHBondContact O-N 3.36Å; L103-E106 PolarHBondContact O-N 2.93Å; E106-N108 VanDerWaalsContact C-N 3.32Å; E106-N108 PolarHBondContact O-N 3.33Å; E106-A109 PolarHBondContact O-N 2.82Å; E106-E110 WeakPolarHBondContact O-CB 3.47Å; E106-E110 WeakPolarHBondContact O-CG 3.43Å; E106-E110 PolarHBondContact O-N 3.39Å; E106-R144 IonicContact OE2-NH2 2.69Å; E106-R144 PolarHBondContact OE2-NH2 3.27Å
107	V	62.4	Low	64.7	Low	36 Å²	36	74.3 Å²	74.3	22%	0.218	44%	0.442	C	S	.	.	H	α-helix	trans	-58.1	-42.2	-178.6	170.7	0	0	0	0	112.1	L103 W104 S111 A119	L103-V107 WeakPolarHBondContact O-CG2 3.29Å; L103-V107 PolarHBondContact O-N 3.07Å; W104-V107 PolarHBondContact O-N 2.93Å; V107-S111 PolarHBondContact O-N 3.39Å; V107-A119 HydrophobicContact CG2-CB 3.78Å
108	N	63.8	Low	63.3	Low	72 Å²	72	78.9 Å²	78.9	39%	0.385	45%	0.453	S	S	.	.	H	α-helix	trans	-76	-39.9	180	-73.7	-30.7	0	0	0	113	W104 N105 E106 S111	W104-N108 VanDerWaalsContact CD2-ND2 3.28Å; W104-N108 WeakPolarHBondContact CH2-ND2 3Å; W104-N108 WeakPolarHBondContact CZ2-ND2 3.22Å; W104-N108 WeakPolarHBondContact CZ3-ND2 3.39Å; W104-N108 PolarHBondContact O-N 2.76Å; W104-N108 VanDerWaalsContact O-N 3.09Å; W104-N108 PolarHBondContact O-ND2 2.91Å; N105-N108 PolarHBondContact O-N 3.42Å; E106-N108 VanDerWaalsContact C-N 3.32Å; E106-N108 PolarHBondContact O-N 3.33Å; N108-S111 WeakPolarHBondContact O-CB 3.3Å; N108-S111 PolarHBondContact O-N 2.96Å; N108-S111 PolarHBondContact O-OG 3.21Å
109	A	61.9	Low	62.1	Low	77 Å²	77	77.9 Å²	77.9	64%	0.636	45%	0.446	S	S	*	.	H	α-helix	trans	-67.4	-37.6	178.3	0	0	0	0	0	112.2	N105 E106 S111	N105-A109 VanDerWaalsContact O-CB 3.22Å; N105-A109 WeakPolarHBondContact O-CB 3.35Å; N105-A109 PolarHBondContact O-N 3.18Å; E106-A109 PolarHBondContact O-N 2.82Å; A109-S111 VanDerWaalsContact C-N 3.31Å; A109-S111 PolarHBondContact O-N 2.72Å
110	E	49.5	Very low	61.3	Low	77 Å²	77	78.4 Å²	78.4	36%	0.36	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	6	179.2	-64.6	-165.8	157.7	0	0	113.9	E106 S112 N113 S115 G116	E106-E110 WeakPolarHBondContact O-CB 3.47Å; E106-E110 WeakPolarHBondContact O-CG 3.43Å; E106-E110 PolarHBondContact O-N 3.39Å; E110-S112 PolarHBondContact O-N 3.18Å; E110-N113 CarbonylContact O-C 3.48Å; E110-N113 PolarHBondContact O-N 3.16Å; E110-S115 WeakPolarHBondContact OE2-CB 3.45Å; E110-S115 PolarHBondContact OE2-OG 3.46Å; E110-G116 PolarHBondContact OE2-N 2.77Å
111	S	49.8	Very low	60.9	Low	105 Å²	105	79.4 Å²	79.4	73%	0.734	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-3.4	178.2	60.4	0	0	0	0	115.2	V107 N108 A109	V107-S111 PolarHBondContact O-N 3.39Å; N108-S111 WeakPolarHBondContact O-CB 3.3Å; N108-S111 PolarHBondContact O-N 2.96Å; N108-S111 PolarHBondContact O-OG 3.21Å; A109-S111 VanDerWaalsContact C-N 3.31Å; A109-S111 PolarHBondContact O-N 2.72Å
112	S	48	Very low	60.5	Low	98 Å²	98	78.1 Å²	78.1	69%	0.685	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-9.1	171.5	57.1	0	0	0	0	115.4	E110	E110-S112 PolarHBondContact O-N 3.18Å
113	N	41.4	Very low	60.2	Low	129 Å²	129	80.5 Å²	80.5	69%	0.69	45%	0.45	S	S	*	.	S	Bend	trans	-143.2	143.2	178.8	-89.5	-45.7	0	0	0	111.4	E110 S115	E110-N113 CarbonylContact O-C 3.48Å; E110-N113 PolarHBondContact O-N 3.16Å; N113-S115 PolarHBondContact O-N 3.43Å
114	A	50	Low	60.6	Low	98 Å²	98	82.7 Å²	82.7	81%	0.81	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	3.8	-160.4	0	0	0	0	0	119.1
115	S	45.2	Very low	60.9	Low	58 Å²	58	76 Å²	76	41%	0.406	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-45	178.8	170.9	0	0	0	0	113.3	E110 N113 S117 R118	E110-S115 WeakPolarHBondContact OE2-CB 3.45Å; E110-S115 PolarHBondContact OE2-OG 3.46Å; N113-S115 PolarHBondContact O-N 3.43Å; S115-S117 PolarHBondContact O-N 3.43Å; S115-R118 PolarHBondContact O-N 3.33Å
116	G	45.3	Very low	61.1	Low	8 Å²	8	72 Å²	72	8%	0.082	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-20.5	-174.9	0	0	0	0	0	115.1	E110 R118	E110-G116 PolarHBondContact OE2-N 2.77Å; G116-R118 VanDerWaalsContact C-N 3.27Å; G116-R118 PolarHBondContact O-N 3.43Å
117	S	55.1	Low	61.6	Low	73 Å²	73	74 Å²	74	51%	0.51	44%	0.435	S	S	.	.	H	α-helix	trans	-51.3	-43.1	168.5	175.9	0	0	0	0	112.7	S115 A119 W121	S115-S117 PolarHBondContact O-N 3.43Å; S117-A119 PolarHBondContact O-N 3.33Å; S117-W121 WeakPolarHBondContact O-CB 3.37Å; S117-W121 PolarHBondContact O-N 2.83Å
118	R	58.4	Low	62.4	Low	172 Å²	172	76.7 Å²	76.7	65%	0.649	46%	0.455	S	S	*	.	H	α-helix	trans	-59.6	-39.4	-163.7	-88.6	-173.6	164.7	115.3	-3.7	115.3	S115 G116 L122	S115-R118 PolarHBondContact O-N 3.33Å; G116-R118 VanDerWaalsContact C-N 3.27Å; G116-R118 PolarHBondContact O-N 3.43Å; R118-L122 WeakPolarHBondContact O-CB 3.25Å; R118-L122 VanDerWaalsContact O-CG 3.22Å; R118-L122 WeakPolarHBondContact O-CG 3.49Å; R118-L122 PolarHBondContact O-N 3.35Å
119	A	62	Low	63.2	Low	8 Å²	8	74.2 Å²	74.2	7%	0.066	45%	0.447	C	S	.	.	H	α-helix	trans	-71.8	-52.8	-174.4	0	0	0	0	0	111.8	L103 V107 S117 W121 L122 D123	L103-A119 HydrophobicContact CD1-CB 4Å; L103-A119 HydrophobicContact CD2-CB 4.19Å; L103-A119 HydrophobicContact CG-CB 4.04Å; V107-A119 HydrophobicContact CG2-CB 3.78Å; S117-A119 PolarHBondContact O-N 3.33Å; A119-W121 VanDerWaalsContact C-N 3.27Å; A119-W121 PolarHBondContact O-N 2.95Å; A119-L122 PolarHBondContact O-N 3.33Å; A119-D123 PolarHBondContact O-N 3.13Å
120	A	66	Low	64.4	Low	49 Å²	49	74.5 Å²	74.5	41%	0.405	44%	0.441	S	S	.	.	H	α-helix	trans	-64.2	-33.3	175.1	0	0	0	0	0	112.2	T124	A120-T124 WeakPolarHBondContact O-CB 3.42Å; A120-T124 PolarHBondContact O-N 3.43Å; A120-T124 PolarHBondContact O-OG1 2.89Å
121	W	72	Confident	66.1	Low	136 Å²	136	72.6 Å²	72.6	52%	0.515	43%	0.433	S	S	.	.	H	α-helix	trans	-65.4	-39	173.1	-179.9	88.7	0	0	0	112.5	S117 A119 T124 I125	S117-W121 WeakPolarHBondContact O-CB 3.37Å; S117-W121 PolarHBondContact O-N 2.83Å; A119-W121 VanDerWaalsContact C-N 3.27Å; A119-W121 PolarHBondContact O-N 2.95Å; W121-T124 PolarHBondContact O-N 3.09Å; W121-I125 HydrophobicContact CD2-CD1 3.66Å; W121-I125 HydrophobicContact CD2-CG1 4.37Å; W121-I125 HydrophobicContact CE3-CD1 3.97Å; W121-I125 HydrophobicContact CG-CD1 4.39Å; W121-I125 HydrophobicContact CH2-CD1 3.58Å; W121-I125 HydrophobicContact CZ2-CD1 3.23Å; W121-I125 HydrophobicContact CZ3-CD1 3.93Å; W121-I125 WeakPolarHBondContact O-CB 3.46Å; W121-I125 WeakPolarHBondContact O-CG1 3.31Å; W121-I125 PolarHBondContact O-N 2.89Å
122	L	72.9	Confident	67.8	Low	23 Å²	23	71.2 Å²	71.2	12%	0.12	42%	0.423	C	S	.	.	H	α-helix	trans	-64.2	-45.3	175.1	-80	170.5	0	0	0	112.1	R118 A119 I125 A126 A137 A140 L141	R118-L122 WeakPolarHBondContact O-CB 3.25Å; R118-L122 VanDerWaalsContact O-CG 3.22Å; R118-L122 WeakPolarHBondContact O-CG 3.49Å; R118-L122 PolarHBondContact O-N 3.35Å; A119-L122 PolarHBondContact O-N 3.33Å; L122-I125 PolarHBondContact O-N 2.99Å; L122-A126 WeakPolarHBondContact O-CB 3.45Å; L122-A126 PolarHBondContact O-N 3.43Å; L122-A137 HydrophobicContact CD2-CB 3.92Å; L122-A140 HydrophobicContact CD1-CB 4.24Å; L122-A140 HydrophobicContact CD2-CB 3.94Å; L122-L141 HydrophobicContact CB-CD2 4.14Å; L122-L141 HydrophobicContact CB-CG 4.35Å
123	D	75.3	Confident	69.7	Low	79 Å²	79	69.9 Å²	69.9	42%	0.422	41%	0.408	S	S	.	.	H	α-helix	trans	-63.1	-42.2	174.7	-78.7	-30.8	0	0	0	111.6	A119 I125 A126 L127 L141	A119-D123 PolarHBondContact O-N 3.13Å; D123-I125 PolarHBondContact O-N 3.44Å; D123-A126 PolarHBondContact O-N 2.85Å; D123-L127 WeakPolarHBondContact O-CG 3.5Å; D123-L127 PolarHBondContact O-N 3.43Å; D123-L141 WeakPolarHBondContact OD1-CD1 3.22Å
124	T	78.9	Confident	71.9	Confident	80 Å²	80	66.6 Å²	66.6	49%	0.491	39%	0.386	S	S	.	.	H	α-helix	trans	-60.1	-46.5	175.5	-57.3	0	0	0	0	111	A120 W121 L127 S128	A120-T124 WeakPolarHBondContact O-CB 3.42Å; A120-T124 PolarHBondContact O-N 3.43Å; A120-T124 PolarHBondContact O-OG1 2.89Å; W121-T124 PolarHBondContact O-N 3.09Å; T124-L127 PolarHBondContact O-N 3.33Å; T124-S128 PolarHBondContact O-N 3.09Å; T124-S128 PolarHBondContact O-OG 2.95Å
125	I	79.4	Confident	73.8	Confident	29 Å²	29	62 Å²	62	15%	0.149	35%	0.348	C	S	.	.	H	α-helix	trans	-66.8	-41.1	177.8	-75.2	-173.8	0	0	0	111.6	W121 L122 D123 L127 S128 G129 D133 R134 A137	W121-I125 HydrophobicContact CD2-CD1 3.66Å; W121-I125 HydrophobicContact CD2-CG1 4.37Å; W121-I125 HydrophobicContact CE3-CD1 3.97Å; W121-I125 HydrophobicContact CG-CD1 4.39Å; W121-I125 HydrophobicContact CH2-CD1 3.58Å; W121-I125 HydrophobicContact CZ2-CD1 3.23Å; W121-I125 HydrophobicContact CZ3-CD1 3.93Å; W121-I125 WeakPolarHBondContact O-CB 3.46Å; W121-I125 WeakPolarHBondContact O-CG1 3.31Å; W121-I125 PolarHBondContact O-N 2.89Å; L122-I125 PolarHBondContact O-N 2.99Å; D123-I125 PolarHBondContact O-N 3.44Å; I125-L127 PolarHBondContact O-N 3.42Å; I125-L127 VanDerWaalsContact O-N 3.17Å; I125-S128 PolarHBondContact O-N 3.24Å; I125-G129 WeakPolarHBondContact O-CA 3.27Å; I125-G129 PolarHBondContact O-N 3.36Å; I125-D133 HydrophobicContact CG2-CB 3.63Å; I125-D133 WeakPolarHBondContact CG2-O 3.49Å; I125-R134 WeakPolarHBondContact O-CG 3.45Å; I125-A137 HydrophobicContact CB-CB 4.24Å; I125-A137 HydrophobicContact CG2-CB 3.73Å
126	A	76.8	Confident	75.9	Confident	9 Å²	9	62.1 Å²	62.1	7%	0.074	35%	0.353	C	S	.	.	H	α-helix	trans	-58.7	-27.3	177	0	0	0	0	0	112.8	L122 D123 R134 A137 L138 L141 R159	L122-A126 WeakPolarHBondContact O-CB 3.45Å; L122-A126 PolarHBondContact O-N 3.43Å; D123-A126 PolarHBondContact O-N 2.85Å; A126-R134 WeakPolarHBondContact O-CD 3.4Å; A126-R134 WeakPolarHBondContact O-CG 3.4Å; A126-A137 HydrophobicContact CB-CB 4.08Å; A126-L138 HydrophobicContact CB-CD2 4.2Å; A126-L138 HydrophobicContact CB-CG 4.26Å; A126-L141 HydrophobicContact CB-CD1 4.29Å; A126-R159 PolarHBondContact O-NH2 2.78Å
127	L	80	Confident	78	Confident	138 Å²	138	61.9 Å²	61.9	72%	0.723	35%	0.35	S	S	*	.	H	α-helix	trans	-85.8	-55.5	173.6	-66.7	169.7	0	0	0	112.7	D123 T124 I125 R134	D123-L127 WeakPolarHBondContact O-CG 3.5Å; D123-L127 PolarHBondContact O-N 3.43Å; T124-L127 PolarHBondContact O-N 3.33Å; I125-L127 PolarHBondContact O-N 3.42Å; I125-L127 VanDerWaalsContact O-N 3.17Å; L127-R134 WeakPolarHBondContact O-CD 3.35Å
128	S	79.3	Confident	79.6	Confident	93 Å²	93	58.8 Å²	58.8	65%	0.65	33%	0.328	S	S	*	.	H	α-helix	trans	-112.8	-7	-164.1	70.9	0	0	0	0	116.6	T124 I125	T124-S128 PolarHBondContact O-N 3.09Å; T124-S128 PolarHBondContact O-OG 2.95Å; I125-S128 PolarHBondContact O-N 3.24Å
129	G	80.6	Confident	81.1	Confident	20 Å²	20	51 Å²	51	21%	0.206	30%	0.301	C	S	.	.	S	Bend	trans	-69	179	-178.4	0	0	0	0	0	114.3	I125 R134	I125-G129 WeakPolarHBondContact O-CA 3.27Å; I125-G129 PolarHBondContact O-N 3.36Å; G129-R134 WeakPolarHBondContact O-CD 3.3Å; G129-R134 PolarHBondContact O-NE 3.48Å
130	T	86.7	Confident	82.3	Confident	83 Å²	83	52.2 Å²	52.2	51%	0.509	31%	0.311	S	S	.	.			trans	-62.2	168	172.3	78.7	0	0	0	0	110.6	S132 D133 R134	T130-S132 PolarHBondContact O-N 3.42Å; T130-D133 VanDerWaalsContact CB-OD2 3.24Å; T130-D133 WeakPolarHBondContact CB-OD2 3.49Å; T130-D133 VanDerWaalsContact CG2-OD2 3.23Å; T130-D133 WeakPolarHBondContact CG2-OD2 3.46Å; T130-D133 PolarHBondContact N-OD2 3.04Å; T130-D133 PolarHBondContact O-N 3.38Å; T130-D133 PolarHBondContact OG1-N 3.47Å; T130-D133 PolarHBondContact OG1-OD2 3.44Å; T130-R134 VanDerWaalsContact O-CB 3.32Å; T130-R134 WeakPolarHBondContact O-CB 3.25Å; T130-R134 WeakPolarHBondContact O-CG 3.37Å; T130-R134 PolarHBondContact O-N 3.42Å; T130-R134 PolarHBondContact O-NE 3.06Å
131	L	84.3	Confident	83.3	Confident	37 Å²	37	50.6 Å²	50.6	19%	0.194	30%	0.295	C	S	.	.	H	α-helix	trans	-58	-38.8	178.8	176.9	60.6	0	0	0	112.5	M135 R166 E167 I170	L131-M135 HydrophobicContact CD1-CE 3.85Å; L131-M135 WeakPolarHBondContact O-CG 3.23Å; L131-M135 PolarHBondContact O-N 2.97Å; L131-R166 HydrophobicContact CD2-CG 4.11Å; L131-E167 HydrophobicContact CD1-CB 3.82Å; L131-E167 HydrophobicContact CD1-CG 3.69Å; L131-E167 HydrophobicContact CD2-CB 4.21Å; L131-I170 HydrophobicContact CD2-CD1 3.91Å; L131-I170 HydrophobicContact CG-CD1 4.32Å
132	S	85.3	Confident	84.2	Confident	75 Å²	75	44.2 Å²	44.2	52%	0.524	27%	0.271	S	S	.	.	H	α-helix	trans	-68.6	-49.2	178	-163.9	0	0	0	0	110.9	T130 R134 M135 A136	T130-S132 PolarHBondContact O-N 3.42Å; S132-R134 VanDerWaalsContact C-N 3.28Å; S132-R134 PolarHBondContact O-N 2.83Å; S132-M135 PolarHBondContact O-N 3.35Å; S132-M135 VanDerWaalsContact O-N 3.13Å; S132-A136 PolarHBondContact O-N 2.95Å
133	D	88	Confident	84.8	Confident	70 Å²	70	46.3 Å²	46.3	37%	0.374	29%	0.288	S	S	.	.	H	α-helix	trans	-64.1	-35.8	-177.9	-45.6	-38.4	0	0	0	111.4	I125 T130 A136 A137	I125-D133 HydrophobicContact CG2-CB 3.63Å; I125-D133 WeakPolarHBondContact CG2-O 3.49Å; T130-D133 VanDerWaalsContact CB-OD2 3.24Å; T130-D133 WeakPolarHBondContact CB-OD2 3.49Å; T130-D133 VanDerWaalsContact CG2-OD2 3.23Å; T130-D133 WeakPolarHBondContact CG2-OD2 3.46Å; T130-D133 PolarHBondContact N-OD2 3.04Å; T130-D133 PolarHBondContact O-N 3.38Å; T130-D133 PolarHBondContact OG1-N 3.47Å; T130-D133 PolarHBondContact OG1-OD2 3.44Å; D133-A136 PolarHBondContact O-N 3.03Å; D133-A137 VanDerWaalsContact O-CB 3.23Å; D133-A137 WeakPolarHBondContact O-CB 3.42Å; D133-A137 PolarHBondContact O-N 2.63Å
134	R	89.1	Confident	85.2	Confident	61 Å²	61	46.7 Å²	46.7	23%	0.23	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-42.4	174.2	-81.1	-175.7	-61.6	160.3	5	112.7	I125 A126 L127 G129 T130 S132 L138	I125-R134 WeakPolarHBondContact O-CG 3.45Å; A126-R134 WeakPolarHBondContact O-CD 3.4Å; A126-R134 WeakPolarHBondContact O-CG 3.4Å; L127-R134 WeakPolarHBondContact O-CD 3.35Å; G129-R134 WeakPolarHBondContact O-CD 3.3Å; G129-R134 PolarHBondContact O-NE 3.48Å; T130-R134 VanDerWaalsContact O-CB 3.32Å; T130-R134 WeakPolarHBondContact O-CB 3.25Å; T130-R134 WeakPolarHBondContact O-CG 3.37Å; T130-R134 PolarHBondContact O-N 3.42Å; T130-R134 PolarHBondContact O-NE 3.06Å; S132-R134 VanDerWaalsContact C-N 3.28Å; S132-R134 PolarHBondContact O-N 2.83Å; R134-L138 VanDerWaalsContact O-CG 3.28Å; R134-L138 WeakPolarHBondContact O-CG 3.38Å; R134-L138 PolarHBondContact O-N 3.17Å; R134-L138 VanDerWaalsContact O-N 3.1Å
135	M	89.8	Confident	85.5	Confident	1 Å²	1	43 Å²	43	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-71.4	-42.2	177.2	-63.6	-39.1	106.5	0	0	111	L131 S132 A137 L138 G139 L156 R159 I170 A171 T174	L131-M135 HydrophobicContact CD1-CE 3.85Å; L131-M135 WeakPolarHBondContact O-CG 3.23Å; L131-M135 PolarHBondContact O-N 2.97Å; S132-M135 PolarHBondContact O-N 3.35Å; S132-M135 VanDerWaalsContact O-N 3.13Å; M135-A137 PolarHBondContact O-N 3.24Å; M135-L138 HydrophobicContact CE-CD1 4.44Å; M135-L138 PolarHBondContact O-N 3.49Å; M135-L138 HydrophobicContact SD-CD1 4.31Å; M135-G139 PolarHBondContact O-N 3.03Å; M135-L156 HydrophobicContact SD-CD1 3.64Å; M135-R159 VanDerWaalsContact CE-CD 3.45Å; M135-I170 HydrophobicContact CB-CG2 4.34Å; M135-I170 HydrophobicContact CG-CG2 3.87Å; M135-A171 HydrophobicContact SD-CB 3.84Å; M135-T174 HydrophobicContact CB-CG2 4.16Å; M135-T174 WeakPolarHBondContact CB-OG1 3.47Å
136	A	88.3	Confident	85.9	Confident	61 Å²	61	42.8 Å²	42.8	50%	0.504	26%	0.261	S	S	.	.	H	α-helix	trans	-60.4	-42.6	176	0	0	0	0	0	112.4	S132 D133 G139 A140	S132-A136 PolarHBondContact O-N 2.95Å; D133-A136 PolarHBondContact O-N 3.03Å; A136-G139 PolarHBondContact O-N 3.34Å; A136-A140 WeakPolarHBondContact O-CB 3.32Å; A136-A140 PolarHBondContact O-N 2.58Å
137	A	89.8	Confident	86.4	Confident	3 Å²	3	42.7 Å²	42.7	3%	0.025	26%	0.259	C	S	.	.	H	α-helix	trans	-66.4	-42.8	176.9	0	0	0	0	0	112.4	L122 I125 A126 D133 M135 G139 A140 L141	L122-A137 HydrophobicContact CD2-CB 3.92Å; I125-A137 HydrophobicContact CB-CB 4.24Å; I125-A137 HydrophobicContact CG2-CB 3.73Å; A126-A137 HydrophobicContact CB-CB 4.08Å; D133-A137 VanDerWaalsContact O-CB 3.23Å; D133-A137 WeakPolarHBondContact O-CB 3.42Å; D133-A137 PolarHBondContact O-N 2.63Å; M135-A137 PolarHBondContact O-N 3.24Å; A137-G139 VanDerWaalsContact C-N 3.31Å; A137-G139 PolarHBondContact O-N 3.24Å; A137-A140 PolarHBondContact O-N 3.45Å; A137-L141 WeakPolarHBondContact O-CG 3.35Å; A137-L141 PolarHBondContact O-N 3.29Å
138	L	88.5	Confident	86.7	Confident	8 Å²	8	36.9 Å²	36.9	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-58.8	-43.1	172.2	-73.8	169.9	0	0	0	111.3	A126 R134 M135 L141 I142 A152 L156	A126-L138 HydrophobicContact CB-CD2 4.2Å; A126-L138 HydrophobicContact CB-CG 4.26Å; R134-L138 VanDerWaalsContact O-CG 3.28Å; R134-L138 WeakPolarHBondContact O-CG 3.38Å; R134-L138 PolarHBondContact O-N 3.17Å; R134-L138 VanDerWaalsContact O-N 3.1Å; M135-L138 HydrophobicContact CE-CD1 4.44Å; M135-L138 PolarHBondContact O-N 3.49Å; M135-L138 HydrophobicContact SD-CD1 4.31Å; L138-L141 PolarHBondContact O-N 3.33Å; L138-I142 WeakPolarHBondContact O-CD1 3.37Å; L138-I142 VanDerWaalsContact O-CG1 3.22Å; L138-I142 WeakPolarHBondContact O-CG1 3.41Å; L138-I142 PolarHBondContact O-N 2.67Å; L138-A152 HydrophobicContact CD2-CB 4.05Å; L138-L156 HydrophobicContact CD1-CB 4.36Å; L138-L156 HydrophobicContact CD1-CD1 4.29Å
139	G	90.1	Very high	87.1	Confident	9 Å²	9	33.8 Å²	33.8	9%	0.093	21%	0.207	C	C	.	.	H	α-helix	trans	-64.3	-39.7	175.5	0	0	0	0	0	113.9	M135 A136 A137 I142 S143	M135-G139 PolarHBondContact O-N 3.03Å; A136-G139 PolarHBondContact O-N 3.34Å; A137-G139 VanDerWaalsContact C-N 3.31Å; A137-G139 PolarHBondContact O-N 3.24Å; G139-I142 PolarHBondContact O-N 3.26Å; G139-S143 WeakPolarHBondContact O-CB 3.34Å; G139-S143 PolarHBondContact O-N 3.04Å; G139-S143 PolarHBondContact O-OG 3.29Å
140	A	88.1	Confident	87.5	Confident	33 Å²	33	33.6 Å²	33.6	27%	0.273	20%	0.201	S	C	.	.	H	α-helix	trans	-65.1	-39.1	174.9	0	0	0	0	0	112.6	L122 A136 A137 S143 R144	L122-A140 HydrophobicContact CD1-CB 4.24Å; L122-A140 HydrophobicContact CD2-CB 3.94Å; A136-A140 WeakPolarHBondContact O-CB 3.32Å; A136-A140 PolarHBondContact O-N 2.58Å; A137-A140 PolarHBondContact O-N 3.45Å; A140-S143 WeakPolarHBondContact CA-OG 3.42Å; A140-S143 PolarHBondContact O-OG 3.3Å; A140-R144 PolarHBondContact O-N 3.07Å; A140-R144 VanDerWaalsContact O-N 3.16Å
141	L	86.7	Confident	87.5	Confident	14 Å²	14	36.8 Å²	36.8	7%	0.073	21%	0.207	C	C	.	.	H	α-helix	trans	-64.5	-49.6	174.4	-70.8	167.9	0	0	0	111.1	L122 D123 A126 A137 L138 S143 R144 N149 A152	L122-L141 HydrophobicContact CB-CD2 4.14Å; L122-L141 HydrophobicContact CB-CG 4.35Å; D123-L141 WeakPolarHBondContact OD1-CD1 3.22Å; A126-L141 HydrophobicContact CB-CD1 4.29Å; A137-L141 WeakPolarHBondContact O-CG 3.35Å; A137-L141 PolarHBondContact O-N 3.29Å; L138-L141 PolarHBondContact O-N 3.33Å; L141-S143 VanDerWaalsContact C-N 3.34Å; L141-S143 PolarHBondContact O-N 3.44Å; L141-R144 PolarHBondContact O-N 3.17Å; L141-N149 PolarHBondContact O-ND2 2.72Å; L141-A152 HydrophobicContact CB-CB 4.48Å
142	I	89.7	Confident	87.8	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-41.6	-179.5	-65.7	160.5	0	0	0	111	L138 G139 N145 P146 A152 L153 L156 L178 L183	L138-I142 WeakPolarHBondContact O-CD1 3.37Å; L138-I142 VanDerWaalsContact O-CG1 3.22Å; L138-I142 WeakPolarHBondContact O-CG1 3.41Å; L138-I142 PolarHBondContact O-N 2.67Å; G139-I142 PolarHBondContact O-N 3.26Å; I142-N145 CarbonylContact O-C 3.56Å; I142-P146 WeakPolarHBondContact O-CA 3.39Å; I142-P146 VanDerWaalsContact O-N 3.08Å; I142-A152 HydrophobicContact CD1-CB 4.4Å; I142-A152 HydrophobicContact CG1-CB 3.89Å; I142-L153 HydrophobicContact CD1-CB 4.04Å; I142-L153 HydrophobicContact CD1-CD1 4.25Å; I142-L153 HydrophobicContact CG1-CB 4.36Å; I142-L156 HydrophobicContact CD1-CD2 4.12Å; I142-L178 HydrophobicContact CD1-CD1 3.88Å; I142-L178 HydrophobicContact CG2-CD2 4.43Å; I142-L183 HydrophobicContact CG2-CD1 4.28Å; I142-L183 HydrophobicContact CG2-CD2 3.98Å
143	S	87	Confident	88.2	Confident	67 Å²	67	32.3 Å²	32.3	47%	0.469	18%	0.18	S	C	.	.	H	α-helix	trans	-71.3	-32.4	-179.3	51.1	0	0	0	0	114.4	G139 A140 L141 N145	G139-S143 WeakPolarHBondContact O-CB 3.34Å; G139-S143 PolarHBondContact O-N 3.04Å; G139-S143 PolarHBondContact O-OG 3.29Å; A140-S143 WeakPolarHBondContact CA-OG 3.42Å; A140-S143 PolarHBondContact O-OG 3.3Å; L141-S143 VanDerWaalsContact C-N 3.34Å; L141-S143 PolarHBondContact O-N 3.44Å; S143-N145 PolarHBondContact O-N 3.17Å
144	R	83.5	Confident	88.5	Confident	87 Å²	87	31.9 Å²	31.9	33%	0.328	18%	0.177	S	C	.	.	H	α-helix	trans	-61	-41.3	174.7	-83.2	-172.3	81.5	-174.8	2.7	112.8	E106 A140 L141	E106-R144 IonicContact OE2-NH2 2.69Å; E106-R144 PolarHBondContact OE2-NH2 3.27Å; A140-R144 PolarHBondContact O-N 3.07Å; A140-R144 VanDerWaalsContact O-N 3.16Å; L141-R144 PolarHBondContact O-N 3.17Å
145	N	85.7	Confident	88.6	Confident	4 Å²	4	31.8 Å²	31.8	2%	0.021	19%	0.186	C	C	.	.			trans	-156.5	92.4	177.5	-171.4	-14.5	0	0	0	110.7	R59 F99 I142 S143 V147 C148 N149	R59-N145 PolarHBondContact NH1-ND2 3.31Å; F99-N145 HydrophobicContact CD1-CB 4.44Å; F99-N145 WeakPolarHBondContact CD2-ND2 3.21Å; F99-N145 HydrophobicContact CE1-CB 3.78Å; F99-N145 HydrophobicContact CE2-CB 3.9Å; F99-N145 WeakPolarHBondContact CE2-ND2 3.48Å; F99-N145 WeakPolarHBondContact CG-ND2 3.48Å; F99-N145 HydrophobicContact CZ-CB 3.47Å; F99-N145 VanDerWaalsContact CZ-CB 3.47Å; I142-N145 CarbonylContact O-C 3.56Å; S143-N145 PolarHBondContact O-N 3.17Å; N145-V147 VanDerWaalsContact C-N 3.27Å; N145-V147 PolarHBondContact O-N 3.45Å; N145-V147 PolarHBondContact OD1-N 3.34Å; N145-C148 PolarHBondContact ND2-SG 2.81Å; N145-C148 PolarHBondContact O-N 2.85Å; N145-C148 PolarHBondContact OD1-N 3.48Å; N145-N149 WeakPolarHBondContact O-CB 3.37Å; N145-N149 PolarHBondContact O-N 2.89Å; N145-N149 VanDerWaalsContact O-N 3.13Å
146	P	87.3	Confident	88.8	Confident	24 Å²	24	31.7 Å²	31.7	16%	0.156	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-30.8	-174.6	26.4	-34.8	0	0	0	112.3	I142 L183 F230	I142-P146 WeakPolarHBondContact O-CA 3.39Å; I142-P146 VanDerWaalsContact O-N 3.08Å; P146-L183 HydrophobicContact CB-CD2 3.44Å; P146-L183 VanDerWaalsContact CB-CD2 3.44Å; P146-L183 HydrophobicContact CG-CD2 4.45Å; P146-F230 HydrophobicContact CB-CZ 4.01Å; P146-F230 WeakPolarHBondContact O-CE2 3.38Å
147	V	87.6	Confident	89.1	Confident	6 Å²	6	29.8 Å²	29.8	4%	0.036	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-45.7	-179.5	-178.3	0	0	0	0	111.3	L51 W62 L92 N145 I226 L227 F230	L51-V147 HydrophobicContact CD1-CB 4.22Å; L51-V147 HydrophobicContact CD1-CG1 4.05Å; L51-V147 HydrophobicContact CD1-CG2 4.35Å; W62-V147 HydrophobicContact CB-CG2 4.44Å; L92-V147 HydrophobicContact CD1-CG1 3.51Å; N145-V147 VanDerWaalsContact C-N 3.27Å; N145-V147 PolarHBondContact O-N 3.45Å; N145-V147 PolarHBondContact OD1-N 3.34Å; V147-I226 HydrophobicContact CG1-CG2 3.95Å; V147-L227 HydrophobicContact CG2-CD2 4.46Å; V147-F230 HydrophobicContact CB-CD2 4.27Å; V147-F230 HydrophobicContact CB-CG 4.46Å; V147-F230 HydrophobicContact CG1-CB 4.35Å; V147-F230 HydrophobicContact CG1-CD2 4.34Å; V147-F230 HydrophobicContact CG1-CG 4.38Å; V147-F230 HydrophobicContact CG2-CD1 4.17Å; V147-F230 HydrophobicContact CG2-CD2 4.28Å; V147-F230 HydrophobicContact CG2-CE1 4.46Å; V147-F230 HydrophobicContact CG2-CG 4.07Å
148	C	85.8	Confident	89.3	Confident	16 Å²	16	35.5 Å²	35.5	11%	0.108	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-23.8	-177.1	-58	0	0	0	0	113.8	C96 F99 N145	C96-C148 HydrophobicContact CB-CB 4.42Å; F99-C148 HydrophobicContact CB-CB 4.31Å; F99-C148 HydrophobicContact CD1-CB 3.62Å; F99-C148 HydrophobicContact CE1-CB 4.27Å; F99-C148 HydrophobicContact CG-CB 4.15Å; N145-C148 PolarHBondContact ND2-SG 2.81Å; N145-C148 PolarHBondContact O-N 2.85Å; N145-C148 PolarHBondContact OD1-N 3.48Å
149	N	87.4	Confident	89.5	Confident	29 Å²	29	36.5 Å²	36.5	16%	0.155	20%	0.196	C	C	.	.			trans	-99	27.7	-173.3	-69.9	-24.6	0	0	0	114.4	L141 N145 K151 A152 L153	L141-N149 PolarHBondContact O-ND2 2.72Å; N145-N149 WeakPolarHBondContact O-CB 3.37Å; N145-N149 PolarHBondContact O-N 2.89Å; N145-N149 VanDerWaalsContact O-N 3.13Å; N149-K151 PolarHBondContact O-N 3.36Å; N149-A152 HydrophobicContact CB-CB 4.35Å; N149-A152 WeakPolarHBondContact O-CB 3.19Å; N149-A152 PolarHBondContact O-N 3.29Å; N149-L153 PolarHBondContact O-N 3.19Å
150	L	88.2	Confident	89.7	Confident	16 Å²	16	36.1 Å²	36.1	8%	0.084	19%	0.192	C	C	.	.	H	α-helix	trans	-52.9	-34.2	172.3	-78.6	178	0	0	0	113.3	A152 L153 D154 F230 D233	L150-A152 VanDerWaalsContact C-N 3.3Å; L150-A152 PolarHBondContact O-N 3.26Å; L150-L153 HydrophobicContact CD2-CD2 4.26Å; L150-L153 CarbonylContact O-C 3.58Å; L150-L153 WeakPolarHBondContact O-CB 3.23Å; L150-L153 PolarHBondContact O-N 3.37Å; L150-L153 VanDerWaalsContact O-N 3.15Å; L150-D154 PolarHBondContact O-N 2.94Å; L150-F230 HydrophobicContact CD1-CD2 4Å; L150-F230 HydrophobicContact CD1-CE2 4.35Å; L150-F230 HydrophobicContact CD2-CD2 4.08Å; L150-F230 HydrophobicContact CD2-CE2 3.6Å; L150-F230 HydrophobicContact CG-CD2 4.07Å; L150-F230 HydrophobicContact CG-CE2 3.93Å; L150-D233 HydrophobicContact CD1-CB 4.2Å
151	K	88.5	Confident	89.9	Confident	150 Å²	150	38.5 Å²	38.5	65%	0.652	21%	0.206	S	C	*	.	H	α-helix	trans	-64.3	-31.8	175.5	-65.4	177.8	-176.9	170.4	0	113.2	N149 S155	N149-K151 PolarHBondContact O-N 3.36Å; K151-S155 WeakPolarHBondContact O-CB 2.84Å; K151-S155 PolarHBondContact O-N 3.17Å; K151-S155 PolarHBondContact O-OG 2.85Å
152	A	89.8	Confident	89.7	Confident	14 Å²	14	41.5 Å²	41.5	12%	0.116	22%	0.219	C	C	.	.	H	α-helix	trans	-73	-37.1	173.7	0	0	0	0	0	110.8	L138 L141 I142 N149 L150 S155 L156	L138-A152 HydrophobicContact CD2-CB 4.05Å; L141-A152 HydrophobicContact CB-CB 4.48Å; I142-A152 HydrophobicContact CD1-CB 4.4Å; I142-A152 HydrophobicContact CG1-CB 3.89Å; N149-A152 HydrophobicContact CB-CB 4.35Å; N149-A152 WeakPolarHBondContact O-CB 3.19Å; N149-A152 PolarHBondContact O-N 3.29Å; L150-A152 VanDerWaalsContact C-N 3.3Å; L150-A152 PolarHBondContact O-N 3.26Å; A152-S155 WeakPolarHBondContact O-CB 3.34Å; A152-S155 PolarHBondContact O-N 2.94Å; A152-L156 PolarHBondContact O-N 3.46Å
153	L	93.4	Very high	89.2	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-63.1	-46.1	171.4	-178.9	61.2	0	0	0	111.3	I142 N149 L150 S155 L156 L157 F179 L183 L234	I142-L153 HydrophobicContact CD1-CB 4.04Å; I142-L153 HydrophobicContact CD1-CD1 4.25Å; I142-L153 HydrophobicContact CG1-CB 4.36Å; N149-L153 PolarHBondContact O-N 3.19Å; L150-L153 HydrophobicContact CD2-CD2 4.26Å; L150-L153 CarbonylContact O-C 3.58Å; L150-L153 WeakPolarHBondContact O-CB 3.23Å; L150-L153 PolarHBondContact O-N 3.37Å; L150-L153 VanDerWaalsContact O-N 3.15Å; L153-S155 VanDerWaalsContact C-N 3.27Å; L153-S155 PolarHBondContact O-N 2.82Å; L153-L156 WeakPolarHBondContact O-CB 3.39Å; L153-L156 PolarHBondContact O-N 2.82Å; L153-L157 HydrophobicContact CD1-CD1 4.38Å; L153-L157 HydrophobicContact CD1-CD2 4.45Å; L153-L157 HydrophobicContact CD1-CG 4.15Å; L153-L157 HydrophobicContact CG-CD1 4.21Å; L153-L157 HydrophobicContact CG-CG 4.35Å; L153-L157 WeakPolarHBondContact O-CG 3.42Å; L153-L157 PolarHBondContact O-N 3.42Å; L153-F179 HydrophobicContact CD1-CZ 4.11Å; L153-F179 HydrophobicContact CD2-CZ 4.42Å; L153-L183 HydrophobicContact CD1-CD1 4.3Å; L153-L183 HydrophobicContact CD2-CD1 4.21Å; L153-L234 HydrophobicContact CD2-CD1 3.96Å
154	D	94.2	Very high	89.3	Confident	61 Å²	61	51.3 Å²	51.3	33%	0.326	26%	0.26	S	S	.	.	H	α-helix	trans	-58.7	-40	174.7	-69.9	-29.3	0	0	0	111.7	L150 L156 L157 H158 R237	L150-D154 PolarHBondContact O-N 2.94Å; D154-L156 VanDerWaalsContact C-N 3.35Å; D154-L156 PolarHBondContact O-N 3.33Å; D154-L157 PolarHBondContact O-N 2.88Å; D154-H158 VanDerWaalsContact O-CB 3.3Å; D154-H158 WeakPolarHBondContact O-CB 3.42Å; D154-H158 PolarHBondContact O-N 3.39Å; D154-R237 WeakPolarHBondContact OD1-CD 3.39Å; D154-R237 IonicContact OD1-CZ 3.23Å; D154-R237 IonicContact OD1-NE 2.7Å; D154-R237 PolarHBondContact OD1-NE 2.99Å; D154-R237 IonicContact OD1-NH2 3.87Å; D154-R237 PolarHBondContact OD1-NH2 3.43Å; D154-R237 IonicContact OD2-CZ 2.77Å; D154-R237 IonicContact OD2-NE 3.42Å; D154-R237 PolarHBondContact OD2-NE 3.23Å; D154-R237 IonicContact OD2-NH2 3.75Å; D154-R237 PolarHBondContact OD2-NH2 2.95Å
155	S	91.9	Very high	89.7	Confident	59 Å²	59	52.4 Å²	52.4	41%	0.413	27%	0.265	S	S	.	.	H	α-helix	trans	-66.3	-33	174.9	-60.5	0	0	0	0	113.2	K151 A152 L153 R159	K151-S155 WeakPolarHBondContact O-CB 2.84Å; K151-S155 PolarHBondContact O-N 3.17Å; K151-S155 PolarHBondContact O-OG 2.85Å; A152-S155 WeakPolarHBondContact O-CB 3.34Å; A152-S155 PolarHBondContact O-N 2.94Å; L153-S155 VanDerWaalsContact C-N 3.27Å; L153-S155 PolarHBondContact O-N 2.82Å; S155-R159 VanDerWaalsContact O-CG 3.32Å; S155-R159 WeakPolarHBondContact O-CG 3.3Å
156	L	93.5	Very high	90	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-72.9	-48.3	174.3	-179.2	64.1	0	0	0	110.9	M135 L138 I142 A152 L153 D154 H158 R159 V160 A171 T174 A175 L178	M135-L156 HydrophobicContact SD-CD1 3.64Å; L138-L156 HydrophobicContact CD1-CB 4.36Å; L138-L156 HydrophobicContact CD1-CD1 4.29Å; I142-L156 HydrophobicContact CD1-CD2 4.12Å; A152-L156 PolarHBondContact O-N 3.46Å; L153-L156 WeakPolarHBondContact O-CB 3.39Å; L153-L156 PolarHBondContact O-N 2.82Å; D154-L156 VanDerWaalsContact C-N 3.35Å; D154-L156 PolarHBondContact O-N 3.33Å; L156-H158 VanDerWaalsContact C-N 3.34Å; L156-H158 PolarHBondContact O-N 3.48Å; L156-R159 WeakPolarHBondContact O-CA 3.49Å; L156-R159 WeakPolarHBondContact O-CB 3.22Å; L156-R159 PolarHBondContact O-N 3.07Å; L156-V160 PolarHBondContact O-N 2.94Å; L156-A171 HydrophobicContact CD1-CB 3.97Å; L156-T174 HydrophobicContact CD2-CG2 4.45Å; L156-A175 HydrophobicContact CD2-CB 4Å; L156-A175 HydrophobicContact CG-CB 4.39Å; L156-L178 HydrophobicContact CD2-CD1 3.59Å
157	L	94.4	Very high	90.2	Very high	20 Å²	20	61.1 Å²	61.1	11%	0.105	30%	0.295	C	S	.	.	H	α-helix	trans	-62.4	-39.5	179.2	-65.7	-175.2	0	0	0	112.1	L153 D154 R159 V160 S161 A175 F179 R237 Y241	L153-L157 HydrophobicContact CD1-CD1 4.38Å; L153-L157 HydrophobicContact CD1-CD2 4.45Å; L153-L157 HydrophobicContact CD1-CG 4.15Å; L153-L157 HydrophobicContact CG-CD1 4.21Å; L153-L157 HydrophobicContact CG-CG 4.35Å; L153-L157 WeakPolarHBondContact O-CG 3.42Å; L153-L157 PolarHBondContact O-N 3.42Å; D154-L157 PolarHBondContact O-N 2.88Å; L157-R159 PolarHBondContact O-N 3.5Å; L157-V160 WeakPolarHBondContact O-CB 3.44Å; L157-V160 PolarHBondContact O-N 2.95Å; L157-V160 VanDerWaalsContact O-N 3.09Å; L157-S161 PolarHBondContact O-N 3.07Å; L157-A175 HydrophobicContact CD2-CB 4.41Å; L157-F179 HydrophobicContact CD2-CE2 4.13Å; L157-F179 HydrophobicContact CD2-CZ 4.47Å; L157-R237 HydrophobicContact CD1-CB 3.88Å; L157-R237 HydrophobicContact CD1-CG 4.38Å; L157-Y241 HydrophobicContact CD2-CD2 3.73Å; L157-Y241 HydrophobicContact CD2-CG 3.92Å
158	H	93.9	Very high	90.6	Very high	123 Å²	123	61 Å²	61	57%	0.569	30%	0.295	S	S	*	.	H	α-helix	trans	-58.7	-31.6	172.8	179.5	69.2	0	0	0	112.7	D154 L156 S161 K162	D154-H158 VanDerWaalsContact O-CB 3.3Å; D154-H158 WeakPolarHBondContact O-CB 3.42Å; D154-H158 PolarHBondContact O-N 3.39Å; L156-H158 VanDerWaalsContact C-N 3.34Å; L156-H158 PolarHBondContact O-N 3.48Å; H158-S161 PolarHBondContact O-N 3.41Å; H158-K162 PolarHBondContact O-N 2.89Å
159	R	93	Very high	91	Very high	30 Å²	30	61.8 Å²	61.8	11%	0.113	30%	0.298	C	S	.	.	H	α-helix	trans	-75.2	-30.9	176	-65.9	172.2	-170.7	-103.7	16.3	112.9	A126 M135 S155 L156 L157 S161 K162 E167 A168 A171	A126-R159 PolarHBondContact O-NH2 2.78Å; M135-R159 VanDerWaalsContact CE-CD 3.45Å; S155-R159 VanDerWaalsContact O-CG 3.32Å; S155-R159 WeakPolarHBondContact O-CG 3.3Å; L156-R159 WeakPolarHBondContact O-CA 3.49Å; L156-R159 WeakPolarHBondContact O-CB 3.22Å; L156-R159 PolarHBondContact O-N 3.07Å; L157-R159 PolarHBondContact O-N 3.5Å; R159-S161 VanDerWaalsContact C-N 3.26Å; R159-S161 PolarHBondContact O-N 3.38Å; R159-K162 HydrophobicContact CG-CD 4.48Å; R159-K162 WeakPolarHBondContact O-CB 3.5Å; R159-K162 PolarHBondContact O-N 2.91Å; R159-E167 HydrophobicContact CB-CG 4.13Å; R159-E167 HydrophobicContact CG-CG 4.48Å; R159-E167 WeakPolarHBondContact CG-OE1 3.41Å; R159-E167 IonicContact CZ-OE1 2.77Å; R159-E167 IonicContact NH1-OE1 3.97Å; R159-E167 PolarHBondContact NH1-OE1 3.28Å; R159-A168 WeakPolarHBondContact O-CA 3.35Å; R159-A171 HydrophobicContact CB-CB 3.85Å
160	V	94.6	Very high	91.3	Very high	1 Å²	1	63 Å²	63	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-58.4	-42.1	170	-176.3	0	0	0	0	110.1	L156 L157 K162 A168 A171 A172 Y241 A244 I248	L156-V160 PolarHBondContact O-N 2.94Å; L157-V160 WeakPolarHBondContact O-CB 3.44Å; L157-V160 PolarHBondContact O-N 2.95Å; L157-V160 VanDerWaalsContact O-N 3.09Å; V160-K162 VanDerWaalsContact C-N 3.3Å; V160-K162 PolarHBondContact O-N 2.83Å; V160-A168 VanDerWaalsContact O-CB 3.31Å; V160-A168 WeakPolarHBondContact O-CB 3.23Å; V160-A171 HydrophobicContact CG2-CB 3.9Å; V160-A172 HydrophobicContact CG1-CB 4.04Å; V160-A172 HydrophobicContact CG2-CB 4.35Å; V160-Y241 HydrophobicContact CG1-CD2 4.35Å; V160-Y241 HydrophobicContact CG1-CE2 4.32Å; V160-Y241 HydrophobicContact CG2-CD2 4.29Å; V160-Y241 HydrophobicContact CG2-CE2 4.24Å; V160-A244 HydrophobicContact CB-CB 4.45Å; V160-A244 HydrophobicContact CG1-CB 3.79Å; V160-I248 HydrophobicContact CG1-CD1 3.75Å
161	S	91.6	Very high	91.6	Very high	82 Å²	82	62.2 Å²	62.2	57%	0.573	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	6.6	178.6	-52.4	0	0	0	0	115.5	L157 H158 R159	L157-S161 PolarHBondContact O-N 3.07Å; H158-S161 PolarHBondContact O-N 3.41Å; R159-S161 VanDerWaalsContact C-N 3.26Å; R159-S161 PolarHBondContact O-N 3.38Å
162	K	83.2	Confident	92	Very high	77 Å²	77	55 Å²	55	34%	0.335	27%	0.268	S	S	.	.	S	Bend	trans	-80.4	151.5	179.8	-83.2	-176.1	-177.5	178.3	0	113	H158 R159 V160 S164 E167	H158-K162 PolarHBondContact O-N 2.89Å; R159-K162 HydrophobicContact CG-CD 4.48Å; R159-K162 WeakPolarHBondContact O-CB 3.5Å; R159-K162 PolarHBondContact O-N 2.91Å; V160-K162 VanDerWaalsContact C-N 3.3Å; V160-K162 PolarHBondContact O-N 2.83Å; K162-S164 PolarHBondContact O-N 2.91Å; K162-S164 VanDerWaalsContact O-N 3.09Å; K162-E167 IonicContact NZ-OE1 3.88Å; K162-E167 PolarHBondContact NZ-OE1 3.24Å; K162-E167 VanDerWaalsContact NZ-OE1 3.07Å; K162-E167 IonicContact NZ-OE2 2.92Å
163	K	78.2	Confident	92.3	Very high	217 Å²	217	58.4 Å²	58.4	94%	0.943	28%	0.282	S	S	*	.	S	Bend	trans	-60.7	-17.6	175	-63.8	-175.6	177.6	-178.7	0	115.1	R165	K163-R165 PolarHBondContact O-N 2.95Å
164	S	90.6	Very high	92.3	Very high	59 Å²	59	59.7 Å²	59.7	41%	0.413	29%	0.289	S	S	.	.			trans	-81.2	97	179	177.2	0	0	0	0	110.3	K162 R166 E167 A168	K162-S164 PolarHBondContact O-N 2.91Å; K162-S164 VanDerWaalsContact O-N 3.09Å; S164-R166 PolarHBondContact O-N 3.28Å; S164-R166 VanDerWaalsContact O-N 3.09Å; S164-E167 PolarHBondContact O-N 3.07Å; S164-A168 WeakPolarHBondContact O-CB 3.32Å; S164-A168 PolarHBondContact O-N 3.32Å
165	R	91.6	Very high	92.4	Very high	110 Å²	110	56.8 Å²	56.8	42%	0.415	27%	0.274	S	S	.	.	H	α-helix	trans	-44.9	-42	-179.7	-72.4	162.4	172.5	150.5	3.4	114.7	K163 L169 D251 T252 I256	K163-R165 PolarHBondContact O-N 2.95Å; R165-L169 WeakPolarHBondContact O-CB 3.24Å; R165-L169 WeakPolarHBondContact O-CG 3.36Å; R165-L169 PolarHBondContact O-N 3.21Å; R165-D251 IonicContact CZ-OD1 2.83Å; R165-D251 IonicContact CZ-OD2 2.7Å; R165-D251 IonicContact NE-OD1 2.75Å; R165-D251 PolarHBondContact NE-OD1 3Å; R165-D251 IonicContact NE-OD2 2.74Å; R165-D251 PolarHBondContact NE-OD2 3.02Å; R165-D251 IonicContact NH2-OD1 3.05Å; R165-D251 PolarHBondContact NH2-OD1 3.4Å; R165-D251 IonicContact NH2-OD2 2.64Å; R165-D251 PolarHBondContact NH2-OD2 3.34Å; R165-T252 PolarHBondContact NH2-OG1 3.02Å; R165-I256 HydrophobicContact CB-CD1 3.84Å; R165-I256 VanDerWaalsContact CD-CD1 3.48Å; R165-I256 HydrophobicContact CG-CD1 3.67Å
166	R	91.4	Very high	92.6	Very high	188 Å²	188	54.6 Å²	54.6	71%	0.709	26%	0.257	S	S	*	.	H	α-helix	trans	-73	-37.8	-179.8	-172.2	176.8	179.8	170.6	1	112.4	L131 S164 I170	L131-R166 HydrophobicContact CD2-CG 4.11Å; S164-R166 PolarHBondContact O-N 3.28Å; S164-R166 VanDerWaalsContact O-N 3.09Å; R166-I170 HydrophobicContact CG-CD1 4Å; R166-I170 VanDerWaalsContact O-CG1 3.29Å; R166-I170 WeakPolarHBondContact O-CG1 3.32Å; R166-I170 PolarHBondContact O-N 3.17Å
167	E	92.2	Very high	92.7	Very high	22 Å²	22	58.5 Å²	58.5	10%	0.103	28%	0.275	C	S	.	.	H	α-helix	trans	-68.9	-44.5	173.3	176.7	169.9	-164.3	0	0	110.5	L131 R159 K162 S164 I170 A171	L131-E167 HydrophobicContact CD1-CB 3.82Å; L131-E167 HydrophobicContact CD1-CG 3.69Å; L131-E167 HydrophobicContact CD2-CB 4.21Å; R159-E167 HydrophobicContact CB-CG 4.13Å; R159-E167 HydrophobicContact CG-CG 4.48Å; R159-E167 WeakPolarHBondContact CG-OE1 3.41Å; R159-E167 IonicContact CZ-OE1 2.77Å; R159-E167 IonicContact NH1-OE1 3.97Å; R159-E167 PolarHBondContact NH1-OE1 3.28Å; K162-E167 IonicContact NZ-OE1 3.88Å; K162-E167 PolarHBondContact NZ-OE1 3.24Å; K162-E167 VanDerWaalsContact NZ-OE1 3.07Å; K162-E167 IonicContact NZ-OE2 2.92Å; S164-E167 PolarHBondContact O-N 3.07Å; E167-I170 PolarHBondContact O-N 3.47Å; E167-A171 WeakPolarHBondContact O-CB 3.35Å; E167-A171 PolarHBondContact O-N 3.06Å
168	A	94.3	Very high	92.7	Very high	4 Å²	4	58.4 Å²	58.4	3%	0.033	28%	0.275	C	S	.	.	H	α-helix	trans	-57.6	-50.4	177.9	0	0	0	0	0	112.5	R159 V160 S164 A172 I248	R159-A168 WeakPolarHBondContact O-CA 3.35Å; V160-A168 VanDerWaalsContact O-CB 3.31Å; V160-A168 WeakPolarHBondContact O-CB 3.23Å; S164-A168 WeakPolarHBondContact O-CB 3.32Å; S164-A168 PolarHBondContact O-N 3.32Å; A168-A172 WeakPolarHBondContact O-CB 3.43Å; A168-A172 PolarHBondContact O-N 3.12Å; A168-I248 HydrophobicContact CB-CD1 4.33Å
169	L	94.4	Very high	92.8	Very high	33 Å²	33	52.5 Å²	52.5	17%	0.173	25%	0.247	C	C	.	.	H	α-helix	trans	-66.7	-41.9	-179.5	-74.2	174.8	0	0	0	113.3	R165 A172 E173 I248 I256 K259	R165-L169 WeakPolarHBondContact O-CB 3.24Å; R165-L169 WeakPolarHBondContact O-CG 3.36Å; R165-L169 PolarHBondContact O-N 3.21Å; L169-A172 PolarHBondContact O-N 3.43Å; L169-E173 PolarHBondContact O-N 3.38Å; L169-I248 HydrophobicContact CD2-CG2 4.13Å; L169-I256 HydrophobicContact CD1-CG1 4.2Å; L169-I256 HydrophobicContact CD1-CG2 4.28Å; L169-I256 HydrophobicContact CD2-CG2 4.39Å; L169-K259 HydrophobicContact CD1-CD 4.41Å; L169-K259 HydrophobicContact CD2-CB 4.18Å
170	I	93.7	Very high	92.9	Very high	53 Å²	53	52.1 Å²	52.1	27%	0.272	25%	0.247	S	C	.	.	H	α-helix	trans	-70	-38.4	179.2	-61.9	172.6	0	0	0	110.5	L131 M135 R166 E167 A172 T174	L131-I170 HydrophobicContact CD2-CD1 3.91Å; L131-I170 HydrophobicContact CG-CD1 4.32Å; M135-I170 HydrophobicContact CB-CG2 4.34Å; M135-I170 HydrophobicContact CG-CG2 3.87Å; R166-I170 HydrophobicContact CG-CD1 4Å; R166-I170 VanDerWaalsContact O-CG1 3.29Å; R166-I170 WeakPolarHBondContact O-CG1 3.32Å; R166-I170 PolarHBondContact O-N 3.17Å; E167-I170 PolarHBondContact O-N 3.47Å; I170-A172 VanDerWaalsContact C-N 3.31Å; I170-T174 WeakPolarHBondContact O-CB 3.4Å; I170-T174 PolarHBondContact O-N 3.29Å; I170-T174 PolarHBondContact O-OG1 3.41Å
171	A	95	Very high	92.8	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.1	-38.6	171.4	0	0	0	0	0	111.6	M135 L156 R159 V160 E167 T174 A175	M135-A171 HydrophobicContact SD-CB 3.84Å; L156-A171 HydrophobicContact CD1-CB 3.97Å; R159-A171 HydrophobicContact CB-CB 3.85Å; V160-A171 HydrophobicContact CG2-CB 3.9Å; E167-A171 WeakPolarHBondContact O-CB 3.35Å; E167-A171 PolarHBondContact O-N 3.06Å; A171-T174 PolarHBondContact O-N 3.46Å; A171-A175 VanDerWaalsContact O-CB 3.3Å; A171-A175 WeakPolarHBondContact O-CB 3.35Å; A171-A175 PolarHBondContact O-N 3.46Å
172	A	96.4	Very high	92.7	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-67.2	-45.4	179.2	0	0	0	0	0	112.1	V160 A168 L169 I170 A175 K176 Y241 L245 L263	V160-A172 HydrophobicContact CG1-CB 4.04Å; V160-A172 HydrophobicContact CG2-CB 4.35Å; A168-A172 WeakPolarHBondContact O-CB 3.43Å; A168-A172 PolarHBondContact O-N 3.12Å; L169-A172 PolarHBondContact O-N 3.43Å; I170-A172 VanDerWaalsContact C-N 3.31Å; A172-A175 PolarHBondContact O-N 2.86Å; A172-K176 PolarHBondContact O-N 2.89Å; A172-Y241 HydrophobicContact CB-CE2 4.42Å; A172-Y241 PolarHBondContact O-OH 3.06Å; A172-L245 HydrophobicContact CB-CD2 3.9Å; A172-L263 HydrophobicContact CB-CD1 3.69Å
173	E	95.9	Very high	93.2	Very high	85 Å²	85	51.4 Å²	51.4	40%	0.397	24%	0.241	S	C	.	.	H	α-helix	trans	-59.3	-47.9	173.9	-162.5	73.4	-119.5	0	0	110.7	L169 A175 K176 E177	L169-E173 PolarHBondContact O-N 3.38Å; E173-A175 VanDerWaalsContact C-N 3.32Å; E173-A175 PolarHBondContact O-N 3.24Å; E173-K176 WeakPolarHBondContact O-CB 3.28Å; E173-K176 PolarHBondContact O-N 3.21Å; E173-K176 VanDerWaalsContact O-N 3.13Å; E173-K176 WeakPolarHBondContact OE1-CE 3.49Å; E173-K176 IonicContact OE1-NZ 3.52Å; E173-K176 PolarHBondContact OE1-NZ 3.48Å; E173-E177 WeakPolarHBondContact O-CG 3.46Å; E173-E177 PolarHBondContact O-N 3.38Å; E173-E177 VanDerWaalsContact O-N 3.1Å
174	T	95	Very high	93.9	Very high	29 Å²	29	41.1 Å²	41.1	18%	0.178	20%	0.196	C	C	.	.	H	α-helix	trans	-61.5	-40.6	178.6	-51.7	0	0	0	0	111.8	M135 L156 I170 A171 L178	M135-T174 HydrophobicContact CB-CG2 4.16Å; M135-T174 WeakPolarHBondContact CB-OG1 3.47Å; L156-T174 HydrophobicContact CD2-CG2 4.45Å; I170-T174 WeakPolarHBondContact O-CB 3.4Å; I170-T174 PolarHBondContact O-N 3.29Å; I170-T174 PolarHBondContact O-OG1 3.41Å; A171-T174 PolarHBondContact O-N 3.46Å; T174-L178 HydrophobicContact CG2-CD1 4.22Å; T174-L178 WeakPolarHBondContact O-CD1 3.4Å; T174-L178 VanDerWaalsContact O-CG 3.28Å; T174-L178 WeakPolarHBondContact O-CG 3.47Å; T174-L178 PolarHBondContact O-N 3.28Å; T174-L178 VanDerWaalsContact O-N 3.17Å
175	A	96.2	Very high	93.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.6	-40.6	175.4	0	0	0	0	0	111.9	L156 L157 A171 A172 E173 L178 F179 Y241	L156-A175 HydrophobicContact CD2-CB 4Å; L156-A175 HydrophobicContact CG-CB 4.39Å; L157-A175 HydrophobicContact CD2-CB 4.41Å; A171-A175 VanDerWaalsContact O-CB 3.3Å; A171-A175 WeakPolarHBondContact O-CB 3.35Å; A171-A175 PolarHBondContact O-N 3.46Å; A172-A175 PolarHBondContact O-N 2.86Å; E173-A175 VanDerWaalsContact C-N 3.32Å; E173-A175 PolarHBondContact O-N 3.24Å; A175-L178 PolarHBondContact O-N 3.36Å; A175-F179 HydrophobicContact CB-CD2 4.37Å; A175-F179 HydrophobicContact CB-CE2 4.33Å; A175-F179 WeakPolarHBondContact O-CB 3.4Å; A175-F179 WeakPolarHBondContact O-CD2 3Å; A175-F179 PolarHBondContact O-N 3.42Å; A175-Y241 HydrophobicContact CB-CD2 4.07Å; A175-Y241 HydrophobicContact CB-CE1 4.45Å; A175-Y241 HydrophobicContact CB-CE2 3.56Å
176	K	96.3	Very high	93.7	Very high	13 Å²	13	39.4 Å²	39.4	6%	0.057	19%	0.191	C	C	.	.	H	α-helix	trans	-56.6	-53.6	176.2	-172.3	-155	71.6	-172.6	0	111	A172 E173 L178 F179 I180 Y241 L263 D266 L267	A172-K176 PolarHBondContact O-N 2.89Å; E173-K176 WeakPolarHBondContact O-CB 3.28Å; E173-K176 PolarHBondContact O-N 3.21Å; E173-K176 VanDerWaalsContact O-N 3.13Å; E173-K176 WeakPolarHBondContact OE1-CE 3.49Å; E173-K176 IonicContact OE1-NZ 3.52Å; E173-K176 PolarHBondContact OE1-NZ 3.48Å; K176-L178 VanDerWaalsContact C-N 3.33Å; K176-L178 PolarHBondContact O-N 3.34Å; K176-F179 PolarHBondContact O-N 2.98Å; K176-F179 VanDerWaalsContact O-N 3.16Å; K176-I180 HydrophobicContact CD-CD1 4.12Å; K176-I180 HydrophobicContact CG-CD1 3.76Å; K176-I180 HydrophobicContact CG-CG1 4.47Å; K176-I180 WeakPolarHBondContact O-CG1 3.48Å; K176-I180 PolarHBondContact O-N 2.84Å; K176-Y241 WeakPolarHBondContact CB-OH 3.46Å; K176-Y241 PolarHBondContact N-OH 3.34Å; K176-L263 HydrophobicContact CB-CD2 4.26Å; K176-L263 HydrophobicContact CD-CD2 3.77Å; K176-L263 HydrophobicContact CG-CD2 4.42Å; K176-D266 HydrophobicContact CD-CB 3.73Å; K176-D266 IonicContact NZ-OD2 3.85Å; K176-D266 PolarHBondContact NZ-OD2 2.96Å; K176-L267 HydrophobicContact CG-CD2 3.84Å; K176-L267 HydrophobicContact CG-CG 4.06Å
177	E	95.5	Very high	93.5	Very high	83 Å²	83	34.2 Å²	34.2	39%	0.388	17%	0.171	S	C	.	.	H	α-helix	trans	-57.7	-44	-179.8	-65.2	-61.4	133.9	0	0	111.7	E173 H181	E173-E177 WeakPolarHBondContact O-CG 3.46Å; E173-E177 PolarHBondContact O-N 3.38Å; E173-E177 VanDerWaalsContact O-N 3.1Å; E177-H181 WeakPolarHBondContact O-CB 3.34Å; E177-H181 PolarHBondContact O-CD2 2.88Å; E177-H181 PolarHBondContact O-N 2.85Å; E177-H181 IonicContact OE2-CD2 3.39Å; E177-H181 PolarHBondContact OE2-CD2 2.58Å; E177-H181 IonicContact OE2-NE2 3.22Å
178	L	94.5	Very high	93.4	Very high	17 Å²	17	38.4 Å²	38.4	9%	0.089	19%	0.189	C	C	.	.	H	α-helix	trans	-63.7	-44.2	175.8	-69.4	165.9	0	0	0	112.3	I142 L156 T174 A175 K176 A182 L183	I142-L178 HydrophobicContact CD1-CD1 3.88Å; I142-L178 HydrophobicContact CG2-CD2 4.43Å; L156-L178 HydrophobicContact CD2-CD1 3.59Å; T174-L178 HydrophobicContact CG2-CD1 4.22Å; T174-L178 WeakPolarHBondContact O-CD1 3.4Å; T174-L178 VanDerWaalsContact O-CG 3.28Å; T174-L178 WeakPolarHBondContact O-CG 3.47Å; T174-L178 PolarHBondContact O-N 3.28Å; T174-L178 VanDerWaalsContact O-N 3.17Å; A175-L178 PolarHBondContact O-N 3.36Å; K176-L178 VanDerWaalsContact C-N 3.33Å; K176-L178 PolarHBondContact O-N 3.34Å; L178-A182 WeakPolarHBondContact O-CB 3.23Å; L178-A182 PolarHBondContact O-N 3.3Å; L178-L183 HydrophobicContact CB-CD1 4.23Å; L178-L183 WeakPolarHBondContact O-CG 3.28Å; L178-L183 PolarHBondContact O-N 2.9Å
179	F	96	Very high	93.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.189	C	C	.	.	I	π-helix	trans	-63.6	-46.3	178.7	-80.2	-60.1	0	0	0	111.9	L153 L157 A175 K176 L183 L184 L234 Y238 Y241	L153-F179 HydrophobicContact CD1-CZ 4.11Å; L153-F179 HydrophobicContact CD2-CZ 4.42Å; L157-F179 HydrophobicContact CD2-CE2 4.13Å; L157-F179 HydrophobicContact CD2-CZ 4.47Å; A175-F179 HydrophobicContact CB-CD2 4.37Å; A175-F179 HydrophobicContact CB-CE2 4.33Å; A175-F179 WeakPolarHBondContact O-CB 3.4Å; A175-F179 WeakPolarHBondContact O-CD2 3Å; A175-F179 PolarHBondContact O-N 3.42Å; K176-F179 PolarHBondContact O-N 2.98Å; K176-F179 VanDerWaalsContact O-N 3.16Å; F179-L183 HydrophobicContact CD1-CB 4.01Å; F179-L183 HydrophobicContact CD1-CD1 3.71Å; F179-L183 HydrophobicContact CD1-CG 4.48Å; F179-L183 HydrophobicContact CE1-CD1 3.8Å; F179-L183 HydrophobicContact CG-CD1 4.33Å; F179-L183 HydrophobicContact CZ-CD1 4.49Å; F179-L184 HydrophobicContact CB-CD1 3.94Å; F179-L184 HydrophobicContact CB-CG 4.18Å; F179-L184 HydrophobicContact CD1-CD1 4.36Å; F179-L184 HydrophobicContact CD1-CD2 4.3Å; F179-L184 HydrophobicContact CD1-CG 4.08Å; F179-L184 HydrophobicContact CG-CD1 4.49Å; F179-L184 VanDerWaalsContact O-CB 3.23Å; F179-L184 WeakPolarHBondContact O-CB 3.07Å; F179-L184 WeakPolarHBondContact O-CG 3.46Å; F179-L184 PolarHBondContact O-N 2.93Å; F179-L234 HydrophobicContact CE1-CD1 3.93Å; F179-Y238 HydrophobicContact CB-CD2 4.32Å; F179-Y238 HydrophobicContact CB-CE2 4.18Å; F179-Y238 AromaticContact CD1-CD2 3.55Å; F179-Y238 HydrophobicContact CD1-CD2 3.55Å; F179-Y238 HydrophobicContact CD1-CE2 4.26Å; F179-Y238 HydrophobicContact CD1-CG 4.34Å; F179-Y238 AromaticContact CD2-CD2 3.78Å; F179-Y238 HydrophobicContact CD2-CD2 3.78Å; F179-Y238 HydrophobicContact CD2-CE2 4.14Å; F179-Y238 AromaticContact CE1-CD2 3.68Å; F179-Y238 HydrophobicContact CE1-CD2 3.68Å; F179-Y238 HydrophobicContact CE1-CG 4.21Å; F179-Y238 AromaticContact CE2-CD2 3.91Å; F179-Y238 HydrophobicContact CE2-CD2 3.91Å; F179-Y238 AromaticContact CG-CD2 3.62Å; F179-Y238 HydrophobicContact CG-CD2 3.62Å; F179-Y238 AromaticContact CG-CE2 3.95Å; F179-Y238 HydrophobicContact CG-CE2 3.95Å; F179-Y238 AromaticContact CZ-CD2 3.87Å; F179-Y238 HydrophobicContact CZ-CD2 3.87Å; F179-Y241 AromaticContact CD2-CD1 3.53Å; F179-Y241 HydrophobicContact CD2-CD1 3.53Å; F179-Y241 AromaticContact CD2-CE1 3.69Å; F179-Y241 HydrophobicContact CD2-CE1 3.69Å; F179-Y241 HydrophobicContact CD2-CG 4.22Å; F179-Y241 AromaticContact CE2-CD1 3.44Å; F179-Y241 HydrophobicContact CE2-CD1 3.44Å; F179-Y241 VanDerWaalsContact CE2-CD1 3.44Å; F179-Y241 HydrophobicContact CE2-CD2 4.45Å; F179-Y241 HydrophobicContact CE2-CE1 4.03Å; F179-Y241 AromaticContact CE2-CG 3.69Å; F179-Y241 HydrophobicContact CE2-CG 3.69Å; F179-Y241 HydrophobicContact CZ-CD1 4.48Å
180	I	94.7	Very high	92.8	Very high	22 Å²	22	37.4 Å²	37.4	11%	0.113	18%	0.183	C	C	.	.	I	π-helix	trans	-66.9	-49.6	-179.1	-66.8	175.2	0	0	0	111.6	K176 L267 A270 K271	K176-I180 HydrophobicContact CD-CD1 4.12Å; K176-I180 HydrophobicContact CG-CD1 3.76Å; K176-I180 HydrophobicContact CG-CG1 4.47Å; K176-I180 WeakPolarHBondContact O-CG1 3.48Å; K176-I180 PolarHBondContact O-N 2.84Å; I180-L267 HydrophobicContact CD1-CD2 4.31Å; I180-L267 HydrophobicContact CG1-CD2 4.08Å; I180-A270 HydrophobicContact CB-CB 4.41Å; I180-A270 HydrophobicContact CD1-CB 3.64Å; I180-A270 HydrophobicContact CG1-CB 3.72Å; I180-A270 HydrophobicContact CG2-CB 3.86Å; I180-K271 WeakPolarHBondContact O-CE 3.45Å; I180-K271 PolarHBondContact O-NZ 2.94Å
181	H	92.1	Very high	92.4	Very high	115 Å²	115	37.7 Å²	37.7	53%	0.532	19%	0.188	S	C	.	.	I	π-helix	trans	-92.4	-31.6	-167	-64.6	-63	0	0	0	114.4	K61 E177	K61-H181 PolarHBondContact NZ-O 3.39Å; E177-H181 WeakPolarHBondContact O-CB 3.34Å; E177-H181 PolarHBondContact O-CD2 2.88Å; E177-H181 PolarHBondContact O-N 2.85Å; E177-H181 IonicContact OE2-CD2 3.39Å; E177-H181 PolarHBondContact OE2-CD2 2.58Å; E177-H181 IonicContact OE2-NE2 3.22Å
182	A	90.2	Very high	91.9	Very high	28 Å²	28	38.1 Å²	38.1	23%	0.231	19%	0.19	C	C	.	.	I	π-helix	trans	-115.8	-39.1	-171.8	0	0	0	0	0	114.7	L178	L178-A182 WeakPolarHBondContact O-CB 3.23Å; L178-A182 PolarHBondContact O-N 3.3Å
183	L	92.7	Very high	91.1	Very high	2 Å²	2	42 Å²	42	1%	0.01	21%	0.207	C	C	.	.	I	π-helix	trans	-97.6	-40.9	-167.3	-55.8	172.6	0	0	0	114.5	W62 I142 P146 L153 L178 F179 L234	W62-L183 WeakPolarHBondContact CZ2-O 3.42Å; W62-L183 PolarHBondContact NE1-O 3.02Å; I142-L183 HydrophobicContact CG2-CD1 4.28Å; I142-L183 HydrophobicContact CG2-CD2 3.98Å; P146-L183 HydrophobicContact CB-CD2 3.44Å; P146-L183 VanDerWaalsContact CB-CD2 3.44Å; P146-L183 HydrophobicContact CG-CD2 4.45Å; L153-L183 HydrophobicContact CD1-CD1 4.3Å; L153-L183 HydrophobicContact CD2-CD1 4.21Å; L178-L183 HydrophobicContact CB-CD1 4.23Å; L178-L183 WeakPolarHBondContact O-CG 3.28Å; L178-L183 PolarHBondContact O-N 2.9Å; F179-L183 HydrophobicContact CD1-CB 4.01Å; F179-L183 HydrophobicContact CD1-CD1 3.71Å; F179-L183 HydrophobicContact CD1-CG 4.48Å; F179-L183 HydrophobicContact CE1-CD1 3.8Å; F179-L183 HydrophobicContact CG-CD1 4.33Å; F179-L183 HydrophobicContact CZ-CD1 4.49Å; L183-L234 HydrophobicContact CB-CD1 4.23Å; L183-L234 HydrophobicContact CB-CD2 4.24Å; L183-L234 HydrophobicContact CD1-CD1 4.25Å
184	L	92.8	Very high	90.1	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	20%	0.198	C	C	.	.			trans	-94.2	129.6	-172.3	-62.6	177.1	0	0	0	113.2	F179 L189 Y238 K271 E273	F179-L184 HydrophobicContact CB-CD1 3.94Å; F179-L184 HydrophobicContact CB-CG 4.18Å; F179-L184 HydrophobicContact CD1-CD1 4.36Å; F179-L184 HydrophobicContact CD1-CD2 4.3Å; F179-L184 HydrophobicContact CD1-CG 4.08Å; F179-L184 HydrophobicContact CG-CD1 4.49Å; F179-L184 VanDerWaalsContact O-CB 3.23Å; F179-L184 WeakPolarHBondContact O-CB 3.07Å; F179-L184 WeakPolarHBondContact O-CG 3.46Å; F179-L184 PolarHBondContact O-N 2.93Å; L184-L189 HydrophobicContact CD2-CD1 3.7Å; L184-L189 HydrophobicContact CD2-CD2 4.3Å; L184-L189 HydrophobicContact CD2-CG 4.12Å; L184-Y238 HydrophobicContact CD1-CD2 4.06Å; L184-Y238 HydrophobicContact CD1-CE1 4.24Å; L184-Y238 HydrophobicContact CD1-CE2 3.67Å; L184-Y238 HydrophobicContact CD1-CG 4.49Å; L184-Y238 HydrophobicContact CD2-CG 4.42Å; L184-K271 HydrophobicContact CB-CB 4.44Å; L184-K271 HydrophobicContact CB-CD 3.8Å; L184-K271 HydrophobicContact CB-CG 3.89Å; L184-K271 HydrophobicContact CD1-CB 3.93Å; L184-K271 HydrophobicContact CD1-CG 3.9Å; L184-K271 WeakPolarHBondContact O-CE 3.31Å; L184-K271 PolarHBondContact O-NZ 2.91Å; L184-E273 HydrophobicContact CD2-CB 4.49Å
185	P	90.4	Very high	88.9	Confident	6 Å²	6	38.2 Å²	38.2	4%	0.039	19%	0.19	C	C	.	.			trans	-70.5	168.1	163.5	28.4	-28.6	0	0	0	111.1	F63 R187 L189 K271	F63-P185 HydrophobicContact CB-CB 3.91Å; F63-P185 HydrophobicContact CB-CG 4.22Å; F63-P185 HydrophobicContact CD1-CB 3.95Å; F63-P185 HydrophobicContact CD1-CG 4.31Å; F63-P185 HydrophobicContact CD2-CB 3.88Å; F63-P185 HydrophobicContact CE1-CB 4.4Å; F63-P185 HydrophobicContact CE2-CB 4.33Å; F63-P185 HydrophobicContact CG-CB 3.66Å; F63-P185 HydrophobicContact CG-CG 4.28Å; P185-R187 HydrophobicContact CB-CG 3.95Å; P185-R187 HydrophobicContact CG-CG 4.06Å; P185-R187 PolarHBondContact O-N 3.41Å; P185-L189 HydrophobicContact CG-CD2 3.95Å; P185-K271 WeakPolarHBondContact O-CD 3.46Å
186	D	87.8	Confident	87.4	Confident	126 Å²	126	38.3 Å²	38.3	67%	0.674	19%	0.191	S	C	*	.	S	Bend	trans	-77	-6.6	178.4	-51.5	-36.2	0	0	0	112.9	K271	D186-K271 IonicContact OD1-NZ 3.07Å; D186-K271 PolarHBondContact OD1-NZ 3.4Å
187	R	87.9	Confident	85.4	Confident	79 Å²	79	38.4 Å²	38.4	30%	0.298	19%	0.193	S	C	.	.	S	Bend	trans	-98.8	158.9	169.3	57.4	159.7	-173	76.3	-7.3	111	P185 E231	P185-R187 HydrophobicContact CB-CG 3.95Å; P185-R187 HydrophobicContact CG-CG 4.06Å; P185-R187 PolarHBondContact O-N 3.41Å; R187-E231 IonicContact CZ-OE1 2.67Å; R187-E231 VanDerWaalsContact CZ-OE1 3.32Å; R187-E231 IonicContact CZ-OE2 3.86Å; R187-E231 IonicContact NH1-OE1 3.85Å; R187-E231 PolarHBondContact NH1-OE1 2.73Å; R187-E231 IonicContact NH1-OE2 3.61Å; R187-E231 IonicContact NH2-OE1 3.32Å; R187-E231 PolarHBondContact NH2-OE1 3.13Å; R187-E231 VanDerWaalsContact NH2-OE1 3.07Å; R187-E231 IonicContact NH2-OE2 3.92Å; R187-E231 PolarHBondContact NH2-OE2 3.33Å
188	K	89.9	Confident	83.5	Confident	111 Å²	111	36.6 Å²	36.6	48%	0.483	19%	0.185	S	C	.	.	P	Polyproline II helix	trans	-57	145.7	169.2	-72.4	170.5	-179.5	170.6	0	111.2	A272 E275	K188-A272 WeakPolarHBondContact CE-O 3.4Å; K188-A272 HydrophobicContact CG-CB 4.18Å; K188-A272 WeakPolarHBondContact CG-O 3.47Å; K188-E275 WeakPolarHBondContact CE-OE2 3.48Å; K188-E275 IonicContact NZ-OE2 3.29Å; K188-E275 PolarHBondContact NZ-OE2 3.08Å
189	L	91	Very high	81.5	Confident	4 Å²	4	37.3 Å²	37.3	2%	0.021	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-73.2	139.6	175.4	-64	175.8	0	0	0	109.8	W62 L184 P185 E231 L234 K235 E273	W62-L189 HydrophobicContact CH2-CD2 3.86Å; W62-L189 HydrophobicContact CZ2-CD2 3.97Å; L184-L189 HydrophobicContact CD2-CD1 3.7Å; L184-L189 HydrophobicContact CD2-CD2 4.3Å; L184-L189 HydrophobicContact CD2-CG 4.12Å; P185-L189 HydrophobicContact CG-CD2 3.95Å; L189-E231 WeakPolarHBondContact CA-OE1 3.08Å; L189-E231 HydrophobicContact CB-CG 4.38Å; L189-E231 HydrophobicContact CD2-CG 4.11Å; L189-L234 HydrophobicContact CD1-CB 4.46Å; L189-L234 HydrophobicContact CD1-CD2 4.21Å; L189-L234 HydrophobicContact CD1-CG 4.1Å; L189-L234 HydrophobicContact CD2-CD2 4.24Å; L189-K235 HydrophobicContact CB-CB 3.92Å; L189-K235 HydrophobicContact CB-CD 4.06Å; L189-K235 HydrophobicContact CB-CG 3.93Å; L189-K235 HydrophobicContact CD1-CB 3.89Å; L189-K235 HydrophobicContact CD1-CG 4.33Å; L189-K235 WeakPolarHBondContact O-CD 3.31Å; L189-K235 WeakPolarHBondContact O-CE 3.3Å; L189-K235 PolarHBondContact O-NZ 3.1Å; L189-E273 HydrophobicContact CB-CG 4.49Å; L189-E273 HydrophobicContact CD1-CG 4.07Å; L189-E273 HydrophobicContact CG-CG 4.12Å; L189-E273 PolarHBondContact N-OE2 3.32Å
190	I	84.9	Confident	79.3	Confident	12 Å²	12	40.3 Å²	40.3	6%	0.062	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-98.3	127.1	-174	-51.2	165.9	0	0	0	109.2	C68 L70 C194 L195 E231	C68-I190 HydrophobicContact CB-CD1 4.43Å; L70-I190 HydrophobicContact CD1-CD1 3.86Å; L70-I190 HydrophobicContact CD1-CG1 3.86Å; L70-I190 HydrophobicContact CD1-CG2 3.85Å; I190-C194 HydrophobicContact CG2-CB 3.88Å; I190-L195 HydrophobicContact CB-CD1 4.09Å; I190-L195 HydrophobicContact CB-CD2 3.95Å; I190-L195 HydrophobicContact CB-CG 3.94Å; I190-L195 HydrophobicContact CD1-CD2 3.83Å; I190-L195 HydrophobicContact CG2-CD1 4.3Å; I190-L195 HydrophobicContact CG2-CD2 3.79Å; I190-L195 HydrophobicContact CG2-CG 3.64Å; I190-E231 PolarHBondContact N-OE1 3.47Å
191	P	84.9	Confident	76.8	Confident	58 Å²	58	44.7 Å²	44.7	38%	0.377	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-60.9	144.7	174.9	-21.2	32.2	0	0	0	112.1	K193 C194 L195 K235	P191-K193 VanDerWaalsContact C-N 3.26Å; P191-K193 PolarHBondContact O-N 3.17Å; P191-C194 PolarHBondContact O-N 3.32Å; P191-L195 PolarHBondContact O-N 3.45Å; P191-K235 HydrophobicContact CG-CD 4.13Å
192	F	84.3	Confident	74.2	Confident	10 Å²	10	43.7 Å²	43.7	4%	0.044	24%	0.236	C	C	.	.	H	α-helix	trans	-50.5	-45.2	179	-174.1	-96.3	0	0	0	112.7	V81 L84 E85 A88 C194 L195 C196 L225 W228 K229	V81-F192 HydrophobicContact CG1-CD1 4.42Å; L84-F192 HydrophobicContact CB-CE1 4.5Å; L84-F192 HydrophobicContact CB-CZ 4.44Å; E85-F192 VanDerWaalsContact CA-CE1 3.47Å; E85-F192 HydrophobicContact CB-CD1 3.92Å; E85-F192 HydrophobicContact CB-CE1 3.46Å; E85-F192 VanDerWaalsContact CB-CE1 3.46Å; E85-F192 HydrophobicContact CB-CZ 4.08Å; E85-F192 HydrophobicContact CG-CD1 3.96Å; E85-F192 HydrophobicContact CG-CE1 3.9Å; E85-F192 HydrophobicContact CG-CZ 4.4Å; A88-F192 HydrophobicContact CB-CE2 4Å; A88-F192 HydrophobicContact CB-CZ 4.05Å; F192-C194 PolarHBondContact O-N 3.1Å; F192-L195 PolarHBondContact O-N 3.35Å; F192-C196 HydrophobicContact CE1-CB 4.25Å; F192-C196 PolarHBondContact O-N 2.89Å; F192-C196 VanDerWaalsContact O-N 3.07Å; F192-C196 PolarHBondContact O-SG 3.36Å; F192-C196 VanDerWaalsContact O-SG 3.4Å; F192-L225 HydrophobicContact CZ-CD2 4.33Å; F192-W228 HydrophobicContact CD2-CB 4.03Å; F192-W228 HydrophobicContact CE2-CB 4.05Å; F192-K229 HydrophobicContact CD2-CB 4.14Å; F192-K229 HydrophobicContact CD2-CD 4.42Å; F192-K229 HydrophobicContact CE2-CB 4.02Å
193	K	81	Confident	71.7	Confident	82 Å²	82	48.3 Å²	48.3	36%	0.357	26%	0.257	S	S	.	.	H	α-helix	trans	-61.5	-3.9	176.5	-174.6	164.4	-175.7	173.6	0	115.2	K76 D78 V81 P191	K76-K193 HydrophobicContact CD-CG 4.1Å; K76-K193 PolarHBondContact NZ-O 2.93Å; D78-K193 WeakPolarHBondContact OD1-CE 3.35Å; D78-K193 IonicContact OD1-NZ 2.69Å; D78-K193 PolarHBondContact OD1-NZ 3.33Å; D78-K193 IonicContact OD2-NZ 3.45Å; D78-K193 PolarHBondContact OD2-NZ 2.87Å; V81-K193 HydrophobicContact CG1-CB 4.16Å; V81-K193 HydrophobicContact CG1-CG 4.11Å; P191-K193 VanDerWaalsContact C-N 3.26Å; P191-K193 PolarHBondContact O-N 3.17Å
194	C	74.7	Confident	68.9	Low	31 Å²	31	56.6 Å²	56.6	21%	0.209	30%	0.295	C	S	.	.	H	α-helix	trans	-110.5	-26.8	172.2	-62.3	0	0	0	0	112.5	I190 P191 F192	I190-C194 HydrophobicContact CG2-CB 3.88Å; P191-C194 PolarHBondContact O-N 3.32Å; F192-C194 PolarHBondContact O-N 3.1Å
195	L	68.7	Low	66	Low	2 Å²	2	67.2 Å²	67.2	1%	0.01	34%	0.335	C	S	.	.	H	α-helix	trans	-76.5	-41.2	176.4	-68.4	166.1	0	0	0	111.8	C68 I190 P191 F192 C197 E198 W228 E231	C68-L195 HydrophobicContact CB-CD2 4.17Å; I190-L195 HydrophobicContact CB-CD1 4.09Å; I190-L195 HydrophobicContact CB-CD2 3.95Å; I190-L195 HydrophobicContact CB-CG 3.94Å; I190-L195 HydrophobicContact CD1-CD2 3.83Å; I190-L195 HydrophobicContact CG2-CD1 4.3Å; I190-L195 HydrophobicContact CG2-CD2 3.79Å; I190-L195 HydrophobicContact CG2-CG 3.64Å; P191-L195 PolarHBondContact O-N 3.45Å; F192-L195 PolarHBondContact O-N 3.35Å; L195-C197 PolarHBondContact O-N 2.98Å; L195-E198 PolarHBondContact O-N 3.16Å; L195-W228 HydrophobicContact CB-CB 4Å; L195-W228 HydrophobicContact CB-CD2 3.61Å; L195-W228 HydrophobicContact CB-CE3 3.92Å; L195-W228 HydrophobicContact CB-CG 3.65Å; L195-W228 HydrophobicContact CD1-CB 3.67Å; L195-W228 HydrophobicContact CD1-CG 3.71Å; L195-W228 HydrophobicContact CD2-CG 4.46Å; L195-W228 HydrophobicContact CG-CB 4.44Å; L195-W228 HydrophobicContact CG-CD2 4.49Å; L195-W228 HydrophobicContact CG-CG 4.13Å; L195-W228 VanDerWaalsContact O-CH2 3.3Å; L195-W228 WeakPolarHBondContact O-CH2 3.4Å; L195-W228 VanDerWaalsContact O-CZ3 3.25Å; L195-W228 WeakPolarHBondContact O-CZ3 3.33Å; L195-E231 HydrophobicContact CD1-CB 4.37Å
196	C	64.4	Low	63.3	Low	2 Å²	2	71.9 Å²	71.9	1%	0.014	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-20	-177.8	62.5	0	0	0	0	114.7	L84 F192 E198 L199 S200	L84-C196 HydrophobicContact CD1-CB 4.13Å; F192-C196 HydrophobicContact CE1-CB 4.25Å; F192-C196 PolarHBondContact O-N 2.89Å; F192-C196 VanDerWaalsContact O-N 3.07Å; F192-C196 PolarHBondContact O-SG 3.36Å; F192-C196 VanDerWaalsContact O-SG 3.4Å; C196-E198 PolarHBondContact O-N 2.95Å; C196-L199 PolarHBondContact O-N 3.02Å; C196-S200 PolarHBondContact O-N 3.38Å
197	C	55.6	Low	60.9	Low	15 Å²	15	72 Å²	72	10%	0.101	37%	0.365	C	S	.	.	H	α-helix	trans	-59.5	-30.7	177.9	-67	0	0	0	0	113	I71 L195 L199 S200	I71-C197 HydrophobicContact CB-CB 4.39Å; I71-C197 HydrophobicContact CG2-CB 4.09Å; L195-C197 PolarHBondContact O-N 2.98Å; C197-L199 PolarHBondContact O-N 3.15Å; C197-S200 PolarHBondContact O-N 2.93Å
198	E	54.3	Low	58.4	Low	46 Å²	46	76.7 Å²	76.7	22%	0.215	39%	0.391	C	S	.	.	H	α-helix	trans	-57.8	-31.9	172.6	-105.1	-165.8	-162	0	0	113.1	S69 I71 L195 C196 K224 W228	S69-E198 VanDerWaalsContact CB-OE1 3.27Å; S69-E198 WeakPolarHBondContact CB-OE1 3.43Å; S69-E198 PolarHBondContact OG-OE1 3.17Å; I71-E198 HydrophobicContact CD1-CB 4.21Å; I71-E198 HydrophobicContact CD1-CG 3.34Å; I71-E198 HydrophobicContact CG1-CG 3.99Å; L195-E198 PolarHBondContact O-N 3.16Å; C196-E198 PolarHBondContact O-N 2.95Å; E198-K224 IonicContact OE1-NZ 3.63Å; E198-K224 IonicContact OE2-NZ 2.8Å; E198-K224 PolarHBondContact OE2-NZ 2.98Å; E198-W228 HydrophobicContact CB-CH2 3.58Å; E198-W228 HydrophobicContact CB-CZ2 4.17Å
199	L	54.3	Low	55.9	Low	31 Å²	31	80.3 Å²	80.3	16%	0.162	41%	0.407	C	S	.	.	H	α-helix	trans	-97.7	-5.9	-177.3	-72.7	175.5	0	0	0	113.7	L84 C196 C197 K221 L225 W228	L84-L199 HydrophobicContact CD1-CB 4.46Å; C196-L199 PolarHBondContact O-N 3.02Å; C197-L199 PolarHBondContact O-N 3.15Å; L199-K221 HydrophobicContact CD1-CD 4.48Å; L199-K221 HydrophobicContact CD1-CG 4.03Å; L199-K221 HydrophobicContact CD2-CD 3.93Å; L199-K221 HydrophobicContact CD2-CG 3.99Å; L199-L225 HydrophobicContact CD1-CD1 4.38Å; L199-L225 HydrophobicContact CD1-CD2 3.89Å; L199-L225 HydrophobicContact CD1-CG 3.94Å; L199-W228 HydrophobicContact CB-CZ3 4.45Å; L199-W228 HydrophobicContact CD1-CE3 4.39Å; L199-W228 HydrophobicContact CD1-CH2 4.02Å; L199-W228 HydrophobicContact CD1-CZ3 3.52Å; L199-W228 HydrophobicContact CG-CH2 3.92Å; L199-W228 HydrophobicContact CG-CZ3 3.8Å
200	S	48.8	Very low	53.4	Low	64 Å²	64	88 Å²	88	45%	0.448	44%	0.44	S	S	.	.	H	α-helix	trans	-90.7	-13.4	178.6	-160.3	0	0	0	0	113.2	C196 C197	C196-S200 PolarHBondContact O-N 3.38Å; C197-S200 PolarHBondContact O-N 2.93Å
201	L	43.4	Very low	51.5	Low	114 Å²	114	92.1 Å²	92.1	60%	0.597	49%	0.485	S	S	*	.	S	Bend	trans	-74	134.2	166.9	-74.5	165.3	0	0	0	109.5	L203	L201-L203 PolarHBondContact O-N 3.33Å
202	P	37	Very low	49.7	Very low	93 Å²	93	94.8 Å²	94.8	60%	0.604	49%	0.492	S	S	*	.			trans	-62.1	135.9	172.8	26.8	-33.3	0	0	0	109.5	Q204	P202-Q204 PolarHBondContact O-N 2.77Å
203	L	38.2	Very low	48.3	Very low	126 Å²	126	98.1 Å²	98.1	66%	0.66	52%	0.517	S	S	*	.			trans	-68.8	80.2	173.6	-86.9	83.6	0	0	0	110.3	L201 R205	L201-L203 PolarHBondContact O-N 3.33Å; L203-R205 VanDerWaalsContact C-N 3.3Å
204	Q	33.1	Very low	47.2	Very low	175 Å²	175	103 Å²	103	82%	0.818	53%	0.534	S	S	*	.			trans	-92.8	21.4	168.6	-77.1	-176.7	-28.2	0	0	112.5	P202	P202-Q204 PolarHBondContact O-N 2.77Å
205	R	32.1	Very low	46.6	Very low	224 Å²	224	107.2 Å²	107.2	85%	0.845	56%	0.555	S	S	*	*	S	Bend	trans	-93.3	113.9	164	-72.3	-170.7	177.6	-174.7	1.3	108.4	L203 L207	L203-R205 VanDerWaalsContact C-N 3.3Å; R205-L207 PolarHBondContact O-N 3.01Å
206	P	32.9	Very low	46.6	Very low	105 Å²	105	109.9 Å²	109.9	68%	0.682	57%	0.574	S	S	*	*			trans	-56.5	131.4	-176.8	-26.9	35.1	0	0	0	112.4	E208	P206-E208 PolarHBondContact O-N 3.34Å
207	L	37.1	Very low	46.5	Very low	127 Å²	127	112.6 Å²	112.6	67%	0.665	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	25.5	-177.5	-80.6	160.5	0	0	0	113.9	R205 I217	R205-L207 PolarHBondContact O-N 3.01Å; L207-I217 HydrophobicContact CD2-CD1 3.66Å
208	E	36.8	Very low	47.3	Very low	178 Å²	178	113.9 Å²	113.9	83%	0.832	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	-3	-169.7	-63.9	-173.5	152.6	0	0	114.5	P206	P206-E208 PolarHBondContact O-N 3.34Å
209	K	37.5	Very low	48.3	Very low	188 Å²	188	116 Å²	116	82%	0.817	61%	0.608	S	S	*	*	S	Bend	trans	-107.2	-3.3	-174.8	-71.7	-165.2	175	-175.8	0	116.8
210	F	38.6	Very low	49.3	Very low	166 Å²	166	117.6 Å²	117.6	73%	0.728	62%	0.622	S	S	*	*			trans	-141.2	120.7	170.7	-73.9	-81.5	0	0	0	110.2	Q212	F210-Q212 HydrophobicContact CB-CG 4.4Å; F210-Q212 PolarHBondContact O-N 3.39Å
211	G	43.6	Very low	50.6	Low	97 Å²	97	118.3 Å²	118.3	100%	1	62%	0.617	S	S	*	*			trans	-72.2	45.4	177.1	0	0	0	0	0	113.9
212	Q	47.7	Very low	52.4	Low	114 Å²	114	114.3 Å²	114.3	53%	0.533	60%	0.598	S	S	.	*			trans	-85.7	121.7	173.5	-68.4	-178.1	8.4	0	0	108.9	F210	F210-Q212 HydrophobicContact CB-CG 4.4Å; F210-Q212 PolarHBondContact O-N 3.39Å
213	S	53.8	Low	54.6	Low	80 Å²	80	113.2 Å²	113.2	56%	0.559	58%	0.582	S	S	*	*			trans	-53.4	145.5	175.6	175	0	0	0	0	111.4	N215 S216 I217	S213-N215 PolarHBondContact O-N 2.69Å; S213-N215 VanDerWaalsContact O-N 3.09Å; S213-S216 WeakPolarHBondContact O-CA 3.43Å; S213-S216 VanDerWaalsContact O-CB 3.23Å; S213-S216 WeakPolarHBondContact O-CB 3.49Å; S213-S216 PolarHBondContact O-N 2.9Å; S213-I217 PolarHBondContact O-N 3.37Å
214	Y	58.1	Low	56.7	Low	184 Å²	184	109.3 Å²	109.3	72%	0.722	56%	0.559	S	S	*	*	H	α-helix	trans	-47.7	-40	177.5	179.3	-96	0	0	0	112.6	S216 I217 A218	Y214-S216 VanDerWaalsContact C-N 3.29Å; Y214-S216 PolarHBondContact O-N 2.8Å; Y214-I217 PolarHBondContact O-N 2.83Å; Y214-I217 VanDerWaalsContact O-N 3.13Å; Y214-A218 PolarHBondContact O-N 3.39Å
215	N	63	Low	59.2	Low	121 Å²	121	101 Å²	101	65%	0.647	52%	0.521	S	S	*	.	H	α-helix	trans	-60.4	-35.3	176.7	-72.4	3.2	0	0	0	112.8	S213 K219	S213-N215 PolarHBondContact O-N 2.69Å; S213-N215 VanDerWaalsContact O-N 3.09Å; N215-K219 WeakPolarHBondContact O-CB 3.33Å; N215-K219 PolarHBondContact O-N 2.85Å
216	S	67.9	Low	61.7	Low	58 Å²	58	90.3 Å²	90.3	41%	0.406	48%	0.48	S	S	.	.	H	α-helix	trans	-66.6	-38	176.3	-169.5	0	0	0	0	112.1	S213 Y214 S220	S213-S216 WeakPolarHBondContact O-CA 3.43Å; S213-S216 VanDerWaalsContact O-CB 3.23Å; S213-S216 WeakPolarHBondContact O-CB 3.49Å; S213-S216 PolarHBondContact O-N 2.9Å; Y214-S216 VanDerWaalsContact C-N 3.29Å; Y214-S216 PolarHBondContact O-N 2.8Å; S216-S220 WeakPolarHBondContact O-CB 3.41Å; S216-S220 PolarHBondContact O-N 2.98Å
217	I	63.9	Low	64.3	Low	59 Å²	59	85.5 Å²	85.5	30%	0.303	45%	0.449	S	S	.	.	H	α-helix	trans	-72.6	-43.9	179.9	-58.3	172	0	0	0	110	L207 S213 Y214 S220 K221	L207-I217 HydrophobicContact CD2-CD1 3.66Å; S213-I217 PolarHBondContact O-N 3.37Å; Y214-I217 PolarHBondContact O-N 2.83Å; Y214-I217 VanDerWaalsContact O-N 3.13Å; I217-S220 PolarHBondContact O-N 3.11Å; I217-K221 WeakPolarHBondContact O-CB 3.46Å; I217-K221 PolarHBondContact O-N 2.81Å
218	A	72.2	Confident	66.7	Low	41 Å²	41	79.4 Å²	79.4	34%	0.339	42%	0.417	S	S	.	.	H	α-helix	trans	-59.1	-47.6	172.6	0	0	0	0	0	111.4	Y214 S220 K221 S222	Y214-A218 PolarHBondContact O-N 3.39Å; A218-S220 VanDerWaalsContact C-N 3.33Å; A218-S220 PolarHBondContact O-N 2.66Å; A218-K221 PolarHBondContact O-N 3.32Å; A218-S222 PolarHBondContact O-N 3.06Å; A218-S222 PolarHBondContact O-OG 3.28Å
219	K	75	Confident	69.2	Low	91 Å²	91	71.6 Å²	71.6	40%	0.396	38%	0.38	S	S	.	.	H	α-helix	trans	-60	-41.6	178.1	-153	169.8	-173.1	166.3	0	112	T48 L50 N215 R223	T48-K219 PolarHBondContact O-NZ 2.84Å; L50-K219 HydrophobicContact CD2-CB 4.45Å; L50-K219 HydrophobicContact CD2-CD 4.21Å; L50-K219 HydrophobicContact CD2-CG 3.37Å; N215-K219 WeakPolarHBondContact O-CB 3.33Å; N215-K219 PolarHBondContact O-N 2.85Å; K219-R223 WeakPolarHBondContact O-CB 3.47Å; K219-R223 PolarHBondContact O-N 3.37Å
220	S	74	Confident	71.7	Confident	65 Å²	65	62.7 Å²	62.7	46%	0.455	34%	0.341	S	S	.	.	H	α-helix	trans	-64.3	-44.6	174.6	-176.7	0	0	0	0	112.8	S216 I217 A218 R223 K224	S216-S220 WeakPolarHBondContact O-CB 3.41Å; S216-S220 PolarHBondContact O-N 2.98Å; I217-S220 PolarHBondContact O-N 3.11Å; A218-S220 VanDerWaalsContact C-N 3.33Å; A218-S220 PolarHBondContact O-N 2.66Å; S220-R223 PolarHBondContact O-N 3.24Å; S220-K224 PolarHBondContact O-N 2.88Å
221	K	76.9	Confident	74.2	Confident	79 Å²	79	54.8 Å²	54.8	34%	0.343	31%	0.307	S	S	.	.	H	α-helix	trans	-62.7	-43.7	176.8	179.7	171.2	174.8	172.4	0	112.2	L199 I217 A218 K224 L225	L199-K221 HydrophobicContact CD1-CD 4.48Å; L199-K221 HydrophobicContact CD1-CG 4.03Å; L199-K221 HydrophobicContact CD2-CD 3.93Å; L199-K221 HydrophobicContact CD2-CG 3.99Å; I217-K221 WeakPolarHBondContact O-CB 3.46Å; I217-K221 PolarHBondContact O-N 2.81Å; A218-K221 PolarHBondContact O-N 3.32Å; K221-K224 PolarHBondContact O-N 3.36Å; K221-L225 HydrophobicContact CG-CD1 4.41Å; K221-L225 PolarHBondContact O-N 2.77Å; K221-L225 VanDerWaalsContact O-N 3.07Å
222	S	81.6	Confident	76.4	Confident	29 Å²	29	50.8 Å²	50.8	20%	0.203	27%	0.266	C	S	.	.	H	α-helix	trans	-63.2	-43.6	175.5	-62.7	0	0	0	0	111.7	A218 K224 L225 I226	A218-S222 PolarHBondContact O-N 3.06Å; A218-S222 PolarHBondContact O-OG 3.28Å; S222-K224 PolarHBondContact O-N 3.18Å; S222-L225 PolarHBondContact O-N 2.8Å; S222-I226 WeakPolarHBondContact O-CG1 3.48Å; S222-I226 PolarHBondContact O-N 2.87Å
223	R	82.6	Confident	78.5	Confident	70 Å²	70	46.8 Å²	46.8	26%	0.264	25%	0.248	S	C	.	.	H	α-helix	trans	-59.2	-44.4	174.3	179.4	179.7	169.8	101.6	5.3	112.2	L51 D65 K219 S220 I226 L227	L51-R223 HydrophobicContact CD2-CG 4.2Å; D65-R223 IonicContact OD2-CZ 2.73Å; D65-R223 IonicContact OD2-NE 3.19Å; D65-R223 PolarHBondContact OD2-NE 2.84Å; D65-R223 IonicContact OD2-NH2 3.28Å; D65-R223 PolarHBondContact OD2-NH2 2.77Å; K219-R223 WeakPolarHBondContact O-CB 3.47Å; K219-R223 PolarHBondContact O-N 3.37Å; S220-R223 PolarHBondContact O-N 3.24Å; R223-I226 PolarHBondContact O-N 3.17Å; R223-L227 HydrophobicContact CG-CD1 4.23Å; R223-L227 WeakPolarHBondContact O-CG 3.48Å; R223-L227 PolarHBondContact O-N 3.3Å; R223-L227 VanDerWaalsContact O-N 3.09Å
224	K	82.2	Confident	80.4	Confident	44 Å²	44	43 Å²	43	19%	0.191	22%	0.221	C	C	.	.	H	α-helix	trans	-57.1	-49.5	174.4	-76.5	-149.9	176.8	-152.3	0	111.8	S67 E198 S220 K221 S222 I226 L227 W228	S67-K224 PolarHBondContact O-NZ 3.09Å; E198-K224 IonicContact OE1-NZ 3.63Å; E198-K224 IonicContact OE2-NZ 2.8Å; E198-K224 PolarHBondContact OE2-NZ 2.98Å; S220-K224 PolarHBondContact O-N 2.88Å; K221-K224 PolarHBondContact O-N 3.36Å; S222-K224 PolarHBondContact O-N 3.18Å; K224-I226 PolarHBondContact O-N 3.23Å; K224-L227 PolarHBondContact O-N 3.42Å; K224-W228 HydrophobicContact CB-CD2 4.47Å; K224-W228 HydrophobicContact CB-CZ2 4.28Å; K224-W228 HydrophobicContact CD-CH2 4.14Å; K224-W228 HydrophobicContact CD-CZ2 3.62Å; K224-W228 WeakPolarHBondContact O-CB 3.46Å; K224-W228 PolarHBondContact O-N 3.38Å
225	L	84.7	Confident	82.1	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-58.9	-44.2	-179.6	-77.3	166.8	0	0	0	112.3	L84 M87 A88 L91 F192 L199 K221 S222 W228 K229	L84-L225 HydrophobicContact CB-CD2 4.37Å; L84-L225 HydrophobicContact CD2-CD2 4.33Å; M87-L225 HydrophobicContact CG-CD1 4.39Å; M87-L225 HydrophobicContact SD-CD1 4.11Å; A88-L225 HydrophobicContact CB-CB 3.99Å; A88-L225 HydrophobicContact CB-CD2 4.4Å; L91-L225 HydrophobicContact CD1-CB 4.36Å; L91-L225 HydrophobicContact CD1-CD1 4.27Å; F192-L225 HydrophobicContact CZ-CD2 4.33Å; L199-L225 HydrophobicContact CD1-CD1 4.38Å; L199-L225 HydrophobicContact CD1-CD2 3.89Å; L199-L225 HydrophobicContact CD1-CG 3.94Å; K221-L225 HydrophobicContact CG-CD1 4.41Å; K221-L225 PolarHBondContact O-N 2.77Å; K221-L225 VanDerWaalsContact O-N 3.07Å; S222-L225 PolarHBondContact O-N 2.8Å; L225-W228 HydrophobicContact CD2-CE3 4.37Å; L225-W228 PolarHBondContact O-N 3.43Å; L225-K229 WeakPolarHBondContact O-CB 3.42Å; L225-K229 PolarHBondContact O-N 2.79Å
226	I	86.1	Confident	83.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.1	-50.5	175.2	-67.5	168.6	0	0	0	110.9	L50 L91 L92 E95 V147 S222 R223 K224 W228 K229 F230	L50-I226 HydrophobicContact CB-CD1 4.32Å; L50-I226 HydrophobicContact CD1-CD1 3.58Å; L91-I226 HydrophobicContact CB-CD1 4.03Å; L91-I226 HydrophobicContact CB-CG1 3.72Å; L92-I226 HydrophobicContact CD1-CG2 3.91Å; E95-I226 HydrophobicContact CB-CD1 4.17Å; E95-I226 HydrophobicContact CG-CD1 4.46Å; V147-I226 HydrophobicContact CG1-CG2 3.95Å; S222-I226 WeakPolarHBondContact O-CG1 3.48Å; S222-I226 PolarHBondContact O-N 2.87Å; R223-I226 PolarHBondContact O-N 3.17Å; K224-I226 PolarHBondContact O-N 3.23Å; I226-W228 PolarHBondContact O-N 3.06Å; I226-K229 PolarHBondContact O-N 3.45Å; I226-F230 WeakPolarHBondContact O-CB 3.36Å; I226-F230 PolarHBondContact O-N 3.22Å
227	L	87.5	Confident	84.8	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.016	18%	0.178	C	C	.	.	H	α-helix	trans	-65.3	-38.3	-178.8	-69.3	175.5	0	0	0	112.2	L51 W62 D65 V147 R223 K224 F230 E231	L51-L227 HydrophobicContact CD2-CD2 4.27Å; W62-L227 HydrophobicContact CB-CD2 4.26Å; D65-L227 HydrophobicContact CB-CD1 4.29Å; V147-L227 HydrophobicContact CG2-CD2 4.46Å; R223-L227 HydrophobicContact CG-CD1 4.23Å; R223-L227 WeakPolarHBondContact O-CG 3.48Å; R223-L227 PolarHBondContact O-N 3.3Å; R223-L227 VanDerWaalsContact O-N 3.09Å; K224-L227 PolarHBondContact O-N 3.42Å; L227-F230 PolarHBondContact O-N 3.05Å; L227-E231 WeakPolarHBondContact O-CB 3.4Å; L227-E231 PolarHBondContact O-N 3.2Å
228	W	87	Confident	86.4	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-67.5	-39.8	176.9	-65.2	-10	0	0	0	112.5	S67 C68 F192 L195 E198 L199 K224 L225 I226 E231 G232	S67-W228 PolarHBondContact O-NE1 2.97Å; C68-W228 VanDerWaalsContact SG-CD1 3.54Å; F192-W228 HydrophobicContact CD2-CB 4.03Å; F192-W228 HydrophobicContact CE2-CB 4.05Å; L195-W228 HydrophobicContact CB-CB 4Å; L195-W228 HydrophobicContact CB-CD2 3.61Å; L195-W228 HydrophobicContact CB-CE3 3.92Å; L195-W228 HydrophobicContact CB-CG 3.65Å; L195-W228 HydrophobicContact CD1-CB 3.67Å; L195-W228 HydrophobicContact CD1-CG 3.71Å; L195-W228 HydrophobicContact CD2-CG 4.46Å; L195-W228 HydrophobicContact CG-CB 4.44Å; L195-W228 HydrophobicContact CG-CD2 4.49Å; L195-W228 HydrophobicContact CG-CG 4.13Å; L195-W228 VanDerWaalsContact O-CH2 3.3Å; L195-W228 WeakPolarHBondContact O-CH2 3.4Å; L195-W228 VanDerWaalsContact O-CZ3 3.25Å; L195-W228 WeakPolarHBondContact O-CZ3 3.33Å; E198-W228 HydrophobicContact CB-CH2 3.58Å; E198-W228 HydrophobicContact CB-CZ2 4.17Å; L199-W228 HydrophobicContact CB-CZ3 4.45Å; L199-W228 HydrophobicContact CD1-CE3 4.39Å; L199-W228 HydrophobicContact CD1-CH2 4.02Å; L199-W228 HydrophobicContact CD1-CZ3 3.52Å; L199-W228 HydrophobicContact CG-CH2 3.92Å; L199-W228 HydrophobicContact CG-CZ3 3.8Å; K224-W228 HydrophobicContact CB-CD2 4.47Å; K224-W228 HydrophobicContact CB-CZ2 4.28Å; K224-W228 HydrophobicContact CD-CH2 4.14Å; K224-W228 HydrophobicContact CD-CZ2 3.62Å; K224-W228 WeakPolarHBondContact O-CB 3.46Å; K224-W228 PolarHBondContact O-N 3.38Å; L225-W228 HydrophobicContact CD2-CE3 4.37Å; L225-W228 PolarHBondContact O-N 3.43Å; I226-W228 PolarHBondContact O-N 3.06Å; W228-E231 PolarHBondContact O-N 3.13Å; W228-G232 PolarHBondContact O-N 3.33Å
229	K	89.2	Confident	87.5	Confident	13 Å²	13	29.5 Å²	29.5	6%	0.057	15%	0.153	C	C	.	.	H	α-helix	trans	-65.8	-45.9	175.6	-178.6	49.7	171.9	159.8	0	110.7	E85 A88 D89 L92 F192 L225 I226 E231 G232 D233	E85-K229 HydrophobicContact CG-CD 4.15Å; E85-K229 IonicContact OE1-NZ 2.94Å; E85-K229 PolarHBondContact OE1-NZ 3.02Å; A88-K229 HydrophobicContact CB-CB 3.78Å; A88-K229 HydrophobicContact CB-CG 4.24Å; D89-K229 VanDerWaalsContact CG-CE 3.49Å; D89-K229 WeakPolarHBondContact OD1-CE 3.3Å; D89-K229 IonicContact OD1-NZ 2.97Å; L92-K229 HydrophobicContact CD2-CG 4.11Å; F192-K229 HydrophobicContact CD2-CB 4.14Å; F192-K229 HydrophobicContact CD2-CD 4.42Å; F192-K229 HydrophobicContact CE2-CB 4.02Å; L225-K229 WeakPolarHBondContact O-CB 3.42Å; L225-K229 PolarHBondContact O-N 2.79Å; I226-K229 PolarHBondContact O-N 3.45Å; K229-E231 VanDerWaalsContact C-N 3.34Å; K229-E231 PolarHBondContact O-N 3.36Å; K229-G232 PolarHBondContact O-N 3.34Å; K229-D233 WeakPolarHBondContact CE-OD2 3.17Å; K229-D233 IonicContact NZ-OD1 2.81Å; K229-D233 PolarHBondContact NZ-OD1 2.94Å; K229-D233 IonicContact NZ-OD2 2.76Å; K229-D233 WeakPolarHBondContact O-CB 3.44Å; K229-D233 PolarHBondContact O-N 2.82Å
230	F	91	Very high	88.5	Confident	1 Å²	1	26.3 Å²	26.3	0%	0.004	15%	0.146	C	C	.	.	H	α-helix	trans	-56	-44.8	172	176.8	-101.4	0	0	0	112.7	W62 P146 V147 L150 I226 L227 G232 D233 L234	W62-F230 AromaticContact CD1-CE1 3.8Å; W62-F230 AromaticContact CD2-CD1 3.85Å; W62-F230 HydrophobicContact CD2-CD1 3.85Å; W62-F230 AromaticContact CD2-CE1 3.61Å; W62-F230 HydrophobicContact CD2-CE1 3.61Å; W62-F230 AromaticContact CE2-CE1 3.59Å; W62-F230 HydrophobicContact CE3-CD1 4Å; W62-F230 HydrophobicContact CE3-CE1 4.22Å; W62-F230 HydrophobicContact CG-CD1 4.21Å; W62-F230 AromaticContact CG-CE1 3.77Å; W62-F230 HydrophobicContact CG-CE1 3.77Å; W62-F230 HydrophobicContact CZ2-CE1 4.19Å; W62-F230 HydrophobicContact CZ3-CD1 4.47Å; W62-F230 AromaticContact NE1-CE1 3.67Å; P146-F230 HydrophobicContact CB-CZ 4.01Å; P146-F230 WeakPolarHBondContact O-CE2 3.38Å; V147-F230 HydrophobicContact CB-CD2 4.27Å; V147-F230 HydrophobicContact CB-CG 4.46Å; V147-F230 HydrophobicContact CG1-CB 4.35Å; V147-F230 HydrophobicContact CG1-CD2 4.34Å; V147-F230 HydrophobicContact CG1-CG 4.38Å; V147-F230 HydrophobicContact CG2-CD1 4.17Å; V147-F230 HydrophobicContact CG2-CD2 4.28Å; V147-F230 HydrophobicContact CG2-CE1 4.46Å; V147-F230 HydrophobicContact CG2-CG 4.07Å; L150-F230 HydrophobicContact CD1-CD2 4Å; L150-F230 HydrophobicContact CD1-CE2 4.35Å; L150-F230 HydrophobicContact CD2-CD2 4.08Å; L150-F230 HydrophobicContact CD2-CE2 3.6Å; L150-F230 HydrophobicContact CG-CD2 4.07Å; L150-F230 HydrophobicContact CG-CE2 3.93Å; I226-F230 WeakPolarHBondContact O-CB 3.36Å; I226-F230 PolarHBondContact O-N 3.22Å; L227-F230 PolarHBondContact O-N 3.05Å; F230-G232 PolarHBondContact O-N 2.9Å; F230-D233 PolarHBondContact O-N 2.73Å; F230-L234 HydrophobicContact CE1-CD2 4.03Å; F230-L234 HydrophobicContact CZ-CB 4.45Å; F230-L234 HydrophobicContact CZ-CD1 4.38Å; F230-L234 HydrophobicContact CZ-CD2 4.2Å; F230-L234 VanDerWaalsContact O-CB 3.23Å; F230-L234 WeakPolarHBondContact O-CB 3.32Å; F230-L234 PolarHBondContact O-N 3.1Å
231	E	90.6	Very high	89.6	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.2	-43	178.9	-177.3	162.3	179.1	0	0	112.5	W62 C68 R187 L189 I190 L195 L227 W228 K229 K235	W62-E231 HydrophobicContact CH2-CB 3.88Å; W62-E231 HydrophobicContact CH2-CG 3.7Å; W62-E231 HydrophobicContact CZ3-CB 3.76Å; W62-E231 HydrophobicContact CZ3-CG 3.98Å; C68-E231 PolarHBondContact SG-OE2 3.04Å; C68-E231 VanDerWaalsContact SG-OE2 3.42Å; R187-E231 IonicContact CZ-OE1 2.67Å; R187-E231 VanDerWaalsContact CZ-OE1 3.32Å; R187-E231 IonicContact CZ-OE2 3.86Å; R187-E231 IonicContact NH1-OE1 3.85Å; R187-E231 PolarHBondContact NH1-OE1 2.73Å; R187-E231 IonicContact NH1-OE2 3.61Å; R187-E231 IonicContact NH2-OE1 3.32Å; R187-E231 PolarHBondContact NH2-OE1 3.13Å; R187-E231 VanDerWaalsContact NH2-OE1 3.07Å; R187-E231 IonicContact NH2-OE2 3.92Å; R187-E231 PolarHBondContact NH2-OE2 3.33Å; L189-E231 WeakPolarHBondContact CA-OE1 3.08Å; L189-E231 HydrophobicContact CB-CG 4.38Å; L189-E231 HydrophobicContact CD2-CG 4.11Å; I190-E231 PolarHBondContact N-OE1 3.47Å; L195-E231 HydrophobicContact CD1-CB 4.37Å; L227-E231 WeakPolarHBondContact O-CB 3.4Å; L227-E231 PolarHBondContact O-N 3.2Å; W228-E231 PolarHBondContact O-N 3.13Å; K229-E231 VanDerWaalsContact C-N 3.34Å; K229-E231 PolarHBondContact O-N 3.36Å; E231-K235 WeakPolarHBondContact O-CB 3.45Å; E231-K235 PolarHBondContact O-N 2.85Å
232	G	89.1	Confident	90.6	Very high	14 Å²	14	19.7 Å²	19.7	14%	0.144	11%	0.109	C	C	.	.	H	α-helix	trans	-65	-42.7	174.5	0	0	0	0	0	113.2	W228 K229 F230 K235 S236	W228-G232 PolarHBondContact O-N 3.33Å; K229-G232 PolarHBondContact O-N 3.34Å; F230-G232 PolarHBondContact O-N 2.9Å; G232-K235 WeakPolarHBondContact O-CB 3.48Å; G232-K235 PolarHBondContact O-N 3.48Å; G232-S236 PolarHBondContact O-N 2.88Å
233	D	91.9	Very high	91.3	Very high	29 Å²	29	25 Å²	25	16%	0.155	13%	0.125	C	C	.	.	H	α-helix	trans	-69.9	-32.8	179.3	-78.1	-5.4	0	0	0	112.6	L150 K229 F230 S236 R237	L150-D233 HydrophobicContact CD1-CB 4.2Å; K229-D233 WeakPolarHBondContact CE-OD2 3.17Å; K229-D233 IonicContact NZ-OD1 2.81Å; K229-D233 PolarHBondContact NZ-OD1 2.94Å; K229-D233 IonicContact NZ-OD2 2.76Å; K229-D233 WeakPolarHBondContact O-CB 3.44Å; K229-D233 PolarHBondContact O-N 2.82Å; F230-D233 PolarHBondContact O-N 2.73Å; D233-S236 PolarHBondContact O-OG 2.91Å; D233-R237 VanDerWaalsContact O-CD 3.31Å; D233-R237 WeakPolarHBondContact O-CD 3.39Å; D233-R237 VanDerWaalsContact O-CG 3.3Å; D233-R237 WeakPolarHBondContact O-CG 3.34Å; D233-R237 PolarHBondContact O-N 2.91Å; D233-R237 PolarHBondContact O-NH1 3.24Å; D233-R237 VanDerWaalsContact O-NH1 3.11Å
234	L	93.7	Very high	92	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-68.1	-39.9	171.7	-175.6	67.1	0	0	0	111.1	W62 L153 F179 L183 L189 F230 S236 R237 Y238	W62-L234 HydrophobicContact CZ2-CD2 3.66Å; L153-L234 HydrophobicContact CD2-CD1 3.96Å; F179-L234 HydrophobicContact CE1-CD1 3.93Å; L183-L234 HydrophobicContact CB-CD1 4.23Å; L183-L234 HydrophobicContact CB-CD2 4.24Å; L183-L234 HydrophobicContact CD1-CD1 4.25Å; L189-L234 HydrophobicContact CD1-CB 4.46Å; L189-L234 HydrophobicContact CD1-CD2 4.21Å; L189-L234 HydrophobicContact CD1-CG 4.1Å; L189-L234 HydrophobicContact CD2-CD2 4.24Å; F230-L234 HydrophobicContact CE1-CD2 4.03Å; F230-L234 HydrophobicContact CZ-CB 4.45Å; F230-L234 HydrophobicContact CZ-CD1 4.38Å; F230-L234 HydrophobicContact CZ-CD2 4.2Å; F230-L234 VanDerWaalsContact O-CB 3.23Å; F230-L234 WeakPolarHBondContact O-CB 3.32Å; F230-L234 PolarHBondContact O-N 3.1Å; L234-S236 PolarHBondContact O-N 3.33Å; L234-R237 PolarHBondContact O-N 2.68Å; L234-Y238 WeakPolarHBondContact O-CB 3.46Å; L234-Y238 PolarHBondContact O-N 3.06Å
235	K	93.5	Very high	92.7	Very high	46 Å²	46	19.8 Å²	19.8	20%	0.2	11%	0.106	C	C	.	.	H	α-helix	trans	-60.9	-44.5	178.7	-169.4	179	-176.3	69.8	0	112.3	L189 P191 E231 G232 A239 E273	L189-K235 HydrophobicContact CB-CB 3.92Å; L189-K235 HydrophobicContact CB-CD 4.06Å; L189-K235 HydrophobicContact CB-CG 3.93Å; L189-K235 HydrophobicContact CD1-CB 3.89Å; L189-K235 HydrophobicContact CD1-CG 4.33Å; L189-K235 WeakPolarHBondContact O-CD 3.31Å; L189-K235 WeakPolarHBondContact O-CE 3.3Å; L189-K235 PolarHBondContact O-NZ 3.1Å; P191-K235 HydrophobicContact CG-CD 4.13Å; E231-K235 WeakPolarHBondContact O-CB 3.45Å; E231-K235 PolarHBondContact O-N 2.85Å; G232-K235 WeakPolarHBondContact O-CB 3.48Å; G232-K235 PolarHBondContact O-N 3.48Å; K235-A239 WeakPolarHBondContact O-CB 3.3Å; K235-A239 PolarHBondContact O-N 2.88Å; K235-A239 VanDerWaalsContact O-N 3.07Å; K235-E273 IonicContact NZ-OE1 3.23Å; K235-E273 PolarHBondContact NZ-OE1 2.98Å; K235-E273 IonicContact NZ-OE2 3.54Å; K235-E273 PolarHBondContact NZ-OE2 3.39Å
236	S	93.2	Very high	93.3	Very high	66 Å²	66	22.9 Å²	22.9	46%	0.462	12%	0.12	S	C	.	.	H	α-helix	trans	-65.4	-38.7	178	67.2	0	0	0	0	112.3	G232 D233 L234 G240	G232-S236 PolarHBondContact O-N 2.88Å; D233-S236 PolarHBondContact O-OG 2.91Å; L234-S236 PolarHBondContact O-N 3.33Å; S236-G240 PolarHBondContact O-N 3.22Å
237	R	94.8	Very high	93.7	Very high	54 Å²	54	28.3 Å²	28.3	20%	0.204	15%	0.149	C	C	.	.	H	α-helix	trans	-67.9	-45	177.4	-75.7	167.8	172	77	3.3	113	D154 L157 D233 L234 G240 Y241	D154-R237 WeakPolarHBondContact OD1-CD 3.39Å; D154-R237 IonicContact OD1-CZ 3.23Å; D154-R237 IonicContact OD1-NE 2.7Å; D154-R237 PolarHBondContact OD1-NE 2.99Å; D154-R237 IonicContact OD1-NH2 3.87Å; D154-R237 PolarHBondContact OD1-NH2 3.43Å; D154-R237 IonicContact OD2-CZ 2.77Å; D154-R237 IonicContact OD2-NE 3.42Å; D154-R237 PolarHBondContact OD2-NE 3.23Å; D154-R237 IonicContact OD2-NH2 3.75Å; D154-R237 PolarHBondContact OD2-NH2 2.95Å; L157-R237 HydrophobicContact CD1-CB 3.88Å; L157-R237 HydrophobicContact CD1-CG 4.38Å; D233-R237 VanDerWaalsContact O-CD 3.31Å; D233-R237 WeakPolarHBondContact O-CD 3.39Å; D233-R237 VanDerWaalsContact O-CG 3.3Å; D233-R237 WeakPolarHBondContact O-CG 3.34Å; D233-R237 PolarHBondContact O-N 2.91Å; D233-R237 PolarHBondContact O-NH1 3.24Å; D233-R237 VanDerWaalsContact O-NH1 3.11Å; L234-R237 PolarHBondContact O-N 2.68Å; R237-G240 CarbonylContact O-C 3.58Å; R237-G240 WeakPolarHBondContact O-CA 3.21Å; R237-G240 PolarHBondContact O-N 3Å; R237-Y241 PolarHBondContact O-N 3.42Å
238	Y	96.7	Very high	94.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65	-40.1	175.9	-178.6	-105.7	0	0	0	111.9	F179 L184 L234 G240 Y241 V242 L267 E273 Q274	F179-Y238 HydrophobicContact CB-CD2 4.32Å; F179-Y238 HydrophobicContact CB-CE2 4.18Å; F179-Y238 AromaticContact CD1-CD2 3.55Å; F179-Y238 HydrophobicContact CD1-CD2 3.55Å; F179-Y238 HydrophobicContact CD1-CE2 4.26Å; F179-Y238 HydrophobicContact CD1-CG 4.34Å; F179-Y238 AromaticContact CD2-CD2 3.78Å; F179-Y238 HydrophobicContact CD2-CD2 3.78Å; F179-Y238 HydrophobicContact CD2-CE2 4.14Å; F179-Y238 AromaticContact CE1-CD2 3.68Å; F179-Y238 HydrophobicContact CE1-CD2 3.68Å; F179-Y238 HydrophobicContact CE1-CG 4.21Å; F179-Y238 AromaticContact CE2-CD2 3.91Å; F179-Y238 HydrophobicContact CE2-CD2 3.91Å; F179-Y238 AromaticContact CG-CD2 3.62Å; F179-Y238 HydrophobicContact CG-CD2 3.62Å; F179-Y238 AromaticContact CG-CE2 3.95Å; F179-Y238 HydrophobicContact CG-CE2 3.95Å; F179-Y238 AromaticContact CZ-CD2 3.87Å; F179-Y238 HydrophobicContact CZ-CD2 3.87Å; L184-Y238 HydrophobicContact CD1-CD2 4.06Å; L184-Y238 HydrophobicContact CD1-CE1 4.24Å; L184-Y238 HydrophobicContact CD1-CE2 3.67Å; L184-Y238 HydrophobicContact CD1-CG 4.49Å; L184-Y238 HydrophobicContact CD2-CG 4.42Å; L234-Y238 WeakPolarHBondContact O-CB 3.46Å; L234-Y238 PolarHBondContact O-N 3.06Å; Y238-G240 PolarHBondContact O-N 3.49Å; Y238-Y241 HydrophobicContact CD2-CD1 4Å; Y238-Y241 HydrophobicContact CE2-CD1 4.01Å; Y238-Y241 HydrophobicContact CE2-CE1 4.47Å; Y238-Y241 WeakPolarHBondContact O-CB 3.26Å; Y238-Y241 PolarHBondContact O-N 3.44Å; Y238-Y241 VanDerWaalsContact O-N 3.11Å; Y238-V242 HydrophobicContact CD1-CG2 4.32Å; Y238-V242 HydrophobicContact CE1-CG2 3.91Å; Y238-V242 HydrophobicContact CE2-CG2 4.31Å; Y238-V242 WeakPolarHBondContact O-CG2 3.35Å; Y238-V242 PolarHBondContact O-N 3.06Å; Y238-L267 HydrophobicContact CE2-CD2 4.17Å; Y238-E273 HydrophobicContact CD1-CB 4.22Å; Y238-E273 HydrophobicContact CD1-CG 3.46Å; Y238-E273 VanDerWaalsContact CD1-CG 3.46Å; Y238-E273 HydrophobicContact CE1-CB 3.91Å; Y238-E273 HydrophobicContact CE1-CG 3.62Å; Y238-E273 WeakPolarHBondContact CE1-O 3.49Å; Y238-E273 PolarHBondContact OH-O 2.91Å; Y238-Q274 HydrophobicContact CD1-CB 4.33Å; Y238-Q274 HydrophobicContact CD1-CG 3.61Å; Y238-Q274 HydrophobicContact CE1-CB 3.76Å; Y238-Q274 HydrophobicContact CE1-CG 3.57Å
239	A	96	Very high	94.5	Very high	15 Å²	15	29.3 Å²	29.3	12%	0.124	15%	0.154	C	C	.	.	H	α-helix	trans	-61.9	-30.9	170.8	0	0	0	0	0	112.8	K235 R243	K235-A239 WeakPolarHBondContact O-CB 3.3Å; K235-A239 PolarHBondContact O-N 2.88Å; K235-A239 VanDerWaalsContact O-N 3.07Å; A239-R243 VanDerWaalsContact C-NH2 3.34Å; A239-R243 VanDerWaalsContact O-CZ 3.3Å; A239-R243 PolarHBondContact O-N 3.43Å; A239-R243 PolarHBondContact O-NE 3.22Å; A239-R243 VanDerWaalsContact O-NE 3.09Å; A239-R243 PolarHBondContact O-NH2 2.94Å
240	G	96.3	Very high	94.8	Very high	24 Å²	24	34.8 Å²	34.8	25%	0.247	18%	0.178	C	C	.	.	H	α-helix	trans	-68.3	-41.3	170.9	0	0	0	0	0	113.1	S236 R237 Y238 R243 A244	S236-G240 PolarHBondContact O-N 3.22Å; R237-G240 CarbonylContact O-C 3.58Å; R237-G240 WeakPolarHBondContact O-CA 3.21Å; R237-G240 PolarHBondContact O-N 3Å; Y238-G240 PolarHBondContact O-N 3.49Å; G240-R243 PolarHBondContact O-N 2.77Å; G240-A244 PolarHBondContact O-N 2.97Å
241	Y	97.4	Very high	95	Very high	1 Å²	1	36.3 Å²	36.3	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-45.9	175.3	174.8	-122.1	0	0	0	112.5	L157 V160 A172 A175 K176 F179 R237 Y238 R243 A244 L245 L267	L157-Y241 HydrophobicContact CD2-CD2 3.73Å; L157-Y241 HydrophobicContact CD2-CG 3.92Å; V160-Y241 HydrophobicContact CG1-CD2 4.35Å; V160-Y241 HydrophobicContact CG1-CE2 4.32Å; V160-Y241 HydrophobicContact CG2-CD2 4.29Å; V160-Y241 HydrophobicContact CG2-CE2 4.24Å; A172-Y241 HydrophobicContact CB-CE2 4.42Å; A172-Y241 PolarHBondContact O-OH 3.06Å; A175-Y241 HydrophobicContact CB-CD2 4.07Å; A175-Y241 HydrophobicContact CB-CE1 4.45Å; A175-Y241 HydrophobicContact CB-CE2 3.56Å; K176-Y241 WeakPolarHBondContact CB-OH 3.46Å; K176-Y241 PolarHBondContact N-OH 3.34Å; F179-Y241 AromaticContact CD2-CD1 3.53Å; F179-Y241 HydrophobicContact CD2-CD1 3.53Å; F179-Y241 AromaticContact CD2-CE1 3.69Å; F179-Y241 HydrophobicContact CD2-CE1 3.69Å; F179-Y241 HydrophobicContact CD2-CG 4.22Å; F179-Y241 AromaticContact CE2-CD1 3.44Å; F179-Y241 HydrophobicContact CE2-CD1 3.44Å; F179-Y241 VanDerWaalsContact CE2-CD1 3.44Å; F179-Y241 HydrophobicContact CE2-CD2 4.45Å; F179-Y241 HydrophobicContact CE2-CE1 4.03Å; F179-Y241 AromaticContact CE2-CG 3.69Å; F179-Y241 HydrophobicContact CE2-CG 3.69Å; F179-Y241 HydrophobicContact CZ-CD1 4.48Å; R237-Y241 PolarHBondContact O-N 3.42Å; Y238-Y241 HydrophobicContact CD2-CD1 4Å; Y238-Y241 HydrophobicContact CE2-CD1 4.01Å; Y238-Y241 HydrophobicContact CE2-CE1 4.47Å; Y238-Y241 WeakPolarHBondContact O-CB 3.26Å; Y238-Y241 PolarHBondContact O-N 3.44Å; Y238-Y241 VanDerWaalsContact O-N 3.11Å; Y241-R243 VanDerWaalsContact C-N 3.31Å; Y241-R243 PolarHBondContact O-N 3.46Å; Y241-A244 WeakPolarHBondContact O-CB 3.19Å; Y241-A244 PolarHBondContact O-N 3.48Å; Y241-A244 VanDerWaalsContact O-N 3.09Å; Y241-L245 HydrophobicContact CD1-CD1 4.47Å; Y241-L245 HydrophobicContact CD2-CG 4.41Å; Y241-L245 HydrophobicContact CE1-CD1 3.88Å; Y241-L245 HydrophobicContact CE1-CG 4.46Å; Y241-L245 HydrophobicContact CE2-CD1 4.23Å; Y241-L245 HydrophobicContact CE2-CD2 3.99Å; Y241-L245 HydrophobicContact CE2-CG 3.96Å; Y241-L245 PolarHBondContact O-N 2.88Å; Y241-L267 HydrophobicContact CD1-CD1 4.4Å; Y241-L267 HydrophobicContact CE1-CD1 3.65Å; Y241-L267 HydrophobicContact CE1-CD2 4.41Å
242	V	97.7	Very high	95.2	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.018	22%	0.218	C	C	.	.	H	α-helix	trans	-59.4	-42	175.8	173.8	0	0	0	0	111.3	Y238 L245 Q246 Q274 A277 L278	Y238-V242 HydrophobicContact CD1-CG2 4.32Å; Y238-V242 HydrophobicContact CE1-CG2 3.91Å; Y238-V242 HydrophobicContact CE2-CG2 4.31Å; Y238-V242 WeakPolarHBondContact O-CG2 3.35Å; Y238-V242 PolarHBondContact O-N 3.06Å; V242-L245 PolarHBondContact O-N 3.32Å; V242-Q246 PolarHBondContact O-N 3.04Å; V242-Q274 HydrophobicContact CG2-CB 4.03Å; V242-Q274 HydrophobicContact CG2-CG 4.13Å; V242-A277 HydrophobicContact CG1-CB 4.38Å; V242-L278 HydrophobicContact CG1-CD2 3.78Å; V242-L278 HydrophobicContact CG1-CG 4.08Å; V242-L278 HydrophobicContact CG2-CD2 4.05Å; V242-L278 HydrophobicContact CG2-CG 4.32Å
243	R	97	Very high	95.5	Very high	140 Å²	140	45 Å²	45	53%	0.528	23%	0.233	S	C	.	.	H	α-helix	trans	-61.6	-42.1	172.6	-83	176.4	-88.4	120.4	-4.9	112.6	A239 G240 Y241 L245 Q246 D247	A239-R243 VanDerWaalsContact C-NH2 3.34Å; A239-R243 VanDerWaalsContact O-CZ 3.3Å; A239-R243 PolarHBondContact O-N 3.43Å; A239-R243 PolarHBondContact O-NE 3.22Å; A239-R243 VanDerWaalsContact O-NE 3.09Å; A239-R243 PolarHBondContact O-NH2 2.94Å; G240-R243 PolarHBondContact O-N 2.77Å; Y241-R243 VanDerWaalsContact C-N 3.31Å; Y241-R243 PolarHBondContact O-N 3.46Å; R243-L245 PolarHBondContact O-N 3.07Å; R243-Q246 WeakPolarHBondContact O-CB 3.48Å; R243-Q246 PolarHBondContact O-N 2.83Å; R243-D247 PolarHBondContact O-N 2.7Å
244	A	96.5	Very high	95.6	Very high	6 Å²	6	45 Å²	45	5%	0.05	24%	0.238	C	C	.	.	H	α-helix	trans	-65.1	-36.7	176.3	0	0	0	0	0	112.8	V160 G240 Y241 D247 I248	V160-A244 HydrophobicContact CB-CB 4.45Å; V160-A244 HydrophobicContact CG1-CB 3.79Å; G240-A244 PolarHBondContact O-N 2.97Å; Y241-A244 WeakPolarHBondContact O-CB 3.19Å; Y241-A244 PolarHBondContact O-N 3.48Å; Y241-A244 VanDerWaalsContact O-N 3.09Å; A244-D247 PolarHBondContact O-N 2.57Å; A244-I248 VanDerWaalsContact O-CG1 3.3Å; A244-I248 WeakPolarHBondContact O-CG1 3.45Å; A244-I248 PolarHBondContact O-N 3.33Å; A244-I248 VanDerWaalsContact O-N 3.07Å
245	L	97.2	Very high	95.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-41.5	171.1	-69.6	-178.5	0	0	0	111.9	A172 Y241 V242 R243 D247 I248 S249 L263 M264 L267	A172-L245 HydrophobicContact CB-CD2 3.9Å; Y241-L245 HydrophobicContact CD1-CD1 4.47Å; Y241-L245 HydrophobicContact CD2-CG 4.41Å; Y241-L245 HydrophobicContact CE1-CD1 3.88Å; Y241-L245 HydrophobicContact CE1-CG 4.46Å; Y241-L245 HydrophobicContact CE2-CD1 4.23Å; Y241-L245 HydrophobicContact CE2-CD2 3.99Å; Y241-L245 HydrophobicContact CE2-CG 3.96Å; Y241-L245 PolarHBondContact O-N 2.88Å; V242-L245 PolarHBondContact O-N 3.32Å; R243-L245 PolarHBondContact O-N 3.07Å; L245-D247 VanDerWaalsContact C-N 3.33Å; L245-D247 PolarHBondContact O-N 2.88Å; L245-I248 PolarHBondContact O-N 3.48Å; L245-S249 PolarHBondContact O-N 3.29Å; L245-L263 HydrophobicContact CD1-CB 4.18Å; L245-L263 HydrophobicContact CD2-CB 4.09Å; L245-L263 HydrophobicContact CD2-CD1 3.72Å; L245-M264 HydrophobicContact CB-CG 3.9Å; L245-M264 HydrophobicContact CB-SD 4.28Å; L245-M264 HydrophobicContact CD1-CG 4.03Å; L245-L267 HydrophobicContact CD1-CD1 3.47Å; L245-L267 VanDerWaalsContact CD1-CD1 3.47Å
246	Q	96.6	Very high	95.8	Very high	66 Å²	66	48.2 Å²	48.2	31%	0.308	25%	0.254	S	S	.	.	H	α-helix	trans	-59.9	-42.7	175	-175.1	177.6	9.6	0	0	111.1	V242 R243 S249 F250 A281	V242-Q246 PolarHBondContact O-N 3.04Å; R243-Q246 WeakPolarHBondContact O-CB 3.48Å; R243-Q246 PolarHBondContact O-N 2.83Å; Q246-S249 WeakPolarHBondContact O-CB 3.23Å; Q246-S249 PolarHBondContact O-N 2.74Å; Q246-S249 PolarHBondContact O-OG 3.45Å; Q246-F250 HydrophobicContact CG-CE2 3.99Å; Q246-F250 WeakPolarHBondContact O-CD2 3.3Å; Q246-A281 HydrophobicContact CG-CB 4.4Å
247	D	95.3	Very high	96	Very high	114 Å²	114	46 Å²	46	61%	0.61	24%	0.235	S	C	*	.	H	α-helix	trans	-61.7	-45.6	174.8	-67.8	-29.4	0	0	0	112.2	R243 A244 L245 S249 F250	R243-D247 PolarHBondContact O-N 2.7Å; A244-D247 PolarHBondContact O-N 2.57Å; L245-D247 VanDerWaalsContact C-N 3.33Å; L245-D247 PolarHBondContact O-N 2.88Å; D247-S249 PolarHBondContact O-N 2.75Å; D247-F250 PolarHBondContact O-N 3.2Å
248	I	95.5	Very high	96.1	Very high	23 Å²	23	44.4 Å²	44.4	12%	0.118	23%	0.23	C	C	.	.	H	α-helix	trans	-62.3	-32.4	175.8	-60.7	164.4	0	0	0	110.8	V160 A168 L169 A244 L245 F250 D251 I256 A260	V160-I248 HydrophobicContact CG1-CD1 3.75Å; A168-I248 HydrophobicContact CB-CD1 4.33Å; L169-I248 HydrophobicContact CD2-CG2 4.13Å; A244-I248 VanDerWaalsContact O-CG1 3.3Å; A244-I248 WeakPolarHBondContact O-CG1 3.45Å; A244-I248 PolarHBondContact O-N 3.33Å; A244-I248 VanDerWaalsContact O-N 3.07Å; L245-I248 PolarHBondContact O-N 3.48Å; I248-F250 PolarHBondContact O-N 3.4Å; I248-D251 PolarHBondContact O-N 3.03Å; I248-I256 HydrophobicContact CG2-CG2 3.61Å; I248-A260 HydrophobicContact CB-CB 4.12Å; I248-A260 HydrophobicContact CG2-CB 3.88Å
249	S	96.2	Very high	96.1	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.007	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-9.4	175.6	90.5	0	0	0	0	113.9	L245 Q246 D247 R257 K285	L245-S249 PolarHBondContact O-N 3.29Å; Q246-S249 WeakPolarHBondContact O-CB 3.23Å; Q246-S249 PolarHBondContact O-N 2.74Å; Q246-S249 PolarHBondContact O-OG 3.45Å; D247-S249 PolarHBondContact O-N 2.75Å; S249-R257 WeakPolarHBondContact O-CD 2.89Å; S249-R257 VanDerWaalsContact O-CG 3.3Å; S249-R257 WeakPolarHBondContact O-CG 3.29Å; S249-K285 WeakPolarHBondContact O-CE 3.2Å; S249-K285 PolarHBondContact O-NZ 2.71Å
250	F	95.4	Very high	96.2	Very high	127 Å²	127	48.2 Å²	48.2	56%	0.557	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.8	10.2	173	-64.9	-71.5	0	0	0	114.4	Q246 D247 I248 K285	Q246-F250 HydrophobicContact CG-CE2 3.99Å; Q246-F250 WeakPolarHBondContact O-CD2 3.3Å; D247-F250 PolarHBondContact O-N 3.2Å; I248-F250 PolarHBondContact O-N 3.4Å; F250-K285 HydrophobicContact CE1-CD 4.41Å
251	D	94.9	Very high	96.3	Very high	33 Å²	33	47 Å²	47	18%	0.176	23%	0.232	C	C	.	.			trans	-59.7	147.8	175.7	-171.9	-77.9	0	0	0	112.3	R165 I248 L253 I256 R257	R165-D251 IonicContact CZ-OD1 2.83Å; R165-D251 IonicContact CZ-OD2 2.7Å; R165-D251 IonicContact NE-OD1 2.75Å; R165-D251 PolarHBondContact NE-OD1 3Å; R165-D251 IonicContact NE-OD2 2.74Å; R165-D251 PolarHBondContact NE-OD2 3.02Å; R165-D251 IonicContact NH2-OD1 3.05Å; R165-D251 PolarHBondContact NH2-OD1 3.4Å; R165-D251 IonicContact NH2-OD2 2.64Å; R165-D251 PolarHBondContact NH2-OD2 3.34Å; I248-D251 PolarHBondContact O-N 3.03Å; D251-L253 PolarHBondContact O-N 3.36Å; D251-L253 VanDerWaalsContact O-N 3.15Å; D251-L253 PolarHBondContact OD1-N 3.15Å; D251-I256 HydrophobicContact CB-CB 4.29Å; D251-I256 HydrophobicContact CB-CG2 3.87Å; D251-R257 WeakPolarHBondContact O-CD 3.03Å; D251-R257 WeakPolarHBondContact O-CG 3.47Å; D251-R257 PolarHBondContact O-NH1 2.73Å
252	T	94.3	Very high	96.3	Very high	109 Å²	109	49.1 Å²	49.1	67%	0.669	24%	0.24	S	C	*	.	S	Bend	trans	-47.8	-35.8	173.6	54.7	0	0	0	0	115.5	R165 R257	R165-T252 PolarHBondContact NH2-OG1 3.02Å; T252-R257 VanDerWaalsContact C-NH1 3.33Å; T252-R257 PolarHBondContact O-NH1 2.69Å
253	L	95.1	Very high	96.3	Very high	88 Å²	88	49.1 Å²	49.1	46%	0.461	24%	0.24	S	C	.	.	S	Bend	trans	-90.9	120.1	-174.6	-62.3	178.4	0	0	0	111.3	D251 E255 I256 R257	D251-L253 PolarHBondContact O-N 3.36Å; D251-L253 VanDerWaalsContact O-N 3.15Å; D251-L253 PolarHBondContact OD1-N 3.15Å; L253-E255 VanDerWaalsContact C-N 3.29Å; L253-E255 PolarHBondContact O-N 2.99Å; L253-I256 HydrophobicContact CB-CB 4.39Å; L253-I256 HydrophobicContact CB-CD1 4.08Å; L253-I256 HydrophobicContact CB-CG1 4.06Å; L253-I256 HydrophobicContact CD1-CD1 3.88Å; L253-I256 HydrophobicContact CG-CD1 4.49Å; L253-I256 WeakPolarHBondContact O-CB 2.95Å; L253-I256 PolarHBondContact O-N 3.06Å; L253-R257 PolarHBondContact O-N 3.29Å
254	A	95.3	Very high	96.4	Very high	30 Å²	30	42.5 Å²	42.5	25%	0.248	22%	0.215	C	C	.	.	H	α-helix	trans	-55.3	-40.4	-177.6	0	0	0	0	0	113.6	I256 R257 I258 E290 V293	A254-I256 VanDerWaalsContact C-N 3.25Å; A254-I256 PolarHBondContact O-N 3.15Å; A254-R257 WeakPolarHBondContact O-CB 3.33Å; A254-R257 PolarHBondContact O-N 2.59Å; A254-R257 VanDerWaalsContact O-N 3.13Å; A254-I258 WeakPolarHBondContact O-CG1 3.18Å; A254-I258 PolarHBondContact O-N 3.44Å; A254-E290 HydrophobicContact CB-CB 4.39Å; A254-E290 HydrophobicContact CB-CG 3.78Å; A254-V293 HydrophobicContact CB-CG2 3.91Å
255	E	95.4	Very high	96.4	Very high	96 Å²	96	42.2 Å²	42.2	45%	0.449	21%	0.213	S	C	.	.	H	α-helix	trans	-60.4	-33.2	178	-175.6	57	-154.6	0	0	113	L253 K259	L253-E255 VanDerWaalsContact C-N 3.29Å; L253-E255 PolarHBondContact O-N 2.99Å; E255-K259 WeakPolarHBondContact O-CG 3.42Å; E255-K259 PolarHBondContact O-N 2.91Å; E255-K259 WeakPolarHBondContact OE1-CE 3.47Å; E255-K259 IonicContact OE1-NZ 2.8Å; E255-K259 PolarHBondContact OE1-NZ 3.21Å
256	I	95.5	Very high	96.4	Very high	17 Å²	17	43.5 Å²	43.5	9%	0.087	22%	0.22	C	C	.	.	H	α-helix	trans	-75.5	-41.1	176.3	-61.6	-174.7	0	0	0	110	R165 L169 I248 D251 L253 A254 I258 K259 A260	R165-I256 HydrophobicContact CB-CD1 3.84Å; R165-I256 VanDerWaalsContact CD-CD1 3.48Å; R165-I256 HydrophobicContact CG-CD1 3.67Å; L169-I256 HydrophobicContact CD1-CG1 4.2Å; L169-I256 HydrophobicContact CD1-CG2 4.28Å; L169-I256 HydrophobicContact CD2-CG2 4.39Å; I248-I256 HydrophobicContact CG2-CG2 3.61Å; D251-I256 HydrophobicContact CB-CB 4.29Å; D251-I256 HydrophobicContact CB-CG2 3.87Å; L253-I256 HydrophobicContact CB-CB 4.39Å; L253-I256 HydrophobicContact CB-CD1 4.08Å; L253-I256 HydrophobicContact CB-CG1 4.06Å; L253-I256 HydrophobicContact CD1-CD1 3.88Å; L253-I256 HydrophobicContact CG-CD1 4.49Å; L253-I256 WeakPolarHBondContact O-CB 2.95Å; L253-I256 PolarHBondContact O-N 3.06Å; A254-I256 VanDerWaalsContact C-N 3.25Å; A254-I256 PolarHBondContact O-N 3.15Å; I256-I258 VanDerWaalsContact C-N 3.35Å; I256-I258 PolarHBondContact O-N 3.3Å; I256-K259 PolarHBondContact O-N 3.07Å; I256-A260 PolarHBondContact O-N 2.87Å
257	R	96.8	Very high	96.5	Very high	20 Å²	20	40.4 Å²	40.4	8%	0.075	21%	0.205	C	C	.	.	H	α-helix	trans	-60	-43.9	174.1	-58.4	-159.6	-65.3	-79.9	8	111.6	S249 D251 T252 L253 A254 K259 A260 C261 D288 E290 V293	S249-R257 WeakPolarHBondContact O-CD 2.89Å; S249-R257 VanDerWaalsContact O-CG 3.3Å; S249-R257 WeakPolarHBondContact O-CG 3.29Å; D251-R257 WeakPolarHBondContact O-CD 3.03Å; D251-R257 WeakPolarHBondContact O-CG 3.47Å; D251-R257 PolarHBondContact O-NH1 2.73Å; T252-R257 VanDerWaalsContact C-NH1 3.33Å; T252-R257 PolarHBondContact O-NH1 2.69Å; L253-R257 PolarHBondContact O-N 3.29Å; A254-R257 WeakPolarHBondContact O-CB 3.33Å; A254-R257 PolarHBondContact O-N 2.59Å; A254-R257 VanDerWaalsContact O-N 3.13Å; R257-K259 PolarHBondContact O-N 2.91Å; R257-A260 PolarHBondContact O-N 3.18Å; R257-C261 PolarHBondContact O-N 3.42Å; R257-C261 PolarHBondContact O-SG 3.35Å; R257-D288 WeakPolarHBondContact CD-OD2 3.34Å; R257-D288 IonicContact CZ-OD1 2.75Å; R257-D288 IonicContact CZ-OD2 2.71Å; R257-D288 IonicContact NE-OD1 2.72Å; R257-D288 PolarHBondContact NE-OD1 2.77Å; R257-D288 IonicContact NE-OD2 3.35Å; R257-D288 PolarHBondContact NE-OD2 3.49Å; R257-D288 IonicContact NH2-OD1 3.9Å; R257-D288 PolarHBondContact NH2-OD1 2.74Å; R257-D288 IonicContact NH2-OD2 3.21Å; R257-E290 VanDerWaalsContact NH2-CB 3.3Å; R257-V293 HydrophobicContact CB-CG1 4.18Å; R257-V293 HydrophobicContact CB-CG2 4.31Å
258	I	97.4	Very high	96.6	Very high	19 Å²	19	35 Å²	35	10%	0.097	18%	0.176	C	C	.	.	H	α-helix	trans	-59.1	-46.6	176.3	-69.5	165.7	0	0	0	110.7	A254 I256 C261 R262 V293 K296 Y300	A254-I258 WeakPolarHBondContact O-CG1 3.18Å; A254-I258 PolarHBondContact O-N 3.44Å; I256-I258 VanDerWaalsContact C-N 3.35Å; I256-I258 PolarHBondContact O-N 3.3Å; I258-C261 WeakPolarHBondContact O-CB 3.42Å; I258-C261 PolarHBondContact O-N 3.47Å; I258-R262 PolarHBondContact O-N 2.97Å; I258-V293 HydrophobicContact CD1-CG2 4.42Å; I258-V293 HydrophobicContact CG1-CB 4.38Å; I258-V293 HydrophobicContact CG1-CG1 4.45Å; I258-V293 HydrophobicContact CG1-CG2 4.05Å; I258-K296 HydrophobicContact CG2-CB 4.41Å; I258-K296 HydrophobicContact CG2-CG 4.3Å; I258-Y300 WeakPolarHBondContact CG2-OH 3.29Å
259	K	96.9	Very high	96.6	Very high	95 Å²	95	35.1 Å²	35.1	41%	0.413	18%	0.177	S	C	.	.	H	α-helix	trans	-63	-43.4	177.8	-76	169.4	176.4	154.3	0	112.6	L169 E255 I256 R257 C261 R262 L263	L169-K259 HydrophobicContact CD1-CD 4.41Å; L169-K259 HydrophobicContact CD2-CB 4.18Å; E255-K259 WeakPolarHBondContact O-CG 3.42Å; E255-K259 PolarHBondContact O-N 2.91Å; E255-K259 WeakPolarHBondContact OE1-CE 3.47Å; E255-K259 IonicContact OE1-NZ 2.8Å; E255-K259 PolarHBondContact OE1-NZ 3.21Å; I256-K259 PolarHBondContact O-N 3.07Å; R257-K259 PolarHBondContact O-N 2.91Å; K259-C261 VanDerWaalsContact C-N 3.34Å; K259-C261 PolarHBondContact O-N 3.25Å; K259-R262 WeakPolarHBondContact O-CB 3.46Å; K259-R262 PolarHBondContact O-N 2.83Å; K259-L263 WeakPolarHBondContact O-CG 3.46Å; K259-L263 PolarHBondContact O-N 3.44Å
260	A	97.3	Very high	96.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.1	-39.8	173.7	0	0	0	0	0	112.7	I248 I256 R257 L263 M264	I248-A260 HydrophobicContact CB-CB 4.12Å; I248-A260 HydrophobicContact CG2-CB 3.88Å; I256-A260 PolarHBondContact O-N 2.87Å; R257-A260 PolarHBondContact O-N 3.18Å; A260-L263 PolarHBondContact O-N 3.28Å; A260-M264 WeakPolarHBondContact O-CG 3.49Å; A260-M264 PolarHBondContact O-N 3.09Å
261	C	98.2	Very high	96.5	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.3	-41.9	174	-62.6	0	0	0	0	111.7	R257 I258 K259 M264 A265 L282 V297 Y300	R257-C261 PolarHBondContact O-N 3.42Å; R257-C261 PolarHBondContact O-SG 3.35Å; I258-C261 WeakPolarHBondContact O-CB 3.42Å; I258-C261 PolarHBondContact O-N 3.47Å; K259-C261 VanDerWaalsContact C-N 3.34Å; K259-C261 PolarHBondContact O-N 3.25Å; C261-M264 PolarHBondContact O-N 3.23Å; C261-A265 WeakPolarHBondContact O-CB 3.47Å; C261-A265 PolarHBondContact O-N 3.12Å; C261-L282 HydrophobicContact CB-CD2 4.17Å; C261-L282 WeakPolarHBondContact O-CD2 3.46Å; C261-V297 HydrophobicContact CB-CG2 4.03Å; C261-Y300 HydrophobicContact CB-CD2 4.06Å; C261-Y300 HydrophobicContact CB-CE2 3.98Å
262	R	98	Very high	96.4	Very high	45 Å²	45	31 Å²	31	17%	0.17	17%	0.167	C	C	.	.	H	α-helix	trans	-59.9	-48	175.3	-172.2	173.1	173.5	165.2	-4.9	111.6	I258 K259 M264 A265 D266 Y300 N766 D769	I258-R262 PolarHBondContact O-N 2.97Å; K259-R262 WeakPolarHBondContact O-CB 3.46Å; K259-R262 PolarHBondContact O-N 2.83Å; R262-M264 VanDerWaalsContact C-N 3.31Å; R262-M264 PolarHBondContact O-N 3.06Å; R262-A265 PolarHBondContact O-N 3.28Å; R262-A265 VanDerWaalsContact O-N 3.12Å; R262-D266 PolarHBondContact O-N 2.84Å; R262-Y300 HydrophobicContact CB-CE1 4.4Å; R262-Y300 HydrophobicContact CB-CE2 4.1Å; R262-Y300 HydrophobicContact CG-CE1 4.34Å; R262-N766 PolarHBondContact NH1-ND2 2.92Å; R262-N766 PolarHBondContact NH2-OD1 2.69Å; R262-D769 IonicContact NH1-OD1 2.82Å; R262-D769 PolarHBondContact NH1-OD1 3.27Å; R262-D769 IonicContact NH1-OD2 2.8Å
263	L	97.9	Very high	96.4	Very high	3 Å²	3	26 Å²	26	2%	0.016	14%	0.136	C	C	.	.	H	α-helix	trans	-57.3	-42.1	175.8	-66.8	173.7	0	0	0	112.3	A172 K176 L245 K259 A260 L267	A172-L263 HydrophobicContact CB-CD1 3.69Å; K176-L263 HydrophobicContact CB-CD2 4.26Å; K176-L263 HydrophobicContact CD-CD2 3.77Å; K176-L263 HydrophobicContact CG-CD2 4.42Å; L245-L263 HydrophobicContact CD1-CB 4.18Å; L245-L263 HydrophobicContact CD2-CB 4.09Å; L245-L263 HydrophobicContact CD2-CD1 3.72Å; K259-L263 WeakPolarHBondContact O-CG 3.46Å; K259-L263 PolarHBondContact O-N 3.44Å; A260-L263 PolarHBondContact O-N 3.28Å; L263-L267 WeakPolarHBondContact O-CD1 3.36Å; L263-L267 VanDerWaalsContact O-CG 3.25Å; L263-L267 WeakPolarHBondContact O-CG 3.25Å; L263-L267 PolarHBondContact O-N 3.44Å
264	M	98.3	Very high	96.4	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66.9	-36.7	176.3	-69.2	-174.7	-63.1	0	0	112.7	L245 A260 C261 R262 L268 L278 A281 L282	L245-M264 HydrophobicContact CB-CG 3.9Å; L245-M264 HydrophobicContact CB-SD 4.28Å; L245-M264 HydrophobicContact CD1-CG 4.03Å; A260-M264 WeakPolarHBondContact O-CG 3.49Å; A260-M264 PolarHBondContact O-N 3.09Å; C261-M264 PolarHBondContact O-N 3.23Å; R262-M264 VanDerWaalsContact C-N 3.31Å; R262-M264 PolarHBondContact O-N 3.06Å; M264-L268 WeakPolarHBondContact O-CB 3.29Å; M264-L268 PolarHBondContact O-N 3.03Å; M264-L268 VanDerWaalsContact O-N 3.1Å; M264-L278 HydrophobicContact CB-CD2 3.88Å; M264-L278 HydrophobicContact CG-CD2 3.96Å; M264-A281 HydrophobicContact CE-CB 4.38Å; M264-A281 HydrophobicContact SD-CB 3.75Å; M264-L282 HydrophobicContact CB-CD1 4.48Å; M264-L282 HydrophobicContact CB-CD2 4.1Å; M264-L282 HydrophobicContact CB-CG 4.16Å; M264-L282 HydrophobicContact CE-CD2 4.35Å
265	A	97.8	Very high	96.3	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.008	13%	0.127	C	C	.	.	H	α-helix	trans	-69.6	-46	176.7	0	0	0	0	0	112.1	C261 R262 L267 L268 I269 L282 Y300	C261-A265 WeakPolarHBondContact O-CB 3.47Å; C261-A265 PolarHBondContact O-N 3.12Å; R262-A265 PolarHBondContact O-N 3.28Å; R262-A265 VanDerWaalsContact O-N 3.12Å; A265-L267 VanDerWaalsContact C-N 3.27Å; A265-L267 PolarHBondContact O-N 3.46Å; A265-L268 PolarHBondContact O-N 3.45Å; A265-I269 WeakPolarHBondContact O-CD1 3.49Å; A265-I269 VanDerWaalsContact O-CG1 3.29Å; A265-I269 WeakPolarHBondContact O-CG1 3.43Å; A265-I269 PolarHBondContact O-N 2.9Å; A265-L282 HydrophobicContact CB-CD1 4.16Å; A265-L282 HydrophobicContact CB-CD2 4.42Å; A265-Y300 HydrophobicContact CB-CG 4.18Å
266	D	97.5	Very high	96.4	Very high	27 Å²	27	28.2 Å²	28.2	14%	0.144	14%	0.139	C	C	.	.	H	α-helix	trans	-54.1	-44.1	174.7	-72.5	6.5	0	0	0	111	K176 R262 I269 A270	K176-D266 HydrophobicContact CD-CB 3.73Å; K176-D266 IonicContact NZ-OD2 3.85Å; K176-D266 PolarHBondContact NZ-OD2 2.96Å; R262-D266 PolarHBondContact O-N 2.84Å; D266-I269 PolarHBondContact O-N 3.13Å; D266-A270 WeakPolarHBondContact O-CB 3.41Å; D266-A270 PolarHBondContact O-N 3.1Å
267	L	97.4	Very high	96.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.1	-45	177.5	-70.6	167.4	0	0	0	112.6	K176 I180 Y238 Y241 L245 L263 A265 I269 A270 K271 L278	K176-L267 HydrophobicContact CG-CD2 3.84Å; K176-L267 HydrophobicContact CG-CG 4.06Å; I180-L267 HydrophobicContact CD1-CD2 4.31Å; I180-L267 HydrophobicContact CG1-CD2 4.08Å; Y238-L267 HydrophobicContact CE2-CD2 4.17Å; Y241-L267 HydrophobicContact CD1-CD1 4.4Å; Y241-L267 HydrophobicContact CE1-CD1 3.65Å; Y241-L267 HydrophobicContact CE1-CD2 4.41Å; L245-L267 HydrophobicContact CD1-CD1 3.47Å; L245-L267 VanDerWaalsContact CD1-CD1 3.47Å; L263-L267 WeakPolarHBondContact O-CD1 3.36Å; L263-L267 VanDerWaalsContact O-CG 3.25Å; L263-L267 WeakPolarHBondContact O-CG 3.25Å; L263-L267 PolarHBondContact O-N 3.44Å; A265-L267 VanDerWaalsContact C-N 3.27Å; A265-L267 PolarHBondContact O-N 3.46Å; L267-I269 VanDerWaalsContact C-N 3.28Å; L267-I269 PolarHBondContact O-N 3.39Å; L267-A270 PolarHBondContact O-N 3.32Å; L267-K271 PolarHBondContact O-N 3.35Å; L267-L278 HydrophobicContact CB-CD1 3.88Å; L267-L278 HydrophobicContact CB-CD2 4.37Å; L267-L278 HydrophobicContact CD1-CD2 4.37Å
268	L	96.9	Very high	96.5	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-64.9	-32.6	178.7	-179.3	60.8	0	0	0	112.2	M264 A265 E275 L278 L279 L282 V304 M311	M264-L268 WeakPolarHBondContact O-CB 3.29Å; M264-L268 PolarHBondContact O-N 3.03Å; M264-L268 VanDerWaalsContact O-N 3.1Å; A265-L268 PolarHBondContact O-N 3.45Å; L268-E275 HydrophobicContact CD1-CB 4.06Å; L268-E275 HydrophobicContact CD1-CG 4.02Å; L268-L278 HydrophobicContact CB-CB 4.18Å; L268-L278 HydrophobicContact CB-CD1 4.31Å; L268-L278 HydrophobicContact CD1-CB 4.29Å; L268-L279 HydrophobicContact CD2-CB 4.06Å; L268-L279 HydrophobicContact CD2-CD1 4.32Å; L268-L282 HydrophobicContact CD2-CD1 3.86Å; L268-V304 HydrophobicContact CD2-CG1 4Å; L268-V304 HydrophobicContact CD2-CG2 3.91Å; L268-V304 HydrophobicContact CG-CG1 4.2Å; L268-V304 HydrophobicContact CG-CG2 4.27Å; L268-M311 HydrophobicContact CD1-CE 4.05Å; L268-M311 HydrophobicContact CD1-SD 4.29Å
269	I	96.4	Very high	96.5	Very high	25 Å²	25	27.9 Å²	27.9	13%	0.128	14%	0.144	C	C	.	.	H	α-helix	trans	-73.8	-39.9	173.6	-68	161.3	0	0	0	110.8	A265 D266 L267 L303 V304 N307 H308	A265-I269 WeakPolarHBondContact O-CD1 3.49Å; A265-I269 VanDerWaalsContact O-CG1 3.29Å; A265-I269 WeakPolarHBondContact O-CG1 3.43Å; A265-I269 PolarHBondContact O-N 2.9Å; D266-I269 PolarHBondContact O-N 3.13Å; L267-I269 VanDerWaalsContact C-N 3.28Å; L267-I269 PolarHBondContact O-N 3.39Å; I269-L303 HydrophobicContact CD1-CB 4.42Å; I269-L303 HydrophobicContact CD1-CD2 3.67Å; I269-L303 HydrophobicContact CD1-CG 3.68Å; I269-V304 HydrophobicContact CD1-CG2 4.22Å; I269-V304 HydrophobicContact CG1-CB 4.49Å; I269-V304 HydrophobicContact CG1-CG2 3.84Å; I269-N307 HydrophobicContact CG2-CB 3.85Å; I269-H308 PolarHBondContact O-NE2 3.18Å
270	A	95.8	Very high	96.5	Very high	37 Å²	37	24.8 Å²	24.8	31%	0.306	13%	0.134	S	C	.	.	H	α-helix	trans	-84.5	-31.7	-170.7	0	0	0	0	0	115.1	I180 D266 L267	I180-A270 HydrophobicContact CB-CB 4.41Å; I180-A270 HydrophobicContact CD1-CB 3.64Å; I180-A270 HydrophobicContact CG1-CB 3.72Å; I180-A270 HydrophobicContact CG2-CB 3.86Å; D266-A270 WeakPolarHBondContact O-CB 3.41Å; D266-A270 PolarHBondContact O-N 3.1Å; L267-A270 PolarHBondContact O-N 3.32Å
271	K	94.3	Very high	96.5	Very high	21 Å²	21	25 Å²	25	9%	0.091	14%	0.136	C	C	.	.			trans	-146.4	141.7	-168.8	-63.9	-67.3	166.7	171.2	0	113.7	I180 L184 P185 D186 L267 E273	I180-K271 WeakPolarHBondContact O-CE 3.45Å; I180-K271 PolarHBondContact O-NZ 2.94Å; L184-K271 HydrophobicContact CB-CB 4.44Å; L184-K271 HydrophobicContact CB-CD 3.8Å; L184-K271 HydrophobicContact CB-CG 3.89Å; L184-K271 HydrophobicContact CD1-CB 3.93Å; L184-K271 HydrophobicContact CD1-CG 3.9Å; L184-K271 WeakPolarHBondContact O-CE 3.31Å; L184-K271 PolarHBondContact O-NZ 2.91Å; P185-K271 WeakPolarHBondContact O-CD 3.46Å; D186-K271 IonicContact OD1-NZ 3.07Å; D186-K271 PolarHBondContact OD1-NZ 3.4Å; L267-K271 PolarHBondContact O-N 3.35Å; K271-E273 VanDerWaalsContact C-N 3.31Å; K271-E273 PolarHBondContact O-N 3.09Å
272	A	91.6	Very high	96.5	Very high	17 Å²	17	25 Å²	25	14%	0.14	14%	0.136	C	C	.	.	S	Bend	trans	-75.3	-9.9	-176.9	0	0	0	0	0	115.5	K188 E275	K188-A272 WeakPolarHBondContact CE-O 3.4Å; K188-A272 HydrophobicContact CG-CB 4.18Å; K188-A272 WeakPolarHBondContact CG-O 3.47Å; A272-E275 WeakPolarHBondContact CA-OE1 3.48Å; A272-E275 VanDerWaalsContact CB-OE1 3.23Å; A272-E275 WeakPolarHBondContact CB-OE1 3.38Å; A272-E275 VanDerWaalsContact O-CD 3.31Å; A272-E275 VanDerWaalsContact O-CG 3.3Å; A272-E275 WeakPolarHBondContact O-CG 3.28Å
273	E	94.5	Very high	96.5	Very high	3 Å²	3	22.9 Å²	22.9	1%	0.014	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	136.1	-179.4	-178.6	59	-147	0	0	111	L184 L189 K235 Y238 K271 E275	L184-E273 HydrophobicContact CD2-CB 4.49Å; L189-E273 HydrophobicContact CB-CG 4.49Å; L189-E273 HydrophobicContact CD1-CG 4.07Å; L189-E273 HydrophobicContact CG-CG 4.12Å; L189-E273 PolarHBondContact N-OE2 3.32Å; K235-E273 IonicContact NZ-OE1 3.23Å; K235-E273 PolarHBondContact NZ-OE1 2.98Å; K235-E273 IonicContact NZ-OE2 3.54Å; K235-E273 PolarHBondContact NZ-OE2 3.39Å; Y238-E273 HydrophobicContact CD1-CB 4.22Å; Y238-E273 HydrophobicContact CD1-CG 3.46Å; Y238-E273 VanDerWaalsContact CD1-CG 3.46Å; Y238-E273 HydrophobicContact CE1-CB 3.91Å; Y238-E273 HydrophobicContact CE1-CG 3.62Å; Y238-E273 WeakPolarHBondContact CE1-O 3.49Å; Y238-E273 PolarHBondContact OH-O 2.91Å; K271-E273 VanDerWaalsContact C-N 3.31Å; K271-E273 PolarHBondContact O-N 3.09Å; E273-E275 VanDerWaalsContact C-N 3.26Å; E273-E275 PolarHBondContact O-N 3.11Å
274	Q	94.9	Very high	96.4	Very high	52 Å²	52	24.8 Å²	24.8	24%	0.243	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	20.7	-175	-57.6	-64.1	-52.2	0	0	116.4	Y238 V242 E276 A277 L278	Y238-Q274 HydrophobicContact CD1-CB 4.33Å; Y238-Q274 HydrophobicContact CD1-CG 3.61Å; Y238-Q274 HydrophobicContact CE1-CB 3.76Å; Y238-Q274 HydrophobicContact CE1-CG 3.57Å; V242-Q274 HydrophobicContact CG2-CB 4.03Å; V242-Q274 HydrophobicContact CG2-CG 4.13Å; Q274-E276 VanDerWaalsContact C-N 3.33Å; Q274-E276 PolarHBondContact O-N 2.87Å; Q274-A277 HydrophobicContact CB-CB 4.4Å; Q274-A277 PolarHBondContact O-N 3Å; Q274-A277 VanDerWaalsContact O-N 3.08Å; Q274-L278 HydrophobicContact CB-CD1 4.39Å; Q274-L278 HydrophobicContact CB-CG 4.44Å; Q274-L278 WeakPolarHBondContact O-CG 3.36Å; Q274-L278 PolarHBondContact O-N 3.41Å
275	E	94.7	Very high	96.3	Very high	57 Å²	57	25.1 Å²	25.1	27%	0.266	14%	0.14	S	C	.	.	H	α-helix	trans	-41.6	-53.9	175.5	-79.5	163	176.5	0	0	114	K188 L268 A272 E273 A277 L278 L279 M311	K188-E275 WeakPolarHBondContact CE-OE2 3.48Å; K188-E275 IonicContact NZ-OE2 3.29Å; K188-E275 PolarHBondContact NZ-OE2 3.08Å; L268-E275 HydrophobicContact CD1-CB 4.06Å; L268-E275 HydrophobicContact CD1-CG 4.02Å; A272-E275 WeakPolarHBondContact CA-OE1 3.48Å; A272-E275 VanDerWaalsContact CB-OE1 3.23Å; A272-E275 WeakPolarHBondContact CB-OE1 3.38Å; A272-E275 VanDerWaalsContact O-CD 3.31Å; A272-E275 VanDerWaalsContact O-CG 3.3Å; A272-E275 WeakPolarHBondContact O-CG 3.28Å; E273-E275 VanDerWaalsContact C-N 3.26Å; E273-E275 PolarHBondContact O-N 3.11Å; E275-A277 PolarHBondContact O-N 2.87Å; E275-L278 PolarHBondContact O-N 2.92Å; E275-L279 VanDerWaalsContact O-CB 3.23Å; E275-L279 WeakPolarHBondContact O-CB 3.34Å; E275-L279 PolarHBondContact O-N 3.35Å; E275-M311 HydrophobicContact CG-CE 4.46Å
276	E	95.4	Very high	96.2	Very high	152 Å²	152	25 Å²	25	71%	0.71	14%	0.139	S	C	*	.	H	α-helix	trans	-62	-42.3	-177.4	-175.7	-178.5	-176.6	0	0	112.3	Q274 S280	Q274-E276 VanDerWaalsContact C-N 3.33Å; Q274-E276 PolarHBondContact O-N 2.87Å; E276-S280 VanDerWaalsContact O-CB 3.27Å; E276-S280 WeakPolarHBondContact O-CB 3.21Å; E276-S280 PolarHBondContact O-N 2.84Å
277	A	96.7	Very high	96.1	Very high	37 Å²	37	25.3 Å²	25.3	31%	0.306	15%	0.149	S	C	.	.	H	α-helix	trans	-70.6	-41.6	179.8	0	0	0	0	0	111.8	V242 Q274 E275 A281	V242-A277 HydrophobicContact CG1-CB 4.38Å; Q274-A277 HydrophobicContact CB-CB 4.4Å; Q274-A277 PolarHBondContact O-N 3Å; Q274-A277 VanDerWaalsContact O-N 3.08Å; E275-A277 PolarHBondContact O-N 2.87Å; A277-A281 WeakPolarHBondContact O-CB 3.41Å; A277-A281 PolarHBondContact O-N 3.21Å
278	L	98.1	Very high	96	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65.1	-45.8	175.8	-72.9	166.9	0	0	0	111.4	V242 M264 L267 L268 Q274 E275 A281 L282	V242-L278 HydrophobicContact CG1-CD2 3.78Å; V242-L278 HydrophobicContact CG1-CG 4.08Å; V242-L278 HydrophobicContact CG2-CD2 4.05Å; V242-L278 HydrophobicContact CG2-CG 4.32Å; M264-L278 HydrophobicContact CB-CD2 3.88Å; M264-L278 HydrophobicContact CG-CD2 3.96Å; L267-L278 HydrophobicContact CB-CD1 3.88Å; L267-L278 HydrophobicContact CB-CD2 4.37Å; L267-L278 HydrophobicContact CD1-CD2 4.37Å; L268-L278 HydrophobicContact CB-CB 4.18Å; L268-L278 HydrophobicContact CB-CD1 4.31Å; L268-L278 HydrophobicContact CD1-CB 4.29Å; Q274-L278 HydrophobicContact CB-CD1 4.39Å; Q274-L278 HydrophobicContact CB-CG 4.44Å; Q274-L278 WeakPolarHBondContact O-CG 3.36Å; Q274-L278 PolarHBondContact O-N 3.41Å; E275-L278 PolarHBondContact O-N 2.92Å; L278-A281 PolarHBondContact O-N 3.09Å; L278-L282 WeakPolarHBondContact O-CB 3.22Å; L278-L282 WeakPolarHBondContact O-CG 3.48Å; L278-L282 PolarHBondContact O-N 3.25Å
279	L	97.8	Very high	95.7	Very high	11 Å²	11	31.2 Å²	31.2	6%	0.058	19%	0.185	C	C	.	.	H	α-helix	trans	-64	-48.3	177.6	177.6	56.9	0	0	0	111.3	L268 E275 A281 L282 V283 L301 E314 L315 E318	L268-L279 HydrophobicContact CD2-CB 4.06Å; L268-L279 HydrophobicContact CD2-CD1 4.32Å; E275-L279 VanDerWaalsContact O-CB 3.23Å; E275-L279 WeakPolarHBondContact O-CB 3.34Å; E275-L279 PolarHBondContact O-N 3.35Å; L279-A281 VanDerWaalsContact C-N 3.32Å; L279-A281 PolarHBondContact O-N 3.3Å; L279-L282 PolarHBondContact O-N 3.14Å; L279-V283 HydrophobicContact CD1-CG2 3.8Å; L279-V283 HydrophobicContact CG-CG2 4.34Å; L279-V283 WeakPolarHBondContact O-CB 3.35Å; L279-V283 WeakPolarHBondContact O-CG2 3.46Å; L279-V283 PolarHBondContact O-N 3.08Å; L279-L301 HydrophobicContact CD1-CD2 3.85Å; L279-E314 HydrophobicContact CD2-CB 4.21Å; L279-L315 HydrophobicContact CD1-CD2 3.42Å; L279-L315 VanDerWaalsContact CD1-CD2 3.42Å; L279-L315 HydrophobicContact CD2-CD2 4.05Å; L279-L315 HydrophobicContact CG-CD2 4.4Å; L279-E318 HydrophobicContact CD2-CB 4.17Å; L279-E318 HydrophobicContact CG-CB 4.23Å; L279-E318 HydrophobicContact CG-CG 4.24Å
280	S	97.3	Very high	95.6	Very high	30 Å²	30	33.1 Å²	33.1	21%	0.21	19%	0.193	C	C	.	.	H	α-helix	trans	-61.8	-42.2	177.2	-164.1	0	0	0	0	111	E276 L282 V283 N284 E318	E276-S280 VanDerWaalsContact O-CB 3.27Å; E276-S280 WeakPolarHBondContact O-CB 3.21Å; E276-S280 PolarHBondContact O-N 2.84Å; S280-L282 PolarHBondContact O-N 3.38Å; S280-V283 PolarHBondContact O-N 3.19Å; S280-N284 WeakPolarHBondContact O-CB 3.39Å; S280-N284 PolarHBondContact O-N 3.39Å; S280-N284 PolarHBondContact O-ND2 3.44Å; S280-N284 PolarHBondContact OG-ND2 2.97Å; S280-E318 WeakPolarHBondContact CB-OE1 3.47Å; S280-E318 PolarHBondContact OG-OE1 2.98Å
281	A	97.3	Very high	95.3	Very high	4 Å²	4	32.8 Å²	32.8	3%	0.033	19%	0.187	C	C	.	.	H	α-helix	trans	-57.3	-50.6	174.7	0	0	0	0	0	111.6	Q246 M264 A277 L278 L279 N284 K285	Q246-A281 HydrophobicContact CG-CB 4.4Å; M264-A281 HydrophobicContact CE-CB 4.38Å; M264-A281 HydrophobicContact SD-CB 3.75Å; A277-A281 WeakPolarHBondContact O-CB 3.41Å; A277-A281 PolarHBondContact O-N 3.21Å; L278-A281 PolarHBondContact O-N 3.09Å; L279-A281 VanDerWaalsContact C-N 3.32Å; L279-A281 PolarHBondContact O-N 3.3Å; A281-N284 PolarHBondContact O-N 2.64Å; A281-K285 WeakPolarHBondContact O-CG 3.43Å; A281-K285 PolarHBondContact O-N 3.17Å
282	L	98	Very high	95.3	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.3	-49.4	177	-74.1	167.7	0	0	0	112.8	C261 M264 A265 L268 L278 L279 S280 N284 K285 V297 L301	C261-L282 HydrophobicContact CB-CD2 4.17Å; C261-L282 WeakPolarHBondContact O-CD2 3.46Å; M264-L282 HydrophobicContact CB-CD1 4.48Å; M264-L282 HydrophobicContact CB-CD2 4.1Å; M264-L282 HydrophobicContact CB-CG 4.16Å; M264-L282 HydrophobicContact CE-CD2 4.35Å; A265-L282 HydrophobicContact CB-CD1 4.16Å; A265-L282 HydrophobicContact CB-CD2 4.42Å; L268-L282 HydrophobicContact CD2-CD1 3.86Å; L278-L282 WeakPolarHBondContact O-CB 3.22Å; L278-L282 WeakPolarHBondContact O-CG 3.48Å; L278-L282 PolarHBondContact O-N 3.25Å; L279-L282 PolarHBondContact O-N 3.14Å; S280-L282 PolarHBondContact O-N 3.38Å; L282-N284 VanDerWaalsContact C-N 3.3Å; L282-N284 PolarHBondContact O-N 3.32Å; L282-K285 WeakPolarHBondContact O-CA 3.06Å; L282-K285 WeakPolarHBondContact O-CB 3.18Å; L282-K285 PolarHBondContact O-N 3.18Å; L282-V297 VanDerWaalsContact O-CG1 3.22Å; L282-V297 WeakPolarHBondContact O-CG1 3.31Å; L282-L301 HydrophobicContact CB-CD2 4.06Å; L282-L301 HydrophobicContact CD1-CD2 4.47Å
283	V	97.7	Very high	95.5	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-59.4	-42.1	179.4	168.7	0	0	0	0	110.8	L279 S280 K285 L286 L301 E318 L322	L279-V283 HydrophobicContact CD1-CG2 3.8Å; L279-V283 HydrophobicContact CG-CG2 4.34Å; L279-V283 WeakPolarHBondContact O-CB 3.35Å; L279-V283 WeakPolarHBondContact O-CG2 3.46Å; L279-V283 PolarHBondContact O-N 3.08Å; S280-V283 PolarHBondContact O-N 3.19Å; V283-K285 PolarHBondContact O-N 3.43Å; V283-K285 VanDerWaalsContact O-N 3.15Å; V283-L286 HydrophobicContact CG1-CD1 4.39Å; V283-L286 VanDerWaalsContact O-CB 3.29Å; V283-L286 WeakPolarHBondContact O-CB 3.17Å; V283-L286 WeakPolarHBondContact O-CG 3.07Å; V283-L286 PolarHBondContact O-N 3.42Å; V283-L301 HydrophobicContact CG2-CD1 4.19Å; V283-L301 HydrophobicContact CG2-CD2 4.33Å; V283-E318 HydrophobicContact CB-CG 4.08Å; V283-E318 HydrophobicContact CG1-CG 4.21Å; V283-E318 HydrophobicContact CG2-CB 4.28Å; V283-E318 HydrophobicContact CG2-CG 4.03Å; V283-L322 HydrophobicContact CG1-CB 3.89Å; V283-L322 HydrophobicContact CG1-CD2 3.94Å; V283-L322 HydrophobicContact CG1-CG 4.44Å; V283-L322 WeakPolarHBondContact O-CD2 3.38Å
284	N	96.5	Very high	95.5	Very high	43 Å²	43	39 Å²	39	23%	0.23	21%	0.207	C	C	.	.	H	α-helix	trans	-59	-26.8	174.3	-76.2	-64.8	0	0	0	112.9	S280 A281 L282 L286 G287 R325	S280-N284 WeakPolarHBondContact O-CB 3.39Å; S280-N284 PolarHBondContact O-N 3.39Å; S280-N284 PolarHBondContact O-ND2 3.44Å; S280-N284 PolarHBondContact OG-ND2 2.97Å; A281-N284 PolarHBondContact O-N 2.64Å; L282-N284 VanDerWaalsContact C-N 3.3Å; L282-N284 PolarHBondContact O-N 3.32Å; N284-L286 VanDerWaalsContact C-N 3.31Å; N284-L286 PolarHBondContact O-N 3.28Å; N284-G287 PolarHBondContact O-N 3.38Å; N284-R325 VanDerWaalsContact OD1-CZ 3.27Å; N284-R325 PolarHBondContact OD1-NH1 2.78Å; N284-R325 PolarHBondContact OD1-NH2 3.09Å
285	K	96.5	Very high	95.5	Very high	6 Å²	6	37.8 Å²	37.8	3%	0.026	20%	0.203	C	C	.	.	H	α-helix	trans	-76.3	-9.6	176.5	-61.5	-54.8	-52	-177.2	0	114.6	S249 F250 A281 L282 V283 G287 D288 V297	S249-K285 WeakPolarHBondContact O-CE 3.2Å; S249-K285 PolarHBondContact O-NZ 2.71Å; F250-K285 HydrophobicContact CE1-CD 4.41Å; A281-K285 WeakPolarHBondContact O-CG 3.43Å; A281-K285 PolarHBondContact O-N 3.17Å; L282-K285 WeakPolarHBondContact O-CA 3.06Å; L282-K285 WeakPolarHBondContact O-CB 3.18Å; L282-K285 PolarHBondContact O-N 3.18Å; V283-K285 PolarHBondContact O-N 3.43Å; V283-K285 VanDerWaalsContact O-N 3.15Å; K285-G287 PolarHBondContact O-N 3.27Å; K285-D288 WeakPolarHBondContact CE-OD2 3.07Å; K285-D288 IonicContact NZ-OD2 2.72Å; K285-D288 PolarHBondContact NZ-OD2 3.16Å; K285-D288 WeakPolarHBondContact O-CB 3.36Å; K285-D288 PolarHBondContact O-N 3.07Å; K285-D288 VanDerWaalsContact O-N 3.12Å; K285-V297 HydrophobicContact CB-CG1 4.23Å; K285-V297 HydrophobicContact CB-CG2 3.73Å
286	L	96	Very high	95.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.7	164.9	-62.4	170.4	0	0	0	112	V283 N284 V297 V298 L301 L322 A336	V283-L286 HydrophobicContact CG1-CD1 4.39Å; V283-L286 VanDerWaalsContact O-CB 3.29Å; V283-L286 WeakPolarHBondContact O-CB 3.17Å; V283-L286 WeakPolarHBondContact O-CG 3.07Å; V283-L286 PolarHBondContact O-N 3.42Å; N284-L286 VanDerWaalsContact C-N 3.31Å; N284-L286 PolarHBondContact O-N 3.28Å; L286-V297 HydrophobicContact CD2-CB 4.2Å; L286-V297 HydrophobicContact CD2-CG1 3.68Å; L286-V297 HydrophobicContact CG-CG1 3.95Å; L286-V298 HydrophobicContact CD2-CB 4.48Å; L286-V298 HydrophobicContact CD2-CG2 3.48Å; L286-V298 VanDerWaalsContact CD2-CG2 3.48Å; L286-L301 HydrophobicContact CD1-CD1 3.86Å; L286-L301 HydrophobicContact CD2-CD1 4.15Å; L286-L301 HydrophobicContact CG-CD1 4.18Å; L286-L322 HydrophobicContact CB-CD2 3.94Å; L286-L322 HydrophobicContact CD1-CD2 4.2Å; L286-A336 HydrophobicContact CD1-CB 4.37Å
287	G	94	Very high	95.6	Very high	33 Å²	33	31.4 Å²	31.4	34%	0.34	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	18	172.7	0	0	0	0	0	115.5	N284 K285	N284-G287 PolarHBondContact O-N 3.38Å; K285-G287 PolarHBondContact O-N 3.27Å
288	D	94.9	Very high	95.6	Very high	12 Å²	12	29.8 Å²	29.8	6%	0.064	16%	0.158	C	C	.	.			trans	-60.5	150.4	176.3	-158.6	-80.7	0	0	0	112	R257 K285 E290 V293	R257-D288 WeakPolarHBondContact CD-OD2 3.34Å; R257-D288 IonicContact CZ-OD1 2.75Å; R257-D288 IonicContact CZ-OD2 2.71Å; R257-D288 IonicContact NE-OD1 2.72Å; R257-D288 PolarHBondContact NE-OD1 2.77Å; R257-D288 IonicContact NE-OD2 3.35Å; R257-D288 PolarHBondContact NE-OD2 3.49Å; R257-D288 IonicContact NH2-OD1 3.9Å; R257-D288 PolarHBondContact NH2-OD1 2.74Å; R257-D288 IonicContact NH2-OD2 3.21Å; K285-D288 WeakPolarHBondContact CE-OD2 3.07Å; K285-D288 IonicContact NZ-OD2 2.72Å; K285-D288 PolarHBondContact NZ-OD2 3.16Å; K285-D288 WeakPolarHBondContact O-CB 3.36Å; K285-D288 PolarHBondContact O-N 3.07Å; K285-D288 VanDerWaalsContact O-N 3.12Å; D288-E290 VanDerWaalsContact C-N 3.28Å; D288-E290 PolarHBondContact O-N 2.97Å; D288-E290 WeakPolarHBondContact OD1-CB 3.4Å; D288-E290 PolarHBondContact OD1-N 2.71Å; D288-V293 HydrophobicContact CB-CB 3.91Å; D288-V293 HydrophobicContact CB-CG1 3.94Å
289	T	92	Very high	95.5	Very high	114 Å²	114	30.1 Å²	30.1	70%	0.699	16%	0.161	S	C	*	.	S	Bend	trans	-69.2	-30.5	178.3	50.3	0	0	0	0	112.1	R331	T289-R331 PolarHBondContact O-NH1 3.26Å; T289-R331 VanDerWaalsContact O-NH1 3.15Å
290	E	92.7	Very high	95.4	Very high	65 Å²	65	30.8 Å²	30.8	30%	0.304	16%	0.163	S	C	.	.	S	Bend	trans	-91.7	117.4	-179.1	176.5	53.3	-136.7	0	0	111.4	A254 R257 D288 R292 V293 A294	A254-E290 HydrophobicContact CB-CB 4.39Å; A254-E290 HydrophobicContact CB-CG 3.78Å; R257-E290 VanDerWaalsContact NH2-CB 3.3Å; D288-E290 VanDerWaalsContact C-N 3.28Å; D288-E290 PolarHBondContact O-N 2.97Å; D288-E290 WeakPolarHBondContact OD1-CB 3.4Å; D288-E290 PolarHBondContact OD1-N 2.71Å; E290-R292 VanDerWaalsContact C-N 3.27Å; E290-R292 HydrophobicContact CG-CB 4.18Å; E290-R292 PolarHBondContact O-N 2.89Å; E290-R292 WeakPolarHBondContact OE1-CG 3.49Å; E290-R292 PolarHBondContact OE1-N 2.96Å; E290-V293 HydrophobicContact CB-CG2 3.85Å; E290-V293 HydrophobicContact CG-CG2 3.91Å; E290-V293 PolarHBondContact O-N 3.4Å; E290-V293 VanDerWaalsContact O-N 3.09Å; E290-A294 PolarHBondContact O-N 2.96Å
291	P	91.4	Very high	95.4	Very high	29 Å²	29	29.3 Å²	29.3	19%	0.188	15%	0.153	C	C	.	.	H	α-helix	trans	-48.4	-44.1	178	-32.4	38.5	0	0	0	114.3	V293 A294 T295 Y335 L782	P291-V293 VanDerWaalsContact C-N 3.26Å; P291-V293 PolarHBondContact O-N 3.21Å; P291-A294 PolarHBondContact O-N 3.42Å; P291-T295 PolarHBondContact O-N 2.75Å; P291-T295 PolarHBondContact O-OG1 2.97Å; P291-Y335 WeakPolarHBondContact CA-OH 3.47Å; P291-Y335 WeakPolarHBondContact CB-OH 3.5Å; P291-L782 HydrophobicContact CB-CD1 4.03Å
292	R	93.9	Very high	95.3	Very high	173 Å²	173	30.8 Å²	30.8	65%	0.653	16%	0.159	S	C	*	.	H	α-helix	trans	-61.5	-31.9	-177	-64.1	179.1	65.9	-175.3	-0.6	113.5	E290 K296	E290-R292 VanDerWaalsContact C-N 3.27Å; E290-R292 HydrophobicContact CG-CB 4.18Å; E290-R292 PolarHBondContact O-N 2.89Å; E290-R292 WeakPolarHBondContact OE1-CG 3.49Å; E290-R292 PolarHBondContact OE1-N 2.96Å; R292-K296 PolarHBondContact O-N 3.09Å
293	V	95.5	Very high	95.2	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-70.3	-51.3	177.6	-176.8	0	0	0	0	109.4	A254 R257 I258 D288 E290 P291 T295 K296 V297	A254-V293 HydrophobicContact CB-CG2 3.91Å; R257-V293 HydrophobicContact CB-CG1 4.18Å; R257-V293 HydrophobicContact CB-CG2 4.31Å; I258-V293 HydrophobicContact CD1-CG2 4.42Å; I258-V293 HydrophobicContact CG1-CB 4.38Å; I258-V293 HydrophobicContact CG1-CG1 4.45Å; I258-V293 HydrophobicContact CG1-CG2 4.05Å; D288-V293 HydrophobicContact CB-CB 3.91Å; D288-V293 HydrophobicContact CB-CG1 3.94Å; E290-V293 HydrophobicContact CB-CG2 3.85Å; E290-V293 HydrophobicContact CG-CG2 3.91Å; E290-V293 PolarHBondContact O-N 3.4Å; E290-V293 VanDerWaalsContact O-N 3.09Å; P291-V293 VanDerWaalsContact C-N 3.26Å; P291-V293 PolarHBondContact O-N 3.21Å; V293-T295 PolarHBondContact O-N 3.31Å; V293-K296 PolarHBondContact O-N 3.32Å; V293-V297 HydrophobicContact CG1-CG2 4.45Å; V293-V297 VanDerWaalsContact O-CG2 3.3Å; V293-V297 WeakPolarHBondContact O-CG2 3.47Å; V293-V297 PolarHBondContact O-N 3.41Å
294	A	95.2	Very high	95.1	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.1	-40	-179.4	0	0	0	0	0	112.3	E290 P291 K296 V297 V298 Y335	E290-A294 PolarHBondContact O-N 2.96Å; P291-A294 PolarHBondContact O-N 3.42Å; A294-K296 PolarHBondContact O-N 3.1Å; A294-V297 PolarHBondContact O-N 3Å; A294-V298 WeakPolarHBondContact O-CG2 3.5Å; A294-V298 PolarHBondContact O-N 3.34Å; A294-Y335 HydrophobicContact CB-CD1 3.69Å; A294-Y335 HydrophobicContact CB-CD2 3.49Å; A294-Y335 VanDerWaalsContact CB-CD2 3.49Å; A294-Y335 HydrophobicContact CB-CE1 3.81Å; A294-Y335 HydrophobicContact CB-CE2 3.64Å; A294-Y335 HydrophobicContact CB-CG 3.56Å
295	T	93.6	Very high	94.9	Very high	25 Å²	25	30.3 Å²	30.3	15%	0.153	16%	0.156	C	C	.	.	H	α-helix	trans	-60.7	-43.1	174.3	-51.5	0	0	0	0	112.4	P291 V293 V298 G299 Y335 A775 F778	P291-T295 PolarHBondContact O-N 2.75Å; P291-T295 PolarHBondContact O-OG1 2.97Å; V293-T295 PolarHBondContact O-N 3.31Å; T295-V298 PolarHBondContact O-N 3.41Å; T295-G299 PolarHBondContact O-N 3.03Å; T295-Y335 WeakPolarHBondContact OG1-CE1 3.37Å; T295-A775 HydrophobicContact CG2-CB 4.15Å; T295-F778 HydrophobicContact CG2-CB 4.04Å; T295-F778 HydrophobicContact CG2-CD1 4.44Å; T295-F778 HydrophobicContact CG2-CD2 4.47Å; T295-F778 HydrophobicContact CG2-CG 4.1Å
296	K	96.2	Very high	94.8	Very high	75 Å²	75	36.8 Å²	36.8	33%	0.326	19%	0.187	S	C	.	.	H	α-helix	trans	-66.7	-36.8	175.9	-78.9	-69.4	-174.9	-179.5	0	112.1	I258 R292 V293 A294 G299 Y300	I258-K296 HydrophobicContact CG2-CB 4.41Å; I258-K296 HydrophobicContact CG2-CG 4.3Å; R292-K296 PolarHBondContact O-N 3.09Å; V293-K296 PolarHBondContact O-N 3.32Å; A294-K296 PolarHBondContact O-N 3.1Å; K296-G299 PolarHBondContact O-N 2.98Å; K296-Y300 HydrophobicContact CB-CE2 4.07Å; K296-Y300 VanDerWaalsContact O-CD2 3.29Å; K296-Y300 WeakPolarHBondContact O-CD2 3.48Å; K296-Y300 PolarHBondContact O-N 3.02Å
297	V	97.2	Very high	94.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.9	-38.9	175.2	172.9	0	0	0	0	112	C261 L282 K285 L286 V293 A294 Y300 L301	C261-V297 HydrophobicContact CB-CG2 4.03Å; L282-V297 VanDerWaalsContact O-CG1 3.22Å; L282-V297 WeakPolarHBondContact O-CG1 3.31Å; K285-V297 HydrophobicContact CB-CG1 4.23Å; K285-V297 HydrophobicContact CB-CG2 3.73Å; L286-V297 HydrophobicContact CD2-CB 4.2Å; L286-V297 HydrophobicContact CD2-CG1 3.68Å; L286-V297 HydrophobicContact CG-CG1 3.95Å; V293-V297 HydrophobicContact CG1-CG2 4.45Å; V293-V297 VanDerWaalsContact O-CG2 3.3Å; V293-V297 WeakPolarHBondContact O-CG2 3.47Å; V293-V297 PolarHBondContact O-N 3.41Å; A294-V297 PolarHBondContact O-N 3Å; V297-Y300 PolarHBondContact O-N 3.09Å; V297-L301 HydrophobicContact CG1-CD1 4.22Å; V297-L301 HydrophobicContact CG1-CG 4.48Å; V297-L301 WeakPolarHBondContact O-CG 3.5Å; V297-L301 PolarHBondContact O-N 2.84Å
298	V	96.1	Very high	94.7	Very high	4 Å²	4	42 Å²	42	2%	0.024	20%	0.204	C	C	.	.	H	α-helix	trans	-56.5	-50.6	171.6	171.5	0	0	0	0	110.5	L286 A294 T295 Y300 L301 E302 Y335 F339	L286-V298 HydrophobicContact CD2-CB 4.48Å; L286-V298 HydrophobicContact CD2-CG2 3.48Å; L286-V298 VanDerWaalsContact CD2-CG2 3.48Å; A294-V298 WeakPolarHBondContact O-CG2 3.5Å; A294-V298 PolarHBondContact O-N 3.34Å; T295-V298 PolarHBondContact O-N 3.41Å; V298-Y300 VanDerWaalsContact C-N 3.32Å; V298-Y300 PolarHBondContact O-N 3.21Å; V298-L301 PolarHBondContact O-N 3.09Å; V298-E302 WeakPolarHBondContact CG1-OE1 3.41Å; V298-E302 WeakPolarHBondContact O-CG 3.41Å; V298-E302 PolarHBondContact O-N 3.03Å; V298-Y335 HydrophobicContact CG2-CD1 4.21Å; V298-F339 HydrophobicContact CG1-CB 4.19Å; V298-F339 HydrophobicContact CG2-CB 4.35Å
299	G	95.2	Very high	94.6	Very high	6 Å²	6	45 Å²	45	6%	0.062	22%	0.224	C	C	.	.	H	α-helix	trans	-62.3	-33.9	177	0	0	0	0	0	114.2	T295 K296 E302 L303 F772	T295-G299 PolarHBondContact O-N 3.03Å; K296-G299 PolarHBondContact O-N 2.98Å; G299-E302 PolarHBondContact O-N 3.05Å; G299-L303 WeakPolarHBondContact O-CB 3.3Å; G299-L303 PolarHBondContact O-N 2.77Å; G299-F772 WeakPolarHBondContact O-CZ 3Å
300	Y	97.2	Very high	94.6	Very high	25 Å²	25	44.6 Å²	44.6	10%	0.098	23%	0.232	C	C	.	.	H	α-helix	trans	-69.2	-37.4	174	-61.4	-31	0	0	0	112.7	I258 C261 R262 A265 K296 V297 V298 L303 V304	I258-Y300 WeakPolarHBondContact CG2-OH 3.29Å; C261-Y300 HydrophobicContact CB-CD2 4.06Å; C261-Y300 HydrophobicContact CB-CE2 3.98Å; R262-Y300 HydrophobicContact CB-CE1 4.4Å; R262-Y300 HydrophobicContact CB-CE2 4.1Å; R262-Y300 HydrophobicContact CG-CE1 4.34Å; A265-Y300 HydrophobicContact CB-CG 4.18Å; K296-Y300 HydrophobicContact CB-CE2 4.07Å; K296-Y300 VanDerWaalsContact O-CD2 3.29Å; K296-Y300 WeakPolarHBondContact O-CD2 3.48Å; K296-Y300 PolarHBondContact O-N 3.02Å; V297-Y300 PolarHBondContact O-N 3.09Å; V298-Y300 VanDerWaalsContact C-N 3.32Å; V298-Y300 PolarHBondContact O-N 3.21Å; Y300-L303 PolarHBondContact O-N 2.75Å; Y300-V304 WeakPolarHBondContact O-CG2 3.37Å; Y300-V304 PolarHBondContact O-N 2.89Å
301	L	97.4	Very high	94.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-71.1	-34.4	174.6	-67.6	172.1	0	0	0	111.9	L279 L282 V283 L286 V297 V298 L303 V304 D305 F339	L279-L301 HydrophobicContact CD1-CD2 3.85Å; L282-L301 HydrophobicContact CB-CD2 4.06Å; L282-L301 HydrophobicContact CD1-CD2 4.47Å; V283-L301 HydrophobicContact CG2-CD1 4.19Å; V283-L301 HydrophobicContact CG2-CD2 4.33Å; L286-L301 HydrophobicContact CD1-CD1 3.86Å; L286-L301 HydrophobicContact CD2-CD1 4.15Å; L286-L301 HydrophobicContact CG-CD1 4.18Å; V297-L301 HydrophobicContact CG1-CD1 4.22Å; V297-L301 HydrophobicContact CG1-CG 4.48Å; V297-L301 WeakPolarHBondContact O-CG 3.5Å; V297-L301 PolarHBondContact O-N 2.84Å; V298-L301 PolarHBondContact O-N 3.09Å; L301-L303 VanDerWaalsContact C-N 3.32Å; L301-V304 PolarHBondContact O-N 3.24Å; L301-D305 PolarHBondContact O-N 2.95Å; L301-F339 HydrophobicContact CB-CD2 3.7Å; L301-F339 HydrophobicContact CB-CE1 4.37Å; L301-F339 HydrophobicContact CB-CE2 3.42Å; L301-F339 VanDerWaalsContact CB-CE2 3.42Å; L301-F339 HydrophobicContact CB-CG 4.32Å; L301-F339 HydrophobicContact CB-CZ 3.78Å; L301-F339 HydrophobicContact CD1-CD1 4.21Å; L301-F339 HydrophobicContact CD1-CE1 4.34Å; L301-F339 HydrophobicContact CD1-CG 4.3Å
302	E	95	Very high	94.7	Very high	35 Å²	35	42.3 Å²	42.3	16%	0.164	22%	0.219	C	C	.	.	H	α-helix	trans	-62.6	-37.9	169.4	-71.6	169.9	-165	0	0	111.7	V298 G299 D305 H306 F339 H342	V298-E302 WeakPolarHBondContact CG1-OE1 3.41Å; V298-E302 WeakPolarHBondContact O-CG 3.41Å; V298-E302 PolarHBondContact O-N 3.03Å; G299-E302 PolarHBondContact O-N 3.05Å; E302-D305 PolarHBondContact O-N 3.35Å; E302-H306 PolarHBondContact O-N 3.46Å; E302-F339 HydrophobicContact CG-CD2 4.22Å; E302-F339 HydrophobicContact CG-CE2 4.49Å; E302-H342 HydrophobicContact CG-CB 4.36Å; E302-H342 VanDerWaalsContact OE1-CB 3.31Å; E302-H342 WeakPolarHBondContact OE1-CB 3.22Å; E302-H342 IonicContact OE1-CE1 3.17Å; E302-H342 IonicContact OE1-CG 2.69Å; E302-H342 IonicContact OE1-ND1 3.71Å; E302-H342 PolarHBondContact OE1-ND1 2.71Å
303	L	94.7	Very high	94.7	Very high	26 Å²	26	35.1 Å²	35.1	14%	0.136	20%	0.199	C	C	.	.	H	α-helix	trans	-68.7	-37.1	174.3	-177.2	66	0	0	0	112.6	I269 G299 Y300 L301 H306 N307 Y768	I269-L303 HydrophobicContact CD1-CB 4.42Å; I269-L303 HydrophobicContact CD1-CD2 3.67Å; I269-L303 HydrophobicContact CD1-CG 3.68Å; G299-L303 WeakPolarHBondContact O-CB 3.3Å; G299-L303 PolarHBondContact O-N 2.77Å; Y300-L303 PolarHBondContact O-N 2.75Å; L301-L303 VanDerWaalsContact C-N 3.32Å; L303-H306 PolarHBondContact O-N 3.23Å; L303-N307 WeakPolarHBondContact CD1-ND2 3.33Å; L303-N307 PolarHBondContact O-N 3.28Å; L303-N307 VanDerWaalsContact O-N 3.13Å; L303-N307 PolarHBondContact O-ND2 3.33Å; L303-Y768 HydrophobicContact CD1-CD1 4.32Å; L303-Y768 HydrophobicContact CD1-CE1 3.79Å; L303-Y768 HydrophobicContact CD2-CD1 3.7Å; L303-Y768 HydrophobicContact CD2-CE1 3.48Å; L303-Y768 VanDerWaalsContact CD2-CE1 3.48Å; L303-Y768 HydrophobicContact CG-CE1 4.27Å
304	V	95.5	Very high	94.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-45.4	172.5	173.2	0	0	0	0	110.5	L268 I269 Y300 L301 H306 N307 H308 M311 L315	L268-V304 HydrophobicContact CD2-CG1 4Å; L268-V304 HydrophobicContact CD2-CG2 3.91Å; L268-V304 HydrophobicContact CG-CG1 4.2Å; L268-V304 HydrophobicContact CG-CG2 4.27Å; I269-V304 HydrophobicContact CD1-CG2 4.22Å; I269-V304 HydrophobicContact CG1-CB 4.49Å; I269-V304 HydrophobicContact CG1-CG2 3.84Å; Y300-V304 WeakPolarHBondContact O-CG2 3.37Å; Y300-V304 PolarHBondContact O-N 2.89Å; L301-V304 PolarHBondContact O-N 3.24Å; V304-H306 VanDerWaalsContact C-N 3.34Å; V304-H306 PolarHBondContact O-N 2.97Å; V304-N307 PolarHBondContact O-N 3.48Å; V304-H308 PolarHBondContact O-N 2.98Å; V304-M311 HydrophobicContact CG1-SD 3.69Å; V304-L315 HydrophobicContact CG1-CD2 4.1Å
305	D	93.4	Very high	94.8	Very high	8 Å²	8	40.9 Å²	40.9	4%	0.043	23%	0.226	C	C	.	.	H	α-helix	trans	-59	-43	174.8	179	72.7	0	0	0	112.7	L301 E302 N307 H308 P309 K312 L315 L343 P344	L301-D305 PolarHBondContact O-N 2.95Å; E302-D305 PolarHBondContact O-N 3.35Å; D305-N307 PolarHBondContact O-N 3.49Å; D305-H308 CarbonylContact O-C 3.51Å; D305-H308 VanDerWaalsContact O-C 3.31Å; D305-H308 PolarHBondContact O-N 3.49Å; D305-P309 WeakPolarHBondContact O-CA 3.16Å; D305-P309 WeakPolarHBondContact O-CD 3.23Å; D305-P309 VanDerWaalsContact O-N 3.15Å; D305-K312 WeakPolarHBondContact OD1-CE 3.24Å; D305-K312 WeakPolarHBondContact OD1-CG 3.39Å; D305-L315 HydrophobicContact CB-CD1 3.85Å; D305-L343 HydrophobicContact CB-CD2 3.95Å; D305-P344 WeakPolarHBondContact OD2-CD 3.41Å; D305-P344 WeakPolarHBondContact OD2-CG 3.41Å
306	H	93.7	Very high	95	Very high	143 Å²	143	39.9 Å²	39.9	66%	0.662	22%	0.22	S	C	*	.	H	α-helix	trans	-62.6	-41.5	-179.4	-174.6	67.5	0	0	0	112.7	E302 L303 V304	E302-H306 PolarHBondContact O-N 3.46Å; L303-H306 PolarHBondContact O-N 3.23Å; V304-H306 VanDerWaalsContact C-N 3.34Å; V304-H306 PolarHBondContact O-N 2.97Å
307	N	94.9	Very high	95	Very high	71 Å²	71	37.5 Å²	37.5	38%	0.38	21%	0.213	S	C	.	.	H	α-helix	trans	-78.8	-33.9	178.4	-73.4	-89.2	0	0	0	112.4	I269 L303 V304 D305	I269-N307 HydrophobicContact CG2-CB 3.85Å; L303-N307 WeakPolarHBondContact CD1-ND2 3.33Å; L303-N307 PolarHBondContact O-N 3.28Å; L303-N307 VanDerWaalsContact O-N 3.13Å; L303-N307 PolarHBondContact O-ND2 3.33Å; V304-N307 PolarHBondContact O-N 3.48Å; D305-N307 PolarHBondContact O-N 3.49Å
308	H	93.7	Very high	95	Very high	71 Å²	71	38.4 Å²	38.4	33%	0.329	22%	0.217	S	C	.	.			trans	-127.5	70.9	-177	-63.4	-67.9	0	0	0	113.1	I269 V304 D305 A310 M311	I269-H308 PolarHBondContact O-NE2 3.18Å; V304-H308 PolarHBondContact O-N 2.98Å; D305-H308 CarbonylContact O-C 3.51Å; D305-H308 VanDerWaalsContact O-C 3.31Å; D305-H308 PolarHBondContact O-N 3.49Å; H308-A310 PolarHBondContact O-N 2.93Å; H308-M311 HydrophobicContact CB-CB 4.08Å; H308-M311 HydrophobicContact CB-CE 4.36Å; H308-M311 VanDerWaalsContact O-CB 3.31Å; H308-M311 WeakPolarHBondContact O-CB 3.07Å; H308-M311 PolarHBondContact O-N 3.24Å
309	P	92.5	Very high	95.1	Very high	75 Å²	75	38.2 Å²	38.2	49%	0.487	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-59.8	-20.2	-179.6	-25.7	34.9	0	0	0	114.6	D305 M311 K312	D305-P309 WeakPolarHBondContact O-CA 3.16Å; D305-P309 WeakPolarHBondContact O-CD 3.23Å; D305-P309 VanDerWaalsContact O-N 3.15Å; P309-M311 VanDerWaalsContact C-N 3.28Å; P309-K312 WeakPolarHBondContact O-CD 2.91Å; P309-K312 VanDerWaalsContact O-CG 3.28Å; P309-K312 WeakPolarHBondContact O-CG 2.93Å
310	A	91.7	Very high	95.1	Very high	105 Å²	105	40.1 Å²	40.1	87%	0.868	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-70	-23.3	173.9	0	0	0	0	0	113	H308 K312	H308-A310 PolarHBondContact O-N 2.93Å; A310-K312 VanDerWaalsContact C-N 3.27Å; A310-K312 PolarHBondContact O-N 3.37Å
311	M	92	Very high	95.1	Very high	26 Å²	26	44.2 Å²	44.2	13%	0.128	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-77.2	-9.4	-178.5	-161.7	-178.8	-72	0	0	113	L268 E275 V304 H308 P309 G313 E314 L315	L268-M311 HydrophobicContact CD1-CE 4.05Å; L268-M311 HydrophobicContact CD1-SD 4.29Å; E275-M311 HydrophobicContact CG-CE 4.46Å; V304-M311 HydrophobicContact CG1-SD 3.69Å; H308-M311 HydrophobicContact CB-CB 4.08Å; H308-M311 HydrophobicContact CB-CE 4.36Å; H308-M311 VanDerWaalsContact O-CB 3.31Å; H308-M311 WeakPolarHBondContact O-CB 3.07Å; H308-M311 PolarHBondContact O-N 3.24Å; P309-M311 VanDerWaalsContact C-N 3.28Å; M311-G313 PolarHBondContact O-N 3.07Å; M311-E314 HydrophobicContact CG-CB 4.27Å; M311-E314 PolarHBondContact O-N 2.95Å; M311-L315 HydrophobicContact CB-CG 4.45Å; M311-L315 HydrophobicContact CG-CD2 4.36Å; M311-L315 HydrophobicContact CG-CG 4.17Å; M311-L315 PolarHBondContact O-N 2.92Å; M311-L315 HydrophobicContact SD-CD2 4.13Å
312	K	93.8	Very high	95	Very high	20 Å²	20	44.4 Å²	44.4	9%	0.087	24%	0.242	C	C	.	.	H	α-helix	trans	-44.6	-42.2	-178.8	-78.8	176.2	-174.3	-174.8	0	114.7	D305 P309 A310 E314 L315 I316 P344 D349 L352	D305-K312 WeakPolarHBondContact OD1-CE 3.24Å; D305-K312 WeakPolarHBondContact OD1-CG 3.39Å; P309-K312 WeakPolarHBondContact O-CD 2.91Å; P309-K312 VanDerWaalsContact O-CG 3.28Å; P309-K312 WeakPolarHBondContact O-CG 2.93Å; A310-K312 VanDerWaalsContact C-N 3.27Å; A310-K312 PolarHBondContact O-N 3.37Å; K312-E314 VanDerWaalsContact C-N 3.34Å; K312-E314 PolarHBondContact O-N 2.91Å; K312-L315 PolarHBondContact O-N 3.28Å; K312-I316 WeakPolarHBondContact O-CB 3.2Å; K312-I316 WeakPolarHBondContact O-CD1 3.44Å; K312-I316 VanDerWaalsContact O-CG1 3.24Å; K312-I316 WeakPolarHBondContact O-CG1 3.43Å; K312-I316 PolarHBondContact O-N 3.47Å; K312-P344 PolarHBondContact NZ-O 3.02Å; K312-D349 IonicContact NZ-OD2 2.66Å; K312-L352 HydrophobicContact CB-CD1 3.76Å; K312-L352 HydrophobicContact CD-CD1 4.45Å
313	G	94.9	Very high	95	Very high	23 Å²	23	42.8 Å²	42.8	24%	0.237	24%	0.235	C	C	.	.	H	α-helix	trans	-60.4	-41.7	178.5	0	0	0	0	0	113	M311 S317	M311-G313 PolarHBondContact O-N 3.07Å; G313-S317 VanDerWaalsContact O-CB 3.31Å; G313-S317 WeakPolarHBondContact O-CB 3.48Å; G313-S317 PolarHBondContact O-N 2.9Å; G313-S317 VanDerWaalsContact O-N 3.1Å; G313-S317 PolarHBondContact O-OG 3.38Å
314	E	95.7	Very high	94.9	Very high	121 Å²	121	45.4 Å²	45.4	57%	0.565	24%	0.243	S	C	*	.	H	α-helix	trans	-75.9	-41.2	178.1	-58.7	-51.4	145.2	0	0	111.7	L279 M311 K312 I316 S317 E318	L279-E314 HydrophobicContact CD2-CB 4.21Å; M311-E314 HydrophobicContact CG-CB 4.27Å; M311-E314 PolarHBondContact O-N 2.95Å; K312-E314 VanDerWaalsContact C-N 3.34Å; K312-E314 PolarHBondContact O-N 2.91Å; E314-I316 VanDerWaalsContact C-N 3.31Å; E314-I316 PolarHBondContact O-N 3.44Å; E314-S317 PolarHBondContact O-N 3.43Å; E314-S317 VanDerWaalsContact O-N 3.1Å; E314-E318 PolarHBondContact O-N 3.34Å
315	L	97	Very high	94.8	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-54.9	-46.2	174.6	-64.6	179.8	0	0	0	111.6	L279 V304 D305 M311 K312 T319 F339	L279-L315 HydrophobicContact CD1-CD2 3.42Å; L279-L315 VanDerWaalsContact CD1-CD2 3.42Å; L279-L315 HydrophobicContact CD2-CD2 4.05Å; L279-L315 HydrophobicContact CG-CD2 4.4Å; V304-L315 HydrophobicContact CG1-CD2 4.1Å; D305-L315 HydrophobicContact CB-CD1 3.85Å; M311-L315 HydrophobicContact CB-CG 4.45Å; M311-L315 HydrophobicContact CG-CD2 4.36Å; M311-L315 HydrophobicContact CG-CG 4.17Å; M311-L315 PolarHBondContact O-N 2.92Å; M311-L315 HydrophobicContact SD-CD2 4.13Å; K312-L315 PolarHBondContact O-N 3.28Å; L315-T319 WeakPolarHBondContact O-CB 3.35Å; L315-T319 PolarHBondContact O-N 2.94Å; L315-T319 PolarHBondContact O-OG1 2.97Å; L315-F339 HydrophobicContact CB-CE1 4.21Å; L315-F339 HydrophobicContact CB-CZ 4Å; L315-F339 HydrophobicContact CD1-CZ 4.19Å; L315-F339 HydrophobicContact CG-CZ 4.48Å
316	I	97.2	Very high	94.6	Very high	3 Å²	3	58.8 Å²	58.8	2%	0.015	30%	0.301	C	S	.	.	H	α-helix	trans	-66.4	-43	176.7	-66.5	165.3	0	0	0	110.7	K312 E314 T319 E320 L340 L343 L352 K355 L356 I359	K312-I316 WeakPolarHBondContact O-CB 3.2Å; K312-I316 WeakPolarHBondContact O-CD1 3.44Å; K312-I316 VanDerWaalsContact O-CG1 3.24Å; K312-I316 WeakPolarHBondContact O-CG1 3.43Å; K312-I316 PolarHBondContact O-N 3.47Å; E314-I316 VanDerWaalsContact C-N 3.31Å; E314-I316 PolarHBondContact O-N 3.44Å; I316-T319 PolarHBondContact O-N 2.95Å; I316-E320 VanDerWaalsContact O-CB 3.29Å; I316-E320 WeakPolarHBondContact O-CB 3.45Å; I316-E320 PolarHBondContact O-N 3.47Å; I316-L340 HydrophobicContact CB-CD2 4.44Å; I316-L340 HydrophobicContact CG1-CD2 4.1Å; I316-L343 HydrophobicContact CD1-CD1 4.12Å; I316-L343 HydrophobicContact CG1-CD1 3.56Å; I316-L352 HydrophobicContact CD1-CB 4.15Å; I316-L352 HydrophobicContact CD1-CD2 4.27Å; I316-K355 HydrophobicContact CG2-CD 4.05Å; I316-K355 HydrophobicContact CG2-CG 4.21Å; I316-L356 HydrophobicContact CD1-CD1 4.11Å; I316-L356 HydrophobicContact CD1-CD2 4.16Å; I316-L356 HydrophobicContact CD1-CG 4.01Å; I316-L356 HydrophobicContact CG1-CD2 4.09Å; I316-L356 HydrophobicContact CG1-CG 4.49Å; I316-L356 HydrophobicContact CG2-CD2 4Å; I316-L356 HydrophobicContact CG2-CG 4.43Å; I316-I359 HydrophobicContact CG2-CD1 3.92Å
317	S	96.9	Very high	94.2	Very high	26 Å²	26	60 Å²	60	18%	0.182	31%	0.312	C	S	.	.	H	α-helix	trans	-69.8	-38.4	-176	-59	0	0	0	0	113.4	G313 E314 K321 K355	G313-S317 VanDerWaalsContact O-CB 3.31Å; G313-S317 WeakPolarHBondContact O-CB 3.48Å; G313-S317 PolarHBondContact O-N 2.9Å; G313-S317 VanDerWaalsContact O-N 3.1Å; G313-S317 PolarHBondContact O-OG 3.38Å; E314-S317 PolarHBondContact O-N 3.43Å; E314-S317 VanDerWaalsContact O-N 3.1Å; S317-K321 WeakPolarHBondContact O-CG 3.27Å; S317-K321 PolarHBondContact O-N 3.03Å; S317-K355 PolarHBondContact OG-NZ 3.29Å
318	E	97.4	Very high	94	Very high	19 Å²	19	58.6 Å²	58.6	9%	0.089	30%	0.304	C	S	.	.	H	α-helix	trans	-72.3	-37.4	175.8	-166	61.5	-160.3	0	0	111.3	L279 S280 V283 E314 K321 L322	L279-E318 HydrophobicContact CD2-CB 4.17Å; L279-E318 HydrophobicContact CG-CB 4.23Å; L279-E318 HydrophobicContact CG-CG 4.24Å; S280-E318 WeakPolarHBondContact CB-OE1 3.47Å; S280-E318 PolarHBondContact OG-OE1 2.98Å; V283-E318 HydrophobicContact CB-CG 4.08Å; V283-E318 HydrophobicContact CG1-CG 4.21Å; V283-E318 HydrophobicContact CG2-CB 4.28Å; V283-E318 HydrophobicContact CG2-CG 4.03Å; E314-E318 PolarHBondContact O-N 3.34Å; E318-K321 WeakPolarHBondContact O-CB 3.5Å; E318-K321 PolarHBondContact O-N 2.94Å; E318-K321 WeakPolarHBondContact OE2-CD 3.32Å; E318-K321 WeakPolarHBondContact OE2-CE 3.09Å; E318-K321 IonicContact OE2-NZ 3.54Å; E318-K321 PolarHBondContact OE2-NZ 3.31Å; E318-L322 PolarHBondContact O-N 3.29Å
319	T	97.7	Very high	93.8	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-66.8	-37	175.4	-53.9	0	0	0	0	112.1	L315 I316 L322 I323 A336 F339 L340	L315-T319 WeakPolarHBondContact O-CB 3.35Å; L315-T319 PolarHBondContact O-N 2.94Å; L315-T319 PolarHBondContact O-OG1 2.97Å; I316-T319 PolarHBondContact O-N 2.95Å; T319-L322 WeakPolarHBondContact O-CB 3.5Å; T319-L322 PolarHBondContact O-N 3.18Å; T319-I323 HydrophobicContact CG2-CD1 4.14Å; T319-I323 WeakPolarHBondContact O-CG1 3.28Å; T319-I323 PolarHBondContact O-N 3.19Å; T319-A336 HydrophobicContact CG2-CB 3.72Å; T319-F339 HydrophobicContact CG2-CD1 4.21Å; T319-L340 HydrophobicContact CG2-CD1 4.03Å; T319-L340 HydrophobicContact CG2-CD2 3.95Å; T319-L340 HydrophobicContact CG2-CG 3.83Å
320	E	95.9	Very high	93.5	Very high	46 Å²	46	56.3 Å²	56.3	22%	0.215	30%	0.298	C	S	.	.	H	α-helix	trans	-59	-44.3	172.3	178.4	-179	-123	0	0	112.1	I316 L322 I323 Y324 K355 I359	I316-E320 VanDerWaalsContact O-CB 3.29Å; I316-E320 WeakPolarHBondContact O-CB 3.45Å; I316-E320 PolarHBondContact O-N 3.47Å; E320-L322 VanDerWaalsContact C-N 3.26Å; E320-L322 PolarHBondContact O-N 2.8Å; E320-I323 PolarHBondContact O-N 2.83Å; E320-Y324 HydrophobicContact CG-CD2 4Å; E320-Y324 HydrophobicContact CG-CE2 4.03Å; E320-Y324 WeakPolarHBondContact O-CD2 3.23Å; E320-Y324 PolarHBondContact O-N 3.31Å; E320-K355 VanDerWaalsContact OE1-CE 3.25Å; E320-K355 WeakPolarHBondContact OE1-CE 3.41Å; E320-K355 IonicContact OE1-NZ 2.59Å; E320-K355 WeakPolarHBondContact OE2-CE 3.3Å; E320-K355 IonicContact OE2-NZ 2.71Å; E320-K355 PolarHBondContact OE2-NZ 3.39Å; E320-I359 HydrophobicContact CB-CD1 3.87Å; E320-I359 HydrophobicContact CB-CG1 4.49Å; E320-I359 HydrophobicContact CG-CD1 3.96Å; E320-I359 HydrophobicContact CG-CG1 4.07Å; E320-I359 WeakPolarHBondContact OE1-CG1 3.26Å
321	K	96.1	Very high	93.3	Very high	110 Å²	110	57.2 Å²	57.2	48%	0.478	28%	0.279	S	S	.	.	H	α-helix	trans	-59.7	-34.5	174.9	-65.3	170.9	-158.4	166.9	0	112.4	S317 E318 R325	S317-K321 WeakPolarHBondContact O-CG 3.27Å; S317-K321 PolarHBondContact O-N 3.03Å; E318-K321 WeakPolarHBondContact O-CB 3.5Å; E318-K321 PolarHBondContact O-N 2.94Å; E318-K321 WeakPolarHBondContact OE2-CD 3.32Å; E318-K321 WeakPolarHBondContact OE2-CE 3.09Å; E318-K321 IonicContact OE2-NZ 3.54Å; E318-K321 PolarHBondContact OE2-NZ 3.31Å; K321-R325 PolarHBondContact O-N 3.39Å
322	L	95.8	Very high	93.3	Very high	5 Å²	5	56 Å²	56	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-70.3	-47	175.4	-176.9	73.7	0	0	0	111.5	V283 L286 E318 T319 E320 Y324 R325 I328 A336	V283-L322 HydrophobicContact CG1-CB 3.89Å; V283-L322 HydrophobicContact CG1-CD2 3.94Å; V283-L322 HydrophobicContact CG1-CG 4.44Å; V283-L322 WeakPolarHBondContact O-CD2 3.38Å; L286-L322 HydrophobicContact CB-CD2 3.94Å; L286-L322 HydrophobicContact CD1-CD2 4.2Å; E318-L322 PolarHBondContact O-N 3.29Å; T319-L322 WeakPolarHBondContact O-CB 3.5Å; T319-L322 PolarHBondContact O-N 3.18Å; E320-L322 VanDerWaalsContact C-N 3.26Å; E320-L322 PolarHBondContact O-N 2.8Å; L322-Y324 VanDerWaalsContact C-N 3.29Å; L322-Y324 PolarHBondContact O-N 3.4Å; L322-R325 WeakPolarHBondContact O-CB 3.34Å; L322-R325 PolarHBondContact O-N 2.91Å; L322-I328 HydrophobicContact CD1-CD1 3.99Å; L322-I328 HydrophobicContact CG-CD1 4.34Å; L322-A336 HydrophobicContact CD2-CB 4.31Å
323	I	94.4	Very high	93.2	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-57.3	-40.1	-176.8	-78.2	171.6	0	0	0	112.3	T319 E320 Q333 A336 L340 I359 L363	T319-I323 HydrophobicContact CG2-CD1 4.14Å; T319-I323 WeakPolarHBondContact O-CG1 3.28Å; T319-I323 PolarHBondContact O-N 3.19Å; E320-I323 PolarHBondContact O-N 2.83Å; I323-Q333 PolarHBondContact O-NE2 3.46Å; I323-A336 HydrophobicContact CD1-CB 3.96Å; I323-A336 HydrophobicContact CG1-CB 3.64Å; I323-L340 HydrophobicContact CD1-CD1 3.57Å; I323-I359 HydrophobicContact CD1-CG2 4.04Å; I323-I359 HydrophobicContact CG2-CG2 4.43Å; I323-L363 HydrophobicContact CG2-CD1 3.75Å; I323-L363 HydrophobicContact CG2-CD2 3.76Å; I323-L363 HydrophobicContact CG2-CG 4.07Å
324	Y	92.6	Very high	93.1	Very high	82 Å²	82	56.3 Å²	56.3	32%	0.322	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	9.1	-178.8	-63.5	-56.3	0	0	0	114.7	E320 L322 Q326 I359 E362 L363	E320-Y324 HydrophobicContact CG-CD2 4Å; E320-Y324 HydrophobicContact CG-CE2 4.03Å; E320-Y324 WeakPolarHBondContact O-CD2 3.23Å; E320-Y324 PolarHBondContact O-N 3.31Å; L322-Y324 VanDerWaalsContact C-N 3.29Å; L322-Y324 PolarHBondContact O-N 3.4Å; Y324-Q326 PolarHBondContact O-N 3.44Å; Y324-I359 PolarHBondContact OH-O 3.31Å; Y324-E362 WeakPolarHBondContact OH-CB 3.39Å; Y324-E362 PolarHBondContact OH-OE2 3.4Å; Y324-L363 HydrophobicContact CE1-CD2 4.04Å; Y324-L363 HydrophobicContact CE1-CG 4.3Å
325	R	93.2	Very high	93	Very high	117 Å²	117	50.6 Å²	50.6	44%	0.442	24%	0.241	S	C	.	.	S	Bend	trans	-63.6	135	175.3	-172	177.2	-69.3	166.6	2.5	110.1	N284 K321 L322 N327 I328	N284-R325 VanDerWaalsContact OD1-CZ 3.27Å; N284-R325 PolarHBondContact OD1-NH1 2.78Å; N284-R325 PolarHBondContact OD1-NH2 3.09Å; K321-R325 PolarHBondContact O-N 3.39Å; L322-R325 WeakPolarHBondContact O-CB 3.34Å; L322-R325 PolarHBondContact O-N 2.91Å; R325-N327 PolarHBondContact O-N 2.67Å; R325-I328 HydrophobicContact CB-CB 4.42Å; R325-I328 VanDerWaalsContact O-CB 3.3Å; R325-I328 WeakPolarHBondContact O-CB 3.1Å; R325-I328 VanDerWaalsContact O-CG2 3.23Å; R325-I328 WeakPolarHBondContact O-CG2 3.03Å; R325-I328 PolarHBondContact O-N 3.37Å
326	Q	89	Confident	93	Very high	172 Å²	172	50.6 Å²	50.6	80%	0.804	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	138.2	175.7	-63.8	-178.1	5.4	0	0	110.9	Y324 I328	Y324-Q326 PolarHBondContact O-N 3.44Å; Q326-I328 PolarHBondContact O-N 3.13Å
327	N	86.8	Confident	92.8	Very high	169 Å²	169	50.5 Å²	50.5	90%	0.904	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.1	24.1	-178.8	-51.7	-46.6	0	0	0	115.1	R325	R325-N327 PolarHBondContact O-N 2.67Å
328	I	90.8	Very high	92.6	Very high	41 Å²	41	49.4 Å²	49.4	21%	0.21	23%	0.233	C	C	.	.			trans	-64	145.2	169.9	-166	62	0	0	0	110.8	L322 R325 Q326 A332 Q333	L322-I328 HydrophobicContact CD1-CD1 3.99Å; L322-I328 HydrophobicContact CG-CD1 4.34Å; R325-I328 HydrophobicContact CB-CB 4.42Å; R325-I328 VanDerWaalsContact O-CB 3.3Å; R325-I328 WeakPolarHBondContact O-CB 3.1Å; R325-I328 VanDerWaalsContact O-CG2 3.23Å; R325-I328 WeakPolarHBondContact O-CG2 3.03Å; R325-I328 PolarHBondContact O-N 3.37Å; Q326-I328 PolarHBondContact O-N 3.13Å; I328-A332 HydrophobicContact CD1-CB 3.56Å; I328-A332 HydrophobicContact CG1-CB 3.83Å; I328-Q333 HydrophobicContact CG1-CG 4.3Å; I328-Q333 HydrophobicContact CG2-CG 3.83Å
329	S	88.5	Confident	92.5	Very high	60 Å²	60	48.5 Å²	48.5	42%	0.42	23%	0.229	S	C	.	.			trans	-79.8	147.7	178.1	71.3	0	0	0	0	112.1	R331 A332 Q333	S329-R331 PolarHBondContact O-N 3.22Å; S329-R331 VanDerWaalsContact O-N 3.1Å; S329-A332 PolarHBondContact O-N 3.03Å; S329-A332 WeakPolarHBondContact OG-CB 3.44Å; S329-A332 PolarHBondContact OG-N 3.02Å; S329-A332 VanDerWaalsContact OG-N 3.13Å; S329-Q333 PolarHBondContact O-N 3.46Å; S329-Q333 VanDerWaalsContact O-N 3.08Å
330	S	86.4	Confident	92.4	Very high	37 Å²	37	48.6 Å²	48.6	26%	0.259	23%	0.23	S	C	.	.	H	α-helix	trans	-51.7	-33.2	171.6	-25.2	0	0	0	0	111.8	F334 E375	S330-F334 WeakPolarHBondContact O-CB 3.36Å; S330-F334 PolarHBondContact O-N 2.99Å; S330-E375 VanDerWaalsContact CB-OE2 3.3Å; S330-E375 WeakPolarHBondContact CB-OE2 3.43Å; S330-E375 PolarHBondContact OG-OE2 2.83Å
331	R	87.2	Confident	92.3	Very high	124 Å²	124	47.1 Å²	47.1	47%	0.468	22%	0.223	S	C	.	.	H	α-helix	trans	-68.1	-44.4	176.3	-179.7	176.9	-67.9	163.5	2	112.5	T289 S329 F334 Y335	T289-R331 PolarHBondContact O-NH1 3.26Å; T289-R331 VanDerWaalsContact O-NH1 3.15Å; S329-R331 PolarHBondContact O-N 3.22Å; S329-R331 VanDerWaalsContact O-N 3.1Å; R331-F334 WeakPolarHBondContact O-CB 3.18Å; R331-F334 PolarHBondContact O-N 2.88Å; R331-Y335 HydrophobicContact CG-CD2 3.93Å; R331-Y335 HydrophobicContact CG-CE2 3.58Å; R331-Y335 WeakPolarHBondContact O-CD2 3.41Å; R331-Y335 PolarHBondContact O-N 3.23Å; R331-Y335 VanDerWaalsContact O-N 3.12Å
332	A	92.1	Very high	92	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.7	-41.9	177.9	0	0	0	0	0	111.3	I328 S329 F334 Y335 A336	I328-A332 HydrophobicContact CD1-CB 3.56Å; I328-A332 HydrophobicContact CG1-CB 3.83Å; S329-A332 PolarHBondContact O-N 3.03Å; S329-A332 WeakPolarHBondContact OG-CB 3.44Å; S329-A332 PolarHBondContact OG-N 3.02Å; S329-A332 VanDerWaalsContact OG-N 3.13Å; A332-F334 VanDerWaalsContact C-N 3.28Å; A332-F334 PolarHBondContact O-N 2.82Å; A332-Y335 PolarHBondContact O-N 2.8Å; A332-A336 WeakPolarHBondContact O-CB 3.37Å; A332-A336 PolarHBondContact O-N 3.02Å
333	Q	92.8	Very high	91.8	Very high	39 Å²	39	45.3 Å²	45.3	18%	0.182	22%	0.216	C	C	.	.	H	α-helix	trans	-59.5	-38.1	171.9	-71.6	-177.2	-23.7	0	0	112.3	I323 I328 S329 A336 L337 L379	I323-Q333 PolarHBondContact O-NE2 3.46Å; I328-Q333 HydrophobicContact CG1-CG 4.3Å; I328-Q333 HydrophobicContact CG2-CG 3.83Å; S329-Q333 PolarHBondContact O-N 3.46Å; S329-Q333 VanDerWaalsContact O-N 3.08Å; Q333-A336 PolarHBondContact O-N 3.28Å; Q333-L337 WeakPolarHBondContact O-CB 3.45Å; Q333-L337 VanDerWaalsContact O-CG 3.3Å; Q333-L337 WeakPolarHBondContact O-CG 3.11Å; Q333-L337 PolarHBondContact O-N 3.16Å; Q333-L379 HydrophobicContact CB-CD2 4.03Å
334	F	91.3	Very high	91.6	Very high	12 Å²	12	47.9 Å²	47.9	5%	0.053	23%	0.233	C	C	.	.	H	α-helix	trans	-62.4	-50.7	176.8	177.2	-97.3	0	0	0	112.4	S330 R331 A332 A336 L337 C338 R378 L379 H382 F778	S330-F334 WeakPolarHBondContact O-CB 3.36Å; S330-F334 PolarHBondContact O-N 2.99Å; R331-F334 WeakPolarHBondContact O-CB 3.18Å; R331-F334 PolarHBondContact O-N 2.88Å; A332-F334 VanDerWaalsContact C-N 3.28Å; A332-F334 PolarHBondContact O-N 2.82Å; F334-A336 PolarHBondContact O-N 2.94Å; F334-L337 PolarHBondContact O-N 3.24Å; F334-C338 PolarHBondContact O-N 2.85Å; F334-C338 PolarHBondContact O-SG 3.23Å; F334-R378 HydrophobicContact CD2-CB 4.1Å; F334-R378 HydrophobicContact CE2-CB 4.05Å; F334-L379 HydrophobicContact CB-CD2 3.91Å; F334-H382 AromaticContact CE2-CE1 3.31Å; F334-H382 WeakPolarHBondContact CE2-CE1 3.47Å; F334-H382 AromaticContact CE2-ND1 3.46Å; F334-H382 WeakPolarHBondContact CE2-ND1 3.5Å; F334-H382 AromaticContact CE2-NE2 3.92Å; F334-H382 AromaticContact CZ-CE1 3.84Å; F334-F778 HydrophobicContact CD1-CE1 4.22Å; F334-F778 HydrophobicContact CE1-CD1 4.34Å; F334-F778 AromaticContact CE1-CE1 3.55Å; F334-F778 HydrophobicContact CE1-CE1 3.55Å; F334-F778 HydrophobicContact CE1-CZ 4.16Å; F334-F778 HydrophobicContact CZ-CE1 4.41Å
335	Y	94.4	Very high	91.3	Very high	1 Å²	1	44.9 Å²	44.9	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-64.1	-39.2	177.1	-73.6	-74.3	0	0	0	112.6	P291 A294 T295 V298 R331 A332 C338 F339 F778	P291-Y335 WeakPolarHBondContact CA-OH 3.47Å; P291-Y335 WeakPolarHBondContact CB-OH 3.5Å; A294-Y335 HydrophobicContact CB-CD1 3.69Å; A294-Y335 HydrophobicContact CB-CD2 3.49Å; A294-Y335 VanDerWaalsContact CB-CD2 3.49Å; A294-Y335 HydrophobicContact CB-CE1 3.81Å; A294-Y335 HydrophobicContact CB-CE2 3.64Å; A294-Y335 HydrophobicContact CB-CG 3.56Å; T295-Y335 WeakPolarHBondContact OG1-CE1 3.37Å; V298-Y335 HydrophobicContact CG2-CD1 4.21Å; R331-Y335 HydrophobicContact CG-CD2 3.93Å; R331-Y335 HydrophobicContact CG-CE2 3.58Å; R331-Y335 WeakPolarHBondContact O-CD2 3.41Å; R331-Y335 PolarHBondContact O-N 3.23Å; R331-Y335 VanDerWaalsContact O-N 3.12Å; A332-Y335 PolarHBondContact O-N 2.8Å; Y335-C338 PolarHBondContact O-N 3.23Å; Y335-F339 PolarHBondContact O-N 3.16Å; Y335-F339 VanDerWaalsContact O-N 3.08Å; Y335-F778 AromaticContact CD1-CE1 3.5Å; Y335-F778 HydrophobicContact CD1-CE1 3.5Å; Y335-F778 VanDerWaalsContact CD1-CE1 3.5Å; Y335-F778 AromaticContact CD1-CZ 3.67Å; Y335-F778 HydrophobicContact CD1-CZ 3.67Å; Y335-F778 AromaticContact CE1-CD1 3.87Å; Y335-F778 HydrophobicContact CE1-CD1 3.87Å; Y335-F778 AromaticContact CE1-CE1 3.16Å; Y335-F778 HydrophobicContact CE1-CE1 3.16Å; Y335-F778 AromaticContact CE1-CZ 3.83Å; Y335-F778 HydrophobicContact CE1-CZ 3.83Å
336	A	95.8	Very high	91.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.6	-45.5	173.9	0	0	0	0	0	112.4	L286 T319 L322 I323 A332 Q333 F334 C338 F339 L340	L286-A336 HydrophobicContact CD1-CB 4.37Å; T319-A336 HydrophobicContact CG2-CB 3.72Å; L322-A336 HydrophobicContact CD2-CB 4.31Å; I323-A336 HydrophobicContact CD1-CB 3.96Å; I323-A336 HydrophobicContact CG1-CB 3.64Å; A332-A336 WeakPolarHBondContact O-CB 3.37Å; A332-A336 PolarHBondContact O-N 3.02Å; Q333-A336 PolarHBondContact O-N 3.28Å; F334-A336 PolarHBondContact O-N 2.94Å; A336-C338 PolarHBondContact O-N 3.49Å; A336-F339 PolarHBondContact O-N 3.22Å; A336-L340 WeakPolarHBondContact O-CG 3.32Å; A336-L340 PolarHBondContact O-N 3.09Å; A336-L340 VanDerWaalsContact O-N 3.07Å
337	L	93.8	Very high	90.8	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-61	-43.2	174.1	-80.1	172.5	0	0	0	112.1	Q333 F334 F339 L340 I341 Y360 L363 L379 H382 I383	Q333-L337 WeakPolarHBondContact O-CB 3.45Å; Q333-L337 VanDerWaalsContact O-CG 3.3Å; Q333-L337 WeakPolarHBondContact O-CG 3.11Å; Q333-L337 PolarHBondContact O-N 3.16Å; F334-L337 PolarHBondContact O-N 3.24Å; L337-F339 PolarHBondContact O-N 3.01Å; L337-L340 PolarHBondContact O-N 2.69Å; L337-I341 HydrophobicContact CB-CD1 4.4Å; L337-I341 WeakPolarHBondContact O-CB 3.31Å; L337-I341 VanDerWaalsContact O-CD1 3.31Å; L337-I341 WeakPolarHBondContact O-CD1 3.4Å; L337-I341 WeakPolarHBondContact O-CG1 3.3Å; L337-I341 PolarHBondContact O-N 2.72Å; L337-Y360 HydrophobicContact CD2-CD1 3.68Å; L337-Y360 HydrophobicContact CD2-CE1 3.61Å; L337-L363 HydrophobicContact CD1-CD1 4.39Å; L337-L363 HydrophobicContact CD2-CD1 3.72Å; L337-L363 HydrophobicContact CG-CD1 4.27Å; L337-L379 HydrophobicContact CD1-CD2 3.74Å; L337-H382 HydrophobicContact CB-CB 4.42Å; L337-H382 HydrophobicContact CD1-CB 4.44Å; L337-I383 HydrophobicContact CD1-CD1 4.3Å; L337-I383 HydrophobicContact CD1-CG1 3.76Å; L337-I383 HydrophobicContact CD2-CG1 4.24Å
338	C	92.5	Very high	90.8	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.02	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-44.8	179.1	-66.6	0	0	0	0	112	F334 Y335 A336 I341 H342 H382 F778	F334-C338 PolarHBondContact O-N 2.85Å; F334-C338 PolarHBondContact O-SG 3.23Å; Y335-C338 PolarHBondContact O-N 3.23Å; A336-C338 PolarHBondContact O-N 3.49Å; C338-I341 PolarHBondContact O-N 2.94Å; C338-H342 PolarHBondContact O-N 2.76Å; C338-H342 PolarHBondContact O-ND1 2.59Å; C338-H382 PolarHBondContact SG-CD2 3.1Å; C338-F778 HydrophobicContact CB-CE2 3.56Å; C338-F778 HydrophobicContact CB-CZ 3.45Å; C338-F778 VanDerWaalsContact CB-CZ 3.45Å; C338-F778 WeakPolarHBondContact SG-CZ 3.46Å
339	F	95.4	Very high	90.6	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-56.6	-51.6	172.7	169.7	-118.4	0	0	0	111.9	V298 L301 E302 L315 T319 Y335 A336 L337 I341 H342 L343	V298-F339 HydrophobicContact CG1-CB 4.19Å; V298-F339 HydrophobicContact CG2-CB 4.35Å; L301-F339 HydrophobicContact CB-CD2 3.7Å; L301-F339 HydrophobicContact CB-CE1 4.37Å; L301-F339 HydrophobicContact CB-CE2 3.42Å; L301-F339 VanDerWaalsContact CB-CE2 3.42Å; L301-F339 HydrophobicContact CB-CG 4.32Å; L301-F339 HydrophobicContact CB-CZ 3.78Å; L301-F339 HydrophobicContact CD1-CD1 4.21Å; L301-F339 HydrophobicContact CD1-CE1 4.34Å; L301-F339 HydrophobicContact CD1-CG 4.3Å; E302-F339 HydrophobicContact CG-CD2 4.22Å; E302-F339 HydrophobicContact CG-CE2 4.49Å; L315-F339 HydrophobicContact CB-CE1 4.21Å; L315-F339 HydrophobicContact CB-CZ 4Å; L315-F339 HydrophobicContact CD1-CZ 4.19Å; L315-F339 HydrophobicContact CG-CZ 4.48Å; T319-F339 HydrophobicContact CG2-CD1 4.21Å; Y335-F339 PolarHBondContact O-N 3.16Å; Y335-F339 VanDerWaalsContact O-N 3.08Å; A336-F339 PolarHBondContact O-N 3.22Å; L337-F339 PolarHBondContact O-N 3.01Å; F339-I341 PolarHBondContact O-N 3.17Å; F339-H342 PolarHBondContact O-N 3.14Å; F339-H342 VanDerWaalsContact O-N 3.1Å; F339-L343 HydrophobicContact CE1-CD1 4.26Å; F339-L343 HydrophobicContact CE2-CD2 3.78Å; F339-L343 HydrophobicContact CE2-CG 4.11Å; F339-L343 HydrophobicContact CZ-CD1 4.14Å; F339-L343 HydrophobicContact CZ-CD2 3.74Å; F339-L343 HydrophobicContact CZ-CG 4.06Å; F339-L343 PolarHBondContact O-N 2.75Å; F339-L343 VanDerWaalsContact O-N 3.16Å
340	L	95.8	Very high	90.4	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-61.9	-30.5	178.6	-65.4	-177.3	0	0	0	113.1	I316 T319 I323 A336 L337 L343 L356 I359 Y360	I316-L340 HydrophobicContact CB-CD2 4.44Å; I316-L340 HydrophobicContact CG1-CD2 4.1Å; T319-L340 HydrophobicContact CG2-CD1 4.03Å; T319-L340 HydrophobicContact CG2-CD2 3.95Å; T319-L340 HydrophobicContact CG2-CG 3.83Å; I323-L340 HydrophobicContact CD1-CD1 3.57Å; A336-L340 WeakPolarHBondContact O-CG 3.32Å; A336-L340 PolarHBondContact O-N 3.09Å; A336-L340 VanDerWaalsContact O-N 3.07Å; L337-L340 PolarHBondContact O-N 2.69Å; L340-L343 HydrophobicContact CD2-CD1 3.95Å; L340-L356 HydrophobicContact CB-CD2 4.02Å; L340-L356 HydrophobicContact CD1-CD2 4.25Å; L340-L356 HydrophobicContact CD2-CD2 3.96Å; L340-L356 HydrophobicContact CG-CD2 4.3Å; L340-I359 HydrophobicContact CD1-CG2 4.34Å; L340-Y360 HydrophobicContact CB-CE1 4.21Å; L340-Y360 VanDerWaalsContact CB-OH 3.27Å; L340-Y360 WeakPolarHBondContact CB-OH 3.49Å; L340-Y360 PolarHBondContact O-OH 3.35Å
341	I	93.2	Very high	90.4	Very high	14 Å²	14	37.2 Å²	37.2	7%	0.072	20%	0.203	C	C	.	.	H	α-helix	trans	-74.1	-32.3	176.8	-72.1	161.5	0	0	0	111.3	L337 C338 F339 Y360 H382 V385 K389	L337-I341 HydrophobicContact CB-CD1 4.4Å; L337-I341 WeakPolarHBondContact O-CB 3.31Å; L337-I341 VanDerWaalsContact O-CD1 3.31Å; L337-I341 WeakPolarHBondContact O-CD1 3.4Å; L337-I341 WeakPolarHBondContact O-CG1 3.3Å; L337-I341 PolarHBondContact O-N 2.72Å; C338-I341 PolarHBondContact O-N 2.94Å; F339-I341 PolarHBondContact O-N 3.17Å; I341-Y360 HydrophobicContact CG1-CE1 4.45Å; I341-Y360 PolarHBondContact N-OH 3.27Å; I341-H382 HydrophobicContact CD1-CB 3.61Å; I341-H382 WeakPolarHBondContact CD1-O 3.14Å; I341-V385 HydrophobicContact CG2-CG1 3.86Å; I341-K389 WeakPolarHBondContact O-CD 3.14Å; I341-K389 PolarHBondContact O-NZ 3.02Å
342	H	90.4	Very high	90.6	Very high	73 Å²	73	33.1 Å²	33.1	34%	0.338	19%	0.19	S	C	.	.	H	α-helix	trans	-78.7	-30.1	178.4	-65.3	155.4	0	0	0	113.6	E302 C338 F339 K389	E302-H342 HydrophobicContact CG-CB 4.36Å; E302-H342 VanDerWaalsContact OE1-CB 3.31Å; E302-H342 WeakPolarHBondContact OE1-CB 3.22Å; E302-H342 IonicContact OE1-CE1 3.17Å; E302-H342 IonicContact OE1-CG 2.69Å; E302-H342 IonicContact OE1-ND1 3.71Å; E302-H342 PolarHBondContact OE1-ND1 2.71Å; C338-H342 PolarHBondContact O-N 2.76Å; C338-H342 PolarHBondContact O-ND1 2.59Å; F339-H342 PolarHBondContact O-N 3.14Å; F339-H342 VanDerWaalsContact O-N 3.1Å; H342-K389 PolarHBondContact O-NZ 3.18Å
343	L	91.2	Very high	90.5	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.021	19%	0.19	C	C	.	.	S	Bend	trans	-42.9	120.8	179.3	-78.1	176.4	0	0	0	113	D305 I316 F339 L340 L345 K389	D305-L343 HydrophobicContact CB-CD2 3.95Å; I316-L343 HydrophobicContact CD1-CD1 4.12Å; I316-L343 HydrophobicContact CG1-CD1 3.56Å; F339-L343 HydrophobicContact CE1-CD1 4.26Å; F339-L343 HydrophobicContact CE2-CD2 3.78Å; F339-L343 HydrophobicContact CE2-CG 4.11Å; F339-L343 HydrophobicContact CZ-CD1 4.14Å; F339-L343 HydrophobicContact CZ-CD2 3.74Å; F339-L343 HydrophobicContact CZ-CG 4.06Å; F339-L343 PolarHBondContact O-N 2.75Å; F339-L343 VanDerWaalsContact O-N 3.16Å; L340-L343 HydrophobicContact CD2-CD1 3.95Å; L343-L345 PolarHBondContact O-N 2.82Å; L343-K389 PolarHBondContact O-NZ 3.39Å
344	P	90.2	Very high	90.2	Very high	55 Å²	55	32.4 Å²	32.4	36%	0.357	19%	0.191	S	C	.	.			trans	-72.8	122.8	-177	27.8	-32.6	0	0	0	110.6	D305 K312	D305-P344 WeakPolarHBondContact OD2-CD 3.41Å; D305-P344 WeakPolarHBondContact OD2-CG 3.41Å; K312-P344 PolarHBondContact NZ-O 3.02Å
345	L	87.3	Confident	90.1	Very high	18 Å²	18	34.4 Å²	34.4	9%	0.094	20%	0.2	C	C	.	.			trans	-104.1	131.4	176.4	-67.2	176.1	0	0	0	110.8	L343 D349 A353 L356 V390 Y393	L343-L345 PolarHBondContact O-N 2.82Å; L345-D349 HydrophobicContact CD2-CB 3.89Å; L345-A353 HydrophobicContact CD1-CB 4.35Å; L345-L356 HydrophobicContact CD1-CD1 4.03Å; L345-L356 HydrophobicContact CD2-CD1 4.04Å; L345-L356 HydrophobicContact CG-CD1 4.44Å; L345-V390 HydrophobicContact CD1-CB 4.46Å; L345-V390 HydrophobicContact CD1-CG1 4.35Å; L345-V390 HydrophobicContact CD1-CG2 3.71Å; L345-Y393 HydrophobicContact CB-CD1 4.27Å; L345-Y393 HydrophobicContact CB-CE1 4.17Å; L345-Y393 HydrophobicContact CB-CE2 4.41Å; L345-Y393 HydrophobicContact CB-CG 4.45Å; L345-Y393 HydrophobicContact CD1-CD2 4.4Å; L345-Y393 WeakPolarHBondContact O-CE1 3.22Å; L345-Y393 PolarHBondContact O-OH 3.27Å
346	T	87.9	Confident	90	Very high	59 Å²	59	34.4 Å²	34.4	36%	0.362	20%	0.2	S	C	.	.			trans	-104.5	170.6	174.8	67	0	0	0	0	110.5	S348 D349	T346-S348 PolarHBondContact O-N 2.81Å; T346-S348 PolarHBondContact OG1-OG 3.23Å; T346-D349 WeakPolarHBondContact CB-OD2 3.44Å; T346-D349 PolarHBondContact N-OD2 3.07Å; T346-D349 PolarHBondContact O-N 2.99Å; T346-D349 VanDerWaalsContact O-N 3.13Å; T346-D349 PolarHBondContact OG1-OD1 3.15Å; T346-D349 PolarHBondContact OG1-OD2 2.96Å
347	S	83.4	Confident	89.7	Confident	101 Å²	101	34.8 Å²	34.8	71%	0.706	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-12.2	178.5	-55.3	0	0	0	0	114.6	K350	S347-K350 WeakPolarHBondContact O-CE 3.32Å
348	S	86.1	Confident	89.5	Confident	95 Å²	95	37.9 Å²	37.9	66%	0.664	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-25.6	170.5	30.8	0	0	0	0	113.4	T346 K350	T346-S348 PolarHBondContact O-N 2.81Å; T346-S348 PolarHBondContact OG1-OG 3.23Å; S348-K350 PolarHBondContact O-N 3.21Å
349	D	87.3	Confident	89.4	Confident	27 Å²	27	37.7 Å²	37.7	14%	0.144	22%	0.218	C	C	.	.			trans	-79	38.6	-169.6	-58.2	-33.8	0	0	0	113.4	K312 L345 T346 L352 A353	K312-D349 IonicContact NZ-OD2 2.66Å; L345-D349 HydrophobicContact CD2-CB 3.89Å; T346-D349 WeakPolarHBondContact CB-OD2 3.44Å; T346-D349 PolarHBondContact N-OD2 3.07Å; T346-D349 PolarHBondContact O-N 2.99Å; T346-D349 VanDerWaalsContact O-N 3.13Å; T346-D349 PolarHBondContact OG1-OD1 3.15Å; T346-D349 PolarHBondContact OG1-OD2 2.96Å; D349-L352 HydrophobicContact CB-CB 4.37Å; D349-L352 HydrophobicContact CB-CD1 4.4Å; D349-L352 PolarHBondContact O-N 2.8Å; D349-A353 VanDerWaalsContact O-CB 3.26Å; D349-A353 WeakPolarHBondContact O-CB 3.12Å; D349-A353 PolarHBondContact O-N 3.39Å
350	K	84.4	Confident	89.2	Confident	55 Å²	55	37.8 Å²	37.8	24%	0.239	22%	0.218	C	C	.	.	H	α-helix	trans	-66.9	-40.4	-172.1	-62.5	-172.1	-177.4	-173.3	0	113.4	S347 S348 A354 A396 R397	S347-K350 WeakPolarHBondContact O-CE 3.32Å; S348-K350 PolarHBondContact O-N 3.21Å; K350-A354 WeakPolarHBondContact O-CB 3.49Å; K350-A354 PolarHBondContact O-N 3.47Å; K350-A396 PolarHBondContact NZ-O 2.69Å; K350-R397 HydrophobicContact CD-CB 4.4Å
351	D	86.3	Confident	88.8	Confident	98 Å²	98	38.4 Å²	38.4	52%	0.524	22%	0.221	S	C	.	.	H	α-helix	trans	-68	-42.5	176.8	-64.9	-79.8	0	0	0	111.2	A354 K355 R397	D351-A354 WeakPolarHBondContact O-CB 3.41Å; D351-A354 PolarHBondContact O-N 2.88Å; D351-K355 PolarHBondContact O-N 3.13Å; D351-R397 IonicContact OD1-CZ 3.93Å; D351-R397 IonicContact OD1-NH1 3.6Å; D351-R397 PolarHBondContact OD1-NH1 3.32Å; D351-R397 IonicContact OD1-NH2 3.73Å; D351-R397 PolarHBondContact OD1-NH2 3.18Å
352	L	90.3	Very high	88.5	Confident	38 Å²	38	41.8 Å²	41.8	20%	0.199	24%	0.236	C	C	.	.	H	α-helix	trans	-65.1	-41.3	175.2	-59.5	-179.5	0	0	0	111.7	K312 I316 D349 K355 L356	K312-L352 HydrophobicContact CB-CD1 3.76Å; K312-L352 HydrophobicContact CD-CD1 4.45Å; I316-L352 HydrophobicContact CD1-CB 4.15Å; I316-L352 HydrophobicContact CD1-CD2 4.27Å; D349-L352 HydrophobicContact CB-CB 4.37Å; D349-L352 HydrophobicContact CB-CD1 4.4Å; D349-L352 PolarHBondContact O-N 2.8Å; L352-K355 PolarHBondContact O-N 3.3Å; L352-L356 WeakPolarHBondContact O-CG 3.26Å; L352-L356 PolarHBondContact O-N 3.02Å
353	A	89.8	Confident	88.3	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.6	-43.5	171.8	0	0	0	0	0	111.5	L345 D349 K355 L356 L357 V390	L345-A353 HydrophobicContact CD1-CB 4.35Å; D349-A353 VanDerWaalsContact O-CB 3.26Å; D349-A353 WeakPolarHBondContact O-CB 3.12Å; D349-A353 PolarHBondContact O-N 3.39Å; A353-K355 VanDerWaalsContact C-N 3.29Å; A353-K355 PolarHBondContact O-N 3.08Å; A353-L356 PolarHBondContact O-N 2.98Å; A353-L357 WeakPolarHBondContact O-CB 3.45Å; A353-L357 PolarHBondContact O-N 3.2Å; A353-V390 HydrophobicContact CB-CG1 3.8Å; A353-V390 WeakPolarHBondContact O-CG1 3.47Å
354	A	86.9	Confident	88.2	Confident	25 Å²	25	38.8 Å²	38.8	21%	0.207	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-36.1	175.3	0	0	0	0	0	112.3	K350 D351 N358 K412	K350-A354 WeakPolarHBondContact O-CB 3.49Å; K350-A354 PolarHBondContact O-N 3.47Å; D351-A354 WeakPolarHBondContact O-CB 3.41Å; D351-A354 PolarHBondContact O-N 2.88Å; A354-N358 PolarHBondContact O-N 2.78Å; A354-K412 PolarHBondContact O-NZ 2.63Å
355	K	90	Very high	87.9	Confident	54 Å²	54	40.1 Å²	40.1	24%	0.235	22%	0.222	C	C	.	.	H	α-helix	trans	-68.7	-52.6	174.6	-177.7	168.8	179.5	166.9	0	112.5	I316 S317 E320 D351 L352 A353 L357 N358 I359	I316-K355 HydrophobicContact CG2-CD 4.05Å; I316-K355 HydrophobicContact CG2-CG 4.21Å; S317-K355 PolarHBondContact OG-NZ 3.29Å; E320-K355 VanDerWaalsContact OE1-CE 3.25Å; E320-K355 WeakPolarHBondContact OE1-CE 3.41Å; E320-K355 IonicContact OE1-NZ 2.59Å; E320-K355 WeakPolarHBondContact OE2-CE 3.3Å; E320-K355 IonicContact OE2-NZ 2.71Å; E320-K355 PolarHBondContact OE2-NZ 3.39Å; D351-K355 PolarHBondContact O-N 3.13Å; L352-K355 PolarHBondContact O-N 3.3Å; A353-K355 VanDerWaalsContact C-N 3.29Å; A353-K355 PolarHBondContact O-N 3.08Å; K355-L357 PolarHBondContact O-N 3.08Å; K355-N358 WeakPolarHBondContact O-CA 3.36Å; K355-N358 WeakPolarHBondContact O-CB 3.44Å; K355-N358 PolarHBondContact O-N 3.21Å; K355-I359 HydrophobicContact CG-CD1 4.37Å; K355-I359 PolarHBondContact O-N 3.25Å
356	L	92.3	Very high	87.7	Confident	1 Å²	1	43 Å²	43	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-53.2	-39	174.4	-74.2	170.2	0	0	0	111.7	I316 L340 L345 L352 A353 N358 I359 Y360 V390	I316-L356 HydrophobicContact CD1-CD1 4.11Å; I316-L356 HydrophobicContact CD1-CD2 4.16Å; I316-L356 HydrophobicContact CD1-CG 4.01Å; I316-L356 HydrophobicContact CG1-CD2 4.09Å; I316-L356 HydrophobicContact CG1-CG 4.49Å; I316-L356 HydrophobicContact CG2-CD2 4Å; I316-L356 HydrophobicContact CG2-CG 4.43Å; L340-L356 HydrophobicContact CB-CD2 4.02Å; L340-L356 HydrophobicContact CD1-CD2 4.25Å; L340-L356 HydrophobicContact CD2-CD2 3.96Å; L340-L356 HydrophobicContact CG-CD2 4.3Å; L345-L356 HydrophobicContact CD1-CD1 4.03Å; L345-L356 HydrophobicContact CD2-CD1 4.04Å; L345-L356 HydrophobicContact CG-CD1 4.44Å; L352-L356 WeakPolarHBondContact O-CG 3.26Å; L352-L356 PolarHBondContact O-N 3.02Å; A353-L356 PolarHBondContact O-N 2.98Å; L356-N358 VanDerWaalsContact C-N 3.34Å; L356-N358 PolarHBondContact O-N 3.23Å; L356-I359 PolarHBondContact O-N 2.98Å; L356-Y360 HydrophobicContact CB-CE2 4.07Å; L356-Y360 VanDerWaalsContact O-CD2 3.23Å; L356-Y360 WeakPolarHBondContact O-CD2 3.41Å; L356-Y360 VanDerWaalsContact O-CG 3.31Å; L356-Y360 PolarHBondContact O-N 3.47Å; L356-V390 HydrophobicContact CB-CG1 4.15Å; L356-V390 HydrophobicContact CB-CG2 4.26Å; L356-V390 HydrophobicContact CD1-CG2 4.32Å
357	L	89.9	Confident	87.3	Confident	7 Å²	7	40.8 Å²	40.8	4%	0.037	22%	0.223	C	C	.	.	H	α-helix	trans	-69	-24.7	176.9	-163.2	67.3	0	0	0	113.7	A353 K355 F361 I387 V390 L391 A394 K412	A353-L357 WeakPolarHBondContact O-CB 3.45Å; A353-L357 PolarHBondContact O-N 3.2Å; K355-L357 PolarHBondContact O-N 3.08Å; L357-F361 HydrophobicContact CD1-CD2 3.93Å; L357-F361 HydrophobicContact CD1-CE2 3.36Å; L357-F361 HydrophobicContact CD1-CZ 3.99Å; L357-F361 HydrophobicContact CD2-CE2 4.04Å; L357-F361 HydrophobicContact CG-CD2 3.75Å; L357-F361 HydrophobicContact CG-CE2 3.49Å; L357-F361 VanDerWaalsContact CG-CE2 3.49Å; L357-F361 WeakPolarHBondContact O-CB 3.4Å; L357-F361 WeakPolarHBondContact O-CD2 3.38Å; L357-F361 PolarHBondContact O-N 2.75Å; L357-I387 HydrophobicContact CD1-CG2 4.29Å; L357-V390 HydrophobicContact CB-CG1 4.09Å; L357-V390 HydrophobicContact CD1-CG1 4.48Å; L357-L391 HydrophobicContact CD1-CD1 4.36Å; L357-L391 HydrophobicContact CD2-CD1 3.89Å; L357-A394 HydrophobicContact CD2-CB 3.59Å; L357-K412 HydrophobicContact CD2-CD 4.31Å; L357-K412 HydrophobicContact CG-CD 4.36Å
358	N	89.1	Confident	87	Confident	66 Å²	66	36.6 Å²	36.6	35%	0.353	19%	0.193	S	C	.	.	H	α-helix	trans	-65.2	-57.7	166.4	-86.9	-34.2	0	0	0	109.7	A354 K355 L356 Y360 F361 E362 K412	A354-N358 PolarHBondContact O-N 2.78Å; K355-N358 WeakPolarHBondContact O-CA 3.36Å; K355-N358 WeakPolarHBondContact O-CB 3.44Å; K355-N358 PolarHBondContact O-N 3.21Å; L356-N358 VanDerWaalsContact C-N 3.34Å; L356-N358 PolarHBondContact O-N 3.23Å; N358-Y360 VanDerWaalsContact C-N 3.28Å; N358-Y360 PolarHBondContact O-N 2.73Å; N358-F361 PolarHBondContact O-N 3.03Å; N358-E362 PolarHBondContact O-N 3.06Å; N358-K412 VanDerWaalsContact N-NZ 3.16Å; N358-K412 PolarHBondContact ND2-NZ 3.04Å; N358-K412 WeakPolarHBondContact OD1-CE 3.38Å; N358-K412 PolarHBondContact OD1-NZ 3.3Å
359	I	90.9	Very high	86.7	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-53.1	-48.5	-174.4	-59	167	0	0	0	110.3	I316 E320 I323 Y324 L340 K355 L356 F361 L363	I316-I359 HydrophobicContact CG2-CD1 3.92Å; E320-I359 HydrophobicContact CB-CD1 3.87Å; E320-I359 HydrophobicContact CB-CG1 4.49Å; E320-I359 HydrophobicContact CG-CD1 3.96Å; E320-I359 HydrophobicContact CG-CG1 4.07Å; E320-I359 WeakPolarHBondContact OE1-CG1 3.26Å; I323-I359 HydrophobicContact CD1-CG2 4.04Å; I323-I359 HydrophobicContact CG2-CG2 4.43Å; Y324-I359 PolarHBondContact OH-O 3.31Å; L340-I359 HydrophobicContact CD1-CG2 4.34Å; K355-I359 HydrophobicContact CG-CD1 4.37Å; K355-I359 PolarHBondContact O-N 3.25Å; L356-I359 PolarHBondContact O-N 2.98Å; I359-F361 PolarHBondContact O-N 3.17Å; I359-L363 HydrophobicContact CG2-CD1 4.14Å; I359-L363 WeakPolarHBondContact O-CB 3.33Å; I359-L363 VanDerWaalsContact O-CG 3.29Å; I359-L363 WeakPolarHBondContact O-CG 3.19Å; I359-L363 PolarHBondContact O-N 3.39Å; I359-L363 VanDerWaalsContact O-N 3.12Å
360	Y	91.4	Very high	85.9	Confident	1 Å²	1	41.7 Å²	41.7	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-66.4	-36.8	178.4	-58	-36.2	0	0	0	113.5	L337 L340 I341 L356 N358 F364 I383 G386 V390	L337-Y360 HydrophobicContact CD2-CD1 3.68Å; L337-Y360 HydrophobicContact CD2-CE1 3.61Å; L340-Y360 HydrophobicContact CB-CE1 4.21Å; L340-Y360 VanDerWaalsContact CB-OH 3.27Å; L340-Y360 WeakPolarHBondContact CB-OH 3.49Å; L340-Y360 PolarHBondContact O-OH 3.35Å; I341-Y360 HydrophobicContact CG1-CE1 4.45Å; I341-Y360 PolarHBondContact N-OH 3.27Å; L356-Y360 HydrophobicContact CB-CE2 4.07Å; L356-Y360 VanDerWaalsContact O-CD2 3.23Å; L356-Y360 WeakPolarHBondContact O-CD2 3.41Å; L356-Y360 VanDerWaalsContact O-CG 3.31Å; L356-Y360 PolarHBondContact O-N 3.47Å; N358-Y360 VanDerWaalsContact C-N 3.28Å; N358-Y360 PolarHBondContact O-N 2.73Å; Y360-F364 WeakPolarHBondContact O-CB 3.08Å; Y360-F364 PolarHBondContact O-N 2.91Å; Y360-I383 VanDerWaalsContact O-CG2 3.28Å; Y360-I383 WeakPolarHBondContact O-CG2 3.4Å; Y360-G386 VanDerWaalsContact CD2-C 3.49Å; Y360-V390 HydrophobicContact CD2-CG2 4.43Å; Y360-V390 HydrophobicContact CE2-CG2 3.8Å
361	F	85.8	Confident	84.8	Confident	16 Å²	16	42.6 Å²	42.6	7%	0.07	21%	0.213	C	C	.	.	H	α-helix	trans	-77.1	-33.4	179.9	-82.1	-48.3	0	0	0	114.4	L357 N358 I359 F364 K365 I387 K412 I416	L357-F361 HydrophobicContact CD1-CD2 3.93Å; L357-F361 HydrophobicContact CD1-CE2 3.36Å; L357-F361 HydrophobicContact CD1-CZ 3.99Å; L357-F361 HydrophobicContact CD2-CE2 4.04Å; L357-F361 HydrophobicContact CG-CD2 3.75Å; L357-F361 HydrophobicContact CG-CE2 3.49Å; L357-F361 VanDerWaalsContact CG-CE2 3.49Å; L357-F361 WeakPolarHBondContact O-CB 3.4Å; L357-F361 WeakPolarHBondContact O-CD2 3.38Å; L357-F361 PolarHBondContact O-N 2.75Å; N358-F361 PolarHBondContact O-N 3.03Å; I359-F361 PolarHBondContact O-N 3.17Å; F361-F364 HydrophobicContact CD1-CB 4.46Å; F361-F364 HydrophobicContact CD1-CD1 4.31Å; F361-F364 WeakPolarHBondContact O-CB 3.33Å; F361-F364 PolarHBondContact O-N 3.49Å; F361-K365 WeakPolarHBondContact O-CG 3.31Å; F361-K365 PolarHBondContact O-N 2.94Å; F361-I387 HydrophobicContact CD1-CD1 3.79Å; F361-I387 HydrophobicContact CD1-CG1 4.26Å; F361-I387 HydrophobicContact CE1-CB 4.48Å; F361-I387 HydrophobicContact CE1-CD1 3.52Å; F361-I387 HydrophobicContact CE1-CG1 3.86Å; F361-I387 HydrophobicContact CE1-CG2 3.75Å; F361-I387 HydrophobicContact CE2-CG2 4.36Å; F361-I387 HydrophobicContact CZ-CB 4.42Å; F361-I387 HydrophobicContact CZ-CD1 4.25Å; F361-I387 HydrophobicContact CZ-CG1 4.1Å; F361-I387 HydrophobicContact CZ-CG2 3.42Å; F361-I387 VanDerWaalsContact CZ-CG2 3.42Å; F361-K412 HydrophobicContact CD2-CB 4.44Å; F361-K412 HydrophobicContact CD2-CD 4.3Å; F361-I416 HydrophobicContact CD1-CG1 4.22Å; F361-I416 HydrophobicContact CE1-CD1 3.74Å; F361-I416 HydrophobicContact CE1-CG1 3.51Å; F361-I416 HydrophobicContact CE2-CD1 3.7Å; F361-I416 HydrophobicContact CE2-CG1 4.03Å; F361-I416 HydrophobicContact CZ-CD1 3.13Å; F361-I416 HydrophobicContact CZ-CG1 3.44Å; F361-I416 VanDerWaalsContact CZ-CG1 3.44Å
362	E	86.9	Confident	83.3	Confident	85 Å²	85	45.5 Å²	45.5	40%	0.397	23%	0.229	S	C	.	.	H	α-helix	trans	-66.2	-47.8	173.5	-77	165	-178.6	0	0	110.5	Y324 N358 F364 K365 I366	Y324-E362 WeakPolarHBondContact OH-CB 3.39Å; Y324-E362 PolarHBondContact OH-OE2 3.4Å; N358-E362 PolarHBondContact O-N 3.06Å; E362-F364 VanDerWaalsContact C-N 3.28Å; E362-F364 PolarHBondContact O-N 2.67Å; E362-K365 PolarHBondContact O-N 3.48Å; E362-I366 WeakPolarHBondContact O-CG1 3.42Å; E362-I366 PolarHBondContact O-N 3.33Å
363	L	88.1	Confident	81.9	Confident	6 Å²	6	46.8 Å²	46.8	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-58.6	-39.5	170	-70.6	174.7	0	0	0	112.5	I323 Y324 L337 I359 I366 V367 I383	I323-L363 HydrophobicContact CG2-CD1 3.75Å; I323-L363 HydrophobicContact CG2-CD2 3.76Å; I323-L363 HydrophobicContact CG2-CG 4.07Å; Y324-L363 HydrophobicContact CE1-CD2 4.04Å; Y324-L363 HydrophobicContact CE1-CG 4.3Å; L337-L363 HydrophobicContact CD1-CD1 4.39Å; L337-L363 HydrophobicContact CD2-CD1 3.72Å; L337-L363 HydrophobicContact CG-CD1 4.27Å; I359-L363 HydrophobicContact CG2-CD1 4.14Å; I359-L363 WeakPolarHBondContact O-CB 3.33Å; I359-L363 VanDerWaalsContact O-CG 3.29Å; I359-L363 WeakPolarHBondContact O-CG 3.19Å; I359-L363 PolarHBondContact O-N 3.39Å; I359-L363 VanDerWaalsContact O-N 3.12Å; L363-I366 PolarHBondContact O-N 2.62Å; L363-V367 WeakPolarHBondContact O-CG2 3.37Å; L363-V367 PolarHBondContact O-N 2.85Å; L363-I383 HydrophobicContact CB-CD1 3.77Å; L363-I383 HydrophobicContact CB-CG1 4.24Å
364	F	87.4	Confident	80.4	Confident	7 Å²	7	50.3 Å²	50.3	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-62.4	-42.5	176	-173.4	-118	0	0	0	112.3	Y360 F361 E362 V367 L368 I383 L384 I387 L423 M426	Y360-F364 WeakPolarHBondContact O-CB 3.08Å; Y360-F364 PolarHBondContact O-N 2.91Å; F361-F364 HydrophobicContact CD1-CB 4.46Å; F361-F364 HydrophobicContact CD1-CD1 4.31Å; F361-F364 WeakPolarHBondContact O-CB 3.33Å; F361-F364 PolarHBondContact O-N 3.49Å; E362-F364 VanDerWaalsContact C-N 3.28Å; E362-F364 PolarHBondContact O-N 2.67Å; F364-V367 PolarHBondContact O-N 2.74Å; F364-L368 HydrophobicContact CD1-CD1 3.89Å; F364-L368 HydrophobicContact CD1-CG 4.28Å; F364-L368 HydrophobicContact CD2-CG 4.41Å; F364-L368 HydrophobicContact CE1-CD1 3.29Å; F364-L368 HydrophobicContact CE1-CD2 4.44Å; F364-L368 HydrophobicContact CE1-CG 3.82Å; F364-L368 HydrophobicContact CE2-CD1 4.34Å; F364-L368 HydrophobicContact CE2-CD2 4.15Å; F364-L368 HydrophobicContact CE2-CG 3.94Å; F364-L368 HydrophobicContact CZ-CD1 3.53Å; F364-L368 HydrophobicContact CZ-CD2 3.8Å; F364-L368 HydrophobicContact CZ-CG 3.59Å; F364-L368 WeakPolarHBondContact O-CB 3.39Å; F364-L368 WeakPolarHBondContact O-CG 3.32Å; F364-L368 PolarHBondContact O-N 3.39Å; F364-I383 HydrophobicContact CB-CG2 3.69Å; F364-I383 HydrophobicContact CD2-CG2 3.99Å; F364-I383 HydrophobicContact CG-CG2 4.24Å; F364-L384 HydrophobicContact CD2-CD2 4.43Å; F364-L384 HydrophobicContact CE2-CD2 3.95Å; F364-L384 HydrophobicContact CZ-CD2 4.4Å; F364-I387 HydrophobicContact CB-CD1 4.25Å; F364-I387 HydrophobicContact CG-CD1 4.27Å; F364-L423 HydrophobicContact CE1-CD2 3.82Å; F364-L423 HydrophobicContact CZ-CD2 3.49Å; F364-L423 VanDerWaalsContact CZ-CD2 3.49Å; F364-M426 HydrophobicContact CE2-CE 3.69Å; F364-M426 HydrophobicContact CE2-SD 4.35Å; F364-M426 HydrophobicContact CZ-CE 3.62Å
365	K	83.7	Confident	79.1	Confident	83 Å²	83	54.3 Å²	54.3	36%	0.361	27%	0.273	S	S	.	.	H	α-helix	trans	-62.9	-41.2	175.8	-75.9	173.4	179.2	179.4	0	111.6	F361 E362 L368 Q369 D415	F361-K365 WeakPolarHBondContact O-CG 3.31Å; F361-K365 PolarHBondContact O-N 2.94Å; E362-K365 PolarHBondContact O-N 3.48Å; K365-L368 PolarHBondContact O-N 3.44Å; K365-Q369 WeakPolarHBondContact O-CG 3.4Å; K365-Q369 PolarHBondContact O-N 3.43Å; K365-D415 IonicContact NZ-OD2 2.84Å; K365-D415 PolarHBondContact NZ-OD2 2.76Å
366	I	83.6	Confident	78.1	Confident	78 Å²	78	53 Å²	53	40%	0.4	27%	0.268	S	S	.	.	H	α-helix	trans	-61.4	-51.6	175.6	-66.2	163.2	0	0	0	110.4	E362 L363 L368 Q369 N370	E362-I366 WeakPolarHBondContact O-CG1 3.42Å; E362-I366 PolarHBondContact O-N 3.33Å; L363-I366 PolarHBondContact O-N 2.62Å; I366-L368 VanDerWaalsContact C-N 3.33Å; I366-L368 PolarHBondContact O-N 2.9Å; I366-Q369 WeakPolarHBondContact O-CB 3.43Å; I366-Q369 PolarHBondContact O-N 3.16Å; I366-Q369 VanDerWaalsContact O-N 3.07Å; I366-N370 PolarHBondContact O-N 2.71Å
367	V	79.5	Confident	77.1	Confident	13 Å²	13	58 Å²	58	8%	0.079	29%	0.287	C	S	.	.	H	α-helix	trans	-67	-31.7	-179.6	170.3	0	0	0	0	112.5	L363 F364 Q369 N370 E376 T380 I383	L363-V367 WeakPolarHBondContact O-CG2 3.37Å; L363-V367 PolarHBondContact O-N 2.85Å; F364-V367 PolarHBondContact O-N 2.74Å; V367-Q369 PolarHBondContact O-N 2.71Å; V367-N370 PolarHBondContact O-N 3.4Å; V367-E376 HydrophobicContact CG1-CB 4.09Å; V367-E376 HydrophobicContact CG2-CB 4.49Å; V367-T380 VanDerWaalsContact CG1-OG1 3.29Å; V367-T380 WeakPolarHBondContact CG1-OG1 3.28Å; V367-I383 HydrophobicContact CG2-CD1 4.07Å
368	L	78.5	Confident	76.5	Confident	13 Å²	13	61 Å²	61	7%	0.068	30%	0.298	C	S	.	.	H	α-helix	trans	-66.2	-21.2	172.8	-84.9	-173.4	0	0	0	113.6	F364 K365 I366 Q371 E419 K422	F364-L368 HydrophobicContact CD1-CD1 3.89Å; F364-L368 HydrophobicContact CD1-CG 4.28Å; F364-L368 HydrophobicContact CD2-CG 4.41Å; F364-L368 HydrophobicContact CE1-CD1 3.29Å; F364-L368 HydrophobicContact CE1-CD2 4.44Å; F364-L368 HydrophobicContact CE1-CG 3.82Å; F364-L368 HydrophobicContact CE2-CD1 4.34Å; F364-L368 HydrophobicContact CE2-CD2 4.15Å; F364-L368 HydrophobicContact CE2-CG 3.94Å; F364-L368 HydrophobicContact CZ-CD1 3.53Å; F364-L368 HydrophobicContact CZ-CD2 3.8Å; F364-L368 HydrophobicContact CZ-CG 3.59Å; F364-L368 WeakPolarHBondContact O-CB 3.39Å; F364-L368 WeakPolarHBondContact O-CG 3.32Å; F364-L368 PolarHBondContact O-N 3.39Å; K365-L368 PolarHBondContact O-N 3.44Å; I366-L368 VanDerWaalsContact C-N 3.33Å; I366-L368 PolarHBondContact O-N 2.9Å; L368-Q371 WeakPolarHBondContact O-CG 3.4Å; L368-Q371 PolarHBondContact O-NE2 3.34Å; L368-E419 HydrophobicContact CD1-CB 4.48Å; L368-K422 HydrophobicContact CD1-CB 4.47Å; L368-K422 HydrophobicContact CD2-CB 4.45Å
369	Q	78.4	Confident	76.4	Confident	151 Å²	151	58.2 Å²	58.2	71%	0.706	28%	0.283	S	S	*	.	H	α-helix	trans	-84	-24.9	176.9	-69.6	169.7	-0.7	0	0	112.5	K365 I366 V367	K365-Q369 WeakPolarHBondContact O-CG 3.4Å; K365-Q369 PolarHBondContact O-N 3.43Å; I366-Q369 WeakPolarHBondContact O-CB 3.43Å; I366-Q369 PolarHBondContact O-N 3.16Å; I366-Q369 VanDerWaalsContact O-N 3.07Å; V367-Q369 PolarHBondContact O-N 2.71Å
370	N	71.7	Confident	76.2	Confident	78 Å²	78	58.8 Å²	58.8	42%	0.417	29%	0.286	S	S	.	.			trans	-114.4	26.9	-168.2	-68.3	-12.1	0	0	0	114.6	I366 V367 D372 V373 E376	I366-N370 PolarHBondContact O-N 2.71Å; V367-N370 PolarHBondContact O-N 3.4Å; N370-D372 PolarHBondContact O-N 2.94Å; N370-V373 PolarHBondContact O-N 3.21Å; N370-E376 WeakPolarHBondContact CB-OE1 3.39Å; N370-E376 WeakPolarHBondContact CB-OE2 3.47Å; N370-E376 PolarHBondContact ND2-OE1 3.1Å
371	Q	60.9	Low	76	Confident	75 Å²	75	61.2 Å²	61.2	35%	0.35	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-13.3	-165.1	-57.4	-169.4	-12.9	0	0	118.5	L368	L368-Q371 WeakPolarHBondContact O-CG 3.4Å; L368-Q371 PolarHBondContact O-NE2 3.34Å
372	D	55.2	Low	76.1	Confident	159 Å²	159	61.2 Å²	61.2	85%	0.85	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-11.2	-177.8	-69.7	-38.9	0	0	0	114.2	N370	N370-D372 PolarHBondContact O-N 2.94Å
373	V	60.1	Low	76.4	Confident	64 Å²	64	57.2 Å²	57.2	39%	0.388	28%	0.277	S	S	.	.			trans	-87.7	126.4	-175.7	-175.8	0	0	0	0	112.4	N370 E375 E376	N370-V373 PolarHBondContact O-N 3.21Å; V373-E375 HydrophobicContact CG1-CB 4.18Å; V373-E375 PolarHBondContact O-N 3.48Å; V373-E376 HydrophobicContact CB-CB 4.31Å; V373-E376 HydrophobicContact CB-CG 3.91Å; V373-E376 HydrophobicContact CG1-CG 4.14Å; V373-E376 PolarHBondContact O-N 3.27Å
374	V	58.3	Low	76.5	Confident	74 Å²	74	57 Å²	57	45%	0.448	28%	0.276	S	S	.	.	H	α-helix	trans	-63.3	-38.8	-178.8	-177.3	0	0	0	0	112.6	E376 R377	V374-E376 VanDerWaalsContact C-N 3.28Å; V374-E376 PolarHBondContact O-N 3.1Å; V374-R377 WeakPolarHBondContact O-CB 3.45Å; V374-R377 PolarHBondContact O-N 2.67Å
375	E	58.7	Low	76.6	Confident	109 Å²	109	58.6 Å²	58.6	51%	0.509	29%	0.286	S	S	.	.	H	α-helix	trans	-63.5	-36.5	-179.7	-58.7	-172.2	174.2	0	0	112	S330 V373 R377 R378	S330-E375 VanDerWaalsContact CB-OE2 3.3Å; S330-E375 WeakPolarHBondContact CB-OE2 3.43Å; S330-E375 PolarHBondContact OG-OE2 2.83Å; V373-E375 HydrophobicContact CG1-CB 4.18Å; V373-E375 PolarHBondContact O-N 3.48Å; E375-R377 PolarHBondContact O-N 2.6Å; E375-R378 WeakPolarHBondContact O-CB 3.45Å; E375-R378 PolarHBondContact O-N 2.92Å; E375-R378 VanDerWaalsContact O-N 3.08Å
376	E	69.2	Low	76.9	Confident	26 Å²	26	54.6 Å²	54.6	12%	0.121	27%	0.269	C	S	.	.	H	α-helix	trans	-64.2	-24.4	178.6	-68.2	-171.7	-171.4	0	0	112.5	V367 N370 V373 V374 R378 L379 T380	V367-E376 HydrophobicContact CG1-CB 4.09Å; V367-E376 HydrophobicContact CG2-CB 4.49Å; N370-E376 WeakPolarHBondContact CB-OE1 3.39Å; N370-E376 WeakPolarHBondContact CB-OE2 3.47Å; N370-E376 PolarHBondContact ND2-OE1 3.1Å; V373-E376 HydrophobicContact CB-CB 4.31Å; V373-E376 HydrophobicContact CB-CG 3.91Å; V373-E376 HydrophobicContact CG1-CG 4.14Å; V373-E376 PolarHBondContact O-N 3.27Å; V374-E376 VanDerWaalsContact C-N 3.28Å; V374-E376 PolarHBondContact O-N 3.1Å; E376-R378 VanDerWaalsContact C-N 3.28Å; E376-R378 PolarHBondContact O-N 2.82Å; E376-L379 CarbonylContact O-C 3.4Å; E376-L379 WeakPolarHBondContact O-CB 3.26Å; E376-L379 PolarHBondContact O-N 3.41Å; E376-L379 VanDerWaalsContact O-N 3.15Å; E376-T380 PolarHBondContact O-N 2.86Å; E376-T380 PolarHBondContact O-OG1 3.2Å
377	R	72.9	Confident	77.3	Confident	106 Å²	106	50.9 Å²	50.9	40%	0.4	25%	0.25	S	C	.	.	H	α-helix	trans	-61.6	-34.6	173.3	-65	-161.6	-81.1	-98.7	12.7	112.7	V374 E375 T380 R381 I434	V374-R377 WeakPolarHBondContact O-CB 3.45Å; V374-R377 PolarHBondContact O-N 2.67Å; E375-R377 PolarHBondContact O-N 2.6Å; R377-T380 PolarHBondContact O-N 3.4Å; R377-R381 PolarHBondContact O-N 2.92Å; R377-R381 VanDerWaalsContact O-N 3.12Å; R377-I434 HydrophobicContact CB-CD1 4Å; R377-I434 WeakPolarHBondContact O-CD1 3.26Å
378	R	76.4	Confident	77.7	Confident	72 Å²	72	51.2 Å²	51.2	27%	0.272	25%	0.251	S	S	.	.	H	α-helix	trans	-66.5	-43.2	174.9	-59.5	-171.4	-172.5	-166.5	2.6	110.5	F334 E375 E376 H382 A785	F334-R378 HydrophobicContact CD2-CB 4.1Å; F334-R378 HydrophobicContact CE2-CB 4.05Å; E375-R378 WeakPolarHBondContact O-CB 3.45Å; E375-R378 PolarHBondContact O-N 2.92Å; E375-R378 VanDerWaalsContact O-N 3.08Å; E376-R378 VanDerWaalsContact C-N 3.28Å; E376-R378 PolarHBondContact O-N 2.82Å; R378-H382 PolarHBondContact O-N 2.67Å; R378-H382 PolarHBondContact O-ND1 2.8Å; R378-A785 PolarHBondContact NH2-O 3.19Å
379	L	86.7	Confident	78.2	Confident	6 Å²	6	53.7 Å²	53.7	3%	0.031	26%	0.261	C	S	.	.	H	α-helix	trans	-64.2	-45.7	174.5	-61.5	173.8	0	0	0	111	Q333 F334 L337 E376 R381 H382 I383	Q333-L379 HydrophobicContact CB-CD2 4.03Å; F334-L379 HydrophobicContact CB-CD2 3.91Å; L337-L379 HydrophobicContact CD1-CD2 3.74Å; E376-L379 CarbonylContact O-C 3.4Å; E376-L379 WeakPolarHBondContact O-CB 3.26Å; E376-L379 PolarHBondContact O-N 3.41Å; E376-L379 VanDerWaalsContact O-N 3.15Å; L379-R381 VanDerWaalsContact C-N 3.31Å; L379-R381 PolarHBondContact O-N 3.22Å; L379-H382 PolarHBondContact O-N 3.16Å; L379-I383 HydrophobicContact CB-CD1 4.12Å; L379-I383 WeakPolarHBondContact O-CB 3.47Å; L379-I383 WeakPolarHBondContact O-CD1 3.3Å; L379-I383 VanDerWaalsContact O-CG1 3.23Å; L379-I383 WeakPolarHBondContact O-CG1 3.22Å; L379-I383 PolarHBondContact O-N 2.66Å
380	T	87.9	Confident	78.7	Confident	12 Å²	12	46.6 Å²	46.6	7%	0.074	23%	0.228	C	C	.	.	H	α-helix	trans	-53.1	-47.4	177.5	-45.2	0	0	0	0	111.3	V367 E376 R377 H382 L384 M426 I434	V367-T380 VanDerWaalsContact CG1-OG1 3.29Å; V367-T380 WeakPolarHBondContact CG1-OG1 3.28Å; E376-T380 PolarHBondContact O-N 2.86Å; E376-T380 PolarHBondContact O-OG1 3.2Å; R377-T380 PolarHBondContact O-N 3.4Å; T380-H382 VanDerWaalsContact C-N 3.33Å; T380-H382 PolarHBondContact O-N 3.1Å; T380-L384 HydrophobicContact CG2-CD1 3.92Å; T380-L384 HydrophobicContact CG2-CG 4.36Å; T380-L384 WeakPolarHBondContact O-CB 3.46Å; T380-L384 VanDerWaalsContact O-CG 3.29Å; T380-L384 WeakPolarHBondContact O-CG 3.49Å; T380-L384 PolarHBondContact O-N 2.96Å; T380-M426 HydrophobicContact CG2-SD 3.64Å; T380-I434 HydrophobicContact CG2-CG2 3.93Å
381	R	86.2	Confident	79.3	Confident	52 Å²	52	43 Å²	43	20%	0.196	21%	0.209	C	C	.	.	H	α-helix	trans	-54.8	-48.9	177.6	175.8	175.6	178.1	178.5	-1.9	111.3	R377 L379 V385 H433 I434 L781 E784	R377-R381 PolarHBondContact O-N 2.92Å; R377-R381 VanDerWaalsContact O-N 3.12Å; L379-R381 VanDerWaalsContact C-N 3.31Å; L379-R381 PolarHBondContact O-N 3.22Å; R381-V385 VanDerWaalsContact O-CG2 3.26Å; R381-V385 WeakPolarHBondContact O-CG2 3.3Å; R381-V385 PolarHBondContact O-N 2.66Å; R381-V385 VanDerWaalsContact O-N 3.14Å; R381-H433 PolarHBondContact NE-CD2 3.24Å; R381-H433 PolarHBondContact NE-CE1 2.82Å; R381-H433 VanDerWaalsContact NE-CE1 3.27Å; R381-H433 PolarHBondContact NE-NE2 2.92Å; R381-H433 PolarHBondContact NH2-CD2 2.95Å; R381-H433 PolarHBondContact NH2-NE2 3.01Å; R381-H433 VanDerWaalsContact NH2-NE2 3.14Å; R381-I434 HydrophobicContact CB-CG1 4.21Å; R381-L781 VanDerWaalsContact CZ-CD2 3.42Å; R381-E784 IonicContact NH1-OE2 2.87Å
382	H	88.9	Confident	80.3	Confident	17 Å²	17	42.4 Å²	42.4	8%	0.079	21%	0.212	C	C	.	.	H	α-helix	trans	-73.1	-44.2	-175.7	-72.1	76.6	0	0	0	111.7	F334 L337 C338 I341 R378 L379 T380 L384 V385 G386	F334-H382 AromaticContact CE2-CE1 3.31Å; F334-H382 WeakPolarHBondContact CE2-CE1 3.47Å; F334-H382 AromaticContact CE2-ND1 3.46Å; F334-H382 WeakPolarHBondContact CE2-ND1 3.5Å; F334-H382 AromaticContact CE2-NE2 3.92Å; F334-H382 AromaticContact CZ-CE1 3.84Å; L337-H382 HydrophobicContact CB-CB 4.42Å; L337-H382 HydrophobicContact CD1-CB 4.44Å; C338-H382 PolarHBondContact SG-CD2 3.1Å; I341-H382 HydrophobicContact CD1-CB 3.61Å; I341-H382 WeakPolarHBondContact CD1-O 3.14Å; R378-H382 PolarHBondContact O-N 2.67Å; R378-H382 PolarHBondContact O-ND1 2.8Å; L379-H382 PolarHBondContact O-N 3.16Å; T380-H382 VanDerWaalsContact C-N 3.33Å; T380-H382 PolarHBondContact O-N 3.1Å; H382-L384 VanDerWaalsContact C-N 3.33Å; H382-L384 PolarHBondContact O-N 3.02Å; H382-V385 WeakPolarHBondContact O-CB 3.35Å; H382-V385 PolarHBondContact O-N 3.1Å; H382-V385 VanDerWaalsContact O-N 3.16Å; H382-G386 PolarHBondContact O-N 2.9Å
383	I	91.6	Very high	81.6	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-55.1	-47.3	174.3	-69	163.1	0	0	0	110.9	L337 Y360 L363 F364 V367 L379 G386 I387	L337-I383 HydrophobicContact CD1-CD1 4.3Å; L337-I383 HydrophobicContact CD1-CG1 3.76Å; L337-I383 HydrophobicContact CD2-CG1 4.24Å; Y360-I383 VanDerWaalsContact O-CG2 3.28Å; Y360-I383 WeakPolarHBondContact O-CG2 3.4Å; L363-I383 HydrophobicContact CB-CD1 3.77Å; L363-I383 HydrophobicContact CB-CG1 4.24Å; F364-I383 HydrophobicContact CB-CG2 3.69Å; F364-I383 HydrophobicContact CD2-CG2 3.99Å; F364-I383 HydrophobicContact CG-CG2 4.24Å; V367-I383 HydrophobicContact CG2-CD1 4.07Å; L379-I383 HydrophobicContact CB-CD1 4.12Å; L379-I383 WeakPolarHBondContact O-CB 3.47Å; L379-I383 WeakPolarHBondContact O-CD1 3.3Å; L379-I383 VanDerWaalsContact O-CG1 3.23Å; L379-I383 WeakPolarHBondContact O-CG1 3.22Å; L379-I383 PolarHBondContact O-N 2.66Å; I383-G386 PolarHBondContact O-N 2.95Å; I383-I387 HydrophobicContact CG2-CD1 3.73Å; I383-I387 HydrophobicContact CG2-CG1 4.49Å; I383-I387 VanDerWaalsContact O-CG1 3.28Å; I383-I387 WeakPolarHBondContact O-CG1 3.3Å; I383-I387 PolarHBondContact O-N 3.48Å
384	L	90.4	Very high	82.4	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66	-38	178.1	-69.4	171.7	0	0	0	112.9	F364 T380 H382 N388 M426 I434 Q437 T438 L441	F364-L384 HydrophobicContact CD2-CD2 4.43Å; F364-L384 HydrophobicContact CE2-CD2 3.95Å; F364-L384 HydrophobicContact CZ-CD2 4.4Å; T380-L384 HydrophobicContact CG2-CD1 3.92Å; T380-L384 HydrophobicContact CG2-CG 4.36Å; T380-L384 WeakPolarHBondContact O-CB 3.46Å; T380-L384 VanDerWaalsContact O-CG 3.29Å; T380-L384 WeakPolarHBondContact O-CG 3.49Å; T380-L384 PolarHBondContact O-N 2.96Å; H382-L384 VanDerWaalsContact C-N 3.33Å; H382-L384 PolarHBondContact O-N 3.02Å; L384-N388 WeakPolarHBondContact O-CB 3.49Å; L384-N388 PolarHBondContact O-N 3.32Å; L384-N388 PolarHBondContact O-ND2 3.46Å; L384-M426 HydrophobicContact CD1-CE 4.14Å; L384-M426 HydrophobicContact CD1-SD 4.46Å; L384-M426 HydrophobicContact CD2-CE 4.29Å; L384-I434 HydrophobicContact CD1-CG2 3.93Å; L384-Q437 HydrophobicContact CB-CB 3.85Å; L384-Q437 HydrophobicContact CD1-CB 4.15Å; L384-T438 WeakPolarHBondContact CD1-OG1 3.37Å; L384-L441 HydrophobicContact CD2-CD2 4.01Å
385	V	90.7	Very high	83	Confident	41 Å²	41	34.6 Å²	34.6	25%	0.248	16%	0.16	C	C	.	.	H	α-helix	trans	-61	-46.6	172.2	169.9	0	0	0	0	110.5	I341 R381 H382 N388 K389 Q437	I341-V385 HydrophobicContact CG2-CG1 3.86Å; R381-V385 VanDerWaalsContact O-CG2 3.26Å; R381-V385 WeakPolarHBondContact O-CG2 3.3Å; R381-V385 PolarHBondContact O-N 2.66Å; R381-V385 VanDerWaalsContact O-N 3.14Å; H382-V385 WeakPolarHBondContact O-CB 3.35Å; H382-V385 PolarHBondContact O-N 3.1Å; H382-V385 VanDerWaalsContact O-N 3.16Å; V385-N388 PolarHBondContact O-N 2.77Å; V385-K389 WeakPolarHBondContact O-CB 3.15Å; V385-K389 PolarHBondContact O-N 2.96Å; V385-Q437 HydrophobicContact CG2-CG 4.09Å
386	G	89.8	Confident	82.8	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.1	-48.7	177	0	0	0	0	0	112.5	Y360 H382 I383 N388 K389 V390	Y360-G386 VanDerWaalsContact CD2-C 3.49Å; H382-G386 PolarHBondContact O-N 2.9Å; I383-G386 PolarHBondContact O-N 2.95Å; G386-N388 PolarHBondContact O-N 3.35Å; G386-K389 PolarHBondContact O-N 2.86Å; G386-V390 WeakPolarHBondContact O-CB 3.47Å; G386-V390 VanDerWaalsContact O-CG2 3.28Å; G386-V390 WeakPolarHBondContact O-CG2 3.42Å; G386-V390 PolarHBondContact O-N 2.88Å
387	I	90.4	Very high	81.9	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.5	-50.4	175	-65.4	159.6	0	0	0	110.4	L357 F361 F364 I383 K389 V390 L391 L441	L357-I387 HydrophobicContact CD1-CG2 4.29Å; F361-I387 HydrophobicContact CD1-CD1 3.79Å; F361-I387 HydrophobicContact CD1-CG1 4.26Å; F361-I387 HydrophobicContact CE1-CB 4.48Å; F361-I387 HydrophobicContact CE1-CD1 3.52Å; F361-I387 HydrophobicContact CE1-CG1 3.86Å; F361-I387 HydrophobicContact CE1-CG2 3.75Å; F361-I387 HydrophobicContact CE2-CG2 4.36Å; F361-I387 HydrophobicContact CZ-CB 4.42Å; F361-I387 HydrophobicContact CZ-CD1 4.25Å; F361-I387 HydrophobicContact CZ-CG1 4.1Å; F361-I387 HydrophobicContact CZ-CG2 3.42Å; F361-I387 VanDerWaalsContact CZ-CG2 3.42Å; F364-I387 HydrophobicContact CB-CD1 4.25Å; F364-I387 HydrophobicContact CG-CD1 4.27Å; I383-I387 HydrophobicContact CG2-CD1 3.73Å; I383-I387 HydrophobicContact CG2-CG1 4.49Å; I383-I387 VanDerWaalsContact O-CG1 3.28Å; I383-I387 WeakPolarHBondContact O-CG1 3.3Å; I383-I387 PolarHBondContact O-N 3.48Å; I387-K389 VanDerWaalsContact C-N 3.3Å; I387-K389 PolarHBondContact O-N 3.12Å; I387-V390 PolarHBondContact O-N 3.34Å; I387-L391 WeakPolarHBondContact O-CB 3.2Å; I387-L391 PolarHBondContact O-N 3.48Å; I387-L441 HydrophobicContact CG2-CD1 3.65Å; I387-L441 HydrophobicContact CG2-CD2 4.16Å
388	N	89.3	Confident	80.7	Confident	20 Å²	20	29.5 Å²	29.5	11%	0.107	15%	0.149	C	C	.	.	H	α-helix	trans	-61.6	-35.5	-178.7	-83.6	-39.1	0	0	0	113.2	L384 V385 G386 P392 Q437 L441 Q444	L384-N388 WeakPolarHBondContact O-CB 3.49Å; L384-N388 PolarHBondContact O-N 3.32Å; L384-N388 PolarHBondContact O-ND2 3.46Å; V385-N388 PolarHBondContact O-N 2.77Å; G386-N388 PolarHBondContact O-N 3.35Å; N388-P392 WeakPolarHBondContact O-CD 3.46Å; N388-Q437 PolarHBondContact ND2-O 3.5Å; N388-Q437 PolarHBondContact ND2-OE1 2.7Å; N388-L441 VanDerWaalsContact OD1-CA 3.22Å; N388-L441 WeakPolarHBondContact OD1-CA 3.3Å; N388-L441 PolarHBondContact OD1-N 3.36Å; N388-L441 VanDerWaalsContact OD1-N 3.15Å; N388-Q444 PolarHBondContact O-NE2 2.95Å; N388-Q444 PolarHBondContact OD1-NE2 3.43Å
389	K	88.5	Confident	79.3	Confident	64 Å²	64	32.9 Å²	32.9	28%	0.278	17%	0.171	S	C	.	.	H	α-helix	trans	-69	-45	174.6	175.3	176.9	169.7	179.3	0	112	I341 H342 L343 V385 G386 I387 Y393	I341-K389 WeakPolarHBondContact O-CD 3.14Å; I341-K389 PolarHBondContact O-NZ 3.02Å; H342-K389 PolarHBondContact O-NZ 3.18Å; L343-K389 PolarHBondContact O-NZ 3.39Å; V385-K389 WeakPolarHBondContact O-CB 3.15Å; V385-K389 PolarHBondContact O-N 2.96Å; G386-K389 PolarHBondContact O-N 2.86Å; I387-K389 VanDerWaalsContact C-N 3.3Å; I387-K389 PolarHBondContact O-N 3.12Å; K389-Y393 VanDerWaalsContact O-CD2 3.26Å; K389-Y393 WeakPolarHBondContact O-CD2 3.35Å; K389-Y393 VanDerWaalsContact O-CE2 3.3Å; K389-Y393 WeakPolarHBondContact O-CE2 3.42Å
390	V	88.1	Confident	77.3	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.012	20%	0.203	C	C	.	.	H	α-helix	trans	-88.6	-31.5	-167.7	178	0	0	0	0	113.4	L345 A353 L356 L357 Y360 G386 I387 P392 Y393 A394	L345-V390 HydrophobicContact CD1-CB 4.46Å; L345-V390 HydrophobicContact CD1-CG1 4.35Å; L345-V390 HydrophobicContact CD1-CG2 3.71Å; A353-V390 HydrophobicContact CB-CG1 3.8Å; A353-V390 WeakPolarHBondContact O-CG1 3.47Å; L356-V390 HydrophobicContact CB-CG1 4.15Å; L356-V390 HydrophobicContact CB-CG2 4.26Å; L356-V390 HydrophobicContact CD1-CG2 4.32Å; L357-V390 HydrophobicContact CB-CG1 4.09Å; L357-V390 HydrophobicContact CD1-CG1 4.48Å; Y360-V390 HydrophobicContact CD2-CG2 4.43Å; Y360-V390 HydrophobicContact CE2-CG2 3.8Å; G386-V390 WeakPolarHBondContact O-CB 3.47Å; G386-V390 VanDerWaalsContact O-CG2 3.28Å; G386-V390 WeakPolarHBondContact O-CG2 3.42Å; G386-V390 PolarHBondContact O-N 2.88Å; I387-V390 PolarHBondContact O-N 3.34Å; V390-P392 VanDerWaalsContact C-CD 3.47Å; V390-Y393 PolarHBondContact O-N 3.36Å; V390-A394 PolarHBondContact O-N 2.7Å; V390-A394 VanDerWaalsContact O-N 3.15Å
391	L	85.2	Confident	75.2	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-53.9	-40.5	-175.9	-172.3	66.6	0	0	0	114.2	L357 I387 Y393 A394 K395 T413 L441 Q444	L357-L391 HydrophobicContact CD1-CD1 4.36Å; L357-L391 HydrophobicContact CD2-CD1 3.89Å; I387-L391 WeakPolarHBondContact O-CB 3.2Å; I387-L391 PolarHBondContact O-N 3.48Å; L391-Y393 PolarHBondContact O-N 2.82Å; L391-A394 PolarHBondContact O-N 3.23Å; L391-K395 HydrophobicContact CG-CG 4.49Å; L391-K395 WeakPolarHBondContact O-CG 3.38Å; L391-K395 PolarHBondContact O-N 3.41Å; L391-T413 HydrophobicContact CD1-CG2 4.41Å; L391-L441 HydrophobicContact CD2-CD1 3.96Å; L391-Q444 HydrophobicContact CD2-CB 4.12Å
392	P	82.5	Confident	73.3	Confident	63 Å²	63	44 Å²	44	41%	0.409	24%	0.239	S	C	.	.	H	α-helix	trans	-60.4	-39.2	175.3	-25.3	35.8	0	0	0	114.1	N388 V390 A396	N388-P392 WeakPolarHBondContact O-CD 3.46Å; V390-P392 VanDerWaalsContact C-CD 3.47Å; P392-A396 PolarHBondContact O-N 2.93Å
393	Y	83	Confident	70.8	Confident	79 Å²	79	54.9 Å²	54.9	31%	0.31	28%	0.279	S	S	.	.	H	α-helix	trans	-70.2	-38.8	179	-61.6	-93.4	0	0	0	111.2	L345 K389 V390 L391 A396	L345-Y393 HydrophobicContact CB-CD1 4.27Å; L345-Y393 HydrophobicContact CB-CE1 4.17Å; L345-Y393 HydrophobicContact CB-CE2 4.41Å; L345-Y393 HydrophobicContact CB-CG 4.45Å; L345-Y393 HydrophobicContact CD1-CD2 4.4Å; L345-Y393 WeakPolarHBondContact O-CE1 3.22Å; L345-Y393 PolarHBondContact O-OH 3.27Å; K389-Y393 VanDerWaalsContact O-CD2 3.26Å; K389-Y393 WeakPolarHBondContact O-CD2 3.35Å; K389-Y393 VanDerWaalsContact O-CE2 3.3Å; K389-Y393 WeakPolarHBondContact O-CE2 3.42Å; V390-Y393 PolarHBondContact O-N 3.36Å; L391-Y393 PolarHBondContact O-N 2.82Å; Y393-A396 PolarHBondContact O-N 3.13Å
394	A	76.9	Confident	68.1	Low	12 Å²	12	58.6 Å²	58.6	10%	0.099	31%	0.305	C	S	.	.	H	α-helix	trans	-68.1	-41.2	174.9	0	0	0	0	0	112.6	L357 V390 L391 A396 R397	L357-A394 HydrophobicContact CD2-CB 3.59Å; V390-A394 PolarHBondContact O-N 2.7Å; V390-A394 VanDerWaalsContact O-N 3.15Å; L391-A394 PolarHBondContact O-N 3.23Å; A394-A396 PolarHBondContact O-N 2.62Å; A394-R397 WeakPolarHBondContact O-CB 3.29Å; A394-R397 PolarHBondContact O-N 3.06Å; A394-R397 VanDerWaalsContact O-N 3.1Å
395	K	69	Low	65.5	Low	42 Å²	42	70.1 Å²	70.1	18%	0.183	35%	0.35	C	S	.	.	H	α-helix	trans	-55.5	-34.9	174.1	-79.9	-176.6	174.7	-172.7	0	112.1	L391 R397 A398 I399 Q444 D447	L391-K395 HydrophobicContact CG-CG 4.49Å; L391-K395 WeakPolarHBondContact O-CG 3.38Å; L391-K395 PolarHBondContact O-N 3.41Å; K395-R397 PolarHBondContact O-N 2.66Å; K395-R397 VanDerWaalsContact O-N 3.1Å; K395-A398 PolarHBondContact O-N 2.97Å; K395-A398 VanDerWaalsContact O-N 3.16Å; K395-I399 PolarHBondContact O-N 2.8Å; K395-Q444 PolarHBondContact NZ-O 3.49Å; K395-D447 IonicContact NZ-OD2 2.7Å; K395-D447 PolarHBondContact NZ-OD2 3.49Å
396	A	55.9	Low	62.9	Low	40 Å²	40	74.9 Å²	74.9	33%	0.331	37%	0.373	S	S	.	.	H	α-helix	trans	-68	-5.2	179.6	0	0	0	0	0	115	K350 P392 Y393 A394	K350-A396 PolarHBondContact NZ-O 2.69Å; P392-A396 PolarHBondContact O-N 2.93Å; Y393-A396 PolarHBondContact O-N 3.13Å; A394-A396 PolarHBondContact O-N 2.62Å
397	R	49.9	Very low	60.3	Low	64 Å²	64	81.6 Å²	81.6	24%	0.242	40%	0.402	C	S	.	.	H	α-helix	trans	-84.6	-52.7	166.3	-173.1	179.1	-165.9	146.7	13.1	111.1	K350 D351 A394 K395 I399 K400 D401	K350-R397 HydrophobicContact CD-CB 4.4Å; D351-R397 IonicContact OD1-CZ 3.93Å; D351-R397 IonicContact OD1-NH1 3.6Å; D351-R397 PolarHBondContact OD1-NH1 3.32Å; D351-R397 IonicContact OD1-NH2 3.73Å; D351-R397 PolarHBondContact OD1-NH2 3.18Å; A394-R397 WeakPolarHBondContact O-CB 3.29Å; A394-R397 PolarHBondContact O-N 3.06Å; A394-R397 VanDerWaalsContact O-N 3.1Å; K395-R397 PolarHBondContact O-N 2.66Å; K395-R397 VanDerWaalsContact O-N 3.1Å; R397-I399 PolarHBondContact O-N 3.02Å; R397-I399 VanDerWaalsContact O-N 3.1Å; R397-K400 PolarHBondContact O-N 3.14Å; R397-D401 WeakPolarHBondContact CG-OD2 3.42Å; R397-D401 IonicContact NE-OD2 3.07Å; R397-D401 PolarHBondContact NE-OD2 2.89Å; R397-D401 PolarHBondContact O-N 3.23Å; R397-D401 VanDerWaalsContact O-N 3.16Å
398	A	48.6	Very low	57.6	Low	30 Å²	30	85.6 Å²	85.6	25%	0.248	43%	0.428	C	S	.	.	H	α-helix	trans	-54.8	-33.5	-175.6	0	0	0	0	0	114.4	K395 T410	K395-A398 PolarHBondContact O-N 2.97Å; K395-A398 VanDerWaalsContact O-N 3.16Å; A398-T410 HydrophobicContact CB-CG2 3.86Å
399	I	46.9	Very low	55.3	Low	142 Å²	142	89.1 Å²	89.1	73%	0.728	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-28.5	-179.1	-60.8	171.4	0	0	0	112.6	K395 R397	K395-I399 PolarHBondContact O-N 2.8Å; R397-I399 PolarHBondContact O-N 3.02Å; R397-I399 VanDerWaalsContact O-N 3.1Å
400	K	44.5	Very low	53.6	Low	162 Å²	162	88.3 Å²	88.3	70%	0.704	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-31.7	179.2	-73.6	-162.4	175.1	-168.5	0	113.2	R397 A402	R397-K400 PolarHBondContact O-N 3.14Å; K400-A402 VanDerWaalsContact C-N 3.27Å; K400-A402 PolarHBondContact O-N 3.22Å
401	D	43.2	Very low	52.2	Low	56 Å²	56	93.3 Å²	93.3	30%	0.299	48%	0.479	S	S	.	.			trans	-83.2	1.8	-171.2	-65.7	-11.6	0	0	0	113.9	R397 R403 S404	R397-D401 WeakPolarHBondContact CG-OD2 3.42Å; R397-D401 IonicContact NE-OD2 3.07Å; R397-D401 PolarHBondContact NE-OD2 2.89Å; R397-D401 PolarHBondContact O-N 3.23Å; R397-D401 VanDerWaalsContact O-N 3.16Å; D401-R403 PolarHBondContact O-N 3.16Å; D401-S404 PolarHBondContact O-N 3.04Å
402	A	45.7	Very low	51.4	Low	86 Å²	86	95.5 Å²	95.5	71%	0.711	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	7.1	175.5	0	0	0	0	0	115.7	K400	K400-A402 VanDerWaalsContact C-N 3.27Å; K400-A402 PolarHBondContact O-N 3.22Å
403	R	37.8	Very low	50.7	Low	246 Å²	246	92.8 Å²	92.8	93%	0.928	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	3.6	174.4	-115	177.7	-177.5	159.1	1.5	114.5	D401	D401-R403 PolarHBondContact O-N 3.16Å
404	S	34.8	Very low	50.3	Low	78 Å²	78	92.6 Å²	92.6	55%	0.545	48%	0.475	S	S	.	.	S	Bend	trans	-120.5	122.6	176.2	-170.3	0	0	0	0	110.7	D401 I406	D401-S404 PolarHBondContact O-N 3.04Å; S404-I406 PolarHBondContact O-N 3.1Å
405	Y	34	Very low	50.2	Low	242 Å²	242	94.3 Å²	94.3	95%	0.949	48%	0.482	S	S	*	.	S	Bend	trans	-71.6	15.7	-168.9	-101.7	-94.4	0	0	0	115.8
406	I	37	Very low	50.6	Low	142 Å²	142	92.6 Å²	92.6	73%	0.728	48%	0.475	S	S	*	.	S	Bend	trans	-135.6	41.7	-173.2	-38.3	-178.9	0	0	0	112.4	S404	S404-I406 PolarHBondContact O-N 3.1Å
407	F	34.7	Very low	51.8	Low	141 Å²	141	93.1 Å²	93.1	62%	0.618	47%	0.472	S	S	*	.	S	Bend	trans	-169.8	109.5	149.5	-97.8	-65.6	0	0	0	108.7
408	P	35.3	Very low	53.4	Low	84 Å²	84	97.4 Å²	97.4	55%	0.545	49%	0.492	S	S	.	.			trans	-72.8	164.7	-174.8	30.1	-35.4	0	0	0	112.9	T410	P408-T410 PolarHBondContact O-N 3.04Å
409	P	40.6	Very low	55.1	Low	93 Å²	93	98 Å²	98	60%	0.604	49%	0.49	S	S	*	.	S	Bend	trans	-65.7	94.4	-179.9	-17.8	31.8	0	0	0	112.3
410	T	53	Low	57.1	Low	47 Å²	47	91.8 Å²	91.8	29%	0.288	46%	0.458	S	S	.	.			trans	45.5	68.9	163.7	49.6	0	0	0	0	116.4	A398 P408 K412 T413 N414	A398-T410 HydrophobicContact CB-CG2 3.86Å; P408-T410 PolarHBondContact O-N 3.04Å; T410-K412 PolarHBondContact O-N 2.92Å; T410-T413 VanDerWaalsContact CB-OG1 3.27Å; T410-T413 WeakPolarHBondContact CB-OG1 3.41Å; T410-T413 HydrophobicContact CG2-CG2 4.36Å; T410-T413 PolarHBondContact O-N 3.39Å; T410-T413 PolarHBondContact O-OG1 2.77Å; T410-T413 PolarHBondContact OG1-OG1 3.24Å; T410-N414 PolarHBondContact O-N 3.16Å
411	D	58.8	Low	59.2	Low	107 Å²	107	89.2 Å²	89.2	57%	0.572	45%	0.452	S	S	*	.	H	α-helix	trans	-46.2	-36.8	165.1	-75.9	-45.5	0	0	0	112.6	T413 N414 D415	D411-T413 PolarHBondContact O-N 2.91Å; D411-N414 WeakPolarHBondContact O-CB 3.27Å; D411-N414 PolarHBondContact O-N 3.23Å; D411-D415 PolarHBondContact O-N 3.09Å
412	K	67.2	Low	61.3	Low	49 Å²	49	90.7 Å²	90.7	21%	0.213	46%	0.456	C	S	.	.	H	α-helix	trans	-62.3	-39.9	175.9	-59.8	-171.8	-164.1	-175.7	0	113.8	A354 L357 N358 F361 T410 N414 D415 I416	A354-K412 PolarHBondContact O-NZ 2.63Å; L357-K412 HydrophobicContact CD2-CD 4.31Å; L357-K412 HydrophobicContact CG-CD 4.36Å; N358-K412 VanDerWaalsContact N-NZ 3.16Å; N358-K412 PolarHBondContact ND2-NZ 3.04Å; N358-K412 WeakPolarHBondContact OD1-CE 3.38Å; N358-K412 PolarHBondContact OD1-NZ 3.3Å; F361-K412 HydrophobicContact CD2-CB 4.44Å; F361-K412 HydrophobicContact CD2-CD 4.3Å; T410-K412 PolarHBondContact O-N 2.92Å; K412-N414 VanDerWaalsContact C-N 3.28Å; K412-N414 PolarHBondContact O-N 3.24Å; K412-D415 WeakPolarHBondContact O-CB 3.14Å; K412-D415 PolarHBondContact O-N 3.4Å; K412-I416 VanDerWaalsContact O-CG1 3.28Å; K412-I416 WeakPolarHBondContact O-CG1 3.32Å; K412-I416 PolarHBondContact O-N 2.88Å
413	T	68	Low	63.4	Low	6 Å²	6	86.6 Å²	86.6	4%	0.037	42%	0.422	C	S	.	.	H	α-helix	trans	-68.1	-36.1	177.8	55.6	0	0	0	0	110.7	L391 T410 D411 D415 I416 M417 I448	L391-T413 HydrophobicContact CD1-CG2 4.41Å; T410-T413 VanDerWaalsContact CB-OG1 3.27Å; T410-T413 WeakPolarHBondContact CB-OG1 3.41Å; T410-T413 HydrophobicContact CG2-CG2 4.36Å; T410-T413 PolarHBondContact O-N 3.39Å; T410-T413 PolarHBondContact O-OG1 2.77Å; T410-T413 PolarHBondContact OG1-OG1 3.24Å; D411-T413 PolarHBondContact O-N 2.91Å; T413-D415 VanDerWaalsContact C-N 3.31Å; T413-D415 PolarHBondContact O-N 3.03Å; T413-I416 HydrophobicContact CG2-CD1 4.47Å; T413-I416 PolarHBondContact O-N 3.26Å; T413-M417 VanDerWaalsContact O-CG 3.29Å; T413-M417 WeakPolarHBondContact O-CG 3.31Å; T413-M417 PolarHBondContact O-N 2.97Å; T413-I448 HydrophobicContact CG2-CD1 3.93Å
414	N	73.6	Confident	66	Low	76 Å²	76	75.9 Å²	75.9	41%	0.406	38%	0.382	S	S	.	.	H	α-helix	trans	-65	-37.6	173.8	-60	-24.3	0	0	0	111.1	T410 D411 K412 M417 K418	T410-N414 PolarHBondContact O-N 3.16Å; D411-N414 WeakPolarHBondContact O-CB 3.27Å; D411-N414 PolarHBondContact O-N 3.23Å; K412-N414 VanDerWaalsContact C-N 3.28Å; K412-N414 PolarHBondContact O-N 3.24Å; N414-M417 WeakPolarHBondContact O-CB 3.43Å; N414-M417 PolarHBondContact O-N 3.23Å; N414-K418 WeakPolarHBondContact O-CG 3.28Å; N414-K418 PolarHBondContact O-N 3.15Å
415	D	76.3	Confident	68.7	Low	47 Å²	47	78.1 Å²	78.1	25%	0.251	38%	0.382	S	S	.	.	H	α-helix	trans	-62.5	-38.9	170.4	-95.2	16.3	0	0	0	113.5	K365 D411 K412 T413 M417 K418	K365-D415 IonicContact NZ-OD2 2.84Å; K365-D415 PolarHBondContact NZ-OD2 2.76Å; D411-D415 PolarHBondContact O-N 3.09Å; K412-D415 WeakPolarHBondContact O-CB 3.14Å; K412-D415 PolarHBondContact O-N 3.4Å; T413-D415 VanDerWaalsContact C-N 3.31Å; T413-D415 PolarHBondContact O-N 3.03Å; D415-M417 VanDerWaalsContact C-N 3.34Å; D415-K418 PolarHBondContact O-N 3.43Å; D415-K418 IonicContact OD1-NZ 3.32Å; D415-K418 PolarHBondContact OD1-NZ 3.18Å
416	I	76.5	Confident	71.3	Confident	6 Å²	6	67.4 Å²	67.4	3%	0.031	34%	0.34	C	S	.	.	H	α-helix	trans	-66.2	-39.9	171.9	-51.2	156.3	0	0	0	110.3	F361 K412 T413 K418 E419 V420 L423 L445	F361-I416 HydrophobicContact CD1-CG1 4.22Å; F361-I416 HydrophobicContact CE1-CD1 3.74Å; F361-I416 HydrophobicContact CE1-CG1 3.51Å; F361-I416 HydrophobicContact CE2-CD1 3.7Å; F361-I416 HydrophobicContact CE2-CG1 4.03Å; F361-I416 HydrophobicContact CZ-CD1 3.13Å; F361-I416 HydrophobicContact CZ-CG1 3.44Å; F361-I416 VanDerWaalsContact CZ-CG1 3.44Å; K412-I416 VanDerWaalsContact O-CG1 3.28Å; K412-I416 WeakPolarHBondContact O-CG1 3.32Å; K412-I416 PolarHBondContact O-N 2.88Å; T413-I416 HydrophobicContact CG2-CD1 4.47Å; T413-I416 PolarHBondContact O-N 3.26Å; I416-K418 VanDerWaalsContact C-N 3.29Å; I416-K418 PolarHBondContact O-N 2.97Å; I416-E419 CarbonylContact O-C 3.57Å; I416-E419 WeakPolarHBondContact O-CA 3.32Å; I416-E419 PolarHBondContact O-N 2.79Å; I416-V420 PolarHBondContact O-N 2.81Å; I416-V420 VanDerWaalsContact O-N 3.15Å; I416-L423 HydrophobicContact CG2-CD1 3.64Å; I416-L445 HydrophobicContact CB-CD1 4.36Å; I416-L445 HydrophobicContact CB-CD2 4.4Å; I416-L445 HydrophobicContact CD1-CD2 4.05Å; I416-L445 HydrophobicContact CG2-CD1 3.51Å; I416-L445 HydrophobicContact CG2-CD2 4.31Å
417	M	80.9	Confident	73.9	Confident	52 Å²	52	60.9 Å²	60.9	26%	0.256	31%	0.308	S	S	.	.	H	α-helix	trans	-62.2	-35	178.6	-69.3	-63.3	-62.8	0	0	112.2	T413 N414 D415 E419 V420 L445 M452	T413-M417 VanDerWaalsContact O-CG 3.29Å; T413-M417 WeakPolarHBondContact O-CG 3.31Å; T413-M417 PolarHBondContact O-N 2.97Å; N414-M417 WeakPolarHBondContact O-CB 3.43Å; N414-M417 PolarHBondContact O-N 3.23Å; D415-M417 VanDerWaalsContact C-N 3.34Å; M417-E419 PolarHBondContact O-N 2.82Å; M417-V420 HydrophobicContact CE-CG2 4.33Å; M417-V420 WeakPolarHBondContact O-CB 3.06Å; M417-V420 PolarHBondContact O-N 3.41Å; M417-V420 HydrophobicContact SD-CG2 3.85Å; M417-L445 HydrophobicContact SD-CB 4.19Å; M417-L445 HydrophobicContact SD-CD1 4.5Å; M417-M452 HydrophobicContact CE-CE 3.79Å; M417-M452 HydrophobicContact CE-SD 3.91Å; M417-M452 HydrophobicContact SD-CE 3.72Å; M417-M452 HydrophobicContact SD-SD 4.36Å
418	K	83.9	Confident	76.6	Confident	154 Å²	154	56.9 Å²	56.9	67%	0.67	30%	0.301	S	S	*	.	H	α-helix	trans	-60.6	-25.4	169.9	-65.5	167.3	-162.6	165.5	0	112.9	N414 D415 I416	N414-K418 WeakPolarHBondContact O-CG 3.28Å; N414-K418 PolarHBondContact O-N 3.15Å; D415-K418 PolarHBondContact O-N 3.43Å; D415-K418 IonicContact OD1-NZ 3.32Å; D415-K418 PolarHBondContact OD1-NZ 3.18Å; I416-K418 VanDerWaalsContact C-N 3.29Å; I416-K418 PolarHBondContact O-N 2.97Å
419	E	84.4	Confident	79.1	Confident	42 Å²	42	57.9 Å²	57.9	20%	0.196	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	6.5	-176	-64.7	-65.4	179.3	0	0	113.8	L368 I416 M417 D421 K422 L423	L368-E419 HydrophobicContact CD1-CB 4.48Å; I416-E419 CarbonylContact O-C 3.57Å; I416-E419 WeakPolarHBondContact O-CA 3.32Å; I416-E419 PolarHBondContact O-N 2.79Å; M417-E419 PolarHBondContact O-N 2.82Å; E419-D421 PolarHBondContact O-N 3.43Å; E419-K422 WeakPolarHBondContact O-CA 3.38Å; E419-K422 WeakPolarHBondContact O-CB 3.46Å; E419-K422 PolarHBondContact O-N 3.1Å; E419-K422 IonicContact OE1-NZ 3.39Å; E419-K422 PolarHBondContact OE1-NZ 3.48Å; E419-K422 WeakPolarHBondContact OE2-CD 3.49Å; E419-K422 WeakPolarHBondContact OE2-CE 3.41Å; E419-K422 WeakPolarHBondContact OE2-CG 3.29Å; E419-K422 IonicContact OE2-NZ 2.8Å; E419-K422 PolarHBondContact OE2-NZ 3.43Å; E419-L423 PolarHBondContact O-N 3.08Å
420	V	88.6	Confident	81.3	Confident	12 Å²	12	54.4 Å²	54.4	7%	0.073	28%	0.284	C	S	.	.	H	α-helix	trans	-57.1	-40.6	-176.2	153.8	0	0	0	0	113.8	I416 M417 K422 L423 Y424 L442 L445 M452	I416-V420 PolarHBondContact O-N 2.81Å; I416-V420 VanDerWaalsContact O-N 3.15Å; M417-V420 HydrophobicContact CE-CG2 4.33Å; M417-V420 WeakPolarHBondContact O-CB 3.06Å; M417-V420 PolarHBondContact O-N 3.41Å; M417-V420 HydrophobicContact SD-CG2 3.85Å; V420-K422 VanDerWaalsContact C-N 3.29Å; V420-K422 PolarHBondContact O-N 2.7Å; V420-L423 HydrophobicContact CG2-CD1 4.47Å; V420-L423 WeakPolarHBondContact O-CB 3.22Å; V420-L423 PolarHBondContact O-N 3.21Å; V420-L423 VanDerWaalsContact O-N 3.16Å; V420-Y424 HydrophobicContact CG1-CD2 3.63Å; V420-Y424 HydrophobicContact CG1-CE2 3.58Å; V420-Y424 WeakPolarHBondContact O-CD2 2.92Å; V420-Y424 PolarHBondContact O-N 3.25Å; V420-L442 HydrophobicContact CG2-CD2 4.44Å; V420-L445 HydrophobicContact CG2-CD1 4.4Å; V420-M452 HydrophobicContact CB-SD 4.4Å; V420-M452 HydrophobicContact CG1-SD 3.59Å; V420-M452 VanDerWaalsContact CG1-SD 3.59Å; V420-M452 HydrophobicContact CG2-CE 4.44Å; V420-M452 HydrophobicContact CG2-SD 3.9Å
421	D	88.8	Confident	83	Confident	108 Å²	108	54.8 Å²	54.8	58%	0.578	29%	0.288	S	S	*	.	H	α-helix	trans	-68.3	-30.5	178.3	-73.5	-36.6	0	0	0	111.8	E419 K425 R455	E419-D421 PolarHBondContact O-N 3.43Å; D421-K425 WeakPolarHBondContact O-CB 3.25Å; D421-K425 PolarHBondContact O-N 3.46Å; D421-R455 IonicContact OD1-NH1 2.96Å; D421-R455 PolarHBondContact OD1-NH1 3.24Å
422	K	88.2	Confident	84.5	Confident	86 Å²	86	50.1 Å²	50.1	37%	0.374	26%	0.263	S	S	.	.	H	α-helix	trans	-70.7	-37	170.9	-58	-166.2	-158.2	140.7	0	111.2	L368 E419 V420 K425 M426	L368-K422 HydrophobicContact CD1-CB 4.47Å; L368-K422 HydrophobicContact CD2-CB 4.45Å; E419-K422 WeakPolarHBondContact O-CA 3.38Å; E419-K422 WeakPolarHBondContact O-CB 3.46Å; E419-K422 PolarHBondContact O-N 3.1Å; E419-K422 IonicContact OE1-NZ 3.39Å; E419-K422 PolarHBondContact OE1-NZ 3.48Å; E419-K422 WeakPolarHBondContact OE2-CD 3.49Å; E419-K422 WeakPolarHBondContact OE2-CE 3.41Å; E419-K422 WeakPolarHBondContact OE2-CG 3.29Å; E419-K422 IonicContact OE2-NZ 2.8Å; E419-K422 PolarHBondContact OE2-NZ 3.43Å; V420-K422 VanDerWaalsContact C-N 3.29Å; V420-K422 PolarHBondContact O-N 2.7Å; K422-K425 PolarHBondContact O-N 3Å; K422-M426 WeakPolarHBondContact O-CB 3.33Å; K422-M426 PolarHBondContact O-N 3.12Å
423	L	89.5	Confident	85.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.6	-48.3	171.1	-67.1	175.7	0	0	0	111.6	F364 I416 E419 V420 K425 M426 A427 T438 L441 L442 L445	F364-L423 HydrophobicContact CE1-CD2 3.82Å; F364-L423 HydrophobicContact CZ-CD2 3.49Å; F364-L423 VanDerWaalsContact CZ-CD2 3.49Å; I416-L423 HydrophobicContact CG2-CD1 3.64Å; E419-L423 PolarHBondContact O-N 3.08Å; V420-L423 HydrophobicContact CG2-CD1 4.47Å; V420-L423 WeakPolarHBondContact O-CB 3.22Å; V420-L423 PolarHBondContact O-N 3.21Å; V420-L423 VanDerWaalsContact O-N 3.16Å; L423-K425 VanDerWaalsContact C-N 3.34Å; L423-K425 PolarHBondContact O-N 3.3Å; L423-M426 HydrophobicContact CD2-CE 3.76Å; L423-M426 PolarHBondContact O-N 3.15Å; L423-A427 WeakPolarHBondContact O-CB 3.49Å; L423-A427 PolarHBondContact O-N 2.98Å; L423-T438 HydrophobicContact CB-CG2 4.06Å; L423-T438 HydrophobicContact CD2-CG2 4.03Å; L423-T438 VanDerWaalsContact O-CG2 3.25Å; L423-T438 WeakPolarHBondContact O-CG2 3.44Å; L423-L441 HydrophobicContact CD1-CD2 4.3Å; L423-L441 HydrophobicContact CD2-CD2 4.12Å; L423-L442 HydrophobicContact CB-CD1 4.27Å; L423-L442 HydrophobicContact CB-CD2 3.94Å; L423-L442 HydrophobicContact CB-CG 4.21Å; L423-L442 HydrophobicContact CD1-CD2 3.95Å; L423-L442 HydrophobicContact CD1-CG 4.42Å; L423-L445 HydrophobicContact CD1-CD1 4.09Å
424	Y	92.2	Very high	86.6	Confident	21 Å²	21	49.2 Å²	49.2	8%	0.082	26%	0.259	C	S	.	.	H	α-helix	trans	-62.4	-39.3	176.7	-83	-65.5	0	0	0	112.5	V420 A427 A428 L442 M452 R455 F456 S459	V420-Y424 HydrophobicContact CG1-CD2 3.63Å; V420-Y424 HydrophobicContact CG1-CE2 3.58Å; V420-Y424 WeakPolarHBondContact O-CD2 2.92Å; V420-Y424 PolarHBondContact O-N 3.25Å; Y424-A427 PolarHBondContact O-N 3.22Å; Y424-A428 WeakPolarHBondContact O-CB 3.43Å; Y424-A428 PolarHBondContact O-N 2.85Å; Y424-L442 HydrophobicContact CD1-CD1 3.88Å; Y424-L442 HydrophobicContact CD2-CD2 4.29Å; Y424-L442 HydrophobicContact CE1-CD1 3.77Å; Y424-L442 HydrophobicContact CE2-CD2 3.91Å; Y424-L442 HydrophobicContact CG-CD1 4.28Å; Y424-M452 HydrophobicContact CE2-SD 4.27Å; Y424-M452 PolarHBondContact OH-O 3.04Å; Y424-R455 HydrophobicContact CE1-CB 3.99Å; Y424-R455 HydrophobicContact CE2-CB 4.08Å; Y424-F456 WeakPolarHBondContact OH-CA 3.45Å; Y424-F456 PolarHBondContact OH-N 2.88Å; Y424-S459 WeakPolarHBondContact CD1-OG 3.41Å
425	K	90.5	Very high	87.5	Confident	126 Å²	126	45.6 Å²	45.6	55%	0.548	24%	0.24	S	C	.	.	H	α-helix	trans	-60.7	-48.5	172.8	-172.5	-174.2	177.5	-165.5	0	111.4	D421 K422 L423 A427 A428 T429	D421-K425 WeakPolarHBondContact O-CB 3.25Å; D421-K425 PolarHBondContact O-N 3.46Å; K422-K425 PolarHBondContact O-N 3Å; L423-K425 VanDerWaalsContact C-N 3.34Å; L423-K425 PolarHBondContact O-N 3.3Å; K425-A427 PolarHBondContact O-N 3.25Å; K425-A428 WeakPolarHBondContact O-CA 3.28Å; K425-A428 WeakPolarHBondContact O-CB 3.5Å; K425-A428 PolarHBondContact O-N 3.28Å; K425-T429 PolarHBondContact O-N 2.76Å; K425-T429 PolarHBondContact O-OG1 2.89Å; K425-T429 VanDerWaalsContact O-OG1 3.11Å
426	M	89.2	Confident	88.4	Confident	16 Å²	16	43.4 Å²	43.4	8%	0.079	23%	0.228	C	C	.	.	H	α-helix	trans	-61.9	-42.4	177.3	179.6	171.2	55.7	0	0	111.9	F364 T380 L384 K422 L423 A428 T429 S430 I434 T438	F364-M426 HydrophobicContact CE2-CE 3.69Å; F364-M426 HydrophobicContact CE2-SD 4.35Å; F364-M426 HydrophobicContact CZ-CE 3.62Å; T380-M426 HydrophobicContact CG2-SD 3.64Å; L384-M426 HydrophobicContact CD1-CE 4.14Å; L384-M426 HydrophobicContact CD1-SD 4.46Å; L384-M426 HydrophobicContact CD2-CE 4.29Å; K422-M426 WeakPolarHBondContact O-CB 3.33Å; K422-M426 PolarHBondContact O-N 3.12Å; L423-M426 HydrophobicContact CD2-CE 3.76Å; L423-M426 PolarHBondContact O-N 3.15Å; M426-A428 PolarHBondContact O-N 3.07Å; M426-T429 PolarHBondContact O-N 3.31Å; M426-S430 VanDerWaalsContact O-CB 3.23Å; M426-S430 WeakPolarHBondContact O-CB 3.4Å; M426-S430 PolarHBondContact O-N 3.42Å; M426-S430 PolarHBondContact O-OG 3.05Å; M426-I434 HydrophobicContact CG-CG2 4.16Å; M426-I434 HydrophobicContact SD-CG2 4.19Å; M426-T438 HydrophobicContact CE-CG2 3.67Å; M426-T438 WeakPolarHBondContact CE-OG1 3.47Å
427	A	91.4	Very high	89.1	Confident	5 Å²	5	44.1 Å²	44.1	4%	0.041	23%	0.231	C	C	.	.	H	α-helix	trans	-61.2	-26.3	173.4	0	0	0	0	0	112.6	L423 Y424 K425 S435 T438 L439 R463	L423-A427 WeakPolarHBondContact O-CB 3.49Å; L423-A427 PolarHBondContact O-N 2.98Å; Y424-A427 PolarHBondContact O-N 3.22Å; K425-A427 PolarHBondContact O-N 3.25Å; A427-S435 WeakPolarHBondContact O-CB 3.5Å; A427-S435 PolarHBondContact O-OG 3.23Å; A427-T438 HydrophobicContact CB-CG2 3.89Å; A427-L439 HydrophobicContact CB-CD2 4.15Å; A427-L439 HydrophobicContact CB-CG 4.11Å; A427-R463 PolarHBondContact O-NH2 3.38Å
428	A	90.7	Very high	89.7	Confident	58 Å²	58	41.6 Å²	41.6	48%	0.479	22%	0.219	S	C	.	.	H	α-helix	trans	-85.2	-33.9	176.9	0	0	0	0	0	114.1	Y424 K425 M426 R463	Y424-A428 WeakPolarHBondContact O-CB 3.43Å; Y424-A428 PolarHBondContact O-N 2.85Å; K425-A428 WeakPolarHBondContact O-CA 3.28Å; K425-A428 WeakPolarHBondContact O-CB 3.5Å; K425-A428 PolarHBondContact O-N 3.28Å; M426-A428 PolarHBondContact O-N 3.07Å; A428-R463 PolarHBondContact O-NH2 3.48Å
429	T	88.8	Confident	90.3	Very high	105 Å²	105	34.3 Å²	34.3	64%	0.644	19%	0.188	S	C	*	.	H	α-helix	trans	-106.2	-20.7	-170.8	58.6	0	0	0	0	115.8	K425 M426	K425-T429 PolarHBondContact O-N 2.76Å; K425-T429 PolarHBondContact O-OG1 2.89Å; K425-T429 VanDerWaalsContact O-OG1 3.11Å; M426-T429 PolarHBondContact O-N 3.31Å
430	S	87.5	Confident	90.6	Very high	20 Å²	20	33 Å²	33	14%	0.14	18%	0.184	C	C	.	.	S	Bend	trans	-79.8	170.3	-176.8	64.8	0	0	0	0	113.7	M426 I434 S435	M426-S430 VanDerWaalsContact O-CB 3.23Å; M426-S430 WeakPolarHBondContact O-CB 3.4Å; M426-S430 PolarHBondContact O-N 3.42Å; M426-S430 PolarHBondContact O-OG 3.05Å; S430-I434 WeakPolarHBondContact OG-CG2 3.5Å; S430-S435 PolarHBondContact OG-N 3.31Å
431	S	88.1	Confident	90.7	Very high	55 Å²	55	32.4 Å²	32.4	39%	0.385	18%	0.18	S	C	.	.			trans	-61.5	155.5	172.9	61.6	0	0	0	0	111.5	H433 I434 S435	S431-H433 VanDerWaalsContact C-N 3.27Å; S431-H433 PolarHBondContact O-N 3.15Å; S431-H433 VanDerWaalsContact O-N 3.13Å; S431-I434 PolarHBondContact O-N 3.19Å; S431-S435 WeakPolarHBondContact O-CB 3.18Å; S431-S435 PolarHBondContact O-N 3.33Å
432	L	90.9	Very high	90.9	Very high	9 Å²	9	27.3 Å²	27.3	5%	0.047	15%	0.153	C	C	.	.	H	α-helix	trans	-53.5	-39.6	-172.4	178.2	61.4	0	0	0	113.4	S435 L436 R463 D466 T468 L469 V475	L432-S435 PolarHBondContact O-N 2.9Å; L432-L436 HydrophobicContact CD1-CD1 3.79Å; L432-L436 HydrophobicContact CD1-CD2 4.39Å; L432-L436 HydrophobicContact CD1-CG 3.8Å; L432-L436 HydrophobicContact CG-CD1 3.87Å; L432-L436 HydrophobicContact CG-CG 4.31Å; L432-L436 WeakPolarHBondContact O-CB 3.27Å; L432-L436 VanDerWaalsContact O-CG 3.28Å; L432-L436 WeakPolarHBondContact O-CG 3.44Å; L432-L436 PolarHBondContact O-N 2.9Å; L432-R463 VanDerWaalsContact CD1-CD 3.48Å; L432-R463 HydrophobicContact CD1-CG 3.57Å; L432-D466 HydrophobicContact CD1-CB 4.26Å; L432-T468 VanDerWaalsContact CB-OG1 3.3Å; L432-T468 WeakPolarHBondContact CB-OG1 3.36Å; L432-T468 WeakPolarHBondContact CD2-OG1 3.49Å; L432-L469 VanDerWaalsContact CD2-CA 3.43Å; L432-L469 HydrophobicContact CD2-CB 3.72Å; L432-L469 HydrophobicContact CD2-CD1 4.12Å; L432-L469 VanDerWaalsContact CD2-N 3.35Å; L432-V475 HydrophobicContact CD2-CG2 3.79Å; L432-V475 HydrophobicContact CG-CG2 4.28Å
433	H	89	Confident	91	Very high	28 Å²	28	23.8 Å²	23.8	13%	0.13	14%	0.139	C	C	.	.	H	α-helix	trans	-65	-44.3	176.9	-171.5	-53	0	0	0	112.6	R381 S431 S435 Q437 V475	R381-H433 PolarHBondContact NE-CD2 3.24Å; R381-H433 PolarHBondContact NE-CE1 2.82Å; R381-H433 VanDerWaalsContact NE-CE1 3.27Å; R381-H433 PolarHBondContact NE-NE2 2.92Å; R381-H433 PolarHBondContact NH2-CD2 2.95Å; R381-H433 PolarHBondContact NH2-NE2 3.01Å; R381-H433 VanDerWaalsContact NH2-NE2 3.14Å; S431-H433 VanDerWaalsContact C-N 3.27Å; S431-H433 PolarHBondContact O-N 3.15Å; S431-H433 VanDerWaalsContact O-N 3.13Å; H433-S435 VanDerWaalsContact C-N 3.34Å; H433-Q437 WeakPolarHBondContact O-CB 3.37Å; H433-Q437 WeakPolarHBondContact O-CG 3.3Å; H433-Q437 PolarHBondContact O-N 2.96Å; H433-V475 HydrophobicContact CB-CG1 3.81Å
434	I	90.1	Very high	90.8	Very high	7 Å²	7	25.1 Å²	25.1	4%	0.036	15%	0.145	C	C	.	.	H	α-helix	trans	-67.2	-41.3	177.6	-62.4	174	0	0	0	109.2	R377 T380 R381 L384 M426 S430 S431 Q437 T438	R377-I434 HydrophobicContact CB-CD1 4Å; R377-I434 WeakPolarHBondContact O-CD1 3.26Å; T380-I434 HydrophobicContact CG2-CG2 3.93Å; R381-I434 HydrophobicContact CB-CG1 4.21Å; L384-I434 HydrophobicContact CD1-CG2 3.93Å; M426-I434 HydrophobicContact CG-CG2 4.16Å; M426-I434 HydrophobicContact SD-CG2 4.19Å; S430-I434 WeakPolarHBondContact OG-CG2 3.5Å; S431-I434 PolarHBondContact O-N 3.19Å; I434-Q437 PolarHBondContact O-N 3.18Å; I434-T438 WeakPolarHBondContact O-CB 3.47Å; I434-T438 PolarHBondContact O-N 3.27Å; I434-T438 PolarHBondContact O-OG1 3.32Å
435	S	92.7	Very high	90.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.1	-49.3	176	-178.7	0	0	0	0	112.2	A427 S430 S431 L432 H433 T438 L439 R463	A427-S435 WeakPolarHBondContact O-CB 3.5Å; A427-S435 PolarHBondContact O-OG 3.23Å; S430-S435 PolarHBondContact OG-N 3.31Å; S431-S435 WeakPolarHBondContact O-CB 3.18Å; S431-S435 PolarHBondContact O-N 3.33Å; L432-S435 PolarHBondContact O-N 2.9Å; H433-S435 VanDerWaalsContact C-N 3.34Å; S435-T438 WeakPolarHBondContact O-CB 3.43Å; S435-T438 PolarHBondContact O-N 3.4Å; S435-L439 WeakPolarHBondContact O-CB 3.34Å; S435-L439 VanDerWaalsContact O-CG 3.28Å; S435-L439 WeakPolarHBondContact O-CG 3.17Å; S435-L439 PolarHBondContact O-N 2.75Å; S435-R463 PolarHBondContact OG-NE 3.49Å
436	L	94	Very high	90.1	Very high	2 Å²	2	18.1 Å²	18.1	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-66.3	-38.2	178.2	-71.3	171.8	0	0	0	112.6	L432 T438 L439 A440 V475 L478 F479 L482	L432-L436 HydrophobicContact CD1-CD1 3.79Å; L432-L436 HydrophobicContact CD1-CD2 4.39Å; L432-L436 HydrophobicContact CD1-CG 3.8Å; L432-L436 HydrophobicContact CG-CD1 3.87Å; L432-L436 HydrophobicContact CG-CG 4.31Å; L432-L436 WeakPolarHBondContact O-CB 3.27Å; L432-L436 VanDerWaalsContact O-CG 3.28Å; L432-L436 WeakPolarHBondContact O-CG 3.44Å; L432-L436 PolarHBondContact O-N 2.9Å; L436-T438 VanDerWaalsContact C-N 3.34Å; L436-L439 PolarHBondContact O-N 3.34Å; L436-A440 WeakPolarHBondContact O-CB 3.4Å; L436-A440 PolarHBondContact O-N 3.46Å; L436-V475 HydrophobicContact CD1-CB 4.03Å; L436-V475 HydrophobicContact CD1-CG2 4.32Å; L436-L478 HydrophobicContact CB-CD2 3.53Å; L436-L478 HydrophobicContact CB-CG 4.03Å; L436-L478 HydrophobicContact CD1-CD2 4.45Å; L436-F479 HydrophobicContact CD1-CB 4.03Å; L436-F479 HydrophobicContact CD2-CD2 4.06Å; L436-L482 HydrophobicContact CD2-CD2 4.19Å
437	Q	91.9	Very high	89.4	Confident	20 Å²	20	22.4 Å²	22.4	9%	0.093	14%	0.138	C	C	.	.	H	α-helix	trans	-66.4	-37.2	173.5	-73.4	-66	-14.6	0	0	112	L384 V385 N388 H433 I434 A440 L441 L478	L384-Q437 HydrophobicContact CB-CB 3.85Å; L384-Q437 HydrophobicContact CD1-CB 4.15Å; V385-Q437 HydrophobicContact CG2-CG 4.09Å; N388-Q437 PolarHBondContact ND2-O 3.5Å; N388-Q437 PolarHBondContact ND2-OE1 2.7Å; H433-Q437 WeakPolarHBondContact O-CB 3.37Å; H433-Q437 WeakPolarHBondContact O-CG 3.3Å; H433-Q437 PolarHBondContact O-N 2.96Å; I434-Q437 PolarHBondContact O-N 3.18Å; Q437-A440 PolarHBondContact O-N 3.16Å; Q437-L441 PolarHBondContact O-N 3.03Å; Q437-L478 HydrophobicContact CG-CD2 3.79Å
438	T	93.8	Very high	88.6	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66	-42.9	174.7	-52	0	0	0	0	111.1	L384 L423 M426 A427 I434 S435 L436 A440 L441 L442	L384-T438 WeakPolarHBondContact CD1-OG1 3.37Å; L423-T438 HydrophobicContact CB-CG2 4.06Å; L423-T438 HydrophobicContact CD2-CG2 4.03Å; L423-T438 VanDerWaalsContact O-CG2 3.25Å; L423-T438 WeakPolarHBondContact O-CG2 3.44Å; M426-T438 HydrophobicContact CE-CG2 3.67Å; M426-T438 WeakPolarHBondContact CE-OG1 3.47Å; A427-T438 HydrophobicContact CB-CG2 3.89Å; I434-T438 WeakPolarHBondContact O-CB 3.47Å; I434-T438 PolarHBondContact O-N 3.27Å; I434-T438 PolarHBondContact O-OG1 3.32Å; S435-T438 WeakPolarHBondContact O-CB 3.43Å; S435-T438 PolarHBondContact O-N 3.4Å; L436-T438 VanDerWaalsContact C-N 3.34Å; T438-A440 VanDerWaalsContact C-N 3.35Å; T438-L441 PolarHBondContact O-N 3.14Å; T438-L442 HydrophobicContact CG2-CD1 4.28Å; T438-L442 WeakPolarHBondContact O-CG 3.42Å; T438-L442 PolarHBondContact O-N 3.24Å
439	L	94.9	Very high	87.9	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-66.7	-35.3	174.9	-70.4	166.3	0	0	0	111.6	A427 S435 L436 L441 L442 C443 F456 F460 R463 L482	A427-L439 HydrophobicContact CB-CD2 4.15Å; A427-L439 HydrophobicContact CB-CG 4.11Å; S435-L439 WeakPolarHBondContact O-CB 3.34Å; S435-L439 VanDerWaalsContact O-CG 3.28Å; S435-L439 WeakPolarHBondContact O-CG 3.17Å; S435-L439 PolarHBondContact O-N 2.75Å; L436-L439 PolarHBondContact O-N 3.34Å; L439-L441 VanDerWaalsContact C-N 3.34Å; L439-L442 HydrophobicContact CD2-CD1 4.26Å; L439-L442 PolarHBondContact O-N 3.24Å; L439-C443 VanDerWaalsContact O-CB 3.27Å; L439-C443 WeakPolarHBondContact O-CB 3.41Å; L439-C443 PolarHBondContact O-N 2.89Å; L439-F456 HydrophobicContact CB-CE2 4.25Å; L439-F456 HydrophobicContact CD2-CD2 4.21Å; L439-F456 HydrophobicContact CD2-CE2 4.24Å; L439-F456 WeakPolarHBondContact O-CE2 3.47Å; L439-F460 HydrophobicContact CD1-CD2 4.33Å; L439-R463 HydrophobicContact CD1-CB 4.18Å; L439-R463 HydrophobicContact CD1-CG 4.34Å; L439-L482 HydrophobicContact CB-CD2 3.71Å
440	A	92.4	Very high	87.1	Confident	14 Å²	14	26.4 Å²	26.4	12%	0.116	14%	0.144	C	C	.	.	H	α-helix	trans	-64.1	-37.7	172.2	0	0	0	0	0	112.2	L436 Q437 T438 C443 Q444 L482	L436-A440 WeakPolarHBondContact O-CB 3.4Å; L436-A440 PolarHBondContact O-N 3.46Å; Q437-A440 PolarHBondContact O-N 3.16Å; T438-A440 VanDerWaalsContact C-N 3.35Å; A440-C443 PolarHBondContact O-N 3.37Å; A440-Q444 WeakPolarHBondContact O-CG 3.39Å; A440-Q444 PolarHBondContact O-N 3.49Å; A440-L482 HydrophobicContact CB-CD1 4.31Å
441	L	90.2	Very high	86.6	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.5	-49.1	172.3	177	56	0	0	0	111.1	L384 I387 N388 L391 L423 Q437 T438 L439 C443 Q444 L445	L384-L441 HydrophobicContact CD2-CD2 4.01Å; I387-L441 HydrophobicContact CG2-CD1 3.65Å; I387-L441 HydrophobicContact CG2-CD2 4.16Å; N388-L441 VanDerWaalsContact OD1-CA 3.22Å; N388-L441 WeakPolarHBondContact OD1-CA 3.3Å; N388-L441 PolarHBondContact OD1-N 3.36Å; N388-L441 VanDerWaalsContact OD1-N 3.15Å; L391-L441 HydrophobicContact CD2-CD1 3.96Å; L423-L441 HydrophobicContact CD1-CD2 4.3Å; L423-L441 HydrophobicContact CD2-CD2 4.12Å; Q437-L441 PolarHBondContact O-N 3.03Å; T438-L441 PolarHBondContact O-N 3.14Å; L439-L441 VanDerWaalsContact C-N 3.34Å; L441-C443 VanDerWaalsContact C-N 3.29Å; L441-C443 PolarHBondContact O-N 2.87Å; L441-Q444 WeakPolarHBondContact O-CB 3.38Å; L441-Q444 PolarHBondContact O-N 3.3Å; L441-L445 HydrophobicContact CG-CD1 4.45Å; L441-L445 WeakPolarHBondContact O-CG 3.5Å; L441-L445 PolarHBondContact O-N 3.08Å
442	L	91.7	Very high	86.3	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-56.8	-42	176	-73.2	164.5	0	0	0	111.9	V420 L423 Y424 T438 L439 Q444 L445 L446 F456	V420-L442 HydrophobicContact CG2-CD2 4.44Å; L423-L442 HydrophobicContact CB-CD1 4.27Å; L423-L442 HydrophobicContact CB-CD2 3.94Å; L423-L442 HydrophobicContact CB-CG 4.21Å; L423-L442 HydrophobicContact CD1-CD2 3.95Å; L423-L442 HydrophobicContact CD1-CG 4.42Å; Y424-L442 HydrophobicContact CD1-CD1 3.88Å; Y424-L442 HydrophobicContact CD2-CD2 4.29Å; Y424-L442 HydrophobicContact CE1-CD1 3.77Å; Y424-L442 HydrophobicContact CE2-CD2 3.91Å; Y424-L442 HydrophobicContact CG-CD1 4.28Å; T438-L442 HydrophobicContact CG2-CD1 4.28Å; T438-L442 WeakPolarHBondContact O-CG 3.42Å; T438-L442 PolarHBondContact O-N 3.24Å; L439-L442 HydrophobicContact CD2-CD1 4.26Å; L439-L442 PolarHBondContact O-N 3.24Å; L442-Q444 PolarHBondContact O-N 3.45Å; L442-L445 HydrophobicContact CD2-CD1 4.48Å; L442-L445 WeakPolarHBondContact O-CA 3.41Å; L442-L445 WeakPolarHBondContact O-CB 3.17Å; L442-L445 PolarHBondContact O-N 3.39Å; L442-L446 WeakPolarHBondContact O-CG 3.32Å; L442-L446 PolarHBondContact O-N 3.13Å; L442-L446 VanDerWaalsContact O-N 3.1Å; L442-F456 HydrophobicContact CB-CD2 4.23Å
443	C	90.4	Very high	86.1	Confident	12 Å²	12	31.3 Å²	31.3	8%	0.081	16%	0.164	C	C	.	.	H	α-helix	trans	-59.8	-31.7	175.5	-172	0	0	0	0	112.9	L439 A440 L441 L445 F456 L482	L439-C443 VanDerWaalsContact O-CB 3.27Å; L439-C443 WeakPolarHBondContact O-CB 3.41Å; L439-C443 PolarHBondContact O-N 2.89Å; A440-C443 PolarHBondContact O-N 3.37Å; L441-C443 VanDerWaalsContact C-N 3.29Å; L441-C443 PolarHBondContact O-N 2.87Å; C443-L445 VanDerWaalsContact C-N 3.35Å; C443-F456 HydrophobicContact CB-CE2 3.79Å; C443-F456 HydrophobicContact CB-CZ 3.84Å; C443-L482 HydrophobicContact CB-CD1 3.75Å
444	Q	86.5	Confident	86.1	Confident	28 Å²	28	33 Å²	33	13%	0.131	17%	0.174	C	C	.	.	H	α-helix	trans	-78.3	-16.5	173	-65.9	-168.9	60.9	0	0	113.4	N388 L391 K395 A440 L441 L442	N388-Q444 PolarHBondContact O-NE2 2.95Å; N388-Q444 PolarHBondContact OD1-NE2 3.43Å; L391-Q444 HydrophobicContact CD2-CB 4.12Å; K395-Q444 PolarHBondContact NZ-O 3.49Å; A440-Q444 WeakPolarHBondContact O-CG 3.39Å; A440-Q444 PolarHBondContact O-N 3.49Å; L441-Q444 WeakPolarHBondContact O-CB 3.38Å; L441-Q444 PolarHBondContact O-N 3.3Å; L442-Q444 PolarHBondContact O-N 3.45Å
445	L	84.2	Confident	86.2	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-91.4	-19.3	176.8	-61.3	170	0	0	0	112.7	I416 M417 V420 L423 L441 L442 C443 D447 I448 S449 M452	I416-L445 HydrophobicContact CB-CD1 4.36Å; I416-L445 HydrophobicContact CB-CD2 4.4Å; I416-L445 HydrophobicContact CD1-CD2 4.05Å; I416-L445 HydrophobicContact CG2-CD1 3.51Å; I416-L445 HydrophobicContact CG2-CD2 4.31Å; M417-L445 HydrophobicContact SD-CB 4.19Å; M417-L445 HydrophobicContact SD-CD1 4.5Å; V420-L445 HydrophobicContact CG2-CD1 4.4Å; L423-L445 HydrophobicContact CD1-CD1 4.09Å; L441-L445 HydrophobicContact CG-CD1 4.45Å; L441-L445 WeakPolarHBondContact O-CG 3.5Å; L441-L445 PolarHBondContact O-N 3.08Å; L442-L445 HydrophobicContact CD2-CD1 4.48Å; L442-L445 WeakPolarHBondContact O-CA 3.41Å; L442-L445 WeakPolarHBondContact O-CB 3.17Å; L442-L445 PolarHBondContact O-N 3.39Å; C443-L445 VanDerWaalsContact C-N 3.35Å; L445-D447 PolarHBondContact O-N 3.45Å; L445-D447 VanDerWaalsContact O-N 3.15Å; L445-I448 HydrophobicContact CD2-CD1 4.01Å; L445-I448 WeakPolarHBondContact O-CB 3.45Å; L445-I448 PolarHBondContact O-N 3.01Å; L445-S449 PolarHBondContact O-N 3.14Å; L445-M452 HydrophobicContact CB-CE 3.7Å
446	L	84.1	Confident	86.4	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-25	173.1	-59	178.8	0	0	0	112.4	L442 I448 S449 M452 F456 R489	L442-L446 WeakPolarHBondContact O-CG 3.32Å; L442-L446 PolarHBondContact O-N 3.13Å; L442-L446 VanDerWaalsContact O-N 3.1Å; L446-I448 PolarHBondContact O-N 3.43Å; L446-S449 CarbonylContact O-C 3.56Å; L446-M452 HydrophobicContact CD2-CB 3.48Å; L446-M452 VanDerWaalsContact CD2-CB 3.48Å; L446-M452 HydrophobicContact CD2-CE 4.33Å; L446-F456 HydrophobicContact CD1-CB 4Å; L446-F456 HydrophobicContact CD1-CD1 3.52Å; L446-F456 HydrophobicContact CD1-CD2 4.31Å; L446-F456 HydrophobicContact CD1-CE1 4.05Å; L446-F456 HydrophobicContact CD1-CG 3.66Å; L446-F456 HydrophobicContact CD2-CB 3.9Å; L446-F456 HydrophobicContact CD2-CG 4.41Å; L446-F456 HydrophobicContact CG-CB 4.46Å; L446-F456 HydrophobicContact CG-CG 4.45Å; L446-R489 VanDerWaalsContact CB-NH2 3.31Å; L446-R489 PolarHBondContact O-NH2 2.9Å
447	D	74	Confident	86.4	Confident	106 Å²	106	39.1 Å²	39.1	57%	0.567	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-20.8	172	-61.5	-28.2	0	0	0	113.4	K395 L445 R489	K395-D447 IonicContact NZ-OD2 2.7Å; K395-D447 PolarHBondContact NZ-OD2 3.49Å; L445-D447 PolarHBondContact O-N 3.45Å; L445-D447 VanDerWaalsContact O-N 3.15Å; D447-R489 IonicContact OD1-CZ 2.76Å; D447-R489 IonicContact OD1-NH1 3.96Å; D447-R489 PolarHBondContact OD1-NH1 3.23Å
448	I	74.6	Confident	86.6	Confident	77 Å²	77	44 Å²	44	40%	0.395	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-36.4	-173.9	-51.4	177.7	0	0	0	111	T413 L445 L446	T413-I448 HydrophobicContact CG2-CD1 3.93Å; L445-I448 HydrophobicContact CD2-CD1 4.01Å; L445-I448 WeakPolarHBondContact O-CB 3.45Å; L445-I448 PolarHBondContact O-N 3.01Å; L446-I448 PolarHBondContact O-N 3.43Å
449	S	75.5	Confident	86.6	Confident	24 Å²	24	45.7 Å²	45.7	17%	0.168	23%	0.225	C	C	.	.			trans	-141.9	117.6	177.7	166.3	0	0	0	0	110.2	L445 L446 D451	L445-S449 PolarHBondContact O-N 3.14Å; L446-S449 CarbonylContact O-C 3.56Å; S449-D451 VanDerWaalsContact C-N 3.3Å; S449-D451 PolarHBondContact OG-OD2 3.11Å
450	Q	73.4	Confident	86.7	Confident	152 Å²	152	45.7 Å²	45.7	71%	0.71	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-72.6	-23.2	176.6	-67.9	179.8	-13.4	0	0	112.3	M452 D453	Q450-M452 PolarHBondContact O-N 3.19Å; Q450-D453 WeakPolarHBondContact O-CB 3.34Å; Q450-D453 PolarHBondContact O-N 3.24Å
451	D	76.6	Confident	86.9	Confident	146 Å²	146	45 Å²	45	78%	0.781	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-58.8	-16.8	177.8	-44.1	-62.2	0	0	0	113.2	S449	S449-D451 VanDerWaalsContact C-N 3.3Å; S449-D451 PolarHBondContact OG-OD2 3.11Å
452	M	81.8	Confident	87.1	Confident	12 Å²	12	54 Å²	54	6%	0.059	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-84.5	-14.3	176.8	-68.2	-150.7	-63.6	0	0	114.8	M417 V420 Y424 L445 L446 Q450 D454 R455 F456	M417-M452 HydrophobicContact CE-CE 3.79Å; M417-M452 HydrophobicContact CE-SD 3.91Å; M417-M452 HydrophobicContact SD-CE 3.72Å; M417-M452 HydrophobicContact SD-SD 4.36Å; V420-M452 HydrophobicContact CB-SD 4.4Å; V420-M452 HydrophobicContact CG1-SD 3.59Å; V420-M452 VanDerWaalsContact CG1-SD 3.59Å; V420-M452 HydrophobicContact CG2-CE 4.44Å; V420-M452 HydrophobicContact CG2-SD 3.9Å; Y424-M452 HydrophobicContact CE2-SD 4.27Å; Y424-M452 PolarHBondContact OH-O 3.04Å; L445-M452 HydrophobicContact CB-CE 3.7Å; L446-M452 HydrophobicContact CD2-CB 3.48Å; L446-M452 VanDerWaalsContact CD2-CB 3.48Å; L446-M452 HydrophobicContact CD2-CE 4.33Å; Q450-M452 PolarHBondContact O-N 3.19Å; M452-D454 PolarHBondContact O-N 3.1Å; M452-R455 PolarHBondContact O-N 2.91Å; M452-R455 VanDerWaalsContact O-N 3.12Å; M452-F456 PolarHBondContact O-N 3.41Å
453	D	86.3	Confident	87.1	Confident	29 Å²	29	55.9 Å²	55.9	16%	0.155	26%	0.261	C	S	.	.	H	α-helix	trans	-54.4	-52.4	-172.5	-80.7	-25.1	0	0	0	111	Q450 R455 F456 Y457 R489	Q450-D453 WeakPolarHBondContact O-CB 3.34Å; Q450-D453 PolarHBondContact O-N 3.24Å; D453-R455 VanDerWaalsContact C-N 3.31Å; D453-R455 PolarHBondContact O-N 3.47Å; D453-F456 WeakPolarHBondContact O-CB 3.13Å; D453-F456 PolarHBondContact O-N 2.77Å; D453-Y457 HydrophobicContact CB-CD2 4.21Å; D453-Y457 HydrophobicContact CB-CE2 4Å; D453-Y457 WeakPolarHBondContact O-CD2 3.29Å; D453-Y457 PolarHBondContact O-N 3.49Å; D453-R489 IonicContact OD1-NE 2.76Å; D453-R489 PolarHBondContact OD1-NE 3.25Å; D453-R489 IonicContact OD1-NH2 3.85Å
454	D	89.5	Confident	87.4	Confident	64 Å²	64	55.4 Å²	55.4	34%	0.342	26%	0.257	S	S	.	.	H	α-helix	trans	-58.5	-38.5	179.8	-103.3	42	0	0	0	113.6	M452 R458 R495 N569	M452-D454 PolarHBondContact O-N 3.1Å; D454-R458 WeakPolarHBondContact O-CB 3.46Å; D454-R458 PolarHBondContact O-N 2.77Å; D454-R458 VanDerWaalsContact O-N 3.13Å; D454-R495 IonicContact OD1-CZ 3.35Å; D454-R495 IonicContact OD1-NH1 3.6Å; D454-R495 PolarHBondContact OD1-NH1 2.87Å; D454-N569 PolarHBondContact OD2-ND2 3.15Å
455	R	92.8	Very high	87.6	Confident	135 Å²	135	58.4 Å²	58.4	51%	0.509	27%	0.274	S	S	.	.	H	α-helix	trans	-69.2	-39.8	176	-66.9	-172.7	-179.9	-160.7	5.2	111.2	D421 Y424 M452 D453 S459	D421-R455 IonicContact OD1-NH1 2.96Å; D421-R455 PolarHBondContact OD1-NH1 3.24Å; Y424-R455 HydrophobicContact CE1-CB 3.99Å; Y424-R455 HydrophobicContact CE2-CB 4.08Å; M452-R455 PolarHBondContact O-N 2.91Å; M452-R455 VanDerWaalsContact O-N 3.12Å; D453-R455 VanDerWaalsContact C-N 3.31Å; D453-R455 PolarHBondContact O-N 3.47Å; R455-S459 WeakPolarHBondContact O-CB 3.45Å; R455-S459 PolarHBondContact O-N 2.84Å; R455-S459 VanDerWaalsContact O-N 3.1Å; R455-S459 PolarHBondContact O-OG 3.48Å
456	F	95.3	Very high	88	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.8	-57.5	177.9	169.2	-100.4	0	0	0	111.4	Y424 L439 L442 C443 L446 M452 D453 R458 S459 F460 L482 A486	Y424-F456 WeakPolarHBondContact OH-CA 3.45Å; Y424-F456 PolarHBondContact OH-N 2.88Å; L439-F456 HydrophobicContact CB-CE2 4.25Å; L439-F456 HydrophobicContact CD2-CD2 4.21Å; L439-F456 HydrophobicContact CD2-CE2 4.24Å; L439-F456 WeakPolarHBondContact O-CE2 3.47Å; L442-F456 HydrophobicContact CB-CD2 4.23Å; C443-F456 HydrophobicContact CB-CE2 3.79Å; C443-F456 HydrophobicContact CB-CZ 3.84Å; L446-F456 HydrophobicContact CD1-CB 4Å; L446-F456 HydrophobicContact CD1-CD1 3.52Å; L446-F456 HydrophobicContact CD1-CD2 4.31Å; L446-F456 HydrophobicContact CD1-CE1 4.05Å; L446-F456 HydrophobicContact CD1-CG 3.66Å; L446-F456 HydrophobicContact CD2-CB 3.9Å; L446-F456 HydrophobicContact CD2-CG 4.41Å; L446-F456 HydrophobicContact CG-CB 4.46Å; L446-F456 HydrophobicContact CG-CG 4.45Å; M452-F456 PolarHBondContact O-N 3.41Å; D453-F456 WeakPolarHBondContact O-CB 3.13Å; D453-F456 PolarHBondContact O-N 2.77Å; F456-R458 VanDerWaalsContact C-N 3.32Å; F456-R458 PolarHBondContact O-N 3.47Å; F456-S459 WeakPolarHBondContact O-CA 3.25Å; F456-S459 WeakPolarHBondContact O-CB 3.25Å; F456-S459 PolarHBondContact O-N 3.19Å; F456-F460 HydrophobicContact CZ-CB 4.44Å; F456-F460 PolarHBondContact O-N 3.41Å; F456-L482 HydrophobicContact CZ-CD1 4.18Å; F456-A486 HydrophobicContact CE1-CB 3.89Å; F456-A486 HydrophobicContact CZ-CB 4.16Å
457	Y	95.1	Very high	88.2	Confident	1 Å²	1	63.8 Å²	63.8	0%	0.004	31%	0.307	C	S	.	.	H	α-helix	trans	-64.2	-36.3	-176.8	-67.8	-74	0	0	0	111.8	D453 S459 F460 Y461 A486 D490 R495 I499	D453-Y457 HydrophobicContact CB-CD2 4.21Å; D453-Y457 HydrophobicContact CB-CE2 4Å; D453-Y457 WeakPolarHBondContact O-CD2 3.29Å; D453-Y457 PolarHBondContact O-N 3.49Å; Y457-S459 VanDerWaalsContact C-N 3.33Å; Y457-S459 PolarHBondContact O-N 2.8Å; Y457-F460 PolarHBondContact O-N 2.92Å; Y457-Y461 WeakPolarHBondContact O-CB 3.19Å; Y457-Y461 PolarHBondContact O-N 2.92Å; Y457-A486 HydrophobicContact CE1-CB 3.98Å; Y457-A486 PolarHBondContact OH-O 3.22Å; Y457-A486 VanDerWaalsContact OH-O 3.07Å; Y457-D490 HydrophobicContact CE1-CB 4.16Å; Y457-R495 HydrophobicContact CG-CG 4.39Å; Y457-I499 HydrophobicContact CD1-CD1 3.81Å
458	R	95	Very high	89	Confident	124 Å²	124	61.6 Å²	61.6	47%	0.468	30%	0.298	S	S	.	.	H	α-helix	trans	-57.7	-43.1	169.6	169	164.4	177.7	-175.3	-4.2	112.7	D454 F456 R462 R568	D454-R458 WeakPolarHBondContact O-CB 3.46Å; D454-R458 PolarHBondContact O-N 2.77Å; D454-R458 VanDerWaalsContact O-N 3.13Å; F456-R458 VanDerWaalsContact C-N 3.32Å; F456-R458 PolarHBondContact O-N 3.47Å; R458-R462 WeakPolarHBondContact O-CB 3.37Å; R458-R462 PolarHBondContact O-N 3.01Å; R458-R462 VanDerWaalsContact O-N 3.14Å; R458-R568 WeakPolarHBondContact CG-O 3.23Å
459	S	95.6	Very high	89.8	Confident	34 Å²	34	58 Å²	58	24%	0.238	28%	0.279	C	S	.	.	H	α-helix	trans	-71	-43.2	-179.2	-59.1	0	0	0	0	111.9	Y424 R455 F456 Y457 R463	Y424-S459 WeakPolarHBondContact CD1-OG 3.41Å; R455-S459 WeakPolarHBondContact O-CB 3.45Å; R455-S459 PolarHBondContact O-N 2.84Å; R455-S459 VanDerWaalsContact O-N 3.1Å; R455-S459 PolarHBondContact O-OG 3.48Å; F456-S459 WeakPolarHBondContact O-CA 3.25Å; F456-S459 WeakPolarHBondContact O-CB 3.25Å; F456-S459 PolarHBondContact O-N 3.19Å; Y457-S459 VanDerWaalsContact C-N 3.33Å; Y457-S459 PolarHBondContact O-N 2.8Å; S459-R463 PolarHBondContact O-N 2.98Å
460	F	96	Very high	90.4	Very high	1 Å²	1	60.6 Å²	60.6	0%	0.004	29%	0.285	C	S	.	.	H	α-helix	trans	-64.9	-49.7	176.2	-178.2	-101.1	0	0	0	111.9	L439 F456 Y457 R462 R463 M464 F479 L482 L483 I499	L439-F460 HydrophobicContact CD1-CD2 4.33Å; F456-F460 HydrophobicContact CZ-CB 4.44Å; F456-F460 PolarHBondContact O-N 3.41Å; Y457-F460 PolarHBondContact O-N 2.92Å; F460-R462 VanDerWaalsContact C-N 3.27Å; F460-R462 PolarHBondContact O-N 3.47Å; F460-R463 PolarHBondContact O-N 3.43Å; F460-M464 HydrophobicContact CD1-SD 4.33Å; F460-M464 HydrophobicContact CE1-CG 4.33Å; F460-M464 HydrophobicContact CE1-SD 3.98Å; F460-M464 PolarHBondContact O-N 2.82Å; F460-M464 VanDerWaalsContact O-N 3.08Å; F460-F479 HydrophobicContact CE2-CD2 4.28Å; F460-F479 HydrophobicContact CE2-CE2 4.09Å; F460-F479 HydrophobicContact CZ-CD2 4.28Å; F460-F479 AromaticContact CZ-CE2 3.73Å; F460-F479 HydrophobicContact CZ-CE2 3.73Å; F460-F479 HydrophobicContact CZ-CZ 4.49Å; F460-L482 HydrophobicContact CD2-CD2 3.92Å; F460-L482 HydrophobicContact CD2-CG 4.2Å; F460-L482 HydrophobicContact CE2-CB 4.46Å; F460-L482 HydrophobicContact CE2-CD2 3.78Å; F460-L482 HydrophobicContact CE2-CG 3.82Å; F460-L483 HydrophobicContact CE1-CD1 3.63Å; F460-L483 HydrophobicContact CZ-CB 3.97Å; F460-L483 HydrophobicContact CZ-CD1 3.78Å; F460-L483 HydrophobicContact CZ-CG 4.49Å; F460-I499 HydrophobicContact CE1-CG2 4.29Å
461	Y	95.8	Very high	90.9	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-58.7	-37.1	177.9	-172.9	-125.1	0	0	0	112.5	Y457 M464 A498 I499 R502 Y563 A567 P570	Y457-Y461 WeakPolarHBondContact O-CB 3.19Å; Y457-Y461 PolarHBondContact O-N 2.92Å; Y461-M464 HydrophobicContact CD2-SD 4.3Å; Y461-A498 HydrophobicContact CE2-CB 4.35Å; Y461-A498 WeakPolarHBondContact CE2-O 3.46Å; Y461-I499 HydrophobicContact CD2-CG1 3.89Å; Y461-I499 HydrophobicContact CE2-CG1 4.47Å; Y461-R502 HydrophobicContact CD2-CB 4.41Å; Y461-R502 HydrophobicContact CE2-CB 3.62Å; Y461-R502 HydrophobicContact CE2-CG 4.16Å; Y461-R502 PolarHBondContact O-NH1 3.42Å; Y461-R502 PolarHBondContact OH-NH2 3.41Å; Y461-Y563 PolarHBondContact OH-OH 3.1Å; Y461-A567 WeakPolarHBondContact CE1-O 3.48Å; Y461-P570 HydrophobicContact CD1-CB 3.66Å; Y461-P570 VanDerWaalsContact CD1-CD 3.49Å; Y461-P570 HydrophobicContact CD1-CG 3.98Å; Y461-P570 HydrophobicContact CD2-CB 3.97Å; Y461-P570 HydrophobicContact CE1-CB 3.83Å; Y461-P570 HydrophobicContact CE2-CB 4.13Å; Y461-P570 HydrophobicContact CG-CB 3.73Å; Y461-P570 HydrophobicContact CG-CG 3.92Å
462	R	94.4	Very high	91.3	Very high	189 Å²	189	52.7 Å²	52.7	71%	0.713	26%	0.258	S	S	*	.	H	α-helix	trans	-66.7	-42.4	171.6	-177.6	178.3	179.8	175.9	1.1	112	R458 F460 M464 L465	R458-R462 WeakPolarHBondContact O-CB 3.37Å; R458-R462 PolarHBondContact O-N 3.01Å; R458-R462 VanDerWaalsContact O-N 3.14Å; F460-R462 VanDerWaalsContact C-N 3.27Å; F460-R462 PolarHBondContact O-N 3.47Å; R462-M464 VanDerWaalsContact C-N 3.26Å; R462-M464 PolarHBondContact O-N 3.19Å; R462-L465 PolarHBondContact O-N 3.39Å
463	R	93.5	Very high	91.4	Very high	39 Å²	39	56 Å²	56	15%	0.147	28%	0.283	C	S	.	.	H	α-helix	trans	-67.9	-23.5	-178	-171	54.9	60.5	-174.2	3.2	113.1	A427 A428 L432 S435 L439 S459 F460 L465 D466	A427-R463 PolarHBondContact O-NH2 3.38Å; A428-R463 PolarHBondContact O-NH2 3.48Å; L432-R463 VanDerWaalsContact CD1-CD 3.48Å; L432-R463 HydrophobicContact CD1-CG 3.57Å; S435-R463 PolarHBondContact OG-NE 3.49Å; L439-R463 HydrophobicContact CD1-CB 4.18Å; L439-R463 HydrophobicContact CD1-CG 4.34Å; S459-R463 PolarHBondContact O-N 2.98Å; F460-R463 PolarHBondContact O-N 3.43Å; R463-L465 PolarHBondContact O-N 3.45Å; R463-D466 IonicContact CZ-OD2 3.31Å; R463-D466 IonicContact NH1-OD2 3.78Å; R463-D466 PolarHBondContact NH1-OD2 2.99Å; R463-D466 WeakPolarHBondContact O-CB 3.26Å; R463-D466 PolarHBondContact O-N 2.9Å; R463-D466 VanDerWaalsContact O-N 3.09Å
464	M	94.6	Very high	91.2	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.01	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.6	171.5	-67.6	174.6	69.5	0	0	113.9	F460 Y461 R462 D466 F479 I499 R502 L503 I506	F460-M464 HydrophobicContact CD1-SD 4.33Å; F460-M464 HydrophobicContact CE1-CG 4.33Å; F460-M464 HydrophobicContact CE1-SD 3.98Å; F460-M464 PolarHBondContact O-N 2.82Å; F460-M464 VanDerWaalsContact O-N 3.08Å; Y461-M464 HydrophobicContact CD2-SD 4.3Å; R462-M464 VanDerWaalsContact C-N 3.26Å; R462-M464 PolarHBondContact O-N 3.19Å; M464-D466 VanDerWaalsContact C-N 3.27Å; M464-D466 PolarHBondContact O-N 3.25Å; M464-F479 HydrophobicContact CE-CZ 4.46Å; M464-F479 HydrophobicContact CG-CE2 4Å; M464-F479 HydrophobicContact CG-CZ 4.26Å; M464-I499 HydrophobicContact CE-CG2 4.23Å; M464-I499 HydrophobicContact SD-CG2 3.89Å; M464-R502 HydrophobicContact CE-CB 4.34Å; M464-R502 HydrophobicContact CE-CG 4.29Å; M464-L503 HydrophobicContact CE-CB 3.87Å; M464-L503 HydrophobicContact CE-CD1 4.22Å; M464-I506 HydrophobicContact CB-CD1 3.89Å; M464-I506 HydrophobicContact CE-CD1 4.09Å; M464-I506 WeakPolarHBondContact O-CD1 3.35Å
465	L	92.1	Very high	91.1	Very high	92 Å²	92	57.4 Å²	57.4	48%	0.482	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	1.3	177.6	-62.8	179.4	0	0	0	113.7	R462 R463 P467 R502	R462-L465 PolarHBondContact O-N 3.39Å; R463-L465 PolarHBondContact O-N 3.45Å; L465-P467 WeakPolarHBondContact O-CD 3.48Å; L465-R502 HydrophobicContact CD2-CG 4.22Å
466	D	91.5	Very high	91	Very high	27 Å²	27	51.2 Å²	51.2	14%	0.144	26%	0.258	C	S	.	.			trans	-65.3	119.4	177.6	-163.4	-48.5	0	0	0	110.5	L432 R463 M464 T468 L469	L432-D466 HydrophobicContact CD1-CB 4.26Å; R463-D466 IonicContact CZ-OD2 3.31Å; R463-D466 IonicContact NH1-OD2 3.78Å; R463-D466 PolarHBondContact NH1-OD2 2.99Å; R463-D466 WeakPolarHBondContact O-CB 3.26Å; R463-D466 PolarHBondContact O-N 2.9Å; R463-D466 VanDerWaalsContact O-N 3.09Å; M464-D466 VanDerWaalsContact C-N 3.27Å; M464-D466 PolarHBondContact O-N 3.25Å; D466-T468 PolarHBondContact O-N 3.05Å; D466-T468 VanDerWaalsContact O-N 3.08Å; D466-T468 WeakPolarHBondContact OD1-CB 3.34Å; D466-T468 PolarHBondContact OD1-N 3.13Å; D466-T468 VanDerWaalsContact OD1-N 3.1Å; D466-T468 PolarHBondContact OD1-OG1 3.48Å; D466-L469 VanDerWaalsContact O-CB 3.27Å; D466-L469 WeakPolarHBondContact O-CB 3.34Å; D466-L469 PolarHBondContact O-N 2.9Å
467	P	89.7	Confident	90.7	Very high	85 Å²	85	53.2 Å²	53.2	55%	0.552	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-26	-176.9	-25.6	35.3	0	0	0	113.7	L465 L469 R470	L465-P467 WeakPolarHBondContact O-CD 3.48Å; P467-L469 PolarHBondContact O-N 3.48Å; P467-R470 PolarHBondContact O-N 2.94Å
468	T	90.3	Very high	90.4	Very high	60 Å²	60	54.7 Å²	54.7	37%	0.368	29%	0.287	S	S	.	.	H	α-helix	trans	-68.1	-18.2	178.4	63.3	0	0	0	0	113.1	L432 D466 R470 S471 S472	L432-T468 VanDerWaalsContact CB-OG1 3.3Å; L432-T468 WeakPolarHBondContact CB-OG1 3.36Å; L432-T468 WeakPolarHBondContact CD2-OG1 3.49Å; D466-T468 PolarHBondContact O-N 3.05Å; D466-T468 VanDerWaalsContact O-N 3.08Å; D466-T468 WeakPolarHBondContact OD1-CB 3.34Å; D466-T468 PolarHBondContact OD1-N 3.13Å; D466-T468 VanDerWaalsContact OD1-N 3.1Å; D466-T468 PolarHBondContact OD1-OG1 3.48Å; T468-R470 VanDerWaalsContact C-N 3.31Å; T468-R470 PolarHBondContact O-N 3.37Å; T468-S471 PolarHBondContact O-N 2.64Å; T468-S471 PolarHBondContact O-OG 3.26Å; T468-S472 VanDerWaalsContact O-CB 3.3Å; T468-S472 WeakPolarHBondContact O-CB 3.45Å; T468-S472 PolarHBondContact O-N 3.1Å
469	L	91.7	Very high	90.4	Very high	1 Å²	1	49 Å²	49	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-65.6	-33.7	177.6	-177.5	59.9	0	0	0	112.3	L432 D466 P467 V475 H476 F479 F514	L432-L469 VanDerWaalsContact CD2-CA 3.43Å; L432-L469 HydrophobicContact CD2-CB 3.72Å; L432-L469 HydrophobicContact CD2-CD1 4.12Å; L432-L469 VanDerWaalsContact CD2-N 3.35Å; D466-L469 VanDerWaalsContact O-CB 3.27Å; D466-L469 WeakPolarHBondContact O-CB 3.34Å; D466-L469 PolarHBondContact O-N 2.9Å; P467-L469 PolarHBondContact O-N 3.48Å; L469-V475 HydrophobicContact CD1-CG2 4.43Å; L469-H476 PolarHBondContact O-CD2 3.29Å; L469-H476 PolarHBondContact O-NE2 3.46Å; L469-F479 HydrophobicContact CD1-CB 4.01Å; L469-F479 HydrophobicContact CD1-CD1 3.96Å; L469-F479 HydrophobicContact CD1-CD2 3.93Å; L469-F479 HydrophobicContact CD1-CE1 4.46Å; L469-F479 HydrophobicContact CD1-CE2 4.44Å; L469-F479 HydrophobicContact CD1-CG 3.67Å; L469-F479 HydrophobicContact CD2-CD2 4.2Å; L469-F479 HydrophobicContact CD2-CE1 4.3Å; L469-F479 HydrophobicContact CD2-CE2 3.9Å; L469-F479 HydrophobicContact CD2-CZ 3.96Å; L469-F514 HydrophobicContact CD1-CE2 4.24Å; L469-F514 HydrophobicContact CG-CE2 4.16Å; L469-F514 HydrophobicContact CG-CZ 4.38Å
470	R	87.3	Confident	90.2	Very high	80 Å²	80	47.9 Å²	47.9	30%	0.302	26%	0.257	S	S	.	.	H	α-helix	trans	-76.8	-28	178.5	-69.1	-174	-65	-92.7	-1.1	113.1	P467 T468 I506 T509 A510 P511	P467-R470 PolarHBondContact O-N 2.94Å; T468-R470 VanDerWaalsContact C-N 3.31Å; T468-R470 PolarHBondContact O-N 3.37Å; R470-I506 HydrophobicContact CG-CG2 3.88Å; R470-T509 VanDerWaalsContact CD-OG1 3.23Å; R470-T509 WeakPolarHBondContact CD-OG1 3.35Å; R470-A510 HydrophobicContact CG-CB 4.49Å; R470-P511 WeakPolarHBondContact O-CD 3.45Å
471	S	84.4	Confident	89.9	Confident	97 Å²	97	53.6 Å²	53.6	68%	0.678	28%	0.283	S	S	*	.	H	α-helix	trans	-101.8	-25.3	-172.8	51.2	0	0	0	0	114.9	T468 S473	T468-S471 PolarHBondContact O-N 2.64Å; T468-S471 PolarHBondContact O-OG 3.26Å; S471-S473 PolarHBondContact O-N 3.42Å
472	S	85.1	Confident	89.7	Confident	34 Å²	34	53.7 Å²	53.7	24%	0.238	28%	0.284	C	S	.	.			trans	-95.3	94.2	-177.3	-175	0	0	0	0	111.9	T468 R474 V475 H476	T468-S472 VanDerWaalsContact O-CB 3.3Å; T468-S472 WeakPolarHBondContact O-CB 3.45Å; T468-S472 PolarHBondContact O-N 3.1Å; S472-R474 VanDerWaalsContact C-N 3.25Å; S472-R474 PolarHBondContact O-N 3.32Å; S472-V475 VanDerWaalsContact O-CG2 3.27Å; S472-V475 WeakPolarHBondContact O-CG2 3.33Å; S472-V475 PolarHBondContact O-N 2.88Å; S472-H476 PolarHBondContact O-CD2 3.08Å; S472-H476 PolarHBondContact O-NE2 3.15Å
473	S	84.2	Confident	89.6	Confident	83 Å²	83	44.7 Å²	44.7	58%	0.58	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-56.5	-38.1	174.2	53.3	0	0	0	0	112.7	S471 V475 H476	S471-S473 PolarHBondContact O-N 3.42Å; S473-V475 PolarHBondContact O-N 3.24Å; S473-H476 WeakPolarHBondContact O-CB 3.13Å; S473-H476 PolarHBondContact O-N 3.37Å
474	R	80.6	Confident	89.5	Confident	116 Å²	116	46.9 Å²	46.9	44%	0.438	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-57.8	-18.9	-179	-63.9	-169.3	-179.7	88.8	12.9	114.6	S472 E780 E784	S472-R474 VanDerWaalsContact C-N 3.25Å; S472-R474 PolarHBondContact O-N 3.32Å; R474-E780 IonicContact CZ-OE1 2.89Å; R474-E780 IonicContact CZ-OE2 3.34Å; R474-E780 VanDerWaalsContact CZ-OE2 3.23Å; R474-E780 IonicContact NE-OE2 2.69Å; R474-E780 PolarHBondContact NE-OE2 2.99Å; R474-E780 IonicContact NH2-OE1 2.87Å; R474-E780 PolarHBondContact NH2-OE1 3.11Å; R474-E780 IonicContact NH2-OE2 2.69Å; R474-E780 PolarHBondContact NH2-OE2 3.05Å; R474-E784 WeakPolarHBondContact CD-OE1 3.35Å; R474-E784 IonicContact CZ-OE1 3.61Å; R474-E784 IonicContact NE-OE1 2.66Å; R474-E784 IonicContact NH1-OE1 3.56Å; R474-E784 PolarHBondContact NH1-OE1 3.48Å
475	V	88.1	Confident	89.2	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.03	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-100.2	-8.2	174.1	-58	0	0	0	0	114.5	L432 H433 L436 L469 S472 S473 G477 L478 F479	L432-V475 HydrophobicContact CD2-CG2 3.79Å; L432-V475 HydrophobicContact CG-CG2 4.28Å; H433-V475 HydrophobicContact CB-CG1 3.81Å; L436-V475 HydrophobicContact CD1-CB 4.03Å; L436-V475 HydrophobicContact CD1-CG2 4.32Å; L469-V475 HydrophobicContact CD1-CG2 4.43Å; S472-V475 VanDerWaalsContact O-CG2 3.27Å; S472-V475 WeakPolarHBondContact O-CG2 3.33Å; S472-V475 PolarHBondContact O-N 2.88Å; S473-V475 PolarHBondContact O-N 3.24Å; V475-G477 PolarHBondContact O-N 3.4Å; V475-L478 PolarHBondContact O-N 3.3Å; V475-F479 WeakPolarHBondContact O-CB 3.35Å; V475-F479 PolarHBondContact O-N 3.26Å
476	H	90.9	Very high	89.1	Confident	5 Å²	5	46.7 Å²	46.7	2%	0.023	25%	0.254	C	S	.	.	H	α-helix	trans	-62.2	-45.4	-173.5	-68.8	177.1	0	0	0	112.4	L469 S472 S473 L478 F479 F480 F514 L632	L469-H476 PolarHBondContact O-CD2 3.29Å; L469-H476 PolarHBondContact O-NE2 3.46Å; S472-H476 PolarHBondContact O-CD2 3.08Å; S472-H476 PolarHBondContact O-NE2 3.15Å; S473-H476 WeakPolarHBondContact O-CB 3.13Å; S473-H476 PolarHBondContact O-N 3.37Å; H476-L478 VanDerWaalsContact C-N 3.33Å; H476-L478 PolarHBondContact O-N 3.13Å; H476-F479 PolarHBondContact O-N 2.93Å; H476-F480 HydrophobicContact CB-CD2 4.23Å; H476-F480 HydrophobicContact CB-CE2 4.26Å; H476-F480 WeakPolarHBondContact O-CD2 3.37Å; H476-F480 PolarHBondContact O-N 3.22Å; H476-F514 AromaticContact CD2-CD2 3.81Å; H476-F514 AromaticContact CE1-CD2 3.66Å; H476-F514 AromaticContact CG-CD2 3.99Å; H476-F514 AromaticContact ND1-CD2 3.88Å; H476-F514 AromaticContact NE2-CD2 3.6Å; H476-L632 HydrophobicContact CB-CD1 3.73Å; H476-L632 HydrophobicContact CB-CD2 3.73Å; H476-L632 HydrophobicContact CB-CG 4.36Å
477	G	88.4	Confident	89.1	Confident	43 Å²	43	45.5 Å²	45.5	44%	0.443	25%	0.247	S	C	.	.	H	α-helix	trans	-59.3	-41.8	177.6	0	0	0	0	0	113.1	V475 H481	V475-G477 PolarHBondContact O-N 3.4Å; G477-H481 VanDerWaalsContact O-CB 3.25Å; G477-H481 WeakPolarHBondContact O-CB 3.3Å; G477-H481 PolarHBondContact O-N 3.37Å; G477-H481 VanDerWaalsContact O-N 3.08Å
478	L	88.9	Confident	88.9	Confident	32 Å²	32	43.5 Å²	43.5	17%	0.168	24%	0.235	C	C	.	.	H	α-helix	trans	-65.8	-45.5	174.5	175	64.6	0	0	0	111.7	L436 Q437 V475 H476 L482	L436-L478 HydrophobicContact CB-CD2 3.53Å; L436-L478 HydrophobicContact CB-CG 4.03Å; L436-L478 HydrophobicContact CD1-CD2 4.45Å; Q437-L478 HydrophobicContact CG-CD2 3.79Å; V475-L478 PolarHBondContact O-N 3.3Å; H476-L478 VanDerWaalsContact C-N 3.33Å; H476-L478 PolarHBondContact O-N 3.13Å; L478-L482 WeakPolarHBondContact O-CB 3.47Å; L478-L482 PolarHBondContact O-N 3.47Å
479	F	94.6	Very high	88.7	Confident	3 Å²	3	43.9 Å²	43.9	1%	0.013	23%	0.23	C	C	.	.	H	α-helix	trans	-60.5	-51.1	179.3	170.1	-105.7	0	0	0	111.6	L436 F460 M464 L469 V475 H476 H481 L482 L483 L503 F514	L436-F479 HydrophobicContact CD1-CB 4.03Å; L436-F479 HydrophobicContact CD2-CD2 4.06Å; F460-F479 HydrophobicContact CE2-CD2 4.28Å; F460-F479 HydrophobicContact CE2-CE2 4.09Å; F460-F479 HydrophobicContact CZ-CD2 4.28Å; F460-F479 AromaticContact CZ-CE2 3.73Å; F460-F479 HydrophobicContact CZ-CE2 3.73Å; F460-F479 HydrophobicContact CZ-CZ 4.49Å; M464-F479 HydrophobicContact CE-CZ 4.46Å; M464-F479 HydrophobicContact CG-CE2 4Å; M464-F479 HydrophobicContact CG-CZ 4.26Å; L469-F479 HydrophobicContact CD1-CB 4.01Å; L469-F479 HydrophobicContact CD1-CD1 3.96Å; L469-F479 HydrophobicContact CD1-CD2 3.93Å; L469-F479 HydrophobicContact CD1-CE1 4.46Å; L469-F479 HydrophobicContact CD1-CE2 4.44Å; L469-F479 HydrophobicContact CD1-CG 3.67Å; L469-F479 HydrophobicContact CD2-CD2 4.2Å; L469-F479 HydrophobicContact CD2-CE1 4.3Å; L469-F479 HydrophobicContact CD2-CE2 3.9Å; L469-F479 HydrophobicContact CD2-CZ 3.96Å; V475-F479 WeakPolarHBondContact O-CB 3.35Å; V475-F479 PolarHBondContact O-N 3.26Å; H476-F479 PolarHBondContact O-N 2.93Å; F479-H481 PolarHBondContact O-N 3.16Å; F479-L482 PolarHBondContact O-N 3.23Å; F479-L483 HydrophobicContact CE1-CD2 4.05Å; F479-L483 HydrophobicContact CZ-CD2 4.13Å; F479-L483 VanDerWaalsContact O-CB 3.26Å; F479-L483 WeakPolarHBondContact O-CB 3.2Å; F479-L483 PolarHBondContact O-N 2.97Å; F479-L503 HydrophobicContact CE1-CD1 3.92Å; F479-L503 HydrophobicContact CZ-CD1 4.03Å; F479-F514 HydrophobicContact CD1-CE2 4.04Å; F479-F514 HydrophobicContact CD1-CZ 4.28Å; F479-F514 HydrophobicContact CE1-CE2 4.04Å; F479-F514 AromaticContact CE1-CZ 3.8Å; F479-F514 HydrophobicContact CE1-CZ 3.8Å
480	F	92.6	Very high	88.5	Confident	11 Å²	11	44.4 Å²	44.4	5%	0.048	23%	0.232	C	C	.	.	H	α-helix	trans	-68.3	-34.6	-178.5	-75.1	-63	0	0	0	112.6	H476 L483 Y484 L503 F514 A517 A518 I521 L632	H476-F480 HydrophobicContact CB-CD2 4.23Å; H476-F480 HydrophobicContact CB-CE2 4.26Å; H476-F480 WeakPolarHBondContact O-CD2 3.37Å; H476-F480 PolarHBondContact O-N 3.22Å; F480-L483 HydrophobicContact CD1-CD2 3.9Å; F480-L483 HydrophobicContact CE1-CD2 4.18Å; F480-L483 PolarHBondContact O-N 3.5Å; F480-Y484 WeakPolarHBondContact O-CB 3.23Å; F480-Y484 PolarHBondContact O-N 3.5Å; F480-L503 HydrophobicContact CE1-CD1 4.31Å; F480-F514 HydrophobicContact CE1-CZ 4.44Å; F480-F514 AromaticContact CE2-CD2 3.61Å; F480-F514 HydrophobicContact CE2-CD2 3.61Å; F480-F514 AromaticContact CE2-CE2 3.76Å; F480-F514 HydrophobicContact CE2-CE2 3.76Å; F480-F514 HydrophobicContact CE2-CG 4.17Å; F480-F514 HydrophobicContact CE2-CZ 4.4Å; F480-F514 HydrophobicContact CZ-CD1 4.07Å; F480-F514 AromaticContact CZ-CD2 3.63Å; F480-F514 HydrophobicContact CZ-CD2 3.63Å; F480-F514 AromaticContact CZ-CE1 3.98Å; F480-F514 HydrophobicContact CZ-CE1 3.98Å; F480-F514 AromaticContact CZ-CE2 3.55Å; F480-F514 HydrophobicContact CZ-CE2 3.55Å; F480-F514 AromaticContact CZ-CG 3.91Å; F480-F514 HydrophobicContact CZ-CG 3.91Å; F480-F514 AromaticContact CZ-CZ 3.74Å; F480-F514 HydrophobicContact CZ-CZ 3.74Å; F480-F514 WeakPolarHBondContact CZ-O 3.48Å; F480-A517 HydrophobicContact CD2-CB 3.88Å; F480-A517 HydrophobicContact CE1-CB 4.32Å; F480-A517 HydrophobicContact CE2-CB 3.6Å; F480-A517 HydrophobicContact CG-CB 4.37Å; F480-A517 HydrophobicContact CZ-CB 3.84Å; F480-A518 HydrophobicContact CE1-CB 3.83Å; F480-A518 HydrophobicContact CZ-CB 4.1Å; F480-I521 HydrophobicContact CB-CD1 4.39Å; F480-I521 HydrophobicContact CB-CG1 4.34Å; F480-I521 HydrophobicContact CD1-CG1 3.96Å; F480-I521 HydrophobicContact CG-CG1 4.46Å; F480-L632 HydrophobicContact CD2-CD1 4.4Å; F480-L632 HydrophobicContact CD2-CD2 4.05Å; F480-L632 HydrophobicContact CE2-CD2 3.9Å
481	H	88.5	Confident	88.4	Confident	121 Å²	121	46.3 Å²	46.3	56%	0.56	25%	0.253	S	S	*	.	H	α-helix	trans	-62.5	-45.1	171.6	-179	73	0	0	0	112.3	G477 F479 K485	G477-H481 VanDerWaalsContact O-CB 3.25Å; G477-H481 WeakPolarHBondContact O-CB 3.3Å; G477-H481 PolarHBondContact O-N 3.37Å; G477-H481 VanDerWaalsContact O-N 3.08Å; F479-H481 PolarHBondContact O-N 3.16Å; H481-K485 PolarHBondContact O-N 3.49Å; H481-K485 VanDerWaalsContact O-N 3.16Å
482	L	91.3	Very high	88.5	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-67.3	-42.5	176.9	-179.5	57.5	0	0	0	111.7	L436 L439 A440 C443 F456 F460 L478 F479 K485 A486	L436-L482 HydrophobicContact CD2-CD2 4.19Å; L439-L482 HydrophobicContact CB-CD2 3.71Å; A440-L482 HydrophobicContact CB-CD1 4.31Å; C443-L482 HydrophobicContact CB-CD1 3.75Å; F456-L482 HydrophobicContact CZ-CD1 4.18Å; F460-L482 HydrophobicContact CD2-CD2 3.92Å; F460-L482 HydrophobicContact CD2-CG 4.2Å; F460-L482 HydrophobicContact CE2-CB 4.46Å; F460-L482 HydrophobicContact CE2-CD2 3.78Å; F460-L482 HydrophobicContact CE2-CG 3.82Å; L478-L482 WeakPolarHBondContact O-CB 3.47Å; L478-L482 PolarHBondContact O-N 3.47Å; F479-L482 PolarHBondContact O-N 3.23Å; L482-K485 PolarHBondContact O-N 3.12Å; L482-A486 VanDerWaalsContact O-CB 3.24Å; L482-A486 WeakPolarHBondContact O-CB 3.49Å; L482-A486 PolarHBondContact O-N 3.4Å
483	L	93.4	Very high	88.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.5	-48.6	176.3	179.4	67.1	0	0	0	111.5	F460 F479 F480 K485 A486 L487 I499 L503 I521	F460-L483 HydrophobicContact CE1-CD1 3.63Å; F460-L483 HydrophobicContact CZ-CB 3.97Å; F460-L483 HydrophobicContact CZ-CD1 3.78Å; F460-L483 HydrophobicContact CZ-CG 4.49Å; F479-L483 HydrophobicContact CE1-CD2 4.05Å; F479-L483 HydrophobicContact CZ-CD2 4.13Å; F479-L483 VanDerWaalsContact O-CB 3.26Å; F479-L483 WeakPolarHBondContact O-CB 3.2Å; F479-L483 PolarHBondContact O-N 2.97Å; F480-L483 HydrophobicContact CD1-CD2 3.9Å; F480-L483 HydrophobicContact CE1-CD2 4.18Å; F480-L483 PolarHBondContact O-N 3.5Å; L483-K485 PolarHBondContact O-N 3.3Å; L483-A486 PolarHBondContact O-N 3.46Å; L483-L487 HydrophobicContact CD1-CD1 3.78Å; L483-L487 HydrophobicContact CD1-CG 4.11Å; L483-L487 HydrophobicContact CG-CD1 3.86Å; L483-L487 HydrophobicContact CG-CG 4.48Å; L483-L487 WeakPolarHBondContact O-CB 3.4Å; L483-L487 VanDerWaalsContact O-CG 3.31Å; L483-L487 WeakPolarHBondContact O-CG 3.12Å; L483-L487 PolarHBondContact O-N 3.01Å; L483-I499 HydrophobicContact CD1-CG2 3.69Å; L483-L503 HydrophobicContact CD2-CD1 3.88Å; L483-L503 HydrophobicContact CD2-CD2 3.72Å; L483-L503 HydrophobicContact CD2-CG 4.41Å; L483-I521 HydrophobicContact CD2-CG2 4.11Å; L483-I521 HydrophobicContact CG-CG2 4.36Å
484	Y	90.8	Very high	88.5	Confident	84 Å²	84	44.2 Å²	44.2	33%	0.329	23%	0.231	S	C	.	.	H	α-helix	trans	-60.2	-46.5	177.8	178.3	-100.9	0	0	0	111.9	F480 C488 I521 R524 V525	F480-Y484 WeakPolarHBondContact O-CB 3.23Å; F480-Y484 PolarHBondContact O-N 3.5Å; Y484-C488 WeakPolarHBondContact CE2-SG 3.29Å; Y484-C488 WeakPolarHBondContact O-CB 3.48Å; Y484-C488 PolarHBondContact O-N 3.4Å; Y484-C488 PolarHBondContact O-SG 2.99Å; Y484-I521 HydrophobicContact CD2-CD1 4.37Å; Y484-R524 HydrophobicContact CE2-CB 4.08Å; Y484-V525 HydrophobicContact CD2-CG2 4.06Å; Y484-V525 HydrophobicContact CE2-CG2 4.44Å
485	K	88.2	Confident	89	Confident	91 Å²	91	39 Å²	39	40%	0.396	21%	0.211	S	C	.	.	H	α-helix	trans	-61.6	-44.9	176.2	-81.8	179.9	165.1	173.2	0	112.4	H481 L482 L483 R489	H481-K485 PolarHBondContact O-N 3.49Å; H481-K485 VanDerWaalsContact O-N 3.16Å; L482-K485 PolarHBondContact O-N 3.12Å; L483-K485 PolarHBondContact O-N 3.3Å; K485-R489 VanDerWaalsContact O-CB 3.23Å; K485-R489 WeakPolarHBondContact O-CB 3.4Å; K485-R489 PolarHBondContact O-N 3.2Å; K485-R489 VanDerWaalsContact O-N 3.15Å
486	A	91.2	Very high	89.1	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.8	-50.4	179.3	0	0	0	0	0	111.1	F456 Y457 L482 L483 R489 D490	F456-A486 HydrophobicContact CE1-CB 3.89Å; F456-A486 HydrophobicContact CZ-CB 4.16Å; Y457-A486 HydrophobicContact CE1-CB 3.98Å; Y457-A486 PolarHBondContact OH-O 3.22Å; Y457-A486 VanDerWaalsContact OH-O 3.07Å; L482-A486 VanDerWaalsContact O-CB 3.24Å; L482-A486 WeakPolarHBondContact O-CB 3.49Å; L482-A486 PolarHBondContact O-N 3.4Å; L483-A486 PolarHBondContact O-N 3.46Å; A486-R489 PolarHBondContact O-N 2.97Å; A486-D490 PolarHBondContact O-N 3Å
487	L	90.5	Very high	88.9	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-63.3	-48.2	179.4	-67.8	171.3	0	0	0	111.7	L483 R489 D490 T496 I499 V525 I529	L483-L487 HydrophobicContact CD1-CD1 3.78Å; L483-L487 HydrophobicContact CD1-CG 4.11Å; L483-L487 HydrophobicContact CG-CD1 3.86Å; L483-L487 HydrophobicContact CG-CG 4.48Å; L483-L487 WeakPolarHBondContact O-CB 3.4Å; L483-L487 VanDerWaalsContact O-CG 3.31Å; L483-L487 WeakPolarHBondContact O-CG 3.12Å; L483-L487 PolarHBondContact O-N 3.01Å; L487-R489 PolarHBondContact O-N 3.36Å; L487-D490 PolarHBondContact O-N 3.13Å; L487-T496 HydrophobicContact CD2-CG2 3.77Å; L487-I499 HydrophobicContact CD2-CB 4.01Å; L487-I499 HydrophobicContact CD2-CD1 4.43Å; L487-I499 HydrophobicContact CD2-CG2 3.78Å; L487-I499 HydrophobicContact CG-CG2 4.47Å; L487-V525 HydrophobicContact CB-CG1 3.92Å; L487-V525 HydrophobicContact CB-CG2 3.88Å; L487-V525 HydrophobicContact CD1-CG1 4.33Å; L487-V525 HydrophobicContact CD1-CG2 3.95Å; L487-I529 WeakPolarHBondContact O-CD1 3.24Å
488	C	86.5	Confident	89.1	Confident	43 Å²	43	37.3 Å²	37.3	29%	0.291	19%	0.191	S	C	.	.	H	α-helix	trans	-68.3	-16.3	-178.6	-63.2	0	0	0	0	114.4	Y484 T528	Y484-C488 WeakPolarHBondContact CE2-SG 3.29Å; Y484-C488 WeakPolarHBondContact O-CB 3.48Å; Y484-C488 PolarHBondContact O-N 3.4Å; Y484-C488 PolarHBondContact O-SG 2.99Å; C488-T528 HydrophobicContact CB-CG2 4.45Å
489	R	85.7	Confident	89.3	Confident	68 Å²	68	35.8 Å²	35.8	26%	0.257	18%	0.183	S	C	.	.	H	α-helix	trans	-84	-34.3	175.2	179.6	-165	170.2	82.3	18.1	112	L446 D447 D453 K485 A486 L487	L446-R489 VanDerWaalsContact CB-NH2 3.31Å; L446-R489 PolarHBondContact O-NH2 2.9Å; D447-R489 IonicContact OD1-CZ 2.76Å; D447-R489 IonicContact OD1-NH1 3.96Å; D447-R489 PolarHBondContact OD1-NH1 3.23Å; D453-R489 IonicContact OD1-NE 2.76Å; D453-R489 PolarHBondContact OD1-NE 3.25Å; D453-R489 IonicContact OD1-NH2 3.85Å; K485-R489 VanDerWaalsContact O-CB 3.23Å; K485-R489 WeakPolarHBondContact O-CB 3.4Å; K485-R489 PolarHBondContact O-N 3.2Å; K485-R489 VanDerWaalsContact O-N 3.15Å; A486-R489 PolarHBondContact O-N 2.97Å; L487-R489 PolarHBondContact O-N 3.36Å
490	D	87.4	Confident	89.2	Confident	12 Å²	12	35.7 Å²	35.7	6%	0.064	18%	0.182	C	C	.	.			trans	-70.5	134.4	-168.4	-161.1	-0.8	0	0	0	112.3	Y457 A486 L487 Q492 R495	Y457-D490 HydrophobicContact CE1-CB 4.16Å; A486-D490 PolarHBondContact O-N 3Å; L487-D490 PolarHBondContact O-N 3.13Å; D490-Q492 PolarHBondContact OD1-N 3.27Å; D490-R495 IonicContact OD1-CZ 3.27Å; D490-R495 IonicContact OD1-NE 3.69Å; D490-R495 PolarHBondContact OD1-NE 3.33Å; D490-R495 IonicContact OD1-NH2 2.75Å; D490-R495 PolarHBondContact OD1-NH2 3.08Å; D490-R495 WeakPolarHBondContact OD2-CB 3.07Å; D490-R495 VanDerWaalsContact OD2-CG 3.26Å; D490-R495 WeakPolarHBondContact OD2-CG 3.27Å; D490-R495 IonicContact OD2-CZ 2.92Å; D490-R495 IonicContact OD2-NE 2.69Å; D490-R495 PolarHBondContact OD2-NE 3.33Å; D490-R495 IonicContact OD2-NH2 3.59Å
491	T	84.7	Confident	89.1	Confident	121 Å²	121	35.1 Å²	35.1	74%	0.742	18%	0.18	S	C	*	.			trans	-91.2	-15.8	173.3	58.2	0	0	0	0	112.4	S493	T491-S493 PolarHBondContact O-N 3.37Å
492	Q	87.7	Confident	89.4	Confident	88 Å²	88	29.7 Å²	29.7	41%	0.411	15%	0.154	S	C	.	.			trans	-89.1	105.9	-176.2	-63.3	-57.5	-53.4	0	0	111.2	D490 G494 R495 T496 L571	D490-Q492 PolarHBondContact OD1-N 3.27Å; Q492-G494 PolarHBondContact O-N 2.85Å; Q492-R495 HydrophobicContact CB-CB 3.87Å; Q492-R495 PolarHBondContact O-N 3.32Å; Q492-T496 WeakPolarHBondContact O-CB 2.92Å; Q492-T496 PolarHBondContact O-N 3.49Å; Q492-T496 PolarHBondContact O-OG1 2.98Å; Q492-L571 HydrophobicContact CB-CD1 4.25Å; Q492-L571 HydrophobicContact CG-CD1 4.41Å
493	S	84.1	Confident	89.6	Confident	71 Å²	71	29.5 Å²	29.5	50%	0.497	15%	0.154	S	C	.	.	H	α-helix	trans	-62.7	-42	-178.2	56.7	0	0	0	0	113.1	T491 R495 T496 R497	T491-S493 PolarHBondContact O-N 3.37Å; S493-R495 VanDerWaalsContact C-N 3.33Å; S493-R495 PolarHBondContact O-N 3.16Å; S493-T496 PolarHBondContact O-N 3.45Å; S493-R497 VanDerWaalsContact O-CB 3.28Å; S493-R497 WeakPolarHBondContact O-CB 3.43Å; S493-R497 PolarHBondContact O-N 3.25Å
494	G	85.6	Confident	89.6	Confident	11 Å²	11	29.5 Å²	29.5	11%	0.113	15%	0.154	C	C	.	.	H	α-helix	trans	-60.6	-40.1	176.6	0	0	0	0	0	112.9	Q492 R497 A498	Q492-G494 PolarHBondContact O-N 2.85Å; G494-R497 PolarHBondContact O-N 3.12Å; G494-A498 WeakPolarHBondContact O-CB 3.38Å; G494-A498 PolarHBondContact O-N 3.48Å
495	R	89.8	Confident	89.8	Confident	5 Å²	5	27.9 Å²	27.9	2%	0.019	15%	0.149	C	C	.	.	H	α-helix	trans	-68	-46.5	176.4	-179	158.7	71.4	-171.2	0.6	112.2	D454 Y457 D490 Q492 S493 R497 A498 I499 P570 L571	D454-R495 IonicContact OD1-CZ 3.35Å; D454-R495 IonicContact OD1-NH1 3.6Å; D454-R495 PolarHBondContact OD1-NH1 2.87Å; Y457-R495 HydrophobicContact CG-CG 4.39Å; D490-R495 IonicContact OD1-CZ 3.27Å; D490-R495 IonicContact OD1-NE 3.69Å; D490-R495 PolarHBondContact OD1-NE 3.33Å; D490-R495 IonicContact OD1-NH2 2.75Å; D490-R495 PolarHBondContact OD1-NH2 3.08Å; D490-R495 WeakPolarHBondContact OD2-CB 3.07Å; D490-R495 VanDerWaalsContact OD2-CG 3.26Å; D490-R495 WeakPolarHBondContact OD2-CG 3.27Å; D490-R495 IonicContact OD2-CZ 2.92Å; D490-R495 IonicContact OD2-NE 2.69Å; D490-R495 PolarHBondContact OD2-NE 3.33Å; D490-R495 IonicContact OD2-NH2 3.59Å; Q492-R495 HydrophobicContact CB-CB 3.87Å; Q492-R495 PolarHBondContact O-N 3.32Å; S493-R495 VanDerWaalsContact C-N 3.33Å; S493-R495 PolarHBondContact O-N 3.16Å; R495-R497 VanDerWaalsContact C-N 3.27Å; R495-R497 PolarHBondContact O-N 3.34Å; R495-A498 PolarHBondContact O-N 3.22Å; R495-I499 HydrophobicContact CG-CD1 4.28Å; R495-I499 WeakPolarHBondContact O-CG1 3.48Å; R495-I499 PolarHBondContact O-N 3.2Å; R495-P570 HydrophobicContact CG-CB 4Å; R495-P570 HydrophobicContact CG-CG 3.72Å; R495-L571 HydrophobicContact CB-CD1 4.31Å
496	T	90	Very high	90.1	Very high	3 Å²	3	23.9 Å²	23.9	2%	0.018	13%	0.132	C	C	.	.	H	α-helix	trans	-56.6	-42.3	173.2	-57.9	0	0	0	0	111.1	L487 Q492 S493 S500 I529	L487-T496 HydrophobicContact CD2-CG2 3.77Å; Q492-T496 WeakPolarHBondContact O-CB 2.92Å; Q492-T496 PolarHBondContact O-N 3.49Å; Q492-T496 PolarHBondContact O-OG1 2.98Å; S493-T496 PolarHBondContact O-N 3.45Å; T496-S500 WeakPolarHBondContact O-CB 3.46Å; T496-S500 PolarHBondContact O-N 3.3Å; T496-S500 PolarHBondContact O-OG 2.74Å; T496-I529 HydrophobicContact CG2-CD1 3.97Å
497	R	87.5	Confident	90.2	Very high	16 Å²	16	23.9 Å²	23.9	6%	0.06	13%	0.132	C	C	.	.	H	α-helix	trans	-70	-40.3	178.1	-174.3	161.7	172	113.1	-0.7	112.8	S493 G494 R495 S500 K501 P533 A575 E578	S493-R497 VanDerWaalsContact O-CB 3.28Å; S493-R497 WeakPolarHBondContact O-CB 3.43Å; S493-R497 PolarHBondContact O-N 3.25Å; G494-R497 PolarHBondContact O-N 3.12Å; R495-R497 VanDerWaalsContact C-N 3.27Å; R495-R497 PolarHBondContact O-N 3.34Å; R497-S500 PolarHBondContact O-N 3.42Å; R497-K501 WeakPolarHBondContact O-CB 3.5Å; R497-K501 PolarHBondContact O-N 3Å; R497-P533 PolarHBondContact NH1-O 3.19Å; R497-A575 WeakPolarHBondContact CD-O 3.28Å; R497-A575 HydrophobicContact CG-CB 4.27Å; R497-A575 PolarHBondContact NE-O 2.93Å; R497-E578 PolarHBondContact NH2-O 2.82Å
498	A	91.9	Very high	90.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.2	-44.4	174.1	0	0	0	0	0	112.4	Y461 G494 R495 S500 K501 R502 P570 A573 A575	Y461-A498 HydrophobicContact CE2-CB 4.35Å; Y461-A498 WeakPolarHBondContact CE2-O 3.46Å; G494-A498 WeakPolarHBondContact O-CB 3.38Å; G494-A498 PolarHBondContact O-N 3.48Å; R495-A498 PolarHBondContact O-N 3.22Å; A498-S500 VanDerWaalsContact C-N 3.32Å; A498-S500 PolarHBondContact O-N 3.43Å; A498-K501 PolarHBondContact O-N 2.75Å; A498-R502 WeakPolarHBondContact O-CB 3.36Å; A498-R502 PolarHBondContact O-N 2.65Å; A498-P570 HydrophobicContact CB-CB 3.83Å; A498-P570 VanDerWaalsContact CB-O 3.27Å; A498-P570 WeakPolarHBondContact CB-O 3.1Å; A498-A573 HydrophobicContact CB-CB 3.86Å; A498-A575 HydrophobicContact CB-CB 3.8Å
499	I	93.6	Very high	90.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.4	-42.6	174.2	-65.7	165.8	0	0	0	110.5	Y457 F460 Y461 M464 L483 L487 R495 L503 P570	Y457-I499 HydrophobicContact CD1-CD1 3.81Å; F460-I499 HydrophobicContact CE1-CG2 4.29Å; Y461-I499 HydrophobicContact CD2-CG1 3.89Å; Y461-I499 HydrophobicContact CE2-CG1 4.47Å; M464-I499 HydrophobicContact CE-CG2 4.23Å; M464-I499 HydrophobicContact SD-CG2 3.89Å; L483-I499 HydrophobicContact CD1-CG2 3.69Å; L487-I499 HydrophobicContact CD2-CB 4.01Å; L487-I499 HydrophobicContact CD2-CD1 4.43Å; L487-I499 HydrophobicContact CD2-CG2 3.78Å; L487-I499 HydrophobicContact CG-CG2 4.47Å; R495-I499 HydrophobicContact CG-CD1 4.28Å; R495-I499 WeakPolarHBondContact O-CG1 3.48Å; R495-I499 PolarHBondContact O-N 3.2Å; I499-L503 WeakPolarHBondContact O-CB 3.35Å; I499-L503 PolarHBondContact O-N 3.19Å; I499-P570 HydrophobicContact CG1-CB 4.24Å
500	S	91.6	Very high	91.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-65.2	-44.9	178.3	-57.2	0	0	0	0	112.9	T496 R497 A498 L503 L504 L522	T496-S500 WeakPolarHBondContact O-CB 3.46Å; T496-S500 PolarHBondContact O-N 3.3Å; T496-S500 PolarHBondContact O-OG 2.74Å; R497-S500 PolarHBondContact O-N 3.42Å; A498-S500 VanDerWaalsContact C-N 3.32Å; A498-S500 PolarHBondContact O-N 3.43Å; S500-L503 WeakPolarHBondContact O-CB 3.46Å; S500-L503 PolarHBondContact O-N 3.32Å; S500-L504 WeakPolarHBondContact O-CG 3.43Å; S500-L504 PolarHBondContact O-N 3.33Å; S500-L522 WeakPolarHBondContact OG-CD2 3.45Å
501	K	91.7	Very high	91.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-58.6	-50.2	174.9	-179.1	70.5	168.1	169.3	0	110.7	R497 A498 L503 L504 Q505 Y563 A575 E578 P579 L580 E582	R497-K501 WeakPolarHBondContact O-CB 3.5Å; R497-K501 PolarHBondContact O-N 3Å; A498-K501 PolarHBondContact O-N 2.75Å; K501-L503 VanDerWaalsContact C-N 3.34Å; K501-L503 PolarHBondContact O-N 2.91Å; K501-L504 PolarHBondContact O-N 2.88Å; K501-Q505 WeakPolarHBondContact O-CG 3.26Å; K501-Q505 PolarHBondContact O-N 3.02Å; K501-Y563 HydrophobicContact CG-CD1 4.45Å; K501-Y563 HydrophobicContact CG-CE1 3.96Å; K501-Y563 HydrophobicContact CG-CE2 4.07Å; K501-A575 HydrophobicContact CB-CB 4.16Å; K501-A575 HydrophobicContact CG-CB 4.39Å; K501-E578 WeakPolarHBondContact CE-OE2 3.29Å; K501-E578 IonicContact NZ-OE1 3.81Å; K501-E578 PolarHBondContact NZ-OE1 3.01Å; K501-E578 IonicContact NZ-OE2 2.82Å; K501-E578 PolarHBondContact NZ-OE2 3.35Å; K501-P579 PolarHBondContact NZ-O 3.23Å; K501-L580 HydrophobicContact CB-CD2 4.14Å; K501-L580 HydrophobicContact CD-CD2 3.83Å; K501-E582 WeakPolarHBondContact CD-OE1 3.34Å; K501-E582 WeakPolarHBondContact CD-OE2 3.4Å; K501-E582 WeakPolarHBondContact CE-OE1 3.37Å; K501-E582 VanDerWaalsContact NZ-CD 3.27Å; K501-E582 IonicContact NZ-OE1 2.89Å; K501-E582 PolarHBondContact NZ-OE1 3.25Å; K501-E582 IonicContact NZ-OE2 3.74Å; K501-E582 PolarHBondContact NZ-OE2 3.5Å
502	R	94.3	Very high	91.8	Very high	6 Å²	6	23.2 Å²	23.2	2%	0.023	13%	0.134	C	C	.	.	H	α-helix	trans	-63.4	-35.6	176	-175.7	172.1	-74.5	174.9	2.2	112.8	Y461 M464 L465 A498 Q505 I506 T565 A567	Y461-R502 HydrophobicContact CD2-CB 4.41Å; Y461-R502 HydrophobicContact CE2-CB 3.62Å; Y461-R502 HydrophobicContact CE2-CG 4.16Å; Y461-R502 PolarHBondContact O-NH1 3.42Å; Y461-R502 PolarHBondContact OH-NH2 3.41Å; M464-R502 HydrophobicContact CE-CB 4.34Å; M464-R502 HydrophobicContact CE-CG 4.29Å; L465-R502 HydrophobicContact CD2-CG 4.22Å; A498-R502 WeakPolarHBondContact O-CB 3.36Å; A498-R502 PolarHBondContact O-N 2.65Å; R502-Q505 PolarHBondContact O-N 2.9Å; R502-I506 HydrophobicContact CG-CD1 4.22Å; R502-I506 WeakPolarHBondContact O-CD1 3.29Å; R502-I506 VanDerWaalsContact O-CG1 3.31Å; R502-I506 WeakPolarHBondContact O-CG1 3.36Å; R502-I506 PolarHBondContact O-N 2.71Å; R502-T565 PolarHBondContact NH2-O 3.44Å; R502-A567 PolarHBondContact NH2-O 3.01Å
503	L	94.7	Very high	92	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.4	-47.1	174.3	-176.8	72.3	0	0	0	111.3	M464 F479 F480 L483 I499 S500 K501 Q505 I506 C507 F514 A518 L522	M464-L503 HydrophobicContact CE-CB 3.87Å; M464-L503 HydrophobicContact CE-CD1 4.22Å; F479-L503 HydrophobicContact CE1-CD1 3.92Å; F479-L503 HydrophobicContact CZ-CD1 4.03Å; F480-L503 HydrophobicContact CE1-CD1 4.31Å; L483-L503 HydrophobicContact CD2-CD1 3.88Å; L483-L503 HydrophobicContact CD2-CD2 3.72Å; L483-L503 HydrophobicContact CD2-CG 4.41Å; I499-L503 WeakPolarHBondContact O-CB 3.35Å; I499-L503 PolarHBondContact O-N 3.19Å; S500-L503 WeakPolarHBondContact O-CB 3.46Å; S500-L503 PolarHBondContact O-N 3.32Å; K501-L503 VanDerWaalsContact C-N 3.34Å; K501-L503 PolarHBondContact O-N 2.91Å; L503-Q505 VanDerWaalsContact C-N 3.32Å; L503-Q505 PolarHBondContact O-N 2.96Å; L503-I506 WeakPolarHBondContact O-CB 3.06Å; L503-I506 PolarHBondContact O-N 2.81Å; L503-I506 VanDerWaalsContact O-N 3.16Å; L503-C507 PolarHBondContact O-N 3.31Å; L503-C507 PolarHBondContact O-SG 3.06Å; L503-F514 HydrophobicContact CD1-CE1 4.3Å; L503-F514 HydrophobicContact CD1-CZ 4.31Å; L503-A518 HydrophobicContact CD1-CB 4.19Å; L503-A518 HydrophobicContact CD2-CB 3.78Å; L503-A518 HydrophobicContact CG-CB 3.93Å; L503-L522 HydrophobicContact CD2-CD1 4.12Å; L503-L522 HydrophobicContact CD2-CD2 4.11Å; L503-L522 HydrophobicContact CD2-CG 3.96Å
504	L	94	Very high	92.5	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62.9	-38.9	177.5	-67.7	167.5	0	0	0	111.9	S500 K501 I506 C507 L508 L519 L522 L580 E582 L583 L586	S500-L504 WeakPolarHBondContact O-CG 3.43Å; S500-L504 PolarHBondContact O-N 3.33Å; K501-L504 PolarHBondContact O-N 2.88Å; L504-I506 VanDerWaalsContact C-N 3.3Å; L504-I506 PolarHBondContact O-N 2.85Å; L504-C507 WeakPolarHBondContact O-CB 3.47Å; L504-C507 PolarHBondContact O-N 3.21Å; L504-L508 PolarHBondContact O-N 3.2Å; L504-L519 HydrophobicContact CD2-CD2 3.92Å; L504-L522 HydrophobicContact CD1-CD1 4.28Å; L504-L522 HydrophobicContact CD2-CD1 3.67Å; L504-L522 HydrophobicContact CG-CD1 3.85Å; L504-L580 HydrophobicContact CD1-CB 4.06Å; L504-L580 HydrophobicContact CD1-CD1 4.07Å; L504-L580 HydrophobicContact CD1-CD2 4.25Å; L504-L580 HydrophobicContact CD1-CG 4.35Å; L504-E582 HydrophobicContact CB-CB 3.7Å; L504-E582 HydrophobicContact CB-CG 4.23Å; L504-L583 HydrophobicContact CD1-CD1 4.46Å; L504-L583 HydrophobicContact CD1-CD2 4.32Å; L504-L583 HydrophobicContact CD1-CG 4Å; L504-L583 HydrophobicContact CD2-CD2 3.65Å; L504-L583 HydrophobicContact CD2-CG 4.19Å; L504-L586 HydrophobicContact CD2-CD1 3.84Å
505	Q	94.2	Very high	93	Very high	49 Å²	49	15.8 Å²	15.8	23%	0.229	9%	0.09	C	C	.	.	H	α-helix	trans	-60.2	-38	173.6	-70.9	168.5	-10.3	0	0	112.4	K501 R502 L503 Y563 E582	K501-Q505 WeakPolarHBondContact O-CG 3.26Å; K501-Q505 PolarHBondContact O-N 3.02Å; R502-Q505 PolarHBondContact O-N 2.9Å; L503-Q505 VanDerWaalsContact C-N 3.32Å; L503-Q505 PolarHBondContact O-N 2.96Å; Q505-Y563 PolarHBondContact OE1-OH 3.25Å; Q505-E582 HydrophobicContact CG-CG 3.84Å; Q505-E582 WeakPolarHBondContact CG-OE1 3.29Å; Q505-E582 PolarHBondContact NE2-OE1 3.34Å
506	I	94.6	Very high	93.2	Very high	7 Å²	7	15.5 Å²	15.5	4%	0.036	9%	0.089	C	C	.	.	H	α-helix	trans	-67.2	-40.2	173	-65.7	158.4	0	0	0	110.7	M464 R470 R502 L503 L504 L508 T509 A510 F514	M464-I506 HydrophobicContact CB-CD1 3.89Å; M464-I506 HydrophobicContact CE-CD1 4.09Å; M464-I506 WeakPolarHBondContact O-CD1 3.35Å; R470-I506 HydrophobicContact CG-CG2 3.88Å; R502-I506 HydrophobicContact CG-CD1 4.22Å; R502-I506 WeakPolarHBondContact O-CD1 3.29Å; R502-I506 VanDerWaalsContact O-CG1 3.31Å; R502-I506 WeakPolarHBondContact O-CG1 3.36Å; R502-I506 PolarHBondContact O-N 2.71Å; L503-I506 WeakPolarHBondContact O-CB 3.06Å; L503-I506 PolarHBondContact O-N 2.81Å; L503-I506 VanDerWaalsContact O-N 3.16Å; L504-I506 VanDerWaalsContact C-N 3.3Å; L504-I506 PolarHBondContact O-N 2.85Å; I506-L508 PolarHBondContact O-N 3.22Å; I506-T509 PolarHBondContact O-N 3Å; I506-T509 PolarHBondContact O-OG1 3.33Å; I506-A510 WeakPolarHBondContact O-CB 3.27Å; I506-A510 PolarHBondContact O-N 3.04Å; I506-F514 HydrophobicContact CG2-CE1 3.77Å; I506-F514 HydrophobicContact CG2-CZ 4.04Å
507	C	95	Very high	93.4	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-59.2	-31.2	-179.4	-64.2	0	0	0	0	113.3	L503 L504 T509 A510 A515 A518 L586	L503-C507 PolarHBondContact O-N 3.31Å; L503-C507 PolarHBondContact O-SG 3.06Å; L504-C507 WeakPolarHBondContact O-CB 3.47Å; L504-C507 PolarHBondContact O-N 3.21Å; C507-T509 PolarHBondContact O-N 3.18Å; C507-A510 PolarHBondContact O-N 3.25Å; C507-A515 HydrophobicContact CB-CB 4.2Å; C507-A518 WeakPolarHBondContact SG-CB 3.21Å; C507-L586 HydrophobicContact CB-CD1 4.02Å; C507-L586 HydrophobicContact CB-CD2 4.22Å
508	L	94.5	Very high	93.7	Very high	71 Å²	71	14.8 Å²	14.8	37%	0.372	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-16.2	175.1	-60.7	-179.5	0	0	0	114.2	L504 I506 E582 L585 L586	L504-L508 PolarHBondContact O-N 3.2Å; I506-L508 PolarHBondContact O-N 3.22Å; L508-E582 HydrophobicContact CD1-CB 4.34Å; L508-E582 HydrophobicContact CD1-CG 3.91Å; L508-E582 HydrophobicContact CD2-CB 4.41Å; L508-E582 HydrophobicContact CG-CB 4.47Å; L508-E582 HydrophobicContact CG-CG 4.47Å; L508-L585 HydrophobicContact CD1-CD1 4.01Å; L508-L585 HydrophobicContact CD2-CB 3.78Å; L508-L585 HydrophobicContact CD2-CD1 4.12Å; L508-L586 HydrophobicContact CD2-CD2 4.1Å; L508-L586 HydrophobicContact CD2-CG 4Å
509	T	92.7	Very high	93.7	Very high	93 Å²	93	14.8 Å²	14.8	57%	0.571	9%	0.087	S	C	*	.	T	Hydrogen-bonded Turn	trans	-129.2	10.8	-179	58.6	0	0	0	0	113.1	R470 I506 C507	R470-T509 VanDerWaalsContact CD-OG1 3.23Å; R470-T509 WeakPolarHBondContact CD-OG1 3.35Å; I506-T509 PolarHBondContact O-N 3Å; I506-T509 PolarHBondContact O-OG1 3.33Å; C507-T509 PolarHBondContact O-N 3.18Å
510	A	93.1	Very high	93.6	Very high	8 Å²	8	14.9 Å²	14.9	7%	0.066	9%	0.088	C	C	.	.	S	Bend	trans	-101.1	162	-177	0	0	0	0	0	111.9	R470 I506 C507 F514	R470-A510 HydrophobicContact CG-CB 4.49Å; I506-A510 WeakPolarHBondContact O-CB 3.27Å; I506-A510 PolarHBondContact O-N 3.04Å; C507-A510 PolarHBondContact O-N 3.25Å; A510-F514 HydrophobicContact CB-CB 3.97Å; A510-F514 HydrophobicContact CB-CD1 3.45Å; A510-F514 VanDerWaalsContact CB-CD1 3.45Å; A510-F514 HydrophobicContact CB-CE1 4.19Å; A510-F514 HydrophobicContact CB-CG 3.89Å
511	P	93.1	Very high	93.4	Very high	50 Å²	50	16 Å²	16	33%	0.325	9%	0.093	S	C	.	.			trans	-58.7	153	170.3	-23.1	34.4	0	0	0	112.4	R470 S513 F514 A515	R470-P511 WeakPolarHBondContact O-CD 3.45Å; P511-S513 VanDerWaalsContact C-N 3.26Å; P511-S513 PolarHBondContact O-N 2.87Å; P511-F514 WeakPolarHBondContact O-CB 3.44Å; P511-F514 PolarHBondContact O-N 3.45Å; P511-A515 PolarHBondContact O-N 2.84Å
512	A	93.8	Very high	93.3	Very high	10 Å²	10	16.3 Å²	16.3	8%	0.083	10%	0.095	C	C	.	.	H	α-helix	trans	-55	-39	-179.4	0	0	0	0	0	113.2	F514 A515 C516 H591 V594	A512-F514 PolarHBondContact O-N 2.9Å; A512-A515 PolarHBondContact O-N 3.26Å; A512-C516 WeakPolarHBondContact O-CB 3.39Å; A512-C516 PolarHBondContact O-N 3.07Å; A512-C516 PolarHBondContact O-SG 2.97Å; A512-H591 HydrophobicContact CB-CB 3.8Å; A512-V594 HydrophobicContact CB-CG2 4.19Å
513	S	93.3	Very high	93	Very high	13 Å²	13	16.1 Å²	16.1	9%	0.091	9%	0.094	C	C	.	.	H	α-helix	trans	-59.6	-43.4	174.6	56.6	0	0	0	0	113.9	P511 A517 P631 L632 F635	P511-S513 VanDerWaalsContact C-N 3.26Å; P511-S513 PolarHBondContact O-N 2.87Å; S513-A517 WeakPolarHBondContact O-CB 3.18Å; S513-A517 PolarHBondContact O-N 3.19Å; S513-P631 WeakPolarHBondContact CA-O 3.41Å; S513-P631 VanDerWaalsContact CB-O 3.3Å; S513-P631 WeakPolarHBondContact CB-O 3.45Å; S513-L632 WeakPolarHBondContact CB-O 3.46Å; S513-F635 WeakPolarHBondContact CB-O 3.29Å; S513-F635 PolarHBondContact N-O 2.85Å
514	F	94.7	Very high	92.4	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-64.7	-43.6	174.7	-175.7	-81	0	0	0	111.3	L469 H476 F479 F480 L503 I506 A510 P511 A512 A517 A518	L469-F514 HydrophobicContact CD1-CE2 4.24Å; L469-F514 HydrophobicContact CG-CE2 4.16Å; L469-F514 HydrophobicContact CG-CZ 4.38Å; H476-F514 AromaticContact CD2-CD2 3.81Å; H476-F514 AromaticContact CE1-CD2 3.66Å; H476-F514 AromaticContact CG-CD2 3.99Å; H476-F514 AromaticContact ND1-CD2 3.88Å; H476-F514 AromaticContact NE2-CD2 3.6Å; F479-F514 HydrophobicContact CD1-CE2 4.04Å; F479-F514 HydrophobicContact CD1-CZ 4.28Å; F479-F514 HydrophobicContact CE1-CE2 4.04Å; F479-F514 AromaticContact CE1-CZ 3.8Å; F479-F514 HydrophobicContact CE1-CZ 3.8Å; F480-F514 HydrophobicContact CE1-CZ 4.44Å; F480-F514 AromaticContact CE2-CD2 3.61Å; F480-F514 HydrophobicContact CE2-CD2 3.61Å; F480-F514 AromaticContact CE2-CE2 3.76Å; F480-F514 HydrophobicContact CE2-CE2 3.76Å; F480-F514 HydrophobicContact CE2-CG 4.17Å; F480-F514 HydrophobicContact CE2-CZ 4.4Å; F480-F514 HydrophobicContact CZ-CD1 4.07Å; F480-F514 AromaticContact CZ-CD2 3.63Å; F480-F514 HydrophobicContact CZ-CD2 3.63Å; F480-F514 AromaticContact CZ-CE1 3.98Å; F480-F514 HydrophobicContact CZ-CE1 3.98Å; F480-F514 AromaticContact CZ-CE2 3.55Å; F480-F514 HydrophobicContact CZ-CE2 3.55Å; F480-F514 AromaticContact CZ-CG 3.91Å; F480-F514 HydrophobicContact CZ-CG 3.91Å; F480-F514 AromaticContact CZ-CZ 3.74Å; F480-F514 HydrophobicContact CZ-CZ 3.74Å; F480-F514 WeakPolarHBondContact CZ-O 3.48Å; L503-F514 HydrophobicContact CD1-CE1 4.3Å; L503-F514 HydrophobicContact CD1-CZ 4.31Å; I506-F514 HydrophobicContact CG2-CE1 3.77Å; I506-F514 HydrophobicContact CG2-CZ 4.04Å; A510-F514 HydrophobicContact CB-CB 3.97Å; A510-F514 HydrophobicContact CB-CD1 3.45Å; A510-F514 VanDerWaalsContact CB-CD1 3.45Å; A510-F514 HydrophobicContact CB-CE1 4.19Å; A510-F514 HydrophobicContact CB-CG 3.89Å; P511-F514 WeakPolarHBondContact O-CB 3.44Å; P511-F514 PolarHBondContact O-N 3.45Å; A512-F514 PolarHBondContact O-N 2.9Å; F514-A517 PolarHBondContact O-N 3.21Å; F514-A518 WeakPolarHBondContact O-CB 3.42Å; F514-A518 PolarHBondContact O-N 2.98Å
515	A	95.6	Very high	91.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.8	-45.2	178	0	0	0	0	0	111.8	C507 P511 A512 A517 A518 L519 V594	C507-A515 HydrophobicContact CB-CB 4.2Å; P511-A515 PolarHBondContact O-N 2.84Å; A512-A515 PolarHBondContact O-N 3.26Å; A515-A517 PolarHBondContact O-N 2.72Å; A515-A518 PolarHBondContact O-N 3.31Å; A515-L519 VanDerWaalsContact O-CG 3.26Å; A515-L519 WeakPolarHBondContact O-CG 3.46Å; A515-L519 PolarHBondContact O-N 2.89Å; A515-V594 HydrophobicContact CB-CG1 4.06Å; A515-V594 HydrophobicContact CB-CG2 4.09Å
516	C	93.9	Very high	91.2	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-58.2	-47.2	173.7	-78.7	0	0	0	0	111.9	A512 A518 L519 L520 V594 F597 P631 F635	A512-C516 WeakPolarHBondContact O-CB 3.39Å; A512-C516 PolarHBondContact O-N 3.07Å; A512-C516 PolarHBondContact O-SG 2.97Å; C516-A518 PolarHBondContact O-N 3.49Å; C516-L519 PolarHBondContact O-N 3.04Å; C516-L520 WeakPolarHBondContact O-CB 3.31Å; C516-L520 WeakPolarHBondContact O-CG 3.43Å; C516-L520 PolarHBondContact O-N 3.46Å; C516-V594 VanDerWaalsContact SG-CG2 3.5Å; C516-F597 HydrophobicContact CB-CD2 4.15Å; C516-F597 HydrophobicContact CB-CE2 4.03Å; C516-P631 HydrophobicContact CB-CB 4.1Å; C516-F635 HydrophobicContact CB-CD2 3.38Å; C516-F635 HydrophobicContact CB-CE2 3.75Å; C516-F635 HydrophobicContact CB-CG 4.23Å; C516-F635 VanDerWaalsContact SG-CD2 3.52Å
517	A	92.8	Very high	90.1	Very high	4 Å²	4	23.4 Å²	23.4	3%	0.033	12%	0.124	C	C	.	.	H	α-helix	trans	-61.4	-43.4	177.2	0	0	0	0	0	112.2	F480 S513 F514 A515 L520 I521 P631 L632	F480-A517 HydrophobicContact CD2-CB 3.88Å; F480-A517 HydrophobicContact CE1-CB 4.32Å; F480-A517 HydrophobicContact CE2-CB 3.6Å; F480-A517 HydrophobicContact CG-CB 4.37Å; F480-A517 HydrophobicContact CZ-CB 3.84Å; S513-A517 WeakPolarHBondContact O-CB 3.18Å; S513-A517 PolarHBondContact O-N 3.19Å; F514-A517 PolarHBondContact O-N 3.21Å; A515-A517 PolarHBondContact O-N 2.72Å; A517-L520 PolarHBondContact O-N 3.12Å; A517-I521 WeakPolarHBondContact O-CG1 3.37Å; A517-I521 PolarHBondContact O-N 3.46Å; A517-P631 HydrophobicContact CB-CB 4.22Å; A517-P631 HydrophobicContact CB-CG 3.78Å; A517-L632 HydrophobicContact CB-CD2 3.6Å; A517-L632 HydrophobicContact CB-CG 4.22Å
518	A	94.2	Very high	88.8	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.5	-47.4	176.8	0	0	0	0	0	112.7	F480 L503 C507 F514 A515 C516 L520 I521 L522	F480-A518 HydrophobicContact CE1-CB 3.83Å; F480-A518 HydrophobicContact CZ-CB 4.1Å; L503-A518 HydrophobicContact CD1-CB 4.19Å; L503-A518 HydrophobicContact CD2-CB 3.78Å; L503-A518 HydrophobicContact CG-CB 3.93Å; C507-A518 WeakPolarHBondContact SG-CB 3.21Å; F514-A518 WeakPolarHBondContact O-CB 3.42Å; F514-A518 PolarHBondContact O-N 2.98Å; A515-A518 PolarHBondContact O-N 3.31Å; C516-A518 PolarHBondContact O-N 3.49Å; A518-L520 VanDerWaalsContact C-N 3.35Å; A518-L520 PolarHBondContact O-N 2.92Å; A518-I521 PolarHBondContact O-N 3.01Å; A518-L522 WeakPolarHBondContact O-CG 3.48Å; A518-L522 PolarHBondContact O-N 3.33Å
519	L	93	Very high	87.3	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.4	-38.8	178.9	-64.6	166.9	0	0	0	111.6	L504 A515 C516 L522 S523 L583 L586 V594 F597 A598 L601 I625	L504-L519 HydrophobicContact CD2-CD2 3.92Å; A515-L519 VanDerWaalsContact O-CG 3.26Å; A515-L519 WeakPolarHBondContact O-CG 3.46Å; A515-L519 PolarHBondContact O-N 2.89Å; C516-L519 PolarHBondContact O-N 3.04Å; L519-L522 PolarHBondContact O-N 2.81Å; L519-S523 WeakPolarHBondContact O-CB 3.31Å; L519-S523 PolarHBondContact O-N 3.22Å; L519-L583 HydrophobicContact CD2-CD2 3.63Å; L519-L586 HydrophobicContact CD2-CD1 4.16Å; L519-V594 HydrophobicContact CD1-CG1 4.01Å; L519-F597 HydrophobicContact CB-CB 4.07Å; L519-F597 HydrophobicContact CD1-CB 3.85Å; L519-A598 HydrophobicContact CD1-CB 4.26Å; L519-L601 HydrophobicContact CB-CD1 4Å; L519-L601 HydrophobicContact CD2-CD1 3.66Å; L519-L601 HydrophobicContact CG-CD1 4.43Å; L519-I625 HydrophobicContact CB-CD1 4.43Å
520	L	90.6	Very high	85.6	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-62.5	-41.3	173.1	-79.3	165.8	0	0	0	113	C516 A517 A518 R524 F597 I625 Y627 P631	C516-L520 WeakPolarHBondContact O-CB 3.31Å; C516-L520 WeakPolarHBondContact O-CG 3.43Å; C516-L520 PolarHBondContact O-N 3.46Å; A517-L520 PolarHBondContact O-N 3.12Å; A518-L520 VanDerWaalsContact C-N 3.35Å; A518-L520 PolarHBondContact O-N 2.92Å; L520-R524 WeakPolarHBondContact O-CG 3.14Å; L520-R524 PolarHBondContact O-N 3.29Å; L520-R524 VanDerWaalsContact O-N 3.1Å; L520-F597 HydrophobicContact CD1-CE2 3.76Å; L520-F597 HydrophobicContact CD1-CZ 4.36Å; L520-F597 HydrophobicContact CD2-CE2 4.21Å; L520-F597 HydrophobicContact CD2-CZ 4.37Å; L520-F597 HydrophobicContact CG-CD2 4.19Å; L520-F597 HydrophobicContact CG-CE2 3.79Å; L520-F597 HydrophobicContact CG-CZ 4.41Å; L520-I625 HydrophobicContact CD2-CB 3.87Å; L520-I625 HydrophobicContact CD2-CG2 3.4Å; L520-I625 VanDerWaalsContact CD2-CG2 3.4Å; L520-I625 HydrophobicContact CG-CG2 4.39Å; L520-Y627 HydrophobicContact CD1-CD1 3.72Å; L520-Y627 HydrophobicContact CD1-CE1 4.38Å; L520-Y627 HydrophobicContact CD1-CG 4.14Å; L520-Y627 HydrophobicContact CD2-CG 4.31Å; L520-P631 HydrophobicContact CD1-CB 3.62Å; L520-P631 HydrophobicContact CD1-CG 3.64Å
521	I	88.7	Confident	83.8	Confident	23 Å²	23	31.4 Å²	31.4	12%	0.118	16%	0.161	C	C	.	.	H	α-helix	trans	-67.4	-44.3	177.3	-66.6	-78.3	0	0	0	110.2	F480 L483 Y484 A517 A518 S523 R524 V525	F480-I521 HydrophobicContact CB-CD1 4.39Å; F480-I521 HydrophobicContact CB-CG1 4.34Å; F480-I521 HydrophobicContact CD1-CG1 3.96Å; F480-I521 HydrophobicContact CG-CG1 4.46Å; L483-I521 HydrophobicContact CD2-CG2 4.11Å; L483-I521 HydrophobicContact CG-CG2 4.36Å; Y484-I521 HydrophobicContact CD2-CD1 4.37Å; A517-I521 WeakPolarHBondContact O-CG1 3.37Å; A517-I521 PolarHBondContact O-N 3.46Å; A518-I521 PolarHBondContact O-N 3.01Å; I521-S523 PolarHBondContact O-N 3.3Å; I521-R524 PolarHBondContact O-N 3.06Å; I521-V525 HydrophobicContact CG2-CG2 4.28Å; I521-V525 WeakPolarHBondContact O-CB 3.26Å; I521-V525 VanDerWaalsContact O-CG2 3.25Å; I521-V525 WeakPolarHBondContact O-CG2 3.37Å; I521-V525 PolarHBondContact O-N 3.31Å
522	L	89.1	Confident	82	Confident	6 Å²	6	29.8 Å²	29.8	3%	0.031	15%	0.149	C	C	.	.	H	α-helix	trans	-61.2	-42.9	175.4	-69.5	176.3	0	0	0	112.1	S500 L503 L504 A518 L519 R524 V525 Q526	S500-L522 WeakPolarHBondContact OG-CD2 3.45Å; L503-L522 HydrophobicContact CD2-CD1 4.12Å; L503-L522 HydrophobicContact CD2-CD2 4.11Å; L503-L522 HydrophobicContact CD2-CG 3.96Å; L504-L522 HydrophobicContact CD1-CD1 4.28Å; L504-L522 HydrophobicContact CD2-CD1 3.67Å; L504-L522 HydrophobicContact CG-CD1 3.85Å; A518-L522 WeakPolarHBondContact O-CG 3.48Å; A518-L522 PolarHBondContact O-N 3.33Å; L519-L522 PolarHBondContact O-N 2.81Å; L522-R524 VanDerWaalsContact C-N 3.34Å; L522-R524 PolarHBondContact O-N 2.9Å; L522-V525 PolarHBondContact O-N 2.93Å; L522-Q526 WeakPolarHBondContact O-CB 3.36Å; L522-Q526 PolarHBondContact O-N 3.28Å
523	S	86.7	Confident	80	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.014	17%	0.168	C	C	.	.	H	α-helix	trans	-58.9	-44.1	175.3	-171.5	0	0	0	0	111.9	L519 I521 Q527 I625	L519-S523 WeakPolarHBondContact O-CB 3.31Å; L519-S523 PolarHBondContact O-N 3.22Å; I521-S523 PolarHBondContact O-N 3.3Å; S523-Q527 WeakPolarHBondContact O-CG 3.35Å; S523-Q527 PolarHBondContact O-N 3.09Å; S523-Q527 PolarHBondContact O-NE2 2.93Å; S523-Q527 PolarHBondContact OG-NE2 3.15Å; S523-I625 PolarHBondContact OG-N 2.76Å
524	R	84	Confident	77.8	Confident	91 Å²	91	34.1 Å²	34.1	34%	0.343	18%	0.179	S	C	.	.	H	α-helix	trans	-67.5	-40.7	176.8	-73.4	-179.4	170.1	116.7	2.6	112.5	Y484 L520 I521 L522 Q527 T528 Y627	Y484-R524 HydrophobicContact CE2-CB 4.08Å; L520-R524 WeakPolarHBondContact O-CG 3.14Å; L520-R524 PolarHBondContact O-N 3.29Å; L520-R524 VanDerWaalsContact O-N 3.1Å; I521-R524 PolarHBondContact O-N 3.06Å; L522-R524 VanDerWaalsContact C-N 3.34Å; L522-R524 PolarHBondContact O-N 2.9Å; R524-Q527 PolarHBondContact O-N 3.27Å; R524-T528 PolarHBondContact O-N 2.88Å; R524-T528 PolarHBondContact O-OG1 3.21Å; R524-Y627 PolarHBondContact NH2-O 3Å
525	V	82.1	Confident	75.3	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.1	-40.2	177.2	169.3	0	0	0	0	111.5	Y484 L487 I521 L522 Q527 T528 I529 L532	Y484-V525 HydrophobicContact CD2-CG2 4.06Å; Y484-V525 HydrophobicContact CE2-CG2 4.44Å; L487-V525 HydrophobicContact CB-CG1 3.92Å; L487-V525 HydrophobicContact CB-CG2 3.88Å; L487-V525 HydrophobicContact CD1-CG1 4.33Å; L487-V525 HydrophobicContact CD1-CG2 3.95Å; I521-V525 HydrophobicContact CG2-CG2 4.28Å; I521-V525 WeakPolarHBondContact O-CB 3.26Å; I521-V525 VanDerWaalsContact O-CG2 3.25Å; I521-V525 WeakPolarHBondContact O-CG2 3.37Å; I521-V525 PolarHBondContact O-N 3.31Å; L522-V525 PolarHBondContact O-N 2.93Å; V525-Q527 VanDerWaalsContact C-N 3.31Å; V525-Q527 PolarHBondContact O-N 2.84Å; V525-T528 PolarHBondContact O-N 3.28Å; V525-T528 VanDerWaalsContact O-N 3.13Å; V525-I529 HydrophobicContact CG1-CD1 3.57Å; V525-I529 HydrophobicContact CG1-CG1 4.24Å; V525-I529 PolarHBondContact O-N 3Å; V525-L532 HydrophobicContact CG1-CD1 4.07Å
526	Q	78.9	Confident	72.8	Confident	27 Å²	27	45.7 Å²	45.7	13%	0.126	25%	0.25	C	C	.	.	H	α-helix	trans	-61	-37.7	176.6	-177.4	164.7	6.9	0	0	112.5	L522 K530 L532 F620	L522-Q526 WeakPolarHBondContact O-CB 3.36Å; L522-Q526 PolarHBondContact O-N 3.28Å; Q526-K530 PolarHBondContact O-N 3.35Å; Q526-L532 HydrophobicContact CB-CB 4.43Å; Q526-L532 HydrophobicContact CB-CD1 4.07Å; Q526-L532 HydrophobicContact CG-CB 4.14Å; Q526-F620 PolarHBondContact NE2-O 3.32Å; Q526-F620 VanDerWaalsContact NE2-O 3.15Å
527	Q	72.5	Confident	70.1	Confident	92 Å²	92	47.7 Å²	47.7	43%	0.43	26%	0.263	S	S	.	.	H	α-helix	trans	-64.8	-40.2	173.6	-70.7	158.4	60.1	0	0	112.1	S523 R524 V525	S523-Q527 WeakPolarHBondContact O-CG 3.35Å; S523-Q527 PolarHBondContact O-N 3.09Å; S523-Q527 PolarHBondContact O-NE2 2.93Å; S523-Q527 PolarHBondContact OG-NE2 3.15Å; R524-Q527 PolarHBondContact O-N 3.27Å; V525-Q527 VanDerWaalsContact C-N 3.31Å; V525-Q527 PolarHBondContact O-N 2.84Å
528	T	67.4	Low	67.5	Low	79 Å²	79	54.4 Å²	54.4	49%	0.485	29%	0.294	S	S	.	.	H	α-helix	trans	-72.6	-47.2	-179.3	-55.6	0	0	0	0	112.8	C488 R524 V525	C488-T528 HydrophobicContact CB-CG2 4.45Å; R524-T528 PolarHBondContact O-N 2.88Å; R524-T528 PolarHBondContact O-OG1 3.21Å; V525-T528 PolarHBondContact O-N 3.28Å; V525-T528 VanDerWaalsContact O-N 3.13Å
529	I	63.5	Low	64.8	Low	35 Å²	35	64.8 Å²	64.8	18%	0.179	33%	0.333	C	S	.	.	H	α-helix	trans	-91.1	-10.8	-165.5	-61	-178.6	0	0	0	112.6	L487 T496 V525 S531	L487-I529 WeakPolarHBondContact O-CD1 3.24Å; T496-I529 HydrophobicContact CG2-CD1 3.97Å; V525-I529 HydrophobicContact CG1-CD1 3.57Å; V525-I529 HydrophobicContact CG1-CG1 4.24Å; V525-I529 PolarHBondContact O-N 3Å; I529-S531 PolarHBondContact O-N 2.92Å; I529-S531 PolarHBondContact O-OG 2.86Å
530	K	57.1	Low	62.1	Low	177 Å²	177	69.2 Å²	69.2	77%	0.77	36%	0.357	S	S	*	.	S	Bend	trans	57.6	-21.8	-170.9	-63.4	-175.6	178.2	-179.1	0	115.7	Q526	Q526-K530 PolarHBondContact O-N 3.35Å
531	S	55	Low	59.5	Low	48 Å²	48	73.3 Å²	73.3	34%	0.336	39%	0.386	S	S	.	.			trans	-112.9	90.3	-177.4	57.9	0	0	0	0	112.8	I529 P533	I529-S531 PolarHBondContact O-N 2.92Å; I529-S531 PolarHBondContact O-OG 2.86Å; S531-P533 VanDerWaalsContact C-CD 3.41Å
532	L	55.6	Low	57.2	Low	17 Å²	17	77.6 Å²	77.6	9%	0.089	41%	0.409	C	S	.	.			trans	-121.6	35.2	147.2	-94.2	101.3	0	0	0	112.1	V525 Q526	V525-L532 HydrophobicContact CG1-CD1 4.07Å; Q526-L532 HydrophobicContact CB-CB 4.43Å; Q526-L532 HydrophobicContact CB-CD1 4.07Å; Q526-L532 HydrophobicContact CG-CB 4.14Å
533	P	50.4	Low	55	Low	73 Å²	73	84.1 Å²	84.1	47%	0.474	44%	0.444	S	S	.	.			trans	-72.6	142.6	-176.9	3.5	19.9	0	0	0	107.3	R497 S531 K535	R497-P533 PolarHBondContact NH1-O 3.19Å; S531-P533 VanDerWaalsContact C-CD 3.41Å; P533-K535 PolarHBondContact O-N 2.89Å
534	A	47.7	Very low	52.9	Low	40 Å²	40	91.5 Å²	91.5	33%	0.331	48%	0.483	S	S	.	.			trans	-60.2	111.5	148.2	0	0	0	0	0	106.2	G536	A534-G536 PolarHBondContact O-N 3.14Å
535	K	43.4	Very low	50.8	Low	172 Å²	172	93.3 Å²	93.3	75%	0.748	50%	0.5	S	S	*	.			trans	-54.1	126.6	147.5	-98.4	-173.6	170.2	-173.7	0	104.3	P533 C537	P533-K535 PolarHBondContact O-N 2.89Å; K535-C537 PolarHBondContact O-N 3.09Å; K535-C537 VanDerWaalsContact O-N 3.08Å
536	G	41.9	Very low	48.8	Very low	71 Å²	71	102.7 Å²	102.7	73%	0.732	54%	0.544	S	S	*	.			trans	-50.4	122.6	-172.3	0	0	0	0	0	108.7	A534 H538	A534-G536 PolarHBondContact O-N 3.14Å; G536-H538 VanDerWaalsContact C-N 3.3Å; G536-H538 PolarHBondContact O-N 3.23Å
537	C	38.3	Very low	46.7	Very low	42 Å²	42	110.8 Å²	110.8	28%	0.284	58%	0.582	S	S	.	*			trans	-68.4	101.8	171.7	-53.9	0	0	0	0	104.8	K535 W539 P579	K535-C537 PolarHBondContact O-N 3.09Å; K535-C537 VanDerWaalsContact O-N 3.08Å; C537-W539 PolarHBondContact O-N 3.5Å; C537-P579 HydrophobicContact CB-CG 4.39Å; C537-P579 WeakPolarHBondContact SG-CD 3.23Å; C537-P579 WeakPolarHBondContact SG-CG 3.28Å
538	H	37.3	Very low	44.9	Very low	145 Å²	145	110.5 Å²	110.5	67%	0.671	60%	0.595	S	S	*	*			trans	-59	103.4	158.7	-132.5	-38.4	0	0	0	104.5	G536 D540	G536-H538 VanDerWaalsContact C-N 3.3Å; G536-H538 PolarHBondContact O-N 3.23Å; H538-D540 IonicContact CD2-OD1 3.21Å; H538-D540 IonicContact CD2-OD2 3.88Å; H538-D540 PolarHBondContact CD2-OD2 3.27Å; H538-D540 VanDerWaalsContact CD2-OD2 3.31Å; H538-D540 VanDerWaalsContact CE1-CG 3.45Å; H538-D540 IonicContact CE1-OD1 2.67Å; H538-D540 PolarHBondContact CE1-OD1 2.94Å; H538-D540 IonicContact CE1-OD2 2.67Å; H538-D540 IonicContact CG-OD1 3.48Å; H538-D540 IonicContact CG-OD2 2.66Å; H538-D540 VanDerWaalsContact CG-OD2 3.31Å; H538-D540 WeakPolarHBondContact ND1-CA 3.36Å; H538-D540 PolarHBondContact ND1-N 3.2Å; H538-D540 VanDerWaalsContact ND1-N 3.15Å; H538-D540 IonicContact ND1-OD1 3.08Å; H538-D540 PolarHBondContact ND1-OD1 3.4Å; H538-D540 IonicContact ND1-OD2 2.63Å; H538-D540 IonicContact NE2-OD1 3.36Å; H538-D540 PolarHBondContact NE2-OD1 3.34Å; H538-D540 IonicContact NE2-OD2 2.73Å; H538-D540 PolarHBondContact O-N 3.35Å
539	W	38.7	Very low	43.4	Very low	218 Å²	218	111.5 Å²	111.5	83%	0.826	61%	0.611	S	S	*	*			trans	-69	92.4	130.2	-50	90.8	0	0	0	102.3	C537 S541	C537-W539 PolarHBondContact O-N 3.5Å; W539-S541 PolarHBondContact O-N 2.89Å; W539-S541 VanDerWaalsContact O-N 3.13Å
540	D	35.7	Very low	42	Very low	93 Å²	93	118.6 Å²	118.6	50%	0.497	64%	0.644	S	S	.	*			trans	-60.7	107.2	145.1	-88	-55.6	0	0	0	103	H538 D542	H538-D540 IonicContact CD2-OD1 3.21Å; H538-D540 IonicContact CD2-OD2 3.88Å; H538-D540 PolarHBondContact CD2-OD2 3.27Å; H538-D540 VanDerWaalsContact CD2-OD2 3.31Å; H538-D540 VanDerWaalsContact CE1-CG 3.45Å; H538-D540 IonicContact CE1-OD1 2.67Å; H538-D540 PolarHBondContact CE1-OD1 2.94Å; H538-D540 IonicContact CE1-OD2 2.67Å; H538-D540 IonicContact CG-OD1 3.48Å; H538-D540 IonicContact CG-OD2 2.66Å; H538-D540 VanDerWaalsContact CG-OD2 3.31Å; H538-D540 WeakPolarHBondContact ND1-CA 3.36Å; H538-D540 PolarHBondContact ND1-N 3.2Å; H538-D540 VanDerWaalsContact ND1-N 3.15Å; H538-D540 IonicContact ND1-OD1 3.08Å; H538-D540 PolarHBondContact ND1-OD1 3.4Å; H538-D540 IonicContact ND1-OD2 2.63Å; H538-D540 IonicContact NE2-OD1 3.36Å; H538-D540 PolarHBondContact NE2-OD1 3.34Å; H538-D540 IonicContact NE2-OD2 2.73Å; H538-D540 PolarHBondContact O-N 3.35Å; D540-D542 PolarHBondContact O-N 3.49Å
541	S	34.7	Very low	40.9	Very low	89 Å²	89	119.6 Å²	119.6	62%	0.622	65%	0.651	S	S	*	*			trans	-67.9	87.3	157.1	-84.8	0	0	0	0	104.3	W539 D543	W539-S541 PolarHBondContact O-N 2.89Å; W539-S541 VanDerWaalsContact O-N 3.13Å; S541-D543 WeakPolarHBondContact CB-OD2 3.22Å; S541-D543 PolarHBondContact O-N 2.8Å
542	D	40.3	Very low	40	Very low	113 Å²	113	120.7 Å²	120.7	60%	0.604	67%	0.67	S	S	*	*			trans	-67.6	63.5	165.3	-65.4	-36.9	0	0	0	108	D540 D544 D545	D540-D542 PolarHBondContact O-N 3.49Å; D542-D544 PolarHBondContact O-N 3.28Å; D542-D545 HydrophobicContact CB-CB 4.39Å
543	D	44.7	Very low	39.1	Very low	142 Å²	142	126.8 Å²	126.8	76%	0.759	71%	0.708	S	S	*	*			trans	-77.4	1.9	173.1	-76	-36.9	0	0	0	111	S541	S541-D543 WeakPolarHBondContact CB-OD2 3.22Å; S541-D543 PolarHBondContact O-N 2.8Å
544	D	42.2	Very low	38.4	Very low	158 Å²	158	130.3 Å²	130.3	85%	0.845	72%	0.723	S	S	*	*	S	Bend	trans	-115.7	-8.1	-176.8	-75.9	-39.7	0	0	0	115	D542 E546	D542-D544 PolarHBondContact O-N 3.28Å; D544-E546 PolarHBondContact O-N 3Å
545	D	40.2	Very low	37.8	Very low	129 Å²	129	132.6 Å²	132.6	69%	0.69	75%	0.75	S	S	*	*			trans	-96.3	52	-172.3	-103.2	5.5	0	0	0	114.3	D542	D542-D545 HydrophobicContact CB-CB 4.39Å
546	E	39.7	Very low	37.3	Very low	197 Å²	197	130.7 Å²	130.7	92%	0.921	75%	0.752	S	S	*	*			trans	-96.1	2.6	171.9	-139.6	178.3	-152.7	0	0	114.2	D544	D544-E546 PolarHBondContact O-N 3Å
547	E	35	Very low	37.3	Very low	197 Å²	197	136.5 Å²	136.5	92%	0.921	76%	0.757	S	S	*	*	S	Bend	trans	-118.2	42.9	-178.6	-69.4	-157.6	148.8	0	0	115.6
548	A	35.1	Very low	37.4	Very low	86 Å²	86	139.3 Å²	139.3	71%	0.711	78%	0.777	S	S	*	*			trans	-142.3	44.2	177	0	0	0	0	0	115.9
549	A	34.6	Very low	37.8	Very low	100 Å²	100	138.8 Å²	138.8	83%	0.826	78%	0.779	S	S	*	*			trans	-124	42.1	-176	0	0	0	0	0	115.7
550	Q	34.6	Very low	38.7	Very low	184 Å²	184	132.5 Å²	132.5	86%	0.86	77%	0.765	S	S	*	*	S	Bend	trans	-135.9	143.4	164.9	-67.3	-167.8	1.5	0	0	112.9
551	E	33.2	Very low	40.3	Very low	197 Å²	197	133.6 Å²	133.6	92%	0.921	77%	0.768	S	S	*	*			trans	72.8	122.1	175	-50.6	-160.9	162	0	0	118.5
552	G	37.3	Very low	42.6	Very low	72 Å²	72	133.9 Å²	133.9	74%	0.742	77%	0.765	S	S	*	*			trans	153.7	44.6	170.7	0	0	0	0	0	118.2	N554	G552-N554 PolarHBondContact O-N 3.34Å
553	V	37.1	Very low	44.8	Very low	145 Å²	145	129.5 Å²	129.5	88%	0.879	74%	0.741	S	S	*	*			trans	-70.3	94.1	172.7	178.7	0	0	0	0	110.5
554	N	35.6	Very low	46.9	Very low	147 Å²	147	125.9 Å²	125.9	79%	0.786	72%	0.721	S	S	*	*	S	Bend	trans	-158.4	135.8	155.6	-99.3	-44.7	0	0	0	111.2	G552 V556	G552-N554 PolarHBondContact O-N 3.34Å; N554-V556 VanDerWaalsContact C-N 3.31Å; N554-V556 PolarHBondContact O-N 3.03Å
555	G	34.9	Very low	49.1	Very low	87 Å²	87	122.5 Å²	122.5	90%	0.897	71%	0.707	S	S	*	*			trans	-74.5	65.1	-165.3	0	0	0	0	0	116.3
556	V	33.5	Very low	51.4	Low	132 Å²	132	120.6 Å²	120.6	80%	0.8	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-83	125.2	164.5	-176.8	0	0	0	0	108.3	N554 S558	N554-V556 VanDerWaalsContact C-N 3.31Å; N554-V556 PolarHBondContact O-N 3.03Å; V556-S558 PolarHBondContact O-N 2.83Å
557	K	40.7	Very low	53.8	Low	194 Å²	194	111.7 Å²	111.7	84%	0.843	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-63.2	124.4	174.1	-67.7	175	-179.8	173.8	0	108.4	N559	K557-N559 PolarHBondContact O-N 3.4Å
558	S	41.2	Very low	56.4	Low	100 Å²	100	111.7 Å²	111.7	70%	0.699	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-53.3	129.1	174.7	46.5	0	0	0	0	109.8	V556 T560	V556-S558 PolarHBondContact O-N 2.83Å; S558-T560 PolarHBondContact O-N 3.07Å
559	N	45.8	Very low	59.1	Low	134 Å²	134	108.6 Å²	108.6	72%	0.717	63%	0.626	S	S	*	*			trans	-81.6	65.8	-172.7	-165.6	30.3	0	0	0	109.7	K557 E561 R574	K557-N559 PolarHBondContact O-N 3.4Å; N559-E561 PolarHBondContact O-N 3.14Å; N559-R574 PolarHBondContact O-NH1 2.88Å
560	T	56.1	Low	61.8	Low	87 Å²	87	103.9 Å²	103.9	53%	0.534	59%	0.587	S	S	.	*			trans	-52.9	114.9	-166	44.1	0	0	0	0	112.4	S558 T562 R574	S558-T560 PolarHBondContact O-N 3.07Å; T560-T562 PolarHBondContact O-N 3.29Å; T560-T562 VanDerWaalsContact O-N 3.16Å; T560-R574 PolarHBondContact O-NH1 3.4Å
561	E	70.3	Confident	64.4	Low	116 Å²	116	97.7 Å²	97.7	54%	0.542	56%	0.56	S	S	.	*			trans	-63	-17.8	-176.9	-66.4	-84.6	100	0	0	113.4	N559 R574	N559-E561 PolarHBondContact O-N 3.14Å; E561-R574 VanDerWaalsContact CA-CZ 3.48Å; E561-R574 IonicContact OE1-CZ 3.72Å; E561-R574 IonicContact OE1-NH1 3.74Å; E561-R574 IonicContact OE1-NH2 2.82Å; E561-R574 PolarHBondContact OE1-NH2 3.12Å
562	T	82	Confident	67.1	Low	94 Å²	94	96.1 Å²	96.1	58%	0.577	55%	0.547	S	S	*	.	S	Bend	trans	-81.8	154.1	-170.4	55.8	0	0	0	0	114.4	T560 D564	T560-T562 PolarHBondContact O-N 3.29Å; T560-T562 VanDerWaalsContact O-N 3.16Å; T562-D564 PolarHBondContact O-N 3.15Å
563	Y	87.5	Confident	69.7	Low	21 Å²	21	92.7 Å²	92.7	8%	0.082	51%	0.511	C	S	.	.			trans	-60	127.1	173.7	166.4	-108.8	0	0	0	113.2	Y461 K501 Q505 T565 A573 A575 E578	Y461-Y563 PolarHBondContact OH-OH 3.1Å; K501-Y563 HydrophobicContact CG-CD1 4.45Å; K501-Y563 HydrophobicContact CG-CE1 3.96Å; K501-Y563 HydrophobicContact CG-CE2 4.07Å; Q505-Y563 PolarHBondContact OE1-OH 3.25Å; Y563-T565 HydrophobicContact CD1-CG2 3.99Å; Y563-T565 HydrophobicContact CE1-CG2 3.53Å; Y563-A573 CarbonylContact C-O 3.53Å; Y563-A573 VanDerWaalsContact CA-O 3.26Å; Y563-A573 WeakPolarHBondContact CA-O 3.3Å; Y563-A573 HydrophobicContact CD2-CB 4.16Å; Y563-A573 WeakPolarHBondContact CD2-O 3.45Å; Y563-A573 HydrophobicContact CE2-CB 3.94Å; Y563-A575 HydrophobicContact CD2-CB 3.55Å; Y563-A575 HydrophobicContact CE2-CB 3.73Å; Y563-E578 WeakPolarHBondContact CB-OE2 3.47Å; Y563-E578 WeakPolarHBondContact CD1-OE2 3.35Å
564	D	89.2	Confident	72	Confident	67 Å²	67	89 Å²	89	36%	0.358	48%	0.481	S	S	.	.			trans	-92.7	101.1	174.6	175.6	20	0	0	0	111.2	T562 S566 A567 A573	T562-D564 PolarHBondContact O-N 3.15Å; D564-S566 PolarHBondContact O-N 2.75Å; D564-S566 WeakPolarHBondContact OD1-CA 3.29Å; D564-S566 VanDerWaalsContact OD1-CB 3.29Å; D564-S566 WeakPolarHBondContact OD1-CB 3.43Å; D564-S566 PolarHBondContact OD1-N 3.2Å; D564-S566 PolarHBondContact OD1-OG 3.15Å; D564-S566 PolarHBondContact OD2-OG 3.22Å; D564-A567 HydrophobicContact CB-CB 4.07Å; D564-A567 VanDerWaalsContact CG-N 3.32Å; D564-A567 VanDerWaalsContact O-CB 3.24Å; D564-A567 WeakPolarHBondContact O-CB 3.39Å; D564-A567 PolarHBondContact O-N 3.07Å; D564-A567 VanDerWaalsContact O-N 3.16Å; D564-A567 PolarHBondContact OD1-N 3.25Å; D564-A567 VanDerWaalsContact OD2-CA 3.24Å; D564-A567 WeakPolarHBondContact OD2-CA 3.28Å; D564-A567 WeakPolarHBondContact OD2-CB 3.47Å; D564-A567 PolarHBondContact OD2-N 2.84Å; D564-A567 VanDerWaalsContact OD2-N 3.09Å; D564-A573 PolarHBondContact N-O 2.98Å
565	T	87.4	Confident	74.4	Confident	87 Å²	87	82 Å²	82	53%	0.534	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-28.8	172.8	58.1	0	0	0	0	113.4	R502 Y563	R502-T565 PolarHBondContact NH2-O 3.44Å; Y563-T565 HydrophobicContact CD1-CG2 3.99Å; Y563-T565 HydrophobicContact CE1-CG2 3.53Å
566	S	88.5	Confident	76.5	Confident	89 Å²	89	81.1 Å²	81.1	62%	0.622	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-6.2	-176.3	82.4	0	0	0	0	113.8	D564 R568	D564-S566 PolarHBondContact O-N 2.75Å; D564-S566 WeakPolarHBondContact OD1-CA 3.29Å; D564-S566 VanDerWaalsContact OD1-CB 3.29Å; D564-S566 WeakPolarHBondContact OD1-CB 3.43Å; D564-S566 PolarHBondContact OD1-N 3.2Å; D564-S566 PolarHBondContact OD1-OG 3.15Å; D564-S566 PolarHBondContact OD2-OG 3.22Å; S566-R568 PolarHBondContact O-N 3.36Å
567	A	90.8	Very high	78.7	Confident	9 Å²	9	79 Å²	79	7%	0.074	40%	0.401	C	S	.	.			trans	-52.3	130.5	-174.4	0	0	0	0	0	112.2	Y461 R502 D564 A573	Y461-A567 WeakPolarHBondContact CE1-O 3.48Å; R502-A567 PolarHBondContact NH2-O 3.01Å; D564-A567 HydrophobicContact CB-CB 4.07Å; D564-A567 VanDerWaalsContact CG-N 3.32Å; D564-A567 VanDerWaalsContact O-CB 3.24Å; D564-A567 WeakPolarHBondContact O-CB 3.39Å; D564-A567 PolarHBondContact O-N 3.07Å; D564-A567 VanDerWaalsContact O-N 3.16Å; D564-A567 PolarHBondContact OD1-N 3.25Å; D564-A567 VanDerWaalsContact OD2-CA 3.24Å; D564-A567 WeakPolarHBondContact OD2-CA 3.28Å; D564-A567 WeakPolarHBondContact OD2-CB 3.47Å; D564-A567 PolarHBondContact OD2-N 2.84Å; D564-A567 VanDerWaalsContact OD2-N 3.09Å; A567-A573 HydrophobicContact CB-CB 3.73Å
568	R	89.1	Confident	80.5	Confident	198 Å²	198	72.6 Å²	72.6	75%	0.747	37%	0.374	S	S	*	.	S	Bend	trans	-76	-41	-179.4	-68.3	179.9	177.2	-179.2	-0.5	112.5	R458 S566	R458-R568 WeakPolarHBondContact CG-O 3.23Å; S566-R568 PolarHBondContact O-N 3.36Å
569	N	90.7	Very high	82.3	Confident	21 Å²	21	69.8 Å²	69.8	11%	0.112	35%	0.354	C	S	.	.	S	Bend	trans	-104.9	123.7	175.3	-177.7	-12.4	0	0	0	107.9	D454 L571 Y572	D454-N569 PolarHBondContact OD2-ND2 3.15Å; N569-L571 PolarHBondContact O-N 3.26Å; N569-L571 WeakPolarHBondContact OD1-CB 3.48Å; N569-L571 PolarHBondContact OD1-N 3.35Å; N569-Y572 HydrophobicContact CB-CD2 3.95Å; N569-Y572 HydrophobicContact CB-CE2 4.47Å; N569-Y572 PolarHBondContact O-N 2.82Å
570	P	92.9	Very high	84.2	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.006	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-58.3	-26.1	179.2	22.3	-33.2	0	0	0	114.1	Y461 R495 A498 I499 Y572 A573	Y461-P570 HydrophobicContact CD1-CB 3.66Å; Y461-P570 VanDerWaalsContact CD1-CD 3.49Å; Y461-P570 HydrophobicContact CD1-CG 3.98Å; Y461-P570 HydrophobicContact CD2-CB 3.97Å; Y461-P570 HydrophobicContact CE1-CB 3.83Å; Y461-P570 HydrophobicContact CE2-CB 4.13Å; Y461-P570 HydrophobicContact CG-CB 3.73Å; Y461-P570 HydrophobicContact CG-CG 3.92Å; R495-P570 HydrophobicContact CG-CB 4Å; R495-P570 HydrophobicContact CG-CG 3.72Å; A498-P570 HydrophobicContact CB-CB 3.83Å; A498-P570 VanDerWaalsContact CB-O 3.27Å; A498-P570 WeakPolarHBondContact CB-O 3.1Å; I499-P570 HydrophobicContact CG1-CB 4.24Å; P570-Y572 VanDerWaalsContact C-N 3.25Å; P570-Y572 PolarHBondContact O-N 2.9Å; P570-A573 WeakPolarHBondContact O-CB 3.23Å; P570-A573 PolarHBondContact O-N 3.4Å
571	L	89.3	Confident	85.7	Confident	53 Å²	53	63.4 Å²	63.4	28%	0.277	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-61.8	-32.6	178	-171.5	66	0	0	0	112.9	Q492 R495 N569	Q492-L571 HydrophobicContact CB-CD1 4.25Å; Q492-L571 HydrophobicContact CG-CD1 4.41Å; R495-L571 HydrophobicContact CB-CD1 4.31Å; N569-L571 PolarHBondContact O-N 3.26Å; N569-L571 WeakPolarHBondContact OD1-CB 3.48Å; N569-L571 PolarHBondContact OD1-N 3.35Å
572	Y	90	Very high	86.7	Confident	165 Å²	165	58.4 Å²	58.4	65%	0.647	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-100.8	13.8	-179.6	-53.9	-61	0	0	0	113	N569 P570 R574	N569-Y572 HydrophobicContact CB-CD2 3.95Å; N569-Y572 HydrophobicContact CB-CE2 4.47Å; N569-Y572 PolarHBondContact O-N 2.82Å; P570-Y572 VanDerWaalsContact C-N 3.25Å; P570-Y572 PolarHBondContact O-N 2.9Å; Y572-R574 VanDerWaalsContact C-N 3.32Å
573	A	90.3	Very high	87.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.271	C	S	.	.	S	Bend	trans	-77.3	-16	179.6	0	0	0	0	0	113.4	A498 Y563 D564 A567 P570 A575	A498-A573 HydrophobicContact CB-CB 3.86Å; Y563-A573 CarbonylContact C-O 3.53Å; Y563-A573 VanDerWaalsContact CA-O 3.26Å; Y563-A573 WeakPolarHBondContact CA-O 3.3Å; Y563-A573 HydrophobicContact CD2-CB 4.16Å; Y563-A573 WeakPolarHBondContact CD2-O 3.45Å; Y563-A573 HydrophobicContact CE2-CB 3.94Å; D564-A573 PolarHBondContact N-O 2.98Å; A567-A573 HydrophobicContact CB-CB 3.73Å; P570-A573 WeakPolarHBondContact O-CB 3.23Å; P570-A573 PolarHBondContact O-N 3.4Å; A573-A575 VanDerWaalsContact C-N 3.29Å; A573-A575 PolarHBondContact O-N 3.26Å
574	R	85.8	Confident	87.3	Confident	66 Å²	66	58.3 Å²	58.3	25%	0.249	29%	0.292	C	S	.	.			trans	58.7	30.3	-177.5	-51.8	-174.6	76.1	163.8	2.9	114.9	N559 T560 E561 Y572 D576 M577	N559-R574 PolarHBondContact O-NH1 2.88Å; T560-R574 PolarHBondContact O-NH1 3.4Å; E561-R574 VanDerWaalsContact CA-CZ 3.48Å; E561-R574 IonicContact OE1-CZ 3.72Å; E561-R574 IonicContact OE1-NH1 3.74Å; E561-R574 IonicContact OE1-NH2 2.82Å; E561-R574 PolarHBondContact OE1-NH2 3.12Å; Y572-R574 VanDerWaalsContact C-N 3.32Å; R574-D576 VanDerWaalsContact C-OD1 3.24Å; R574-D576 WeakPolarHBondContact CA-OD1 3.47Å; R574-D576 PolarHBondContact O-N 2.98Å; R574-M577 HydrophobicContact CB-CG 4.16Å; R574-M577 WeakPolarHBondContact O-CB 3.17Å; R574-M577 PolarHBondContact O-N 2.88Å; R574-M577 VanDerWaalsContact O-N 3.11Å
575	A	85.9	Confident	87.5	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-11.3	-179.6	0	0	0	0	0	114.3	R497 A498 K501 Y563 A573 M577	R497-A575 WeakPolarHBondContact CD-O 3.28Å; R497-A575 HydrophobicContact CG-CB 4.27Å; R497-A575 PolarHBondContact NE-O 2.93Å; A498-A575 HydrophobicContact CB-CB 3.8Å; K501-A575 HydrophobicContact CB-CB 4.16Å; K501-A575 HydrophobicContact CG-CB 4.39Å; Y563-A575 HydrophobicContact CD2-CB 3.55Å; Y563-A575 HydrophobicContact CE2-CB 3.73Å; A573-A575 VanDerWaalsContact C-N 3.29Å; A573-A575 PolarHBondContact O-N 3.26Å; A575-M577 VanDerWaalsContact C-N 3.34Å
576	D	79.8	Confident	87.9	Confident	69 Å²	69	56 Å²	56	37%	0.369	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-21.3	171	52.6	-40.6	0	0	0	113.8	R574	R574-D576 VanDerWaalsContact C-OD1 3.24Å; R574-D576 WeakPolarHBondContact CA-OD1 3.47Å; R574-D576 PolarHBondContact O-N 2.98Å
577	M	78.5	Confident	88.1	Confident	89 Å²	89	55.8 Å²	55.8	44%	0.438	26%	0.263	S	S	.	.	S	Bend	trans	-82.5	-21.8	175.8	-53.5	-57.8	-68.4	0	0	113.3	R574 A575	R574-M577 HydrophobicContact CB-CG 4.16Å; R574-M577 WeakPolarHBondContact O-CB 3.17Å; R574-M577 PolarHBondContact O-N 2.88Å; R574-M577 VanDerWaalsContact O-N 3.11Å; A575-M577 VanDerWaalsContact C-N 3.34Å
578	E	79.4	Confident	88.2	Confident	58 Å²	58	64.2 Å²	64.2	27%	0.271	30%	0.298	S	S	.	.	S	Bend	trans	-108.2	142.9	-173.9	-165.8	-168.9	167.7	0	0	112	R497 K501 Y563	R497-E578 PolarHBondContact NH2-O 2.82Å; K501-E578 WeakPolarHBondContact CE-OE2 3.29Å; K501-E578 IonicContact NZ-OE1 3.81Å; K501-E578 PolarHBondContact NZ-OE1 3.01Å; K501-E578 IonicContact NZ-OE2 2.82Å; K501-E578 PolarHBondContact NZ-OE2 3.35Å; Y563-E578 WeakPolarHBondContact CB-OE2 3.47Å; Y563-E578 WeakPolarHBondContact CD1-OE2 3.35Å
579	P	79.7	Confident	88.5	Confident	42 Å²	42	56.3 Å²	56.3	27%	0.273	27%	0.27	S	S	.	.			trans	-72.2	158.8	174.4	20.4	-17.2	0	0	0	112.2	K501 C537 V581	K501-P579 PolarHBondContact NZ-O 3.23Å; C537-P579 HydrophobicContact CB-CG 4.39Å; C537-P579 WeakPolarHBondContact SG-CD 3.23Å; C537-P579 WeakPolarHBondContact SG-CG 3.28Å; P579-V581 HydrophobicContact CB-CG1 4.15Å; P579-V581 HydrophobicContact CG-CG1 3.81Å; P579-V581 PolarHBondContact O-N 3.28Å
580	L	84.5	Confident	88.6	Confident	29 Å²	29	63.5 Å²	63.5	15%	0.152	30%	0.296	C	S	.	.			trans	-80.1	55.9	176.7	-57.9	-175.9	0	0	0	111.2	K501 L504 E582 L583	K501-L580 HydrophobicContact CB-CD2 4.14Å; K501-L580 HydrophobicContact CD-CD2 3.83Å; L504-L580 HydrophobicContact CD1-CB 4.06Å; L504-L580 HydrophobicContact CD1-CD1 4.07Å; L504-L580 HydrophobicContact CD1-CD2 4.25Å; L504-L580 HydrophobicContact CD1-CG 4.35Å; L580-E582 PolarHBondContact O-N 3.23Å; L580-L583 HydrophobicContact CB-CD1 4.01Å; L580-L583 HydrophobicContact CB-CG 4.42Å; L580-L583 HydrophobicContact CD1-CD1 4.31Å; L580-L583 WeakPolarHBondContact O-CB 3.48Å; L580-L583 PolarHBondContact O-N 3.46Å
581	V	88.1	Confident	88.6	Confident	57 Å²	57	64.9 Å²	64.9	35%	0.345	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-24.4	-175	-61	0	0	0	0	113.7	P579 L583 L584 L585	P579-V581 HydrophobicContact CB-CG1 4.15Å; P579-V581 HydrophobicContact CG-CG1 3.81Å; P579-V581 PolarHBondContact O-N 3.28Å; V581-L583 PolarHBondContact O-N 3.01Å; V581-L584 VanDerWaalsContact O-CB 3.3Å; V581-L584 WeakPolarHBondContact O-CB 3.46Å; V581-L584 PolarHBondContact O-N 3.37Å; V581-L585 PolarHBondContact O-N 3.45Å
582	E	92.4	Very high	88.7	Confident	11 Å²	11	65 Å²	65	5%	0.051	31%	0.306	C	S	.	.	H	α-helix	trans	-58	-30.2	174.5	-62.1	84.6	172.6	0	0	112.3	K501 L504 Q505 L508 L580 L584 L585 L586	K501-E582 WeakPolarHBondContact CD-OE1 3.34Å; K501-E582 WeakPolarHBondContact CD-OE2 3.4Å; K501-E582 WeakPolarHBondContact CE-OE1 3.37Å; K501-E582 VanDerWaalsContact NZ-CD 3.27Å; K501-E582 IonicContact NZ-OE1 2.89Å; K501-E582 PolarHBondContact NZ-OE1 3.25Å; K501-E582 IonicContact NZ-OE2 3.74Å; K501-E582 PolarHBondContact NZ-OE2 3.5Å; L504-E582 HydrophobicContact CB-CB 3.7Å; L504-E582 HydrophobicContact CB-CG 4.23Å; Q505-E582 HydrophobicContact CG-CG 3.84Å; Q505-E582 WeakPolarHBondContact CG-OE1 3.29Å; Q505-E582 PolarHBondContact NE2-OE1 3.34Å; L508-E582 HydrophobicContact CD1-CB 4.34Å; L508-E582 HydrophobicContact CD1-CG 3.91Å; L508-E582 HydrophobicContact CD2-CB 4.41Å; L508-E582 HydrophobicContact CG-CB 4.47Å; L508-E582 HydrophobicContact CG-CG 4.47Å; L580-E582 PolarHBondContact O-N 3.23Å; E582-L584 VanDerWaalsContact C-N 3.3Å; E582-L584 PolarHBondContact O-N 3.35Å; E582-L585 PolarHBondContact O-N 2.78Å; E582-L586 WeakPolarHBondContact O-CG 3.34Å; E582-L586 PolarHBondContact O-N 3.15Å
583	L	89.9	Confident	88.8	Confident	14 Å²	14	57.3 Å²	57.3	7%	0.073	28%	0.277	C	S	.	.	H	α-helix	trans	-65.2	-32.2	173.5	-69.8	170.4	0	0	0	112.4	L504 L519 L580 V581 L585 L586 K587 L601 L602	L504-L583 HydrophobicContact CD1-CD1 4.46Å; L504-L583 HydrophobicContact CD1-CD2 4.32Å; L504-L583 HydrophobicContact CD1-CG 4Å; L504-L583 HydrophobicContact CD2-CD2 3.65Å; L504-L583 HydrophobicContact CD2-CG 4.19Å; L519-L583 HydrophobicContact CD2-CD2 3.63Å; L580-L583 HydrophobicContact CB-CD1 4.01Å; L580-L583 HydrophobicContact CB-CG 4.42Å; L580-L583 HydrophobicContact CD1-CD1 4.31Å; L580-L583 WeakPolarHBondContact O-CB 3.48Å; L580-L583 PolarHBondContact O-N 3.46Å; V581-L583 PolarHBondContact O-N 3.01Å; L583-L585 VanDerWaalsContact C-N 3.32Å; L583-L586 PolarHBondContact O-N 3.22Å; L583-K587 WeakPolarHBondContact O-CB 3.49Å; L583-K587 PolarHBondContact O-N 2.89Å; L583-L601 HydrophobicContact CD2-CB 4.48Å; L583-L601 HydrophobicContact CD2-CD1 4.27Å; L583-L602 HydrophobicContact CB-CD1 4.03Å; L583-L602 HydrophobicContact CB-CD2 3.84Å; L583-L602 HydrophobicContact CB-CG 3.95Å; L583-L602 HydrophobicContact CD1-CD2 4.17Å
584	L	91	Very high	89.1	Confident	100 Å²	100	57.3 Å²	57.3	52%	0.524	28%	0.277	S	S	.	.	H	α-helix	trans	-68.5	-33.9	176.7	-58.5	172.6	0	0	0	111.5	V581 E582 L602	V581-L584 VanDerWaalsContact O-CB 3.3Å; V581-L584 WeakPolarHBondContact O-CB 3.46Å; V581-L584 PolarHBondContact O-N 3.37Å; E582-L584 VanDerWaalsContact C-N 3.3Å; E582-L584 PolarHBondContact O-N 3.35Å; L584-L602 HydrophobicContact CD2-CD1 3.94Å; L584-L602 HydrophobicContact CD2-CD2 4.26Å
585	L	94.1	Very high	89.5	Confident	103 Å²	103	55 Å²	55	54%	0.539	27%	0.272	S	S	.	.	H	α-helix	trans	-72.9	-43.6	172.5	-61.4	177.7	0	0	0	111	L508 V581 E582 L583 K587 K588 H589	L508-L585 HydrophobicContact CD1-CD1 4.01Å; L508-L585 HydrophobicContact CD2-CB 3.78Å; L508-L585 HydrophobicContact CD2-CD1 4.12Å; V581-L585 PolarHBondContact O-N 3.45Å; E582-L585 PolarHBondContact O-N 2.78Å; L583-L585 VanDerWaalsContact C-N 3.32Å; L585-K587 VanDerWaalsContact C-N 3.29Å; L585-K587 PolarHBondContact O-N 3.21Å; L585-K588 CarbonylContact O-C 3.54Å; L585-K588 WeakPolarHBondContact O-CA 3.22Å; L585-K588 PolarHBondContact O-N 3.19Å; L585-H589 PolarHBondContact O-N 2.89Å
586	L	94.6	Very high	89.8	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-65.2	-29.3	176.8	-68.6	170.3	0	0	0	112.8	L504 C507 L508 L519 E582 L583 K588 H589 V594 A595 A598	L504-L586 HydrophobicContact CD2-CD1 3.84Å; C507-L586 HydrophobicContact CB-CD1 4.02Å; C507-L586 HydrophobicContact CB-CD2 4.22Å; L508-L586 HydrophobicContact CD2-CD2 4.1Å; L508-L586 HydrophobicContact CD2-CG 4Å; L519-L586 HydrophobicContact CD2-CD1 4.16Å; E582-L586 WeakPolarHBondContact O-CG 3.34Å; E582-L586 PolarHBondContact O-N 3.15Å; L583-L586 PolarHBondContact O-N 3.22Å; L586-K588 PolarHBondContact O-N 3.46Å; L586-H589 WeakPolarHBondContact O-CB 3.44Å; L586-H589 PolarHBondContact O-N 2.9Å; L586-V594 HydrophobicContact CB-CG1 4.48Å; L586-V594 HydrophobicContact CD2-CG1 4.07Å; L586-A595 WeakPolarHBondContact O-CA 3.34Å; L586-A598 HydrophobicContact CB-CB 3.68Å
587	K	92.5	Very high	90.4	Very high	85 Å²	85	54.4 Å²	54.4	37%	0.37	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.8	169.7	-179	168.7	178.8	167.2	0	113	L583 L585 A595 A598 H599 L602	L583-K587 WeakPolarHBondContact O-CB 3.49Å; L583-K587 PolarHBondContact O-N 2.89Å; L585-K587 VanDerWaalsContact C-N 3.29Å; L585-K587 PolarHBondContact O-N 3.21Å; K587-A595 WeakPolarHBondContact O-CB 3.39Å; K587-A598 HydrophobicContact CB-CB 4.4Å; K587-H599 HydrophobicContact CD-CB 4.15Å; K587-H599 HydrophobicContact CG-CB 4.28Å; K587-H599 PolarHBondContact NZ-CD2 3.47Å; K587-H599 PolarHBondContact NZ-CE1 3.03Å; K587-H599 PolarHBondContact NZ-ND1 2.88Å; K587-H599 PolarHBondContact NZ-NE2 3.34Å; K587-H599 VanDerWaalsContact NZ-NE2 3.13Å; K587-L602 HydrophobicContact CB-CD1 4.18Å; K587-L602 HydrophobicContact CD-CD1 4.11Å
588	K	93.9	Very high	91	Very high	186 Å²	186	50.1 Å²	50.1	81%	0.809	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.3	16.4	175.4	-59.9	-177.7	-179.9	-179.1	0	112.8	L585 L586	L585-K588 CarbonylContact O-C 3.54Å; L585-K588 WeakPolarHBondContact O-CA 3.22Å; L585-K588 PolarHBondContact O-N 3.19Å; L586-K588 PolarHBondContact O-N 3.46Å
589	H	94.8	Very high	91.5	Very high	32 Å²	32	50.7 Å²	50.7	15%	0.148	25%	0.25	C	C	.	.			trans	-68.8	145	-178.8	-169.5	-95.9	0	0	0	111.8	L585 L586 H591 V594	L585-H589 PolarHBondContact O-N 2.89Å; L586-H589 WeakPolarHBondContact O-CB 3.44Å; L586-H589 PolarHBondContact O-N 2.9Å; H589-H591 VanDerWaalsContact C-N 3.25Å; H589-H591 WeakPolarHBondContact ND1-CB 3.34Å; H589-H591 PolarHBondContact ND1-N 3.49Å; H589-H591 PolarHBondContact O-N 3.19Å; H589-V594 HydrophobicContact CB-CB 4.08Å; H589-V594 HydrophobicContact CB-CG1 3.73Å; H589-V594 WeakPolarHBondContact ND1-CB 3.43Å
590	Y	92.5	Very high	91.9	Very high	173 Å²	173	52.3 Å²	52.3	68%	0.678	25%	0.25	S	S	*	.	S	Bend	trans	-61.9	-30.4	-176.3	61.8	-93.2	0	0	0	113.6
591	H	92.9	Very high	91.8	Very high	30 Å²	30	51.5 Å²	51.5	14%	0.139	25%	0.246	C	C	.	.	S	Bend	trans	-81.9	118.7	176.6	-168.9	-80.8	0	0	0	110.3	A512 H589 T593 V594 A595 F635	A512-H591 HydrophobicContact CB-CB 3.8Å; H589-H591 VanDerWaalsContact C-N 3.25Å; H589-H591 WeakPolarHBondContact ND1-CB 3.34Å; H589-H591 PolarHBondContact ND1-N 3.49Å; H589-H591 PolarHBondContact O-N 3.19Å; H591-T593 VanDerWaalsContact C-N 3.32Å; H591-T593 PolarHBondContact CE1-OG1 2.95Å; H591-T593 PolarHBondContact ND1-N 3.26Å; H591-T593 PolarHBondContact ND1-OG1 3.48Å; H591-T593 PolarHBondContact O-N 3.48Å; H591-V594 HydrophobicContact CB-CB 4.31Å; H591-V594 HydrophobicContact CB-CG2 3.9Å; H591-V594 WeakPolarHBondContact O-CB 3.44Å; H591-V594 PolarHBondContact O-N 2.69Å; H591-A595 PolarHBondContact O-N 3.44Å; H591-F635 AromaticContact CE1-CD1 3.62Å
592	P	92.4	Very high	91.4	Very high	54 Å²	54	50.7 Å²	50.7	35%	0.351	24%	0.239	S	C	.	.	H	α-helix	trans	-62.4	-36.1	-168.2	24.9	-35.4	0	0	0	112.8	V594 A595 L596 P697 E698	P592-V594 VanDerWaalsContact C-N 3.34Å; P592-V594 PolarHBondContact O-N 3.24Å; P592-A595 WeakPolarHBondContact O-CB 3.42Å; P592-A595 PolarHBondContact O-N 2.87Å; P592-L596 WeakPolarHBondContact O-CB 3.45Å; P592-L596 PolarHBondContact O-N 2.95Å; P592-P697 HydrophobicContact CB-CB 4.02Å; P592-P697 HydrophobicContact CG-CB 4.36Å; P592-P697 WeakPolarHBondContact CG-O 2.92Å; P592-E698 HydrophobicContact CG-CB 4.38Å
593	T	92.9	Very high	90.6	Very high	4 Å²	4	53.6 Å²	53.6	3%	0.025	25%	0.253	C	S	.	.	H	α-helix	trans	-70.2	-28.7	177.9	-22	0	0	0	0	113	H591 F597 F635 E698	H591-T593 VanDerWaalsContact C-N 3.32Å; H591-T593 PolarHBondContact CE1-OG1 2.95Å; H591-T593 PolarHBondContact ND1-N 3.26Å; H591-T593 PolarHBondContact ND1-OG1 3.48Å; H591-T593 PolarHBondContact O-N 3.48Å; T593-F597 HydrophobicContact CG2-CD1 4.2Å; T593-F597 HydrophobicContact CG2-CE1 3.73Å; T593-F597 HydrophobicContact CG2-CE2 4.18Å; T593-F597 HydrophobicContact CG2-CZ 3.72Å; T593-F597 VanDerWaalsContact O-CB 3.27Å; T593-F597 WeakPolarHBondContact O-CB 3.27Å; T593-F597 WeakPolarHBondContact O-CD1 3.43Å; T593-F597 WeakPolarHBondContact O-CG 3.3Å; T593-F597 PolarHBondContact O-N 3.28Å; T593-F635 HydrophobicContact CG2-CE1 3.78Å; T593-F635 HydrophobicContact CG2-CZ 3.71Å; T593-E698 WeakPolarHBondContact CG2-OE2 3.42Å; T593-E698 WeakPolarHBondContact OG1-CB 3.32Å; T593-E698 PolarHBondContact OG1-OE2 2.97Å
594	V	95	Very high	89.3	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-69.9	-44.3	173.4	177.6	0	0	0	0	109.1	A512 A515 C516 L519 L586 H589 H591 P592 L596 F597 A598	A512-V594 HydrophobicContact CB-CG2 4.19Å; A515-V594 HydrophobicContact CB-CG1 4.06Å; A515-V594 HydrophobicContact CB-CG2 4.09Å; C516-V594 VanDerWaalsContact SG-CG2 3.5Å; L519-V594 HydrophobicContact CD1-CG1 4.01Å; L586-V594 HydrophobicContact CB-CG1 4.48Å; L586-V594 HydrophobicContact CD2-CG1 4.07Å; H589-V594 HydrophobicContact CB-CB 4.08Å; H589-V594 HydrophobicContact CB-CG1 3.73Å; H589-V594 WeakPolarHBondContact ND1-CB 3.43Å; H591-V594 HydrophobicContact CB-CB 4.31Å; H591-V594 HydrophobicContact CB-CG2 3.9Å; H591-V594 WeakPolarHBondContact O-CB 3.44Å; H591-V594 PolarHBondContact O-N 2.69Å; P592-V594 VanDerWaalsContact C-N 3.34Å; P592-V594 PolarHBondContact O-N 3.24Å; V594-L596 PolarHBondContact O-N 3.37Å; V594-F597 PolarHBondContact O-N 2.95Å; V594-A598 VanDerWaalsContact O-CB 3.29Å; V594-A598 WeakPolarHBondContact O-CB 3.4Å; V594-A598 PolarHBondContact O-N 3.44Å
595	A	94.3	Very high	87.8	Confident	18 Å²	18	55.3 Å²	55.3	15%	0.149	27%	0.268	C	S	.	.	H	α-helix	trans	-59.5	-44.8	175.1	0	0	0	0	0	111.9	L586 K587 H591 P592 H599	L586-A595 WeakPolarHBondContact O-CA 3.34Å; K587-A595 WeakPolarHBondContact O-CB 3.39Å; H591-A595 PolarHBondContact O-N 3.44Å; P592-A595 WeakPolarHBondContact O-CB 3.42Å; P592-A595 PolarHBondContact O-N 2.87Å; A595-H599 VanDerWaalsContact O-CB 3.29Å; A595-H599 WeakPolarHBondContact O-CB 3.29Å; A595-H599 PolarHBondContact O-N 2.91Å
596	L	92	Very high	86.2	Confident	51 Å²	51	51.8 Å²	51.8	27%	0.267	26%	0.257	S	S	.	.	H	α-helix	trans	-65.8	-45.6	177	-176.9	154	0	0	0	112.4	P592 V594 H599 R600 P697	P592-L596 WeakPolarHBondContact O-CB 3.45Å; P592-L596 PolarHBondContact O-N 2.95Å; V594-L596 PolarHBondContact O-N 3.37Å; L596-H599 PolarHBondContact O-N 3.48Å; L596-R600 HydrophobicContact CD2-CG 4.28Å; L596-R600 PolarHBondContact O-N 2.99Å; L596-P697 HydrophobicContact CD1-CG 3.64Å
597	F	92	Very high	84.3	Confident	5 Å²	5	55.4 Å²	55.4	2%	0.022	28%	0.279	C	S	.	.	H	α-helix	trans	-63.9	-41.9	177.6	-74.6	-0.4	0	0	0	111.8	C516 L519 L520 T593 V594 H599 R600 L601 I625 Y627 F635	C516-F597 HydrophobicContact CB-CD2 4.15Å; C516-F597 HydrophobicContact CB-CE2 4.03Å; L519-F597 HydrophobicContact CB-CB 4.07Å; L519-F597 HydrophobicContact CD1-CB 3.85Å; L520-F597 HydrophobicContact CD1-CE2 3.76Å; L520-F597 HydrophobicContact CD1-CZ 4.36Å; L520-F597 HydrophobicContact CD2-CE2 4.21Å; L520-F597 HydrophobicContact CD2-CZ 4.37Å; L520-F597 HydrophobicContact CG-CD2 4.19Å; L520-F597 HydrophobicContact CG-CE2 3.79Å; L520-F597 HydrophobicContact CG-CZ 4.41Å; T593-F597 HydrophobicContact CG2-CD1 4.2Å; T593-F597 HydrophobicContact CG2-CE1 3.73Å; T593-F597 HydrophobicContact CG2-CE2 4.18Å; T593-F597 HydrophobicContact CG2-CZ 3.72Å; T593-F597 VanDerWaalsContact O-CB 3.27Å; T593-F597 WeakPolarHBondContact O-CB 3.27Å; T593-F597 WeakPolarHBondContact O-CD1 3.43Å; T593-F597 WeakPolarHBondContact O-CG 3.3Å; T593-F597 PolarHBondContact O-N 3.28Å; V594-F597 PolarHBondContact O-N 2.95Å; F597-H599 VanDerWaalsContact C-N 3.34Å; F597-R600 PolarHBondContact O-N 3.35Å; F597-L601 PolarHBondContact O-N 2.96Å; F597-I625 HydrophobicContact CB-CD1 3.72Å; F597-I625 HydrophobicContact CD1-CD1 4.23Å; F597-I625 HydrophobicContact CD1-CG2 3.5Å; F597-I625 HydrophobicContact CD2-CD1 4.45Å; F597-I625 HydrophobicContact CD2-CG2 4.43Å; F597-I625 HydrophobicContact CE1-CG2 3.4Å; F597-I625 HydrophobicContact CE2-CG2 4.36Å; F597-I625 HydrophobicContact CG-CD1 3.9Å; F597-I625 HydrophobicContact CG-CG2 4.05Å; F597-I625 HydrophobicContact CZ-CG2 3.86Å; F597-Y627 HydrophobicContact CZ-CD2 4.05Å; F597-Y627 HydrophobicContact CZ-CG 4.3Å; F597-F635 HydrophobicContact CE2-CE2 4.09Å; F597-F635 HydrophobicContact CE2-CZ 4.38Å; F597-F635 HydrophobicContact CZ-CE2 4.37Å; F597-F635 HydrophobicContact CZ-CZ 4.26Å
598	A	91.7	Very high	82.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.5	-37.4	173.7	0	0	0	0	0	111.8	L519 L586 K587 V594 L601 L602	L519-A598 HydrophobicContact CD1-CB 4.26Å; L586-A598 HydrophobicContact CB-CB 3.68Å; K587-A598 HydrophobicContact CB-CB 4.4Å; V594-A598 VanDerWaalsContact O-CB 3.29Å; V594-A598 WeakPolarHBondContact O-CB 3.4Å; V594-A598 PolarHBondContact O-N 3.44Å; A598-L601 PolarHBondContact O-N 2.86Å; A598-L602 WeakPolarHBondContact O-CG 3.4Å; A598-L602 PolarHBondContact O-N 3.37Å
599	H	89.6	Confident	80.5	Confident	70 Å²	70	48.9 Å²	48.9	32%	0.324	27%	0.268	S	S	.	.	H	α-helix	trans	-63.6	-47.7	174.7	-171.3	-12	0	0	0	112.1	K587 A595 L596 F597 L601 L602 E603	K587-H599 HydrophobicContact CD-CB 4.15Å; K587-H599 HydrophobicContact CG-CB 4.28Å; K587-H599 PolarHBondContact NZ-CD2 3.47Å; K587-H599 PolarHBondContact NZ-CE1 3.03Å; K587-H599 PolarHBondContact NZ-ND1 2.88Å; K587-H599 PolarHBondContact NZ-NE2 3.34Å; K587-H599 VanDerWaalsContact NZ-NE2 3.13Å; A595-H599 VanDerWaalsContact O-CB 3.29Å; A595-H599 WeakPolarHBondContact O-CB 3.29Å; A595-H599 PolarHBondContact O-N 2.91Å; L596-H599 PolarHBondContact O-N 3.48Å; F597-H599 VanDerWaalsContact C-N 3.34Å; H599-L601 VanDerWaalsContact C-N 3.27Å; H599-L601 PolarHBondContact O-N 3.07Å; H599-L602 CarbonylContact O-C 3.59Å; H599-L602 WeakPolarHBondContact O-CA 3.43Å; H599-L602 PolarHBondContact O-N 3.27Å; H599-E603 IonicContact CE1-OE1 3.45Å; H599-E603 PolarHBondContact O-N 3.23Å
600	R	87.8	Confident	78.6	Confident	76 Å²	76	52.4 Å²	52.4	29%	0.287	28%	0.283	S	S	.	.	H	α-helix	trans	-59.2	-36.8	177.8	-76.2	-174.7	180	168	2.3	112.5	L596 F597 L602 E603 G622 Q623 I625	L596-R600 HydrophobicContact CD2-CG 4.28Å; L596-R600 PolarHBondContact O-N 2.99Å; F597-R600 PolarHBondContact O-N 3.35Å; R600-L602 VanDerWaalsContact C-N 3.3Å; R600-L602 PolarHBondContact O-N 3.15Å; R600-E603 PolarHBondContact O-N 3.01Å; R600-G622 CarbonylContact O-C 3.36Å; R600-Q623 HydrophobicContact CB-CB 4.33Å; R600-Q623 PolarHBondContact O-N 3.07Å; R600-I625 HydrophobicContact CB-CG1 4.24Å
601	L	83.6	Confident	76.6	Confident	12 Å²	12	51.8 Å²	51.8	6%	0.063	29%	0.287	C	S	.	.	H	α-helix	trans	-69.9	-24.7	174.9	-75.6	172.2	0	0	0	113.9	L519 L583 F597 A598 H599 G622 I625	L519-L601 HydrophobicContact CB-CD1 4Å; L519-L601 HydrophobicContact CD2-CD1 3.66Å; L519-L601 HydrophobicContact CG-CD1 4.43Å; L583-L601 HydrophobicContact CD2-CB 4.48Å; L583-L601 HydrophobicContact CD2-CD1 4.27Å; F597-L601 PolarHBondContact O-N 2.96Å; A598-L601 PolarHBondContact O-N 2.86Å; H599-L601 VanDerWaalsContact C-N 3.27Å; H599-L601 PolarHBondContact O-N 3.07Å; L601-G622 WeakPolarHBondContact O-CA 3.28Å; L601-I625 HydrophobicContact CD1-CD1 4.21Å; L601-I625 HydrophobicContact CG-CD1 4.08Å
602	L	80.5	Confident	74.5	Confident	39 Å²	39	58.6 Å²	58.6	20%	0.204	32%	0.324	C	S	.	.	H	α-helix	trans	-89.3	-12.9	176	-73.1	169	0	0	0	113.6	L583 L584 K587 A598 H599 R600 V604	L583-L602 HydrophobicContact CB-CD1 4.03Å; L583-L602 HydrophobicContact CB-CD2 3.84Å; L583-L602 HydrophobicContact CB-CG 3.95Å; L583-L602 HydrophobicContact CD1-CD2 4.17Å; L584-L602 HydrophobicContact CD2-CD1 3.94Å; L584-L602 HydrophobicContact CD2-CD2 4.26Å; K587-L602 HydrophobicContact CB-CD1 4.18Å; K587-L602 HydrophobicContact CD-CD1 4.11Å; A598-L602 WeakPolarHBondContact O-CG 3.4Å; A598-L602 PolarHBondContact O-N 3.37Å; H599-L602 CarbonylContact O-C 3.59Å; H599-L602 WeakPolarHBondContact O-CA 3.43Å; H599-L602 PolarHBondContact O-N 3.27Å; R600-L602 VanDerWaalsContact C-N 3.3Å; R600-L602 PolarHBondContact O-N 3.15Å; L602-V604 PolarHBondContact O-N 3.05Å
603	E	74.8	Confident	72.9	Confident	73 Å²	73	58 Å²	58	34%	0.341	32%	0.321	S	S	.	.			trans	-67	132.4	-179.1	-82	-179.9	143.7	0	0	112	H599 R600 T605	H599-E603 IonicContact CE1-OE1 3.45Å; H599-E603 PolarHBondContact O-N 3.23Å; R600-E603 PolarHBondContact O-N 3.01Å; E603-T605 PolarHBondContact O-N 3.04Å
604	V	62.4	Low	71.3	Confident	68 Å²	68	67 Å²	67	41%	0.412	36%	0.363	S	S	.	.			trans	-82.4	112.2	177.4	175.9	0	0	0	0	107.9	L602 G606 P618 F620	L602-V604 PolarHBondContact O-N 3.05Å; V604-G606 WeakPolarHBondContact CG1-O 3.39Å; V604-P618 HydrophobicContact CB-CB 4.39Å; V604-P618 HydrophobicContact CG1-CB 3.55Å; V604-P618 HydrophobicContact CG2-CB 3.9Å; V604-F620 HydrophobicContact CG2-CD1 3.75Å; V604-F620 HydrophobicContact CG2-CE1 3.54Å; V604-F620 HydrophobicContact CG2-CZ 4.18Å
605	T	59.3	Low	69.5	Low	81 Å²	81	72.4 Å²	72.4	50%	0.497	39%	0.391	S	S	.	.			trans	-93.5	0.1	179.7	53.9	0	0	0	0	113.6	E603 Q621	E603-T605 PolarHBondContact O-N 3.04Å; T605-Q621 WeakPolarHBondContact CB-O 3.48Å; T605-Q621 WeakPolarHBondContact CG2-O 3.26Å; T605-Q621 VanDerWaalsContact OG1-CB 3.29Å; T605-Q621 WeakPolarHBondContact OG1-CB 3.3Å; T605-Q621 PolarHBondContact OG1-O 2.65Å
606	G	59.7	Low	67.4	Low	29 Å²	29	78.5 Å²	78.5	30%	0.299	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.7	-170.7	172.6	0	0	0	0	0	113.8	V604 C619	V604-G606 WeakPolarHBondContact CG1-O 3.39Å; G606-C619 PolarHBondContact O-N 2.91Å; G606-C619 PolarHBondContact O-SG 2.95Å
607	T	55.8	Low	65.7	Low	77 Å²	77	80.1 Å²	80.1	47%	0.472	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	135	170.2	59.7	0	0	0	0	110.3	K616 L617	T607-K616 HydrophobicContact CG2-CB 4.35Å; T607-L617 CarbonylContact C-O 3.31Å; T607-L617 WeakPolarHBondContact CA-O 3.5Å; T607-L617 WeakPolarHBondContact CB-O 3.41Å
608	A	56.4	Low	63.7	Low	45 Å²	45	82.8 Å²	82.8	37%	0.372	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	141.5	172.6	0	0	0	0	0	110.3	F610 L617 C619	A608-F610 PolarHBondContact O-N 2.98Å; A608-L617 PolarHBondContact N-O 2.85Å; A608-L617 PolarHBondContact O-N 2.95Å; A608-C619 HydrophobicContact CB-CB 4.14Å
609	P	49.6	Very low	61.9	Low	90 Å²	90	84.3 Å²	84.3	58%	0.584	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	129.4	171	27.7	-32.9	0	0	0	109.6	Q611	P609-Q611 PolarHBondContact O-N 3.13Å
610	F	54.7	Low	60.3	Low	105 Å²	105	85.4 Å²	85.4	46%	0.461	45%	0.454	S	S	.	.	S	Bend	trans	-79.1	103.9	175.4	178.8	-104.8	0	0	0	109.6	A608 D612 S613 I615 L617	A608-F610 PolarHBondContact O-N 2.98Å; F610-D612 PolarHBondContact O-N 3Å; F610-S613 VanDerWaalsContact O-CB 3.29Å; F610-S613 WeakPolarHBondContact O-CB 3.39Å; F610-S613 PolarHBondContact O-N 3.07Å; F610-S613 PolarHBondContact O-OG 3.16Å; F610-I615 WeakPolarHBondContact CB-O 3.37Å; F610-I615 PolarHBondContact N-O 3.39Å; F610-L617 HydrophobicContact CB-CD1 3.89Å; F610-L617 HydrophobicContact CB-CG 4.16Å; F610-L617 HydrophobicContact CD2-CD1 3.55Å; F610-L617 HydrophobicContact CE2-CD1 4.33Å; F610-L617 HydrophobicContact CG-CD1 3.9Å
611	Q	50.2	Low	58.8	Low	161 Å²	161	87 Å²	87	75%	0.752	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	57.7	163.6	-151.4	161.8	7.2	0	0	113.3	P609 S613	P609-Q611 PolarHBondContact O-N 3.13Å; Q611-S613 PolarHBondContact O-N 3.24Å; Q611-S613 VanDerWaalsContact O-N 3.12Å
612	D	50.5	Low	57.8	Low	172 Å²	172	87.1 Å²	87.1	92%	0.92	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	8.6	-177.5	-56.4	-32.6	0	0	0	116.7	F610	F610-D612 PolarHBondContact O-N 3Å
613	S	58.5	Low	57.3	Low	42 Å²	42	89.5 Å²	89.5	29%	0.294	48%	0.479	S	S	.	.	S	Bend	trans	-85.6	158.9	170.4	77.4	0	0	0	0	113.2	F610 Q611 I615	F610-S613 VanDerWaalsContact O-CB 3.29Å; F610-S613 WeakPolarHBondContact O-CB 3.39Å; F610-S613 PolarHBondContact O-N 3.07Å; F610-S613 PolarHBondContact O-OG 3.16Å; Q611-S613 PolarHBondContact O-N 3.24Å; Q611-S613 VanDerWaalsContact O-N 3.12Å; S613-I615 PolarHBondContact O-N 3.03Å; S613-I615 PolarHBondContact OG-N 3.46Å
614	E	59.9	Low	57.5	Low	194 Å²	194	90.8 Å²	90.8	91%	0.907	48%	0.483	S	S	*	.	S	Bend	trans	-66.7	-10.6	171.6	-65.4	-169	136.4	0	0	113.3	K616	E614-K616 PolarHBondContact O-N 3.42Å
615	I	56.2	Low	58.5	Low	112 Å²	112	87.6 Å²	87.6	57%	0.574	46%	0.464	S	S	*	.			trans	-73.6	104.1	-178.8	-56.5	178.4	0	0	0	109.3	F610 S613 L617	F610-I615 WeakPolarHBondContact CB-O 3.37Å; F610-I615 PolarHBondContact N-O 3.39Å; S613-I615 PolarHBondContact O-N 3.03Å; S613-I615 PolarHBondContact OG-N 3.46Å; I615-L617 HydrophobicContact CG2-CD2 4.49Å; I615-L617 PolarHBondContact O-N 2.88Å
616	K	50.5	Low	59.4	Low	147 Å²	147	88.9 Å²	88.9	64%	0.639	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	96	177.2	-80.3	175.5	177.2	170.9	0	110.5	T607 E614	T607-K616 HydrophobicContact CG2-CB 4.35Å; E614-K616 PolarHBondContact O-N 3.42Å
617	L	55.3	Low	60.5	Low	85 Å²	85	88.9 Å²	88.9	45%	0.445	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	141.6	174.8	-72.5	175.8	0	0	0	111	T607 A608 F610 I615 C619	T607-L617 CarbonylContact C-O 3.31Å; T607-L617 WeakPolarHBondContact CA-O 3.5Å; T607-L617 WeakPolarHBondContact CB-O 3.41Å; A608-L617 PolarHBondContact N-O 2.85Å; A608-L617 PolarHBondContact O-N 2.95Å; F610-L617 HydrophobicContact CB-CD1 3.89Å; F610-L617 HydrophobicContact CB-CG 4.16Å; F610-L617 HydrophobicContact CD2-CD1 3.55Å; F610-L617 HydrophobicContact CE2-CD1 4.33Å; F610-L617 HydrophobicContact CG-CD1 3.9Å; I615-L617 HydrophobicContact CG2-CD2 4.49Å; I615-L617 PolarHBondContact O-N 2.88Å; L617-C619 PolarHBondContact O-N 3.26Å
618	P	51.3	Low	61.3	Low	60 Å²	60	89.6 Å²	89.6	39%	0.39	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	119.6	174.8	25.3	-33.3	0	0	0	110.4	V604 F620	V604-P618 HydrophobicContact CB-CB 4.39Å; V604-P618 HydrophobicContact CG1-CB 3.55Å; V604-P618 HydrophobicContact CG2-CB 3.9Å; P618-F620 HydrophobicContact CG-CE2 4.48Å
619	C	53.5	Low	62.3	Low	33 Å²	33	89.1 Å²	89.1	22%	0.223	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	113.8	175.8	55.8	0	0	0	0	110.1	G606 A608 L617 Q621	G606-C619 PolarHBondContact O-N 2.91Å; G606-C619 PolarHBondContact O-SG 2.95Å; A608-C619 HydrophobicContact CB-CB 4.14Å; L617-C619 PolarHBondContact O-N 3.26Å; C619-Q621 PolarHBondContact O-N 3.13Å
620	F	55.6	Low	63.8	Low	92 Å²	92	88.3 Å²	88.3	40%	0.404	46%	0.458	S	S	.	.			trans	-74.2	66.4	177.7	-63.1	-83.1	0	0	0	111.8	Q526 V604 P618 G622	Q526-F620 PolarHBondContact NE2-O 3.32Å; Q526-F620 VanDerWaalsContact NE2-O 3.15Å; V604-F620 HydrophobicContact CG2-CD1 3.75Å; V604-F620 HydrophobicContact CG2-CE1 3.54Å; V604-F620 HydrophobicContact CG2-CZ 4.18Å; P618-F620 HydrophobicContact CG-CE2 4.48Å; F620-G622 PolarHBondContact O-N 3.26Å
621	Q	57.7	Low	65.4	Low	111 Å²	111	84.2 Å²	84.2	52%	0.519	44%	0.441	S	S	.	.			trans	-88.6	80.2	163	-83.2	177.1	-36.1	0	0	108.5	T605 C619	T605-Q621 WeakPolarHBondContact CB-O 3.48Å; T605-Q621 WeakPolarHBondContact CG2-O 3.26Å; T605-Q621 VanDerWaalsContact OG1-CB 3.29Å; T605-Q621 WeakPolarHBondContact OG1-CB 3.3Å; T605-Q621 PolarHBondContact OG1-O 2.65Å; C619-Q621 PolarHBondContact O-N 3.13Å
622	G	61.3	Low	67.2	Low	13 Å²	13	78 Å²	78	13%	0.134	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-49.7	139.5	-178.1	0	0	0	0	0	112.5	R600 L601 F620	R600-G622 CarbonylContact O-C 3.36Å; L601-G622 WeakPolarHBondContact O-CA 3.28Å; F620-G622 PolarHBondContact O-N 3.26Å
623	Q	71.1	Confident	68.8	Low	90 Å²	90	74.8 Å²	74.8	42%	0.421	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-60.6	141.9	-174.4	-162.5	-172	56.7	0	0	110.8	R600 I625	R600-Q623 HydrophobicContact CB-CB 4.33Å; R600-Q623 PolarHBondContact O-N 3.07Å; Q623-I625 PolarHBondContact O-N 3.41Å; Q623-I625 VanDerWaalsContact O-N 3.1Å
624	K	78.2	Confident	70.1	Confident	99 Å²	99	73.5 Å²	73.5	43%	0.43	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-56.7	118.7	172	172.2	177.3	-176.3	-143.9	0	109.2	D626	K624-D626 WeakPolarHBondContact CE-OD2 3.5Å; K624-D626 IonicContact NZ-OD1 3.46Å; K624-D626 PolarHBondContact NZ-OD1 2.83Å; K624-D626 VanDerWaalsContact NZ-OD1 3.08Å; K624-D626 IonicContact NZ-OD2 3.94Å; K624-D626 PolarHBondContact NZ-OD2 3.4Å; K624-D626 PolarHBondContact O-N 2.84Å; K624-D626 VanDerWaalsContact O-N 3.16Å
625	I	84.2	Confident	71.5	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.005	34%	0.341	C	S	.	.			trans	-78.1	99.7	166.4	-52.1	170.6	0	0	0	107	L519 L520 S523 F597 R600 L601 Q623	L519-I625 HydrophobicContact CB-CD1 4.43Å; L520-I625 HydrophobicContact CD2-CB 3.87Å; L520-I625 HydrophobicContact CD2-CG2 3.4Å; L520-I625 VanDerWaalsContact CD2-CG2 3.4Å; L520-I625 HydrophobicContact CG-CG2 4.39Å; S523-I625 PolarHBondContact OG-N 2.76Å; F597-I625 HydrophobicContact CB-CD1 3.72Å; F597-I625 HydrophobicContact CD1-CD1 4.23Å; F597-I625 HydrophobicContact CD1-CG2 3.5Å; F597-I625 HydrophobicContact CD2-CD1 4.45Å; F597-I625 HydrophobicContact CD2-CG2 4.43Å; F597-I625 HydrophobicContact CE1-CG2 3.4Å; F597-I625 HydrophobicContact CE2-CG2 4.36Å; F597-I625 HydrophobicContact CG-CD1 3.9Å; F597-I625 HydrophobicContact CG-CG2 4.05Å; F597-I625 HydrophobicContact CZ-CG2 3.86Å; R600-I625 HydrophobicContact CB-CG1 4.24Å; L601-I625 HydrophobicContact CD1-CD1 4.21Å; L601-I625 HydrophobicContact CG-CD1 4.08Å; Q623-I625 PolarHBondContact O-N 3.41Å; Q623-I625 VanDerWaalsContact O-N 3.1Å
626	D	76.5	Confident	73	Confident	108 Å²	108	60.2 Å²	60.2	58%	0.578	32%	0.32	S	S	*	.			trans	-81.2	119.2	169.3	-125.1	-27.2	0	0	0	110.2	K624	K624-D626 WeakPolarHBondContact CE-OD2 3.5Å; K624-D626 IonicContact NZ-OD1 3.46Å; K624-D626 PolarHBondContact NZ-OD1 2.83Å; K624-D626 VanDerWaalsContact NZ-OD1 3.08Å; K624-D626 IonicContact NZ-OD2 3.94Å; K624-D626 PolarHBondContact NZ-OD2 3.4Å; K624-D626 PolarHBondContact O-N 2.84Å; K624-D626 VanDerWaalsContact O-N 3.16Å
627	Y	83.2	Confident	74.8	Confident	29 Å²	29	58.1 Å²	58.1	11%	0.114	32%	0.32	C	S	.	.			trans	-152.5	124.4	-179.7	-171.6	-99.8	0	0	0	109.3	L520 R524 F597 G629 P631 D634 F635 R678	L520-Y627 HydrophobicContact CD1-CD1 3.72Å; L520-Y627 HydrophobicContact CD1-CE1 4.38Å; L520-Y627 HydrophobicContact CD1-CG 4.14Å; L520-Y627 HydrophobicContact CD2-CG 4.31Å; R524-Y627 PolarHBondContact NH2-O 3Å; F597-Y627 HydrophobicContact CZ-CD2 4.05Å; F597-Y627 HydrophobicContact CZ-CG 4.3Å; Y627-G629 WeakPolarHBondContact CD1-O 3.37Å; Y627-G629 VanDerWaalsContact CE1-O 3.3Å; Y627-G629 WeakPolarHBondContact CE1-O 3.27Å; Y627-P631 HydrophobicContact CE1-CB 4.22Å; Y627-D634 WeakPolarHBondContact OH-CB 3.39Å; Y627-D634 PolarHBondContact OH-OD2 3.21Å; Y627-F635 HydrophobicContact CD2-CZ 4.5Å; Y627-F635 HydrophobicContact CE1-CE2 4.11Å; Y627-F635 HydrophobicContact CE1-CZ 4.42Å; Y627-F635 HydrophobicContact CE2-CE2 4.08Å; Y627-F635 AromaticContact CE2-CZ 3.59Å; Y627-F635 HydrophobicContact CE2-CZ 3.59Å; Y627-F635 AromaticContact CZ-CE2 3.63Å; Y627-F635 AromaticContact CZ-CZ 3.53Å; Y627-F635 WeakPolarHBondContact OH-CE2 3.45Å; Y627-F635 VanDerWaalsContact OH-CZ 3.3Å; Y627-F635 WeakPolarHBondContact OH-CZ 3.08Å; Y627-R678 PolarHBondContact OH-NH1 2.69Å; Y627-R678 PolarHBondContact OH-NH2 3.27Å
628	S	73	Confident	76.3	Confident	93 Å²	93	57.9 Å²	57.9	65%	0.65	33%	0.325	S	S	*	.			trans	-101.9	-18.4	-172	50.5	0	0	0	0	114.4
629	G	77	Confident	77.7	Confident	35 Å²	35	56.2 Å²	56.2	36%	0.361	31%	0.311	S	S	.	.	S	Bend	trans	-79.7	-175.4	177.6	0	0	0	0	0	114	Y627 P631	Y627-G629 WeakPolarHBondContact CD1-O 3.37Å; Y627-G629 VanDerWaalsContact CE1-O 3.3Å; Y627-G629 WeakPolarHBondContact CE1-O 3.27Å; G629-P631 WeakPolarHBondContact O-CD 3.46Å
630	D	82.4	Confident	79.3	Confident	73 Å²	73	58.7 Å²	58.7	39%	0.39	32%	0.318	S	S	.	.			trans	-99	107	172.8	-168.3	-26.2	0	0	0	109.8	L632 E633 D634	D630-L632 PolarHBondContact O-N 3.46Å; D630-L632 VanDerWaalsContact O-N 3.14Å; D630-L632 WeakPolarHBondContact OD1-CB 3.28Å; D630-L632 PolarHBondContact OD1-N 3.41Å; D630-E633 HydrophobicContact CB-CB 4.42Å; D630-E633 HydrophobicContact CB-CG 4.49Å; D630-E633 PolarHBondContact O-N 3.2Å; D630-D634 PolarHBondContact N-OD2 2.68Å; D630-D634 VanDerWaalsContact O-CB 3.28Å; D630-D634 WeakPolarHBondContact O-CB 3.25Å; D630-D634 PolarHBondContact O-N 2.85Å
631	P	87.6	Confident	80.8	Confident	18 Å²	18	58.6 Å²	58.6	12%	0.117	32%	0.321	C	S	.	.	H	α-helix	trans	-64.6	-18.3	-177.6	30.2	-38.2	0	0	0	113.7	S513 C516 A517 L520 Y627 G629 F635	S513-P631 WeakPolarHBondContact CA-O 3.41Å; S513-P631 VanDerWaalsContact CB-O 3.3Å; S513-P631 WeakPolarHBondContact CB-O 3.45Å; C516-P631 HydrophobicContact CB-CB 4.1Å; A517-P631 HydrophobicContact CB-CB 4.22Å; A517-P631 HydrophobicContact CB-CG 3.78Å; L520-P631 HydrophobicContact CD1-CB 3.62Å; L520-P631 HydrophobicContact CD1-CG 3.64Å; Y627-P631 HydrophobicContact CE1-CB 4.22Å; G629-P631 WeakPolarHBondContact O-CD 3.46Å; P631-F635 HydrophobicContact CB-CD2 3.77Å; P631-F635 HydrophobicContact CB-CE2 3.82Å; P631-F635 WeakPolarHBondContact O-CD2 3.41Å
632	L	88.8	Confident	81.9	Confident	30 Å²	30	56.5 Å²	56.5	16%	0.157	31%	0.311	C	S	.	.	H	α-helix	trans	-74.2	-38.5	178.6	-62.2	176.4	0	0	0	111.5	H476 F480 S513 A517 D630	H476-L632 HydrophobicContact CB-CD1 3.73Å; H476-L632 HydrophobicContact CB-CD2 3.73Å; H476-L632 HydrophobicContact CB-CG 4.36Å; F480-L632 HydrophobicContact CD2-CD1 4.4Å; F480-L632 HydrophobicContact CD2-CD2 4.05Å; F480-L632 HydrophobicContact CE2-CD2 3.9Å; S513-L632 WeakPolarHBondContact CB-O 3.46Å; A517-L632 HydrophobicContact CB-CD2 3.6Å; A517-L632 HydrophobicContact CB-CG 4.22Å; D630-L632 PolarHBondContact O-N 3.46Å; D630-L632 VanDerWaalsContact O-N 3.14Å; D630-L632 WeakPolarHBondContact OD1-CB 3.28Å; D630-L632 PolarHBondContact OD1-N 3.41Å
633	E	84.1	Confident	82.9	Confident	105 Å²	105	56.6 Å²	56.6	49%	0.491	31%	0.308	S	S	.	.	H	α-helix	trans	-85.6	-51.2	177.9	-64.7	-59.6	151.2	0	0	111.8	D630 F635 S636 R639 Y672	D630-E633 HydrophobicContact CB-CB 4.42Å; D630-E633 HydrophobicContact CB-CG 4.49Å; D630-E633 PolarHBondContact O-N 3.2Å; E633-F635 VanDerWaalsContact C-N 3.35Å; E633-F635 PolarHBondContact O-N 2.86Å; E633-S636 VanDerWaalsContact O-CB 3.26Å; E633-S636 WeakPolarHBondContact O-CB 3.47Å; E633-S636 PolarHBondContact O-N 3Å; E633-S636 VanDerWaalsContact O-N 3.1Å; E633-S636 PolarHBondContact O-OG 3.47Å; E633-R639 WeakPolarHBondContact O-CB 3.47Å; E633-Y672 HydrophobicContact CB-CD2 4.43Å; E633-Y672 HydrophobicContact CB-CE2 4.47Å
634	D	84.2	Confident	83.4	Confident	15 Å²	15	56.4 Å²	56.4	8%	0.08	31%	0.306	C	S	.	.	H	α-helix	trans	-59.3	-41.2	-172	-78.3	-56.7	0	0	0	113.5	Y627 D630 Y672 R678	Y627-D634 WeakPolarHBondContact OH-CB 3.39Å; Y627-D634 PolarHBondContact OH-OD2 3.21Å; D630-D634 PolarHBondContact N-OD2 2.68Å; D630-D634 VanDerWaalsContact O-CB 3.28Å; D630-D634 WeakPolarHBondContact O-CB 3.25Å; D630-D634 PolarHBondContact O-N 2.85Å; D634-Y672 WeakPolarHBondContact OD1-CE2 3.5Å; D634-Y672 VanDerWaalsContact OD1-CZ 3.29Å; D634-Y672 PolarHBondContact OD1-OH 3.15Å; D634-R678 IonicContact OD1-CZ 3.81Å; D634-R678 IonicContact OD1-NH1 3.43Å; D634-R678 PolarHBondContact OD1-NH1 2.69Å; D634-R678 IonicContact OD2-NH1 3.45Å; D634-R678 PolarHBondContact OD2-NH1 3.23Å
635	F	89.2	Confident	83.5	Confident	7 Å²	7	56 Å²	56	3%	0.031	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	17.6	-179	-49.5	-59.8	0	0	0	112.3	S513 C516 H591 T593 F597 Y627 P631 E633 E698	S513-F635 WeakPolarHBondContact CB-O 3.29Å; S513-F635 PolarHBondContact N-O 2.85Å; C516-F635 HydrophobicContact CB-CD2 3.38Å; C516-F635 HydrophobicContact CB-CE2 3.75Å; C516-F635 HydrophobicContact CB-CG 4.23Å; C516-F635 VanDerWaalsContact SG-CD2 3.52Å; H591-F635 AromaticContact CE1-CD1 3.62Å; T593-F635 HydrophobicContact CG2-CE1 3.78Å; T593-F635 HydrophobicContact CG2-CZ 3.71Å; F597-F635 HydrophobicContact CE2-CE2 4.09Å; F597-F635 HydrophobicContact CE2-CZ 4.38Å; F597-F635 HydrophobicContact CZ-CE2 4.37Å; F597-F635 HydrophobicContact CZ-CZ 4.26Å; Y627-F635 HydrophobicContact CD2-CZ 4.5Å; Y627-F635 HydrophobicContact CE1-CE2 4.11Å; Y627-F635 HydrophobicContact CE1-CZ 4.42Å; Y627-F635 HydrophobicContact CE2-CE2 4.08Å; Y627-F635 AromaticContact CE2-CZ 3.59Å; Y627-F635 HydrophobicContact CE2-CZ 3.59Å; Y627-F635 AromaticContact CZ-CE2 3.63Å; Y627-F635 AromaticContact CZ-CZ 3.53Å; Y627-F635 WeakPolarHBondContact OH-CE2 3.45Å; Y627-F635 VanDerWaalsContact OH-CZ 3.3Å; Y627-F635 WeakPolarHBondContact OH-CZ 3.08Å; P631-F635 HydrophobicContact CB-CD2 3.77Å; P631-F635 HydrophobicContact CB-CE2 3.82Å; P631-F635 WeakPolarHBondContact O-CD2 3.41Å; E633-F635 VanDerWaalsContact C-N 3.35Å; E633-F635 PolarHBondContact O-N 2.86Å; F635-E698 HydrophobicContact CD1-CG 4.28Å; F635-E698 HydrophobicContact CE1-CG 4.05Å
636	S	88.5	Confident	83	Confident	21 Å²	21	60 Å²	60	15%	0.147	33%	0.329	C	S	.	.	S	Bend	trans	-73	146.8	173.5	73.6	0	0	0	0	110.8	E633 S638 R639 F640	E633-S636 VanDerWaalsContact O-CB 3.26Å; E633-S636 WeakPolarHBondContact O-CB 3.47Å; E633-S636 PolarHBondContact O-N 3Å; E633-S636 VanDerWaalsContact O-N 3.1Å; E633-S636 PolarHBondContact O-OG 3.47Å; S636-S638 PolarHBondContact O-N 3.08Å; S636-R639 PolarHBondContact O-N 3.34Å; S636-R639 VanDerWaalsContact OG-CB 3.26Å; S636-R639 WeakPolarHBondContact OG-CB 3.45Å; S636-R639 PolarHBondContact OG-N 3.23Å; S636-R639 VanDerWaalsContact OG-N 3.11Å; S636-F640 PolarHBondContact O-N 3.42Å; S636-F640 VanDerWaalsContact O-N 3.08Å
637	T	88.7	Confident	82.4	Confident	103 Å²	103	61.6 Å²	61.6	63%	0.632	33%	0.331	S	S	*	.	H	α-helix	trans	-58.8	-33.4	175	-43.1	0	0	0	0	111.7	L641	T637-L641 HydrophobicContact CG2-CD1 4.28Å; T637-L641 WeakPolarHBondContact O-CB 3.48Å; T637-L641 VanDerWaalsContact O-CG 3.28Å; T637-L641 WeakPolarHBondContact O-CG 3.4Å; T637-L641 PolarHBondContact O-N 3.12Å
638	S	85.6	Confident	81.5	Confident	79 Å²	79	65.3 Å²	65.3	55%	0.552	35%	0.352	S	S	*	.	H	α-helix	trans	-62.8	-50	176.4	-163.5	0	0	0	0	111.2	S636 F640 L641 E642	S636-S638 PolarHBondContact O-N 3.08Å; S638-F640 VanDerWaalsContact C-N 3.32Å; S638-F640 PolarHBondContact O-N 3.32Å; S638-L641 PolarHBondContact O-N 2.93Å; S638-L641 VanDerWaalsContact O-N 3.14Å; S638-E642 WeakPolarHBondContact O-CG 3.34Å; S638-E642 PolarHBondContact O-N 2.9Å
639	R	82.2	Confident	81	Confident	26 Å²	26	61.6 Å²	61.6	10%	0.098	33%	0.326	C	S	.	.	H	α-helix	trans	-63.6	-37.3	-179.7	-166.1	73.5	-172.7	118.6	8	112.6	E633 S636 E642 R643 Y672	E633-R639 WeakPolarHBondContact O-CB 3.47Å; S636-R639 PolarHBondContact O-N 3.34Å; S636-R639 VanDerWaalsContact OG-CB 3.26Å; S636-R639 WeakPolarHBondContact OG-CB 3.45Å; S636-R639 PolarHBondContact OG-N 3.23Å; S636-R639 VanDerWaalsContact OG-N 3.11Å; R639-E642 IonicContact CZ-OE2 2.9Å; R639-E642 IonicContact NH1-OE2 2.73Å; R639-E642 PolarHBondContact NH1-OE2 3.21Å; R639-R643 PolarHBondContact O-N 3.36Å; R639-Y672 PolarHBondContact NE-OH 2.9Å
640	F	86.1	Confident	80.2	Confident	84 Å²	84	68.5 Å²	68.5	37%	0.368	35%	0.346	S	S	.	.	H	α-helix	trans	-61.1	-49.1	171.5	175.1	-98.8	0	0	0	111.7	S636 S638 E642 R643 F644 L702	S636-F640 PolarHBondContact O-N 3.42Å; S636-F640 VanDerWaalsContact O-N 3.08Å; S638-F640 VanDerWaalsContact C-N 3.32Å; S638-F640 PolarHBondContact O-N 3.32Å; F640-E642 PolarHBondContact O-N 2.67Å; F640-R643 PolarHBondContact O-N 2.99Å; F640-F644 HydrophobicContact CE1-CB 4.38Å; F640-F644 HydrophobicContact CZ-CD2 4.45Å; F640-F644 WeakPolarHBondContact O-CB 3.45Å; F640-F644 PolarHBondContact O-N 3.45Å; F640-L702 HydrophobicContact CE2-CD2 4.46Å
641	L	87	Confident	78.7	Confident	91 Å²	91	74.5 Å²	74.5	48%	0.476	37%	0.369	S	S	.	.	H	α-helix	trans	-64.8	-39.4	-179.2	-71.8	172.5	0	0	0	113	T637 S638 R643 F644 V645	T637-L641 HydrophobicContact CG2-CD1 4.28Å; T637-L641 WeakPolarHBondContact O-CB 3.48Å; T637-L641 VanDerWaalsContact O-CG 3.28Å; T637-L641 WeakPolarHBondContact O-CG 3.4Å; T637-L641 PolarHBondContact O-N 3.12Å; S638-L641 PolarHBondContact O-N 2.93Å; S638-L641 VanDerWaalsContact O-N 3.14Å; L641-R643 VanDerWaalsContact C-N 3.27Å; L641-R643 PolarHBondContact O-N 3.3Å; L641-F644 PolarHBondContact O-N 3.3Å; L641-V645 VanDerWaalsContact O-CG2 3.32Å; L641-V645 WeakPolarHBondContact O-CG2 3.37Å; L641-V645 PolarHBondContact O-N 3.48Å
642	E	82	Confident	76.7	Confident	66 Å²	66	75.6 Å²	75.6	31%	0.308	38%	0.377	S	S	.	.	H	α-helix	trans	-54.2	-45.4	174.3	-74.4	-178	155.6	0	0	111.8	S638 R639 F640 K647	S638-E642 WeakPolarHBondContact O-CG 3.34Å; S638-E642 PolarHBondContact O-N 2.9Å; R639-E642 IonicContact CZ-OE2 2.9Å; R639-E642 IonicContact NH1-OE2 2.73Å; R639-E642 PolarHBondContact NH1-OE2 3.21Å; F640-E642 PolarHBondContact O-N 2.67Å; E642-K647 WeakPolarHBondContact O-CB 3.42Å; E642-K647 PolarHBondContact O-N 3.37Å; E642-K647 VanDerWaalsContact O-N 3.09Å
643	R	81.5	Confident	74.3	Confident	16 Å²	16	79.6 Å²	79.6	6%	0.06	40%	0.402	C	S	.	.	H	α-helix	trans	-80.8	-31.9	-176.9	-64.5	-171	68.9	-152.1	1	113.1	R639 F640 L641 V645 F646 V677 V682 E699 L702	R639-R643 PolarHBondContact O-N 3.36Å; F640-R643 PolarHBondContact O-N 2.99Å; L641-R643 VanDerWaalsContact C-N 3.27Å; L641-R643 PolarHBondContact O-N 3.3Å; R643-V645 VanDerWaalsContact C-N 3.33Å; R643-F646 PolarHBondContact O-N 2.74Å; R643-F646 VanDerWaalsContact O-N 3.16Å; R643-V677 PolarHBondContact NH2-O 2.99Å; R643-V682 HydrophobicContact CB-CG2 4.18Å; R643-E699 IonicContact CZ-OE1 3.56Å; R643-E699 IonicContact CZ-OE2 3Å; R643-E699 IonicContact NH1-OE1 2.77Å; R643-E699 PolarHBondContact NH1-OE1 3.41Å; R643-E699 IonicContact NH1-OE2 2.72Å; R643-E699 PolarHBondContact NH1-OE2 3.21Å; R643-E699 IonicContact NH2-OE1 2.84Å; R643-E699 IonicContact NH2-OE2 3.57Å; R643-E699 PolarHBondContact NH2-OE2 3.19Å; R643-L702 HydrophobicContact CB-CD1 4.09Å
644	F	82.1	Confident	72.1	Confident	86 Å²	86	78.5 Å²	78.5	38%	0.377	41%	0.411	S	S	.	.	H	α-helix	trans	-64.6	-35.7	172.6	-178.1	-101.9	0	0	0	112.4	F640 L641 F646 Y701 L702	F640-F644 HydrophobicContact CE1-CB 4.38Å; F640-F644 HydrophobicContact CZ-CD2 4.45Å; F640-F644 WeakPolarHBondContact O-CB 3.45Å; F640-F644 PolarHBondContact O-N 3.45Å; L641-F644 PolarHBondContact O-N 3.3Å; F644-F646 PolarHBondContact O-N 2.82Å; F644-Y701 HydrophobicContact CD2-CE1 4.29Å; F644-Y701 AromaticContact CE2-CE1 3.9Å; F644-Y701 HydrophobicContact CE2-CE1 3.9Å; F644-L702 HydrophobicContact CB-CD2 4.07Å; F644-L702 HydrophobicContact CD2-CD2 3.8Å; F644-L702 HydrophobicContact CG-CD2 4.45Å
645	V	80.4	Confident	69.7	Low	91 Å²	91	86 Å²	86	55%	0.552	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	15.9	175.5	-176.4	0	0	0	0	111.7	L641 R643 K647	L641-V645 VanDerWaalsContact O-CG2 3.32Å; L641-V645 WeakPolarHBondContact O-CG2 3.37Å; L641-V645 PolarHBondContact O-N 3.48Å; R643-V645 VanDerWaalsContact C-N 3.33Å; V645-K647 PolarHBondContact O-N 2.84Å
646	F	72.5	Confident	66.9	Low	83 Å²	83	94.3 Å²	94.3	36%	0.364	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	24	-179	-52.7	-78.8	0	0	0	114.9	R643 F644 N648 V682 N683 A706	R643-F646 PolarHBondContact O-N 2.74Å; R643-F646 VanDerWaalsContact O-N 3.16Å; F644-F646 PolarHBondContact O-N 2.82Å; F646-N648 PolarHBondContact O-N 2.92Å; F646-V682 HydrophobicContact CD1-CB 3.89Å; F646-V682 HydrophobicContact CD1-CG1 3.8Å; F646-V682 HydrophobicContact CE1-CB 4.36Å; F646-V682 HydrophobicContact CE1-CG1 3.75Å; F646-N683 HydrophobicContact CB-CB 4.21Å; F646-N683 HydrophobicContact CD1-CB 4.07Å; F646-N683 HydrophobicContact CG-CB 4.4Å; F646-A706 HydrophobicContact CE1-CB 4.35Å
647	K	65.3	Low	64.3	Low	143 Å²	143	98.9 Å²	98.9	62%	0.622	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-66.5	125.2	173.4	-69.8	-171.5	174.4	-176.8	0	108.3	E642 V645	E642-K647 WeakPolarHBondContact O-CB 3.42Å; E642-K647 PolarHBondContact O-N 3.37Å; E642-K647 VanDerWaalsContact O-N 3.09Å; V645-K647 PolarHBondContact O-N 2.84Å
648	N	63.2	Low	61.6	Low	106 Å²	106	102.3 Å²	102.3	57%	0.567	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-50.8	129.3	174.4	-70	-16.3	0	0	0	108.9	F646 K650 P681	F646-N648 PolarHBondContact O-N 2.92Å; N648-K650 PolarHBondContact O-N 3.25Å; N648-K650 VanDerWaalsContact O-N 3.14Å; N648-P681 WeakPolarHBondContact OD1-CB 3.41Å
649	P	62	Low	59	Low	15 Å²	15	110.1 Å²	110.1	10%	0.097	54%	0.54	C	S	.	.	P	Polyproline II helix	trans	-55.3	126.1	174.3	22	-31	0	0	0	108.2	K651 P674 S679	P649-K651 PolarHBondContact O-N 2.81Å; P649-P674 HydrophobicContact CB-CG 4.47Å; P649-S679 WeakPolarHBondContact CG-O 3.45Å
650	K	59.9	Low	56.4	Low	180 Å²	180	111.5 Å²	111.5	78%	0.783	56%	0.563	S	S	*	*			trans	-53.3	115.1	178.4	-67	-176.8	-178.7	179.4	0	107.5	N648 S652	N648-K650 PolarHBondContact O-N 3.25Å; N648-K650 VanDerWaalsContact O-N 3.14Å; K650-S652 PolarHBondContact O-N 2.74Å
651	K	52.9	Low	53.7	Low	200 Å²	200	113 Å²	113	87%	0.87	57%	0.574	S	S	*	*			trans	-58.7	114.2	171.4	-67.7	-179.9	-178.7	175.5	0	106.2	P649 V653	P649-K651 PolarHBondContact O-N 2.81Å; K651-V653 PolarHBondContact O-N 2.97Å
652	S	45.6	Very low	51	Low	41 Å²	41	114.1 Å²	114.1	29%	0.287	59%	0.587	S	S	.	*			trans	-59.1	133.8	165.7	46.6	0	0	0	0	106.9	K650 A654	K650-S652 PolarHBondContact O-N 2.74Å; S652-A654 PolarHBondContact O-N 2.72Å
653	V	38.3	Very low	48.9	Very low	113 Å²	113	114.4 Å²	114.4	69%	0.685	60%	0.597	S	S	*	*			trans	-71.5	85.8	177.6	-178.5	0	0	0	0	107.7	K651 E655	K651-V653 PolarHBondContact O-N 2.97Å; V653-E655 HydrophobicContact CG1-CG 4.47Å
654	A	38.1	Very low	46.8	Very low	82 Å²	82	118.9 Å²	118.9	68%	0.678	63%	0.625	S	S	*	*			trans	-102.9	54.5	167.6	0	0	0	0	0	108.7	S652 Q656	S652-A654 PolarHBondContact O-N 2.72Å; A654-Q656 PolarHBondContact O-N 3.34Å
655	E	32.9	Very low	44.6	Very low	172 Å²	172	119.7 Å²	119.7	80%	0.804	64%	0.641	S	S	*	*			trans	-58.4	127.2	149.4	-74.4	-163	146.6	0	0	106.7	V653 P657	V653-E655 HydrophobicContact CG1-CG 4.47Å; E655-P657 WeakPolarHBondContact O-CD 3.37Å
656	Q	31.3	Very low	42.4	Very low	182 Å²	182	124.7 Å²	124.7	85%	0.85	66%	0.656	S	S	*	*			trans	-61.9	126.6	-177.2	-65.7	-177.8	-5.4	0	0	108.8	A654 E658	A654-Q656 PolarHBondContact O-N 3.34Å; Q656-E658 PolarHBondContact O-N 3.1Å
657	P	32.8	Very low	40.4	Very low	117 Å²	117	124 Å²	124	76%	0.76	67%	0.672	S	S	*	*			trans	-66.6	111.3	171	26.9	-31.8	0	0	0	108.3	E655 R659	E655-P657 WeakPolarHBondContact O-CD 3.37Å; P657-R659 PolarHBondContact O-N 2.85Å
658	E	32.8	Very low	39	Very low	176 Å²	176	125.4 Å²	125.4	82%	0.822	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46	100.9	167.7	-87.1	-82.2	170.6	0	0	110.1	Q656 G660	Q656-E658 PolarHBondContact O-N 3.1Å; E658-G660 PolarHBondContact O-N 2.92Å; E658-G660 VanDerWaalsContact O-N 3.1Å
659	R	30.1	Very low	37.7	Very low	243 Å²	243	129.7 Å²	129.7	92%	0.917	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	38.9	53.5	166.6	-59.9	-174.6	179.1	-166	0.6	116.5	P657	P657-R659 PolarHBondContact O-N 2.85Å
660	G	28	Very low	36.6	Very low	55 Å²	55	138.5 Å²	138.5	57%	0.567	72%	0.718	S	S	*	*			trans	-93.4	143.9	164.6	0	0	0	0	0	112.9	E658	E658-G660 PolarHBondContact O-N 2.92Å; E658-G660 VanDerWaalsContact O-N 3.1Å
661	D	29.9	Very low	35.9	Very low	115 Å²	115	133.4 Å²	133.4	62%	0.615	71%	0.71	S	S	*	*			trans	-61.5	129.5	-178.1	-178.3	43.5	0	0	0	112.6	S663	D661-S663 PolarHBondContact O-N 3.43Å; D661-S663 VanDerWaalsContact OD2-CB 3.26Å; D661-S663 WeakPolarHBondContact OD2-CB 3.36Å; D661-S663 PolarHBondContact OD2-OG 3.4Å
662	P	29.1	Very low	35.8	Very low	114 Å²	114	127.5 Å²	127.5	74%	0.74	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	1.9	-174.3	-23	34.1	0	0	0	116.4
663	S	38.1	Very low	36.2	Very low	73 Å²	73	131 Å²	131	51%	0.51	70%	0.698	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.7	-19.5	-173.1	67	0	0	0	0	114.5	D661	D661-S663 PolarHBondContact O-N 3.43Å; D661-S663 VanDerWaalsContact OD2-CB 3.26Å; D661-S663 WeakPolarHBondContact OD2-CB 3.36Å; D661-S663 PolarHBondContact OD2-OG 3.4Å
664	V	38.3	Very low	37.3	Very low	110 Å²	110	126 Å²	126	67%	0.667	67%	0.668	S	S	*	*	S	Bend	trans	-96.6	-23.8	-164.8	-172.3	0	0	0	0	114.6	K666	V664-K666 PolarHBondContact O-N 3.47Å
665	S	36.3	Very low	38.6	Very low	102 Å²	102	130.8 Å²	130.8	71%	0.713	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	14.5	-170.7	-47.8	0	0	0	0	116.7	G667	S665-G667 VanDerWaalsContact C-N 3.32Å; S665-G667 PolarHBondContact O-N 2.96Å
666	K	32.2	Very low	40.4	Very low	196 Å²	196	126.2 Å²	126.2	85%	0.852	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	0.6	-177.3	-73.1	178.9	177.9	170.8	0	114.9	V664	V664-K666 PolarHBondContact O-N 3.47Å
667	G	31.8	Very low	42.7	Very low	68 Å²	68	117.6 Å²	117.6	70%	0.701	61%	0.613	S	S	*	*	S	Bend	trans	-96.3	-40.2	-176.9	0	0	0	0	0	116.1	S665	S665-G667 VanDerWaalsContact C-N 3.32Å; S665-G667 PolarHBondContact O-N 2.96Å
668	R	34.8	Very low	44.7	Very low	174 Å²	174	113.2 Å²	113.2	66%	0.657	58%	0.581	S	S	*	*	S	Bend	trans	-70.9	136.8	171.4	-85	-176.5	166.6	-167.6	-4.3	108.2	K670 E771	R668-K670 PolarHBondContact O-N 3.33Å; R668-E771 IonicContact CZ-OE2 2.74Å; R668-E771 IonicContact NH1-OE2 3.37Å; R668-E771 PolarHBondContact NH1-OE2 3.48Å; R668-E771 IonicContact NH2-OE2 3.96Å; R668-E771 PolarHBondContact NH2-OE2 2.91Å
669	R	35.7	Very low	46.8	Very low	195 Å²	195	107.6 Å²	107.6	74%	0.736	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-52.5	127.9	157.3	-64.5	-176.4	-167.8	128.2	4.3	105.3	A671 E777	R669-A671 PolarHBondContact O-N 2.95Å; R669-E777 IonicContact CZ-OE1 3.21Å; R669-E777 VanDerWaalsContact CZ-OE1 3.29Å; R669-E777 IonicContact NH1-OE1 2.77Å; R669-E777 PolarHBondContact NH1-OE1 3.07Å; R669-E777 IonicContact NH1-OE2 3.63Å; R669-E777 PolarHBondContact NH1-OE2 3.35Å; R669-E777 IonicContact NH2-OE1 3.8Å; R669-E777 PolarHBondContact NH2-OE1 3.11Å
670	K	39.6	Very low	49.1	Very low	201 Å²	201	97.1 Å²	97.1	87%	0.874	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-51	122.1	174.9	-80.4	-171.7	171.8	-169.2	0	106.7	R668 Y672	R668-K670 PolarHBondContact O-N 3.33Å; K670-Y672 PolarHBondContact O-N 2.96Å; K670-Y672 VanDerWaalsContact O-N 3.15Å
671	A	45.6	Very low	51.5	Low	73 Å²	73	96.2 Å²	96.2	60%	0.603	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-52.4	127.1	173	0	0	0	0	0	106.7	R669 D673	R669-A671 PolarHBondContact O-N 2.95Å; A671-D673 PolarHBondContact O-N 3.39Å
672	Y	50.8	Low	54	Low	75 Å²	75	91 Å²	91	29%	0.294	48%	0.479	S	S	.	.			trans	-56.3	114.1	-172	164.5	-94	0	0	0	109	E633 D634 R639 K670 P674	E633-Y672 HydrophobicContact CB-CD2 4.43Å; E633-Y672 HydrophobicContact CB-CE2 4.47Å; D634-Y672 WeakPolarHBondContact OD1-CE2 3.5Å; D634-Y672 VanDerWaalsContact OD1-CZ 3.29Å; D634-Y672 PolarHBondContact OD1-OH 3.15Å; R639-Y672 PolarHBondContact NE-OH 2.9Å; K670-Y672 PolarHBondContact O-N 2.96Å; K670-Y672 VanDerWaalsContact O-N 3.15Å; Y672-P674 HydrophobicContact CE1-CB 3.69Å; Y672-P674 HydrophobicContact CE1-CG 4.01Å; Y672-P674 WeakPolarHBondContact O-CD 3.23Å
673	D	54.7	Low	56.4	Low	115 Å²	115	88.9 Å²	88.9	62%	0.615	46%	0.462	S	S	*	.			trans	-108	97.6	-177.3	-173.3	13	0	0	0	107.8	A671 W675	A671-D673 PolarHBondContact O-N 3.39Å; D673-W675 PolarHBondContact O-N 3.01Å
674	P	61.1	Low	58.4	Low	8 Å²	8	86.6 Å²	86.6	5%	0.052	45%	0.446	C	S	.	.			trans	-69.5	98.1	-175.3	26.3	-32.8	0	0	0	110.5	P649 Y672 R678 S679	P649-P674 HydrophobicContact CB-CG 4.47Å; Y672-P674 HydrophobicContact CE1-CB 3.69Å; Y672-P674 HydrophobicContact CE1-CG 4.01Å; Y672-P674 WeakPolarHBondContact O-CD 3.23Å; P674-R678 HydrophobicContact CB-CB 3.67Å; P674-S679 WeakPolarHBondContact O-CA 3.4Å; P674-S679 WeakPolarHBondContact O-CB 3.3Å; P674-S679 PolarHBondContact O-N 3.23Å; P674-S679 PolarHBondContact O-OG 3.17Å
675	W	64	Low	60.5	Low	182 Å²	182	87 Å²	87	69%	0.689	44%	0.438	S	S	*	.			trans	-73.8	152.8	-174.6	-171.6	21	0	0	0	113.8	D673 V677 R678	D673-W675 PolarHBondContact O-N 3.01Å; W675-V677 PolarHBondContact O-N 3.46Å; W675-R678 PolarHBondContact O-N 3.2Å
676	T	72	Confident	62.8	Low	76 Å²	76	89 Å²	89	47%	0.466	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	-108.1	170.2	-43.9	0	0	0	0	113.6	R678 S679	T676-R678 VanDerWaalsContact C-N 3.31Å; T676-S679 PolarHBondContact O-OG 3.02Å; T676-S679 VanDerWaalsContact O-OG 3.1Å
677	V	78	Confident	65.3	Low	2 Å²	2	79.7 Å²	79.7	1%	0.012	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-17.3	-176.4	-174.1	0	0	0	0	111.1	R643 W675 I680 Y687 K690 E694 I695	R643-V677 PolarHBondContact NH2-O 2.99Å; W675-V677 PolarHBondContact O-N 3.46Å; V677-I680 PolarHBondContact O-N 3.42Å; V677-Y687 HydrophobicContact CG1-CD2 3.93Å; V677-Y687 HydrophobicContact CG1-CE2 3.47Å; V677-Y687 VanDerWaalsContact CG1-CE2 3.47Å; V677-K690 HydrophobicContact CG2-CD 4.16Å; V677-E694 WeakPolarHBondContact CG2-O 3.05Å; V677-I695 HydrophobicContact CG1-CG1 4.4Å
678	R	76.6	Confident	67.7	Low	25 Å²	25	76.5 Å²	76.5	9%	0.094	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-23.1	-177.2	-64.9	174.6	178.4	172.8	-0.1	114.9	Y627 D634 P674 W675 T676 I680 E698 E699	Y627-R678 PolarHBondContact OH-NH1 2.69Å; Y627-R678 PolarHBondContact OH-NH2 3.27Å; D634-R678 IonicContact OD1-CZ 3.81Å; D634-R678 IonicContact OD1-NH1 3.43Å; D634-R678 PolarHBondContact OD1-NH1 2.69Å; D634-R678 IonicContact OD2-NH1 3.45Å; D634-R678 PolarHBondContact OD2-NH1 3.23Å; P674-R678 HydrophobicContact CB-CB 3.67Å; W675-R678 PolarHBondContact O-N 3.2Å; T676-R678 VanDerWaalsContact C-N 3.31Å; R678-I680 VanDerWaalsContact C-N 3.29Å; R678-E698 IonicContact CZ-OE1 2.74Å; R678-E698 IonicContact NE-OE1 2.82Å; R678-E698 IonicContact NH2-OE1 3.61Å; R678-E698 PolarHBondContact NH2-OE1 3.4Å; R678-E699 WeakPolarHBondContact CG-OE1 3.47Å; R678-E699 IonicContact NE-OE1 3.77Å
679	S	75.3	Confident	70.1	Confident	58 Å²	58	73.5 Å²	73.5	41%	0.406	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-16.5	172.1	45.8	0	0	0	0	112.5	P649 P674 T676	P649-S679 WeakPolarHBondContact CG-O 3.45Å; P674-S679 WeakPolarHBondContact O-CA 3.4Å; P674-S679 WeakPolarHBondContact O-CB 3.3Å; P674-S679 PolarHBondContact O-N 3.23Å; P674-S679 PolarHBondContact O-OG 3.17Å; T676-S679 PolarHBondContact O-OG 3.02Å; T676-S679 VanDerWaalsContact O-OG 3.1Å
680	I	78.7	Confident	72.5	Confident	23 Å²	23	66.4 Å²	66.4	12%	0.118	34%	0.335	C	S	.	.	S	Bend	trans	-83.6	128.1	-177.4	-51.8	178.3	0	0	0	108.7	V677 R678 V682 S684 Q686 Y687	V677-I680 PolarHBondContact O-N 3.42Å; R678-I680 VanDerWaalsContact C-N 3.29Å; I680-V682 PolarHBondContact O-N 3.19Å; I680-S684 WeakPolarHBondContact CG2-OG 3.45Å; I680-Q686 HydrophobicContact CG2-CB 4.13Å; I680-Y687 HydrophobicContact CB-CD2 4.18Å; I680-Y687 HydrophobicContact CG2-CD2 4.17Å
681	P	79.7	Confident	74.6	Confident	36 Å²	36	61.1 Å²	61.1	23%	0.234	32%	0.316	C	S	.	.			trans	-59.1	130.8	171	-22.4	33	0	0	0	111.5	N648 N683 S684 Y687	N648-P681 WeakPolarHBondContact OD1-CB 3.41Å; P681-N683 WeakPolarHBondContact CB-OD1 3.38Å; P681-N683 PolarHBondContact O-N 3.08Å; P681-S684 WeakPolarHBondContact O-CB 3.49Å; P681-S684 PolarHBondContact O-N 2.91Å; P681-S684 PolarHBondContact O-OG 2.89Å; P681-Y687 WeakPolarHBondContact O-CB 3.17Å
682	V	80.8	Confident	76.3	Confident	4 Å²	4	64.6 Å²	64.6	2%	0.024	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-24	-174.7	-177.8	0	0	0	0	112.1	R643 F646 I680 Y687 L702 A706	R643-V682 HydrophobicContact CB-CG2 4.18Å; F646-V682 HydrophobicContact CD1-CB 3.89Å; F646-V682 HydrophobicContact CD1-CG1 3.8Å; F646-V682 HydrophobicContact CE1-CB 4.36Å; F646-V682 HydrophobicContact CE1-CG1 3.75Å; I680-V682 PolarHBondContact O-N 3.19Å; V682-Y687 HydrophobicContact CB-CD1 4.4Å; V682-Y687 HydrophobicContact CB-CE1 4.31Å; V682-Y687 HydrophobicContact CG1-CD1 4.03Å; V682-Y687 HydrophobicContact CG1-CE1 3.7Å; V682-Y687 HydrophobicContact CG2-CE1 4.44Å; V682-Y687 HydrophobicContact CG2-CE2 4.27Å; V682-L702 HydrophobicContact CG1-CB 4.19Å; V682-A706 HydrophobicContact CG1-CB 4.14Å; V682-A706 WeakPolarHBondContact O-CB 3.5Å
683	N	79.7	Confident	77.7	Confident	71 Å²	71	68.2 Å²	68.2	38%	0.38	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-0.6	173.9	59.2	-11.8	0	0	0	114.4	F646 P681 L710	F646-N683 HydrophobicContact CB-CB 4.21Å; F646-N683 HydrophobicContact CD1-CB 4.07Å; F646-N683 HydrophobicContact CG-CB 4.4Å; P681-N683 WeakPolarHBondContact CB-OD1 3.38Å; P681-N683 PolarHBondContact O-N 3.08Å; N683-L710 WeakPolarHBondContact O-CD2 3.35Å
684	S	81.2	Confident	79	Confident	25 Å²	25	68.1 Å²	68.1	18%	0.175	34%	0.34	C	S	.	.	S	Bend	trans	-85.3	147.2	-179.7	71.2	0	0	0	0	112.3	I680 P681 Q686 Y687 A688	I680-S684 WeakPolarHBondContact CG2-OG 3.45Å; P681-S684 WeakPolarHBondContact O-CB 3.49Å; P681-S684 PolarHBondContact O-N 2.91Å; P681-S684 PolarHBondContact O-OG 2.89Å; S684-Q686 PolarHBondContact O-N 3.06Å; S684-Y687 WeakPolarHBondContact O-CB 3.47Å; S684-Y687 PolarHBondContact O-N 3.39Å; S684-Y687 PolarHBondContact OG-N 3.01Å; S684-A688 PolarHBondContact O-N 3.08Å
685	K	81.6	Confident	80.1	Confident	117 Å²	117	68.5 Å²	68.5	51%	0.509	34%	0.341	S	S	.	.	H	α-helix	trans	-56.7	-38.1	171.8	-65.7	176.6	-176.5	171.5	0	111.3	Y687 A688 D689 T714	K685-Y687 PolarHBondContact O-N 2.78Å; K685-Y687 VanDerWaalsContact O-N 3.15Å; K685-A688 PolarHBondContact O-N 2.87Å; K685-D689 WeakPolarHBondContact O-CB 3.32Å; K685-D689 VanDerWaalsContact O-CG 3.25Å; K685-D689 PolarHBondContact O-N 3.39Å; K685-T714 VanDerWaalsContact CE-CG2 3.44Å
686	Q	84	Confident	81	Confident	145 Å²	145	61.2 Å²	61.2	68%	0.678	32%	0.318	S	S	*	.	H	α-helix	trans	-55.6	-30.7	173.6	-63.6	-178.3	6.3	0	0	113.8	I680 S684	I680-Q686 HydrophobicContact CG2-CB 4.13Å; S684-Q686 PolarHBondContact O-N 3.06Å
687	Y	85.1	Confident	81.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-77.1	-46.2	174.2	-167.7	-96.2	0	0	0	111.4	V677 I680 P681 V682 S684 K685 D689 K690 E699 H703 A706	V677-Y687 HydrophobicContact CG1-CD2 3.93Å; V677-Y687 HydrophobicContact CG1-CE2 3.47Å; V677-Y687 VanDerWaalsContact CG1-CE2 3.47Å; I680-Y687 HydrophobicContact CB-CD2 4.18Å; I680-Y687 HydrophobicContact CG2-CD2 4.17Å; P681-Y687 WeakPolarHBondContact O-CB 3.17Å; V682-Y687 HydrophobicContact CB-CD1 4.4Å; V682-Y687 HydrophobicContact CB-CE1 4.31Å; V682-Y687 HydrophobicContact CG1-CD1 4.03Å; V682-Y687 HydrophobicContact CG1-CE1 3.7Å; V682-Y687 HydrophobicContact CG2-CE1 4.44Å; V682-Y687 HydrophobicContact CG2-CE2 4.27Å; S684-Y687 WeakPolarHBondContact O-CB 3.47Å; S684-Y687 PolarHBondContact O-N 3.39Å; S684-Y687 PolarHBondContact OG-N 3.01Å; K685-Y687 PolarHBondContact O-N 2.78Å; K685-Y687 VanDerWaalsContact O-N 3.15Å; Y687-D689 VanDerWaalsContact C-N 3.3Å; Y687-D689 PolarHBondContact O-N 2.62Å; Y687-K690 WeakPolarHBondContact O-CB 3.14Å; Y687-K690 PolarHBondContact O-N 3.1Å; Y687-E699 WeakPolarHBondContact CE2-OE2 3.27Å; Y687-E699 PolarHBondContact OH-OE2 2.76Å; Y687-H703 HydrophobicContact CE1-CB 3.92Å; Y687-H703 PolarHBondContact O-CD2 2.99Å; Y687-H703 PolarHBondContact O-NE2 3.08Å; Y687-A706 HydrophobicContact CD1-CB 4.38Å
688	A	83.2	Confident	81.6	Confident	2 Å²	2	61 Å²	61	2%	0.017	32%	0.316	C	S	.	.	H	α-helix	trans	-64.3	-32.7	179.9	0	0	0	0	0	113.8	S684 K685 K690 H703 R707 L710	S684-A688 PolarHBondContact O-N 3.08Å; K685-A688 PolarHBondContact O-N 2.87Å; A688-K690 VanDerWaalsContact C-N 3.31Å; A688-H703 PolarHBondContact O-NE2 3.3Å; A688-H703 VanDerWaalsContact O-NE2 3.09Å; A688-R707 PolarHBondContact O-NH1 3.13Å; A688-L710 HydrophobicContact CB-CD1 3.88Å
689	D	85.3	Confident	81.9	Confident	110 Å²	110	59.9 Å²	59.9	59%	0.588	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-8	-179.4	-65	-28	0	0	0	113.3	K685 Y687	K685-D689 WeakPolarHBondContact O-CB 3.32Å; K685-D689 VanDerWaalsContact O-CG 3.25Å; K685-D689 PolarHBondContact O-N 3.39Å; Y687-D689 VanDerWaalsContact C-N 3.3Å; Y687-D689 PolarHBondContact O-N 2.62Å
690	K	84.6	Confident	82.4	Confident	46 Å²	46	60 Å²	60	20%	0.2	31%	0.312	C	S	.	.	S	Bend	trans	-60.2	139.8	170.8	-79	-82.4	171.9	179.9	0	111	V677 Y687 A688 E694 I695 H703	V677-K690 HydrophobicContact CG2-CD 4.16Å; Y687-K690 WeakPolarHBondContact O-CB 3.14Å; Y687-K690 PolarHBondContact O-N 3.1Å; A688-K690 VanDerWaalsContact C-N 3.31Å; K690-E694 HydrophobicContact CD-CB 4.2Å; K690-E694 WeakPolarHBondContact CD-OE2 3.21Å; K690-E694 WeakPolarHBondContact CE-OE2 3.3Å; K690-E694 IonicContact NZ-OE2 3.54Å; K690-E694 PolarHBondContact NZ-OE2 3.08Å; K690-I695 HydrophobicContact CB-CD1 3.89Å; K690-I695 HydrophobicContact CB-CG1 4.02Å; K690-H703 PolarHBondContact O-CE1 2.99Å; K690-H703 PolarHBondContact O-NE2 3.37Å
691	D	83.9	Confident	82.7	Confident	90 Å²	90	65.1 Å²	65.1	48%	0.481	33%	0.331	S	S	.	.			trans	-68.4	141.7	171.4	-169.3	-71.6	0	0	0	110.4	N693 E694 I695	D691-N693 PolarHBondContact O-N 2.87Å; D691-N693 VanDerWaalsContact O-N 3.09Å; D691-N693 WeakPolarHBondContact OD1-CB 3.31Å; D691-N693 PolarHBondContact OD1-N 2.73Å; D691-N693 PolarHBondContact OD1-ND2 3.21Å; D691-E694 HydrophobicContact CB-CG 4.44Å; D691-E694 PolarHBondContact O-N 2.8Å; D691-I695 WeakPolarHBondContact O-CD1 3.46Å
692	E	81.5	Confident	82.9	Confident	147 Å²	147	63.7 Å²	63.7	69%	0.687	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-54.3	-29.3	179.7	-69.4	-179.7	-170.3	0	0	112.8
693	N	81.7	Confident	83.2	Confident	151 Å²	151	63.7 Å²	63.7	81%	0.807	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-78	-20.2	179	-60.8	-78.6	0	0	0	114	D691	D691-N693 PolarHBondContact O-N 2.87Å; D691-N693 VanDerWaalsContact O-N 3.09Å; D691-N693 WeakPolarHBondContact OD1-CB 3.31Å; D691-N693 PolarHBondContact OD1-N 2.73Å; D691-N693 PolarHBondContact OD1-ND2 3.21Å
694	E	81.6	Confident	83.5	Confident	112 Å²	112	64.7 Å²	64.7	52%	0.523	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-85.1	-12.4	176.4	-68.4	-165.7	177	0	0	112.9	V677 K690 D691	V677-E694 WeakPolarHBondContact CG2-O 3.05Å; K690-E694 HydrophobicContact CD-CB 4.2Å; K690-E694 WeakPolarHBondContact CD-OE2 3.21Å; K690-E694 WeakPolarHBondContact CE-OE2 3.3Å; K690-E694 IonicContact NZ-OE2 3.54Å; K690-E694 PolarHBondContact NZ-OE2 3.08Å; D691-E694 HydrophobicContact CB-CG 4.44Å; D691-E694 PolarHBondContact O-N 2.8Å
695	I	83	Confident	83.5	Confident	16 Å²	16	65.6 Å²	65.6	8%	0.082	34%	0.336	C	S	.	.	S	Bend	trans	-90.1	128.5	-171.5	-68.8	153.8	0	0	0	110	V677 K690 D691 E699 H703	V677-I695 HydrophobicContact CG1-CG1 4.4Å; K690-I695 HydrophobicContact CB-CD1 3.89Å; K690-I695 HydrophobicContact CB-CG1 4.02Å; D691-I695 WeakPolarHBondContact O-CD1 3.46Å; I695-E699 HydrophobicContact CG2-CB 3.56Å; I695-H703 HydrophobicContact CD1-CB 3.8Å; I695-H703 WeakPolarHBondContact CD1-CD2 3.48Å; I695-H703 WeakPolarHBondContact CD1-ND1 3.28Å; I695-H703 WeakPolarHBondContact CD1-NE2 3.4Å; I695-H703 HydrophobicContact CG2-CB 4.3Å
696	P	84.6	Confident	83.3	Confident	30 Å²	30	60 Å²	60	20%	0.195	31%	0.312	C	S	.	.			trans	-57.8	147.8	177.1	-26	34.9	0	0	0	112.6	E698 E699 S700	P696-E698 VanDerWaalsContact C-N 3.26Å; P696-E698 VanDerWaalsContact CB-CD 3.48Å; P696-E698 HydrophobicContact CB-CG 4.4Å; P696-E698 WeakPolarHBondContact CB-OE1 3.31Å; P696-E698 PolarHBondContact O-N 3.45Å; P696-E698 VanDerWaalsContact O-N 3.13Å; P696-E699 HydrophobicContact CB-CB 4.48Å; P696-E699 HydrophobicContact CB-CG 4.33Å; P696-E699 HydrophobicContact CG-CG 4.47Å; P696-E699 WeakPolarHBondContact O-CA 3.48Å; P696-E699 WeakPolarHBondContact O-CB 3.18Å; P696-E699 PolarHBondContact O-N 3.48Å; P696-S700 PolarHBondContact O-N 3.19Å
697	P	82.8	Confident	83	Confident	47 Å²	47	58 Å²	58	31%	0.305	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-39.3	-175.6	-22.8	27.5	0	0	0	114.2	P592 L596 E699 S700	P592-P697 HydrophobicContact CB-CB 4.02Å; P592-P697 HydrophobicContact CG-CB 4.36Å; P592-P697 WeakPolarHBondContact CG-O 2.92Å; L596-P697 HydrophobicContact CD1-CG 3.64Å; P697-E699 PolarHBondContact O-N 3.09Å; P697-S700 PolarHBondContact O-N 2.84Å; P697-S700 PolarHBondContact O-OG 2.9Å
698	E	78.6	Confident	82.5	Confident	27 Å²	27	61.7 Å²	61.7	13%	0.126	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-17.3	176.1	61.8	-78.2	-174.8	0	0	114.8	P592 T593 F635 R678 P696	P592-E698 HydrophobicContact CG-CB 4.38Å; T593-E698 WeakPolarHBondContact CG2-OE2 3.42Å; T593-E698 WeakPolarHBondContact OG1-CB 3.32Å; T593-E698 PolarHBondContact OG1-OE2 2.97Å; F635-E698 HydrophobicContact CD1-CG 4.28Å; F635-E698 HydrophobicContact CE1-CG 4.05Å; R678-E698 IonicContact CZ-OE1 2.74Å; R678-E698 IonicContact NE-OE1 2.82Å; R678-E698 IonicContact NH2-OE1 3.61Å; R678-E698 PolarHBondContact NH2-OE1 3.4Å; P696-E698 VanDerWaalsContact C-N 3.26Å; P696-E698 VanDerWaalsContact CB-CD 3.48Å; P696-E698 HydrophobicContact CB-CG 4.4Å; P696-E698 WeakPolarHBondContact CB-OE1 3.31Å; P696-E698 PolarHBondContact O-N 3.45Å; P696-E698 VanDerWaalsContact O-N 3.13Å
699	E	83.9	Confident	81.9	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.005	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-14.1	-179.9	-68.9	-168.4	-141.7	0	0	113.9	R643 R678 Y687 I695 P696 P697 Y701 L702 H703	R643-E699 IonicContact CZ-OE1 3.56Å; R643-E699 IonicContact CZ-OE2 3Å; R643-E699 IonicContact NH1-OE1 2.77Å; R643-E699 PolarHBondContact NH1-OE1 3.41Å; R643-E699 IonicContact NH1-OE2 2.72Å; R643-E699 PolarHBondContact NH1-OE2 3.21Å; R643-E699 IonicContact NH2-OE1 2.84Å; R643-E699 IonicContact NH2-OE2 3.57Å; R643-E699 PolarHBondContact NH2-OE2 3.19Å; R678-E699 WeakPolarHBondContact CG-OE1 3.47Å; R678-E699 IonicContact NE-OE1 3.77Å; Y687-E699 WeakPolarHBondContact CE2-OE2 3.27Å; Y687-E699 PolarHBondContact OH-OE2 2.76Å; I695-E699 HydrophobicContact CG2-CB 3.56Å; P696-E699 HydrophobicContact CB-CB 4.48Å; P696-E699 HydrophobicContact CB-CG 4.33Å; P696-E699 HydrophobicContact CG-CG 4.47Å; P696-E699 WeakPolarHBondContact O-CA 3.48Å; P696-E699 WeakPolarHBondContact O-CB 3.18Å; P696-E699 PolarHBondContact O-N 3.48Å; P697-E699 PolarHBondContact O-N 3.09Å; E699-Y701 PolarHBondContact O-N 3.28Å; E699-Y701 VanDerWaalsContact O-N 3.12Å; E699-L702 WeakPolarHBondContact O-CA 3.18Å; E699-L702 WeakPolarHBondContact O-CB 3.45Å; E699-L702 PolarHBondContact O-N 3.05Å; E699-H703 PolarHBondContact O-N 3.14Å
700	S	85.2	Confident	80.9	Confident	61 Å²	61	66.4 Å²	66.4	43%	0.427	33%	0.334	S	S	.	.	H	α-helix	trans	-47.6	-43	178.1	58.4	0	0	0	0	112.7	P696 P697 T704	P696-S700 PolarHBondContact O-N 3.19Å; P697-S700 PolarHBondContact O-N 2.84Å; P697-S700 PolarHBondContact O-OG 2.9Å; S700-T704 WeakPolarHBondContact O-CB 3.43Å; S700-T704 PolarHBondContact O-N 3.36Å; S700-T704 PolarHBondContact O-OG1 3.06Å
701	Y	84.6	Confident	79.8	Confident	129 Å²	129	69.3 Å²	69.3	51%	0.506	35%	0.347	S	S	.	.	H	α-helix	trans	-63.9	-44.8	174	179.5	-101.6	0	0	0	113	F644 E699 H703 T704 C705	F644-Y701 HydrophobicContact CD2-CE1 4.29Å; F644-Y701 AromaticContact CE2-CE1 3.9Å; F644-Y701 HydrophobicContact CE2-CE1 3.9Å; E699-Y701 PolarHBondContact O-N 3.28Å; E699-Y701 VanDerWaalsContact O-N 3.12Å; Y701-H703 PolarHBondContact O-N 3.29Å; Y701-T704 PolarHBondContact O-N 2.97Å; Y701-C705 WeakPolarHBondContact O-CB 3.04Å; Y701-C705 PolarHBondContact O-N 2.81Å; Y701-C705 PolarHBondContact O-SG 2.95Å; Y701-C705 VanDerWaalsContact O-SG 3.35Å
702	L	84.7	Confident	78.5	Confident	7 Å²	7	69.3 Å²	69.3	4%	0.037	35%	0.35	C	S	.	.	H	α-helix	trans	-62.4	-43	178.5	-65.9	177.3	0	0	0	111.6	F640 R643 F644 V682 E699 C705 A706	F640-L702 HydrophobicContact CE2-CD2 4.46Å; R643-L702 HydrophobicContact CB-CD1 4.09Å; F644-L702 HydrophobicContact CB-CD2 4.07Å; F644-L702 HydrophobicContact CD2-CD2 3.8Å; F644-L702 HydrophobicContact CG-CD2 4.45Å; V682-L702 HydrophobicContact CG1-CB 4.19Å; E699-L702 WeakPolarHBondContact O-CA 3.18Å; E699-L702 WeakPolarHBondContact O-CB 3.45Å; E699-L702 PolarHBondContact O-N 3.05Å; L702-C705 PolarHBondContact O-N 2.79Å; L702-A706 VanDerWaalsContact O-CB 3.23Å; L702-A706 WeakPolarHBondContact O-CB 3.46Å; L702-A706 PolarHBondContact O-N 2.66Å
703	H	86.2	Confident	77.1	Confident	4 Å²	4	65.1 Å²	65.1	2%	0.019	34%	0.337	C	S	.	.	H	α-helix	trans	-67.1	-45.9	176.6	179	-100.9	0	0	0	112.6	Y687 A688 K690 I695 E699 Y701 C705 A706 R707	Y687-H703 HydrophobicContact CE1-CB 3.92Å; Y687-H703 PolarHBondContact O-CD2 2.99Å; Y687-H703 PolarHBondContact O-NE2 3.08Å; A688-H703 PolarHBondContact O-NE2 3.3Å; A688-H703 VanDerWaalsContact O-NE2 3.09Å; K690-H703 PolarHBondContact O-CE1 2.99Å; K690-H703 PolarHBondContact O-NE2 3.37Å; I695-H703 HydrophobicContact CD1-CB 3.8Å; I695-H703 WeakPolarHBondContact CD1-CD2 3.48Å; I695-H703 WeakPolarHBondContact CD1-ND1 3.28Å; I695-H703 WeakPolarHBondContact CD1-NE2 3.4Å; I695-H703 HydrophobicContact CG2-CB 4.3Å; E699-H703 PolarHBondContact O-N 3.14Å; Y701-H703 PolarHBondContact O-N 3.29Å; H703-C705 PolarHBondContact O-N 2.81Å; H703-A706 PolarHBondContact O-N 2.82Å; H703-A706 VanDerWaalsContact O-N 3.16Å; H703-R707 WeakPolarHBondContact O-CB 3.23Å; H703-R707 PolarHBondContact O-N 2.64Å
704	T	85.5	Confident	75.4	Confident	91 Å²	91	59.5 Å²	59.5	56%	0.558	31%	0.309	S	S	*	.	H	α-helix	trans	-57	-39.7	175.8	-55.7	0	0	0	0	111.3	S700 Y701 P708	S700-T704 WeakPolarHBondContact O-CB 3.43Å; S700-T704 PolarHBondContact O-N 3.36Å; S700-T704 PolarHBondContact O-OG1 3.06Å; Y701-T704 PolarHBondContact O-N 2.97Å; T704-P708 WeakPolarHBondContact O-CD 3.44Å
705	C	81.4	Confident	73.6	Confident	44 Å²	44	58 Å²	58	30%	0.297	31%	0.31	S	S	.	.	H	α-helix	trans	-75.6	-37.7	175.9	-71.2	0	0	0	0	113.7	Y701 L702 H703 Y709	Y701-C705 WeakPolarHBondContact O-CB 3.04Å; Y701-C705 PolarHBondContact O-N 2.81Å; Y701-C705 PolarHBondContact O-SG 2.95Å; Y701-C705 VanDerWaalsContact O-SG 3.35Å; L702-C705 PolarHBondContact O-N 2.79Å; H703-C705 PolarHBondContact O-N 2.81Å; C705-Y709 WeakPolarHBondContact O-CD2 3.46Å
706	A	78.8	Confident	71.6	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.008	34%	0.342	C	S	.	.	H	α-helix	trans	-70.9	-36.7	-177.1	0	0	0	0	0	112.8	F646 V682 Y687 L702 H703 Y709 L710	F646-A706 HydrophobicContact CE1-CB 4.35Å; V682-A706 HydrophobicContact CG1-CB 4.14Å; V682-A706 WeakPolarHBondContact O-CB 3.5Å; Y687-A706 HydrophobicContact CD1-CB 4.38Å; L702-A706 VanDerWaalsContact O-CB 3.23Å; L702-A706 WeakPolarHBondContact O-CB 3.46Å; L702-A706 PolarHBondContact O-N 2.66Å; H703-A706 PolarHBondContact O-N 2.82Å; H703-A706 VanDerWaalsContact O-N 3.16Å; A706-Y709 PolarHBondContact O-N 3.35Å; A706-L710 HydrophobicContact CB-CD1 4.49Å; A706-L710 PolarHBondContact O-N 3.48Å
707	R	77.9	Confident	69.4	Low	103 Å²	103	69.5 Å²	69.5	39%	0.389	36%	0.359	S	S	.	.	H	α-helix	trans	-58.8	-49.2	-173.4	-170.9	176.5	178.3	117.6	-13.5	113	A688 H703 Y709 L710 F711	A688-R707 PolarHBondContact O-NH1 3.13Å; H703-R707 WeakPolarHBondContact O-CB 3.23Å; H703-R707 PolarHBondContact O-N 2.64Å; R707-Y709 PolarHBondContact O-N 3Å; R707-L710 PolarHBondContact O-N 3.41Å; R707-F711 HydrophobicContact CG-CD2 3.93Å; R707-F711 HydrophobicContact CG-CE2 3.98Å; R707-F711 WeakPolarHBondContact O-CD2 3.49Å; R707-F711 PolarHBondContact O-N 2.85Å; R707-F711 VanDerWaalsContact O-N 3.14Å
708	P	74	Confident	67.3	Low	76 Å²	76	71.6 Å²	71.6	49%	0.494	37%	0.37	S	S	.	.	H	α-helix	trans	-60.2	-38.2	175.6	-25.3	34.9	0	0	0	114.7	T704 L710 T712	T704-P708 WeakPolarHBondContact O-CD 3.44Å; P708-L710 VanDerWaalsContact C-N 3.32Å; P708-L710 PolarHBondContact O-N 3.44Å; P708-T712 WeakPolarHBondContact O-CB 3.38Å; P708-T712 WeakPolarHBondContact O-CG2 3.45Å; P708-T712 PolarHBondContact O-N 2.99Å; P708-T712 PolarHBondContact O-OG1 3.1Å
709	Y	69.5	Low	65.3	Low	179 Å²	179	78.1 Å²	78.1	70%	0.702	40%	0.398	S	S	*	.	H	α-helix	trans	-69.1	-28.6	-179	-83.4	-95.8	0	0	0	112.9	C705 A706 R707 T712 S713	C705-Y709 WeakPolarHBondContact O-CD2 3.46Å; A706-Y709 PolarHBondContact O-N 3.35Å; R707-Y709 PolarHBondContact O-N 3Å; Y709-T712 PolarHBondContact O-OG1 3.04Å; Y709-S713 PolarHBondContact O-OG 3.03Å; Y709-S713 VanDerWaalsContact O-OG 3.08Å
710	L	64.1	Low	63	Low	32 Å²	32	82.5 Å²	82.5	17%	0.168	43%	0.428	C	S	.	.	H	α-helix	trans	-90.3	-27	-179.6	-65.3	169.1	0	0	0	113.2	N683 A688 A706 R707 P708 S713 T714	N683-L710 WeakPolarHBondContact O-CD2 3.35Å; A688-L710 HydrophobicContact CB-CD1 3.88Å; A706-L710 HydrophobicContact CB-CD1 4.49Å; A706-L710 PolarHBondContact O-N 3.48Å; R707-L710 PolarHBondContact O-N 3.41Å; P708-L710 VanDerWaalsContact C-N 3.32Å; P708-L710 PolarHBondContact O-N 3.44Å; L710-S713 PolarHBondContact O-OG 3.24Å; L710-T714 PolarHBondContact O-OG1 3.43Å
711	F	61.6	Low	60.7	Low	107 Å²	107	86.8 Å²	86.8	47%	0.469	45%	0.445	S	S	.	.	H	α-helix	trans	-78	-23.4	171.6	-86.6	-84.7	0	0	0	113.7	R707 T714 S715	R707-F711 HydrophobicContact CG-CD2 3.93Å; R707-F711 HydrophobicContact CG-CE2 3.98Å; R707-F711 WeakPolarHBondContact O-CD2 3.49Å; R707-F711 PolarHBondContact O-N 2.85Å; R707-F711 VanDerWaalsContact O-N 3.14Å; F711-T714 PolarHBondContact O-OG1 2.72Å; F711-S715 PolarHBondContact O-OG 2.81Å
712	T	56.8	Low	58.4	Low	90 Å²	90	89 Å²	89	55%	0.552	46%	0.457	S	S	*	.	H	α-helix	trans	-81.2	-34.8	177.9	45.2	0	0	0	0	113.5	P708 Y709	P708-T712 WeakPolarHBondContact O-CB 3.38Å; P708-T712 WeakPolarHBondContact O-CG2 3.45Å; P708-T712 PolarHBondContact O-N 2.99Å; P708-T712 PolarHBondContact O-OG1 3.1Å; Y709-T712 PolarHBondContact O-OG1 3.04Å
713	S	52.2	Low	56	Low	59 Å²	59	99.2 Å²	99.2	41%	0.413	50%	0.495	S	S	.	.	H	α-helix	trans	-67.2	-48.8	175.3	41.2	0	0	0	0	112.2	Y709 L710 S715 K716	Y709-S713 PolarHBondContact O-OG 3.03Å; Y709-S713 VanDerWaalsContact O-OG 3.08Å; L710-S713 PolarHBondContact O-OG 3.24Å; S713-S715 PolarHBondContact O-N 3.49Å; S713-S715 VanDerWaalsContact O-N 3.15Å; S713-K716 PolarHBondContact O-N 3.33Å
714	T	46.4	Very low	53.5	Low	34 Å²	34	108.9 Å²	108.9	21%	0.209	54%	0.537	C	S	.	.	H	α-helix	trans	-59.9	-26	178.2	46.4	0	0	0	0	114.6	K685 L710 F711 K716 V718	K685-T714 VanDerWaalsContact CE-CG2 3.44Å; L710-T714 PolarHBondContact O-OG1 3.43Å; F711-T714 PolarHBondContact O-OG1 2.72Å; T714-K716 VanDerWaalsContact C-N 3.28Å; T714-K716 PolarHBondContact O-N 2.89Å; T714-V718 WeakPolarHBondContact O-CG2 3.39Å
715	S	43.5	Very low	51	Low	79 Å²	79	113.7 Å²	113.7	55%	0.552	55%	0.55	S	S	*	*	H	α-helix	trans	-71.4	-18	176	-70.1	0	0	0	0	114.1	F711 S713	F711-S715 PolarHBondContact O-OG 2.81Å; S713-S715 PolarHBondContact O-N 3.49Å; S713-S715 VanDerWaalsContact O-N 3.15Å
716	K	42.3	Very low	48.5	Very low	172 Å²	172	123.2 Å²	123.2	75%	0.748	58%	0.58	S	S	*	*	H	α-helix	trans	-80.9	-44.6	175.2	-69.6	-175.2	175.9	-178.1	0	111.6	S713 T714 V718 K719	S713-K716 PolarHBondContact O-N 3.33Å; T714-K716 VanDerWaalsContact C-N 3.28Å; T714-K716 PolarHBondContact O-N 2.89Å; K716-V718 PolarHBondContact O-N 3.24Å; K716-K719 PolarHBondContact O-N 3.26Å
717	E	36.7	Very low	46	Very low	117 Å²	117	127.9 Å²	127.9	55%	0.547	61%	0.613	S	S	.	*	H	α-helix	trans	-60.1	-45.7	-179.5	-62.5	173.7	137	0	0	112.8	K719 C720 L721	E717-K719 PolarHBondContact O-N 2.74Å; E717-C720 PolarHBondContact O-N 3.35Å; E717-L721 PolarHBondContact O-N 2.7Å
718	V	39.5	Very low	43.6	Very low	90 Å²	90	130 Å²	130	55%	0.545	63%	0.632	S	S	.	*	H	α-helix	trans	-66.2	-23.6	-174.9	178	0	0	0	0	112.9	T714 K716	T714-V718 WeakPolarHBondContact O-CG2 3.39Å; K716-V718 PolarHBondContact O-N 3.24Å
719	K	36.1	Very low	41.5	Very low	164 Å²	164	133.1 Å²	133.1	71%	0.713	64%	0.644	S	S	*	*	H	α-helix	trans	-79.4	-27.4	173.7	-87.3	-179	175.5	175.7	0	113.3	K716 E717	K716-K719 PolarHBondContact O-N 3.26Å; E717-K719 PolarHBondContact O-N 2.74Å
720	C	36.2	Very low	39.8	Very low	93 Å²	93	130 Å²	130	63%	0.628	64%	0.644	S	S	*	*	H	α-helix	trans	-70.5	-48.5	178.6	-166.1	0	0	0	0	111.2	E717 K722 R723	E717-C720 PolarHBondContact O-N 3.35Å; C720-K722 VanDerWaalsContact C-N 3.3Å; C720-K722 PolarHBondContact O-N 2.89Å; C720-R723 PolarHBondContact O-N 3.27Å
721	L	36.4	Very low	38.1	Very low	151 Å²	151	137.4 Å²	137.4	79%	0.791	68%	0.677	S	S	*	*	H	α-helix	trans	-65	-24.7	-175.5	-75.6	159.9	0	0	0	114.8	E717	E717-L721 PolarHBondContact O-N 2.7Å
722	K	35.8	Very low	36.7	Very low	177 Å²	177	138 Å²	138	77%	0.77	70%	0.695	S	S	*	*	H	α-helix	trans	-87.4	-14.6	178	-80.7	-178	176.6	174.4	0	115.1	C720	C720-K722 VanDerWaalsContact C-N 3.3Å; C720-K722 PolarHBondContact O-N 2.89Å
723	R	35.5	Very low	35.4	Very low	221 Å²	221	140.7 Å²	140.7	83%	0.834	71%	0.706	S	S	*	*	H	α-helix	trans	-86.7	-11.9	-178	-82.2	178.4	70.6	127	-7	114.9	C720 K725	C720-R723 PolarHBondContact O-N 3.27Å; R723-K725 VanDerWaalsContact C-N 3.3Å; R723-K725 PolarHBondContact O-N 3.12Å
724	K	33	Very low	34.4	Very low	206 Å²	206	146.3 Å²	146.3	90%	0.896	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	8	-176.8	-121.1	168.1	-175.5	169.7	0	115.7
725	K	32.6	Very low	33.6	Very low	192 Å²	192	152.6 Å²	152.6	84%	0.835	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.1	43.5	-178.8	-156.2	175.1	-178.6	170.8	0	115.5	R723	R723-K725 VanDerWaalsContact C-N 3.3Å; R723-K725 PolarHBondContact O-N 3.12Å
726	R	28.8	Very low	32.9	Very low	245 Å²	245	155.8 Å²	155.8	93%	0.925	76%	0.762	S	S	*	*			trans	-170.6	134.5	149.7	-110.4	161.7	171.9	173.6	-4.9	110.9
727	S	27.7	Very low	32.3	Very low	99 Å²	99	159.6 Å²	159.6	69%	0.692	77%	0.772	S	S	*	*			trans	-99.6	147.9	-178.1	52.4	0	0	0	0	112
728	N	27.5	Very low	31.8	Very low	147 Å²	147	159.9 Å²	159.9	79%	0.786	78%	0.777	S	S	*	*			trans	71.4	137.7	173.3	-47.1	4.7	0	0	0	113.2
729	D	29.5	Very low	31.4	Very low	141 Å²	141	160.9 Å²	160.9	75%	0.754	79%	0.788	S	S	*	*			cis	-156.1	166.4	16.7	-141.6	-22.6	0	0	0	112.9
730	V	32.8	Very low	31	Very low	114 Å²	114	157.9 Å²	157.9	69%	0.691	79%	0.788	S	S	*	*			trans	56.4	102.2	161.8	-167.6	0	0	0	0	121.7
731	E	29.9	Very low	30.6	Very low	187 Å²	187	158.5 Å²	158.5	87%	0.874	79%	0.793	S	S	*	*				44.8	119.2	119.4	-149.8	166.3	-127.5	0	0	123.7
732	S	31.9	Very low	30.3	Very low	119 Å²	119	159.9 Å²	159.9	83%	0.832	80%	0.796	S	S	*	*				180	147.1	123.9	-171.3	0	0	0	0	112.1
733	N	28.9	Very low	29.8	Very low	147 Å²	147	160.1 Å²	160.1	79%	0.786	80%	0.8	S	S	*	*			trans	-75.8	156.7	-179.3	-78	-26.1	0	0	0	114.3
734	E	30.7	Very low	29.5	Very low	177 Å²	177	156.5 Å²	156.5	83%	0.827	80%	0.796	S	S	*	*				-178.1	139.5	100.4	-96.2	175.9	-170	0	0	114.8
735	E	30.5	Very low	29.1	Very low	166 Å²	166	155.6 Å²	155.6	78%	0.776	80%	0.795	S	S	*	*			trans	46.7	110.4	156.6	-54.9	-168.5	156.6	0	0	120.8
736	I	29.8	Very low	29	Very low	147 Å²	147	153.6 Å²	153.6	75%	0.754	79%	0.794	S	S	*	*				66.2	105.8	73	-64.6	174	0	0	0	113.3
737	W	29.5	Very low	29.1	Very low	252 Å²	252	149.2 Å²	149.2	96%	0.955	78%	0.784	S	S	*	*				-145.9	109.7	127.7	-104.8	81	0	0	0	107.1
738	D	26.6	Very low	29.4	Very low	122 Å²	122	153.4 Å²	153.4	65%	0.652	79%	0.793	S	S	*	*			trans	-81.4	134.8	-179	178.4	12.6	0	0	0	110.6	S740	D738-S740 PolarHBondContact OD1-N 3.34Å
739	S	30	Very low	29.7	Very low	111 Å²	111	154.7 Å²	154.7	78%	0.776	79%	0.794	S	S	*	*			trans	-156.9	66.7	160.4	-74.8	0	0	0	0	107.9	S741	S739-S741 PolarHBondContact O-N 3.07Å
740	S	27.7	Very low	29.9	Very low	101 Å²	101	154.9 Å²	154.9	71%	0.706	79%	0.79	S	S	*	*			trans	15.9	89	154.2	-41.1	0	0	0	0	115.9	D738	D738-S740 PolarHBondContact OD1-N 3.34Å
741	S	27.5	Very low	30.1	Very low	107 Å²	107	157 Å²	157	75%	0.748	79%	0.793	S	S	*	*			trans	-97.2	110.1	148.7	53.1	0	0	0	0	106.9	S739	S739-S741 PolarHBondContact O-N 3.07Å
742	E	30.5	Very low	30.3	Very low	180 Å²	180	155.2 Å²	155.2	84%	0.841	78%	0.784	S	S	*	*			trans	-63.3	144.5	164.8	-70.2	178.5	144.6	0	0	108.7	D744	E742-D744 PolarHBondContact O-N 3.18Å
743	E	26.1	Very low	30.3	Very low	182 Å²	182	154.7 Å²	154.7	85%	0.85	77%	0.77	S	S	*	*			trans	-87.8	96.7	-168.9	-63.5	172.4	151.4	0	0	110.3
744	D	27.9	Very low	31	Very low	144 Å²	144	150.4 Å²	150.4	77%	0.77	75%	0.749	S	S	*	*			trans	-99.4	56.8	167.5	-69.7	-41.2	0	0	0	110.6	E742 D746	E742-D744 PolarHBondContact O-N 3.18Å; D744-D746 PolarHBondContact O-N 2.92Å
745	E	26	Very low	31.4	Very low	187 Å²	187	145.6 Å²	145.6	87%	0.874	73%	0.727	S	S	*	*			trans	-90.3	65.1	167.3	-74.2	-168.3	172.3	0	0	110.6
746	D	28.4	Very low	31.6	Very low	151 Å²	151	142.3 Å²	142.3	81%	0.807	71%	0.714	S	S	*	*			trans	-155.5	5.1	173.3	-102.3	-27.9	0	0	0	116.1	D744	D744-D746 PolarHBondContact O-N 2.92Å
747	E	31.5	Very low	31.9	Very low	153 Å²	153	141.8 Å²	141.8	72%	0.715	71%	0.706	S	S	*	*			trans	-88.1	-16.5	-174.7	-69.8	-160.1	143.4	0	0	116.4	E749	E747-E749 PolarHBondContact O-N 3.38Å
748	E	35	Very low	32.2	Very low	187 Å²	187	137.7 Å²	137.7	87%	0.874	69%	0.691	S	S	*	*	H	α-helix	trans	-74.1	-19.2	-172.8	-69.3	-164.2	158	0	0	115
749	E	33.7	Very low	32.5	Very low	174 Å²	174	137.3 Å²	137.3	81%	0.813	68%	0.683	S	S	*	*	H	α-helix	trans	-93.2	-18.7	176.7	-67.5	-163.1	171.8	0	0	114	E747	E747-E749 PolarHBondContact O-N 3.38Å
750	E	33.6	Very low	32.6	Very low	145 Å²	145	137.5 Å²	137.5	68%	0.678	68%	0.68	S	S	*	*	H	α-helix	trans	-76.8	-33.2	175.4	-74.1	-132	134.7	0	0	112.5	E752 M753 V754	E750-E752 PolarHBondContact O-N 2.88Å; E750-M753 PolarHBondContact O-N 3.39Å; E750-V754 WeakPolarHBondContact O-CB 3.17Å; E750-V754 VanDerWaalsContact O-CG2 3.3Å; E750-V754 WeakPolarHBondContact O-CG2 3.12Å; E750-V754 PolarHBondContact O-N 3.43Å
751	E	36.4	Very low	32.6	Very low	157 Å²	157	141.6 Å²	141.6	73%	0.734	69%	0.685	S	S	*	*	H	α-helix	trans	-61.5	-41.9	-178.4	-70.3	-148.9	133.4	0	0	112.8	M753 V754 E755	E751-M753 PolarHBondContact O-N 3.29Å; E751-V754 PolarHBondContact O-N 2.97Å; E751-E755 WeakPolarHBondContact O-CB 3.45Å; E751-E755 PolarHBondContact O-N 3.31Å
752	E	34.7	Very low	32.6	Very low	151 Å²	151	145.3 Å²	145.3	71%	0.706	68%	0.683	S	S	*	*	H	α-helix	trans	-68.6	-35.2	-180	-163	171.3	-151.1	0	0	111.9	E750 E755 L756	E750-E752 PolarHBondContact O-N 2.88Å; E752-E755 PolarHBondContact O-N 3.16Å; E752-L756 PolarHBondContact O-N 3.3Å
753	M	32.5	Very low	32.3	Very low	107 Å²	107	144.9 Å²	144.9	53%	0.527	68%	0.68	S	S	.	*	H	α-helix	trans	-74.3	-31.4	174.7	-91.9	-72.8	-78.4	0	0	113.5	E750 E751 K757	E750-M753 PolarHBondContact O-N 3.39Å; E751-M753 PolarHBondContact O-N 3.29Å; M753-K757 WeakPolarHBondContact O-CG 3.48Å; M753-K757 PolarHBondContact O-N 3.02Å
754	V	43.3	Very low	32.3	Very low	58 Å²	58	141.4 Å²	141.4	35%	0.352	67%	0.673	S	S	.	*	H	α-helix	trans	-69.9	-38.7	170.6	169.2	0	0	0	0	110.6	E750 E751 K757 R758	E750-V754 WeakPolarHBondContact O-CB 3.17Å; E750-V754 VanDerWaalsContact O-CG2 3.3Å; E750-V754 WeakPolarHBondContact O-CG2 3.12Å; E750-V754 PolarHBondContact O-N 3.43Å; E751-V754 PolarHBondContact O-N 2.97Å; V754-K757 PolarHBondContact O-N 3.33Å; V754-R758 WeakPolarHBondContact O-CB 3.48Å; V754-R758 WeakPolarHBondContact O-CG 3.34Å; V754-R758 PolarHBondContact O-N 3.31Å
755	E	37.8	Very low	32.3	Very low	75 Å²	75	139.5 Å²	139.5	35%	0.35	67%	0.669	S	S	.	*	H	α-helix	trans	-65.2	-37.6	176	-169.7	55.8	-148.9	0	0	112.1	E751 E752 R758 K759	E751-E755 WeakPolarHBondContact O-CB 3.45Å; E751-E755 PolarHBondContact O-N 3.31Å; E752-E755 PolarHBondContact O-N 3.16Å; E755-R758 PolarHBondContact O-N 3.34Å; E755-K759 WeakPolarHBondContact O-CG 3.43Å; E755-K759 PolarHBondContact O-N 3.25Å; E755-K759 WeakPolarHBondContact OE1-CE 3.45Å; E755-K759 IonicContact OE1-NZ 3.86Å
756	L	35.2	Very low	32.5	Very low	98 Å²	98	135.2 Å²	135.2	51%	0.513	65%	0.652	S	S	.	*	H	α-helix	trans	-69	-38.6	171.9	-89.4	151.8	0	0	0	113.4	E752 K759 T760	E752-L756 PolarHBondContact O-N 3.3Å; L756-K759 PolarHBondContact O-N 2.66Å; L756-T760 PolarHBondContact O-OG1 3.41Å
757	K	36.9	Very low	32.5	Very low	136 Å²	136	134.1 Å²	134.1	59%	0.591	65%	0.645	S	S	*	*	H	α-helix	trans	-68.9	-34	172.8	-76.3	171.5	-177.5	164.5	0	112.4	M753 V754 K759 T760	M753-K757 WeakPolarHBondContact O-CG 3.48Å; M753-K757 PolarHBondContact O-N 3.02Å; V754-K757 PolarHBondContact O-N 3.33Å; K757-K759 VanDerWaalsContact C-N 3.3Å; K757-K759 PolarHBondContact O-N 2.87Å; K757-T760 PolarHBondContact O-N 2.84Å; K757-T760 PolarHBondContact O-OG1 2.87Å
758	R	35.3	Very low	32.8	Very low	166 Å²	166	130.8 Å²	130.8	63%	0.626	63%	0.627	S	S	*	*	H	α-helix	trans	-64.3	-31.1	172.3	-81	175.4	165.7	150.8	-0.9	112.7	V754 E755 R762	V754-R758 WeakPolarHBondContact O-CB 3.48Å; V754-R758 WeakPolarHBondContact O-CG 3.34Å; V754-R758 PolarHBondContact O-N 3.31Å; E755-R758 PolarHBondContact O-N 3.34Å; R758-R762 WeakPolarHBondContact O-CG 3.37Å
759	K	32.8	Very low	32.5	Very low	113 Å²	113	126.4 Å²	126.4	49%	0.491	61%	0.609	S	S	.	*	H	α-helix	trans	-72	-23.3	175.9	-73.9	162.6	-174.2	164.3	0	113.8	E755 L756 K757	E755-K759 WeakPolarHBondContact O-CG 3.43Å; E755-K759 PolarHBondContact O-N 3.25Å; E755-K759 WeakPolarHBondContact OE1-CE 3.45Å; E755-K759 IonicContact OE1-NZ 3.86Å; L756-K759 PolarHBondContact O-N 2.66Å; K757-K759 VanDerWaalsContact C-N 3.3Å; K757-K759 PolarHBondContact O-N 2.87Å
760	T	32.8	Very low	32.2	Very low	116 Å²	116	127.5 Å²	127.5	71%	0.712	61%	0.614	S	S	*	*	H	α-helix	trans	-99.3	-3	-176.1	40.6	0	0	0	0	115.8	L756 K757	L756-T760 PolarHBondContact O-OG1 3.41Å; K757-T760 PolarHBondContact O-N 2.84Å; K757-T760 PolarHBondContact O-OG1 2.87Å
761	K	27.9	Very low	32	Very low	186 Å²	186	125 Å²	125	81%	0.809	60%	0.603	S	S	*	*	S	Bend	trans	-130.5	49.5	168	-78.6	-173.2	176.7	176.8	0	112.6	H763	K761-H763 VanDerWaalsContact C-N 3.31Å; K761-H763 PolarHBondContact O-N 3.25Å
762	R	25.6	Very low	31.6	Very low	186 Å²	186	120.7 Å²	120.7	70%	0.702	58%	0.582	S	S	*	*			trans	-73.8	84.8	169.1	-67.7	-171.4	170.1	-164.1	-4.7	110.7	R758	R758-R762 WeakPolarHBondContact O-CG 3.37Å
763	H	25.8	Very low	31.5	Very low	171 Å²	171	120 Å²	120	79%	0.792	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-55.8	145.6	137.3	-87.8	-82.7	0	0	0	107.6	K761	K761-H763 VanDerWaalsContact C-N 3.31Å; K761-H763 PolarHBondContact O-N 3.25Å
764	P	26.4	Very low	31.8	Very low	109 Å²	109	117 Å²	117	71%	0.708	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-55.1	139.3	177	24.4	-33.5	0	0	0	109.2	N766	P764-N766 PolarHBondContact O-N 2.81Å
765	P	26.5	Very low	31.3	Very low	103 Å²	103	116.1 Å²	116.1	67%	0.669	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-56.6	136	178.6	24.8	-33.4	0	0	0	108.8	L767	P765-L767 HydrophobicContact CG-CD1 4.11Å; P765-L767 PolarHBondContact O-N 3.29Å
766	N	29.8	Very low	31.1	Very low	97 Å²	97	119 Å²	119	52%	0.519	58%	0.583	S	S	.	*			trans	-73	83.2	178	-149.3	24.7	0	0	0	107.7	R262 P764 Y768 D769	R262-N766 PolarHBondContact NH1-ND2 2.92Å; R262-N766 PolarHBondContact NH2-OD1 2.69Å; P764-N766 PolarHBondContact O-N 2.81Å; N766-Y768 PolarHBondContact O-N 2.92Å; N766-D769 PolarHBondContact ND2-OD2 3.15Å; N766-D769 PolarHBondContact O-N 3.13Å
767	L	29.9	Very low	31.4	Very low	128 Å²	128	118.1 Å²	118.1	67%	0.67	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	15.9	-160.2	-150.9	80	0	0	0	115.6	P765	P765-L767 HydrophobicContact CG-CD1 4.11Å; P765-L767 PolarHBondContact O-N 3.29Å
768	Y	36.8	Very low	31.7	Very low	84 Å²	84	112 Å²	112	33%	0.329	55%	0.55	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.2	-3.1	-160.5	-57.8	-62.5	0	0	0	114.6	L303 N766	L303-Y768 HydrophobicContact CD1-CD1 4.32Å; L303-Y768 HydrophobicContact CD1-CE1 3.79Å; L303-Y768 HydrophobicContact CD2-CD1 3.7Å; L303-Y768 HydrophobicContact CD2-CE1 3.48Å; L303-Y768 VanDerWaalsContact CD2-CE1 3.48Å; L303-Y768 HydrophobicContact CG-CE1 4.27Å; N766-Y768 PolarHBondContact O-N 2.92Å
769	D	28.7	Very low	31.7	Very low	95 Å²	95	106.2 Å²	106.2	51%	0.508	54%	0.537	S	S	.	.	S	Bend	trans	-94.9	-17.1	-173.1	-67.7	-24.4	0	0	0	114.3	R262 N766	R262-D769 IonicContact NH1-OD1 2.82Å; R262-D769 PolarHBondContact NH1-OD1 3.27Å; R262-D769 IonicContact NH1-OD2 2.8Å; N766-D769 PolarHBondContact ND2-OD2 3.15Å; N766-D769 PolarHBondContact O-N 3.13Å
770	E	27.1	Very low	32.3	Very low	196 Å²	196	104.4 Å²	104.4	92%	0.916	53%	0.53	S	S	*	.	S	Bend	trans	-107.9	-9.4	-174	-61	-143	155	0	0	117
771	E	29.3	Very low	32.9	Very low	93 Å²	93	100.3 Å²	100.3	44%	0.435	50%	0.504	S	S	.	.			trans	-120.7	61.7	-169.2	-89.2	-147.2	-144.5	0	0	116.2	R668	R668-E771 IonicContact CZ-OE2 2.74Å; R668-E771 IonicContact NH1-OE2 3.37Å; R668-E771 PolarHBondContact NH1-OE2 3.48Å; R668-E771 IonicContact NH2-OE2 3.96Å; R668-E771 PolarHBondContact NH2-OE2 2.91Å
772	F	28.7	Very low	33.6	Very low	67 Å²	67	93.3 Å²	93.3	29%	0.294	48%	0.475	S	S	.	.			trans	-140.3	74.4	163.1	-78.3	-79.1	0	0	0	113	G299 T774 A775	G299-F772 WeakPolarHBondContact O-CZ 3Å; F772-T774 WeakPolarHBondContact CD1-OG1 3.37Å; F772-T774 PolarHBondContact O-N 2.74Å; F772-T774 VanDerWaalsContact O-N 3.07Å; F772-A775 WeakPolarHBondContact O-CB 2.97Å; F772-A775 PolarHBondContact O-N 3.29Å
773	N	32.9	Very low	34.4	Very low	137 Å²	137	91 Å²	91	73%	0.733	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-21.4	165.1	-87.9	-0.2	0	0	0	113	A775 E776 E777	N773-A775 PolarHBondContact O-N 2.94Å; N773-E776 PolarHBondContact O-N 3.32Å; N773-E777 PolarHBondContact O-N 3.31Å; N773-E777 VanDerWaalsContact O-N 3.16Å
774	T	38.3	Very low	35.3	Very low	44 Å²	44	86 Å²	86	27%	0.27	45%	0.449	S	S	.	.	H	α-helix	trans	-62	-26.6	173.4	55.4	0	0	0	0	112.6	F772 F778	F772-T774 WeakPolarHBondContact CD1-OG1 3.37Å; F772-T774 PolarHBondContact O-N 2.74Å; F772-T774 VanDerWaalsContact O-N 3.07Å; T774-F778 VanDerWaalsContact O-CB 3.3Å; T774-F778 WeakPolarHBondContact O-CB 3.45Å; T774-F778 PolarHBondContact O-N 3.03Å
775	A	32.6	Very low	36	Very low	39 Å²	39	81.3 Å²	81.3	32%	0.322	42%	0.42	S	S	.	.	H	α-helix	trans	-72.2	-31.4	177.6	0	0	0	0	0	112.6	T295 F772 N773 F778 A779	T295-A775 HydrophobicContact CG2-CB 4.15Å; F772-A775 WeakPolarHBondContact O-CB 2.97Å; F772-A775 PolarHBondContact O-N 3.29Å; N773-A775 PolarHBondContact O-N 2.94Å; A775-F778 WeakPolarHBondContact O-CB 3.49Å; A775-A779 WeakPolarHBondContact O-CB 3.36Å; A775-A779 PolarHBondContact O-N 3.44Å
776	E	34.8	Very low	36.7	Very low	135 Å²	135	82.5 Å²	82.5	63%	0.631	42%	0.417	S	S	*	.	H	α-helix	trans	-75.6	-44.1	174.8	-161.1	160.9	-144.9	0	0	110	N773 F778 A779 E780	N773-E776 PolarHBondContact O-N 3.32Å; E776-F778 PolarHBondContact O-N 2.89Å; E776-A779 PolarHBondContact O-N 2.89Å; E776-E780 WeakPolarHBondContact O-CG 3.36Å; E776-E780 PolarHBondContact O-N 3.33Å
777	E	39.8	Very low	37.3	Very low	80 Å²	80	82 Å²	82	37%	0.374	41%	0.414	S	S	.	.	H	α-helix	trans	-59.7	-32.4	170.5	-153.8	171.7	-166	0	0	111.5	R669 N773 L781	R669-E777 IonicContact CZ-OE1 3.21Å; R669-E777 VanDerWaalsContact CZ-OE1 3.29Å; R669-E777 IonicContact NH1-OE1 2.77Å; R669-E777 PolarHBondContact NH1-OE1 3.07Å; R669-E777 IonicContact NH1-OE2 3.63Å; R669-E777 PolarHBondContact NH1-OE2 3.35Å; R669-E777 IonicContact NH2-OE1 3.8Å; R669-E777 PolarHBondContact NH2-OE1 3.11Å; N773-E777 PolarHBondContact O-N 3.31Å; N773-E777 VanDerWaalsContact O-N 3.16Å; E777-L781 WeakPolarHBondContact O-CB 3.47Å; E777-L781 WeakPolarHBondContact O-CD1 3.47Å; E777-L781 WeakPolarHBondContact O-CG 3.39Å; E777-L781 PolarHBondContact O-N 2.98Å
778	F	43.4	Very low	38	Very low	8 Å²	8	81.7 Å²	81.7	4%	0.035	41%	0.409	C	S	.	.	H	α-helix	trans	-71.8	-38.5	171.6	-122.3	-84.6	0	0	0	114.1	T295 F334 Y335 C338 T774 A775 E776 L781 L782	T295-F778 HydrophobicContact CG2-CB 4.04Å; T295-F778 HydrophobicContact CG2-CD1 4.44Å; T295-F778 HydrophobicContact CG2-CD2 4.47Å; T295-F778 HydrophobicContact CG2-CG 4.1Å; F334-F778 HydrophobicContact CD1-CE1 4.22Å; F334-F778 HydrophobicContact CE1-CD1 4.34Å; F334-F778 AromaticContact CE1-CE1 3.55Å; F334-F778 HydrophobicContact CE1-CE1 3.55Å; F334-F778 HydrophobicContact CE1-CZ 4.16Å; F334-F778 HydrophobicContact CZ-CE1 4.41Å; Y335-F778 AromaticContact CD1-CE1 3.5Å; Y335-F778 HydrophobicContact CD1-CE1 3.5Å; Y335-F778 VanDerWaalsContact CD1-CE1 3.5Å; Y335-F778 AromaticContact CD1-CZ 3.67Å; Y335-F778 HydrophobicContact CD1-CZ 3.67Å; Y335-F778 AromaticContact CE1-CD1 3.87Å; Y335-F778 HydrophobicContact CE1-CD1 3.87Å; Y335-F778 AromaticContact CE1-CE1 3.16Å; Y335-F778 HydrophobicContact CE1-CE1 3.16Å; Y335-F778 AromaticContact CE1-CZ 3.83Å; Y335-F778 HydrophobicContact CE1-CZ 3.83Å; C338-F778 HydrophobicContact CB-CE2 3.56Å; C338-F778 HydrophobicContact CB-CZ 3.45Å; C338-F778 VanDerWaalsContact CB-CZ 3.45Å; C338-F778 WeakPolarHBondContact SG-CZ 3.46Å; T774-F778 VanDerWaalsContact O-CB 3.3Å; T774-F778 WeakPolarHBondContact O-CB 3.45Å; T774-F778 PolarHBondContact O-N 3.03Å; A775-F778 WeakPolarHBondContact O-CB 3.49Å; E776-F778 PolarHBondContact O-N 2.89Å; F778-L781 WeakPolarHBondContact O-CB 3.12Å; F778-L781 PolarHBondContact O-N 2.84Å; F778-L782 WeakPolarHBondContact O-CG 3.5Å; F778-L782 PolarHBondContact O-N 3.4Å; F778-L782 VanDerWaalsContact O-N 3.13Å
779	A	36.3	Very low	38.3	Very low	44 Å²	44	81 Å²	81	36%	0.364	41%	0.409	S	S	.	.	H	α-helix	trans	-69.1	-44.4	179	0	0	0	0	0	110.4	A775 E776 L781 L782 E783	A775-A779 WeakPolarHBondContact O-CB 3.36Å; A775-A779 PolarHBondContact O-N 3.44Å; E776-A779 PolarHBondContact O-N 2.89Å; A779-L781 VanDerWaalsContact C-N 3.31Å; A779-L781 PolarHBondContact O-N 3.14Å; A779-L782 WeakPolarHBondContact O-CA 3.39Å; A779-L782 WeakPolarHBondContact O-CB 3.34Å; A779-L782 PolarHBondContact O-N 3.41Å; A779-E783 PolarHBondContact O-N 3.22Å
780	E	44.4	Very low	39.2	Very low	74 Å²	74	84.5 Å²	84.5	35%	0.346	42%	0.415	S	S	.	.	H	α-helix	trans	-59.1	-40.9	172.3	-67.2	-165.5	143.3	0	0	112	R474 E776 L782 E783 E784	R474-E780 IonicContact CZ-OE1 2.89Å; R474-E780 IonicContact CZ-OE2 3.34Å; R474-E780 VanDerWaalsContact CZ-OE2 3.23Å; R474-E780 IonicContact NE-OE2 2.69Å; R474-E780 PolarHBondContact NE-OE2 2.99Å; R474-E780 IonicContact NH2-OE1 2.87Å; R474-E780 PolarHBondContact NH2-OE1 3.11Å; R474-E780 IonicContact NH2-OE2 2.69Å; R474-E780 PolarHBondContact NH2-OE2 3.05Å; E776-E780 WeakPolarHBondContact O-CG 3.36Å; E776-E780 PolarHBondContact O-N 3.33Å; E780-L782 PolarHBondContact O-N 3.17Å; E780-E783 PolarHBondContact O-N 3.18Å; E780-E784 PolarHBondContact O-N 3.06Å
781	L	45.4	Very low	40.1	Very low	30 Å²	30	78.8 Å²	78.8	16%	0.157	40%	0.395	C	S	.	.	H	α-helix	trans	-62.8	-24.8	173.5	-80.9	170.9	0	0	0	113.8	R381 E777 F778 A779 A785	R381-L781 VanDerWaalsContact CZ-CD2 3.42Å; E777-L781 WeakPolarHBondContact O-CB 3.47Å; E777-L781 WeakPolarHBondContact O-CD1 3.47Å; E777-L781 WeakPolarHBondContact O-CG 3.39Å; E777-L781 PolarHBondContact O-N 2.98Å; F778-L781 WeakPolarHBondContact O-CB 3.12Å; F778-L781 PolarHBondContact O-N 2.84Å; A779-L781 VanDerWaalsContact C-N 3.31Å; A779-L781 PolarHBondContact O-N 3.14Å; L781-A785 WeakPolarHBondContact O-CB 3.2Å
782	L	42.8	Very low	41	Very low	39 Å²	39	77.6 Å²	77.6	20%	0.204	39%	0.391	C	S	.	.	H	α-helix	trans	-82.6	-44.2	173.5	-73.2	163.6	0	0	0	111	P291 F778 A779 E780 A785 E786	P291-L782 HydrophobicContact CB-CD1 4.03Å; F778-L782 WeakPolarHBondContact O-CG 3.5Å; F778-L782 PolarHBondContact O-N 3.4Å; F778-L782 VanDerWaalsContact O-N 3.13Å; A779-L782 WeakPolarHBondContact O-CA 3.39Å; A779-L782 WeakPolarHBondContact O-CB 3.34Å; A779-L782 PolarHBondContact O-N 3.41Å; E780-L782 PolarHBondContact O-N 3.17Å; L782-A785 CarbonylContact O-C 3.56Å; L782-A785 PolarHBondContact O-N 2.81Å; L782-E786 PolarHBondContact O-N 3.48Å; L782-E786 VanDerWaalsContact O-N 3.09Å
783	E	43.1	Very low	42.2	Very low	138 Å²	138	80 Å²	80	65%	0.645	40%	0.402	S	S	*	.	H	α-helix	trans	-65.8	-49.4	-179.4	-71.8	-171.5	168.2	0	0	113.1	A779 E780 A785 E786 D787	A779-E783 PolarHBondContact O-N 3.22Å; E780-E783 PolarHBondContact O-N 3.18Å; E783-A785 PolarHBondContact O-N 2.87Å; E783-E786 PolarHBondContact O-N 3.33Å; E783-D787 PolarHBondContact O-N 2.82Å
784	E	45	Very low	43.2	Very low	65 Å²	65	78.5 Å²	78.5	30%	0.304	39%	0.39	S	S	.	.	H	α-helix	trans	-51.5	-35.7	174.2	-77.5	-169	152.7	0	0	111.2	R381 R474 E780 D787 E788	R381-E784 IonicContact NH1-OE2 2.87Å; R474-E784 WeakPolarHBondContact CD-OE1 3.35Å; R474-E784 IonicContact CZ-OE1 3.61Å; R474-E784 IonicContact NE-OE1 2.66Å; R474-E784 IonicContact NH1-OE1 3.56Å; R474-E784 PolarHBondContact NH1-OE1 3.48Å; E780-E784 PolarHBondContact O-N 3.06Å; E784-D787 PolarHBondContact O-N 3.47Å; E784-E788 PolarHBondContact O-N 3.36Å
785	A	41.5	Very low	44.2	Very low	12 Å²	12	84.9 Å²	84.9	10%	0.099	41%	0.409	C	S	.	.	H	α-helix	trans	-92.3	-2.7	-174.3	0	0	0	0	0	113.8	R378 L781 L782 E783	R378-A785 PolarHBondContact NH2-O 3.19Å; L781-A785 WeakPolarHBondContact O-CB 3.2Å; L782-A785 CarbonylContact O-C 3.56Å; L782-A785 PolarHBondContact O-N 2.81Å; E783-A785 PolarHBondContact O-N 2.87Å
786	E	39.9	Very low	45.9	Very low	128 Å²	128	89.4 Å²	89.4	60%	0.598	42%	0.422	S	S	*	.	H	α-helix	trans	-85.5	-37.4	155.6	-63.7	-149.8	155	0	0	111.2	L782 E783 Q789 R790	L782-E786 PolarHBondContact O-N 3.48Å; L782-E786 VanDerWaalsContact O-N 3.09Å; E783-E786 PolarHBondContact O-N 3.33Å; E786-Q789 WeakPolarHBondContact O-CA 3.13Å; E786-Q789 WeakPolarHBondContact O-CB 3.26Å; E786-Q789 PolarHBondContact O-N 3.48Å; E786-R790 PolarHBondContact O-N 2.95Å; E786-R790 VanDerWaalsContact O-N 3.15Å
787	D	43	Very low	47.6	Very low	85 Å²	85	90.7 Å²	90.7	46%	0.455	43%	0.425	S	S	.	.	H	α-helix	trans	-68.9	-36.2	177.8	-84.4	-5.8	0	0	0	112.9	E783 E784 Q789 R790 P791	E783-D787 PolarHBondContact O-N 2.82Å; E784-D787 PolarHBondContact O-N 3.47Å; D787-Q789 PolarHBondContact O-N 3.01Å; D787-R790 WeakPolarHBondContact O-CB 3.36Å; D787-R790 PolarHBondContact O-N 2.79Å; D787-R790 VanDerWaalsContact O-N 3.08Å; D787-R790 VanDerWaalsContact OD1-CD 3.22Å; D787-R790 WeakPolarHBondContact OD1-CD 3.39Å; D787-R790 IonicContact OD1-CZ 3.79Å; D787-R790 IonicContact OD1-NE 3.02Å; D787-R790 PolarHBondContact OD1-NE 3.09Å; D787-R790 IonicContact OD1-NH2 3.8Å; D787-P791 WeakPolarHBondContact O-CD 3.41Å
788	E	43.7	Very low	49	Very low	122 Å²	122	92.9 Å²	92.9	57%	0.57	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-24.1	166.9	-78.8	-163.5	165.2	0	0	112.9	E784 P791	E784-E788 PolarHBondContact O-N 3.36Å; E788-P791 WeakPolarHBondContact O-CD 3.48Å; E788-P791 WeakPolarHBondContact O-CG 3.39Å
789	Q	44.7	Very low	50.3	Low	71 Å²	71	96.6 Å²	96.6	33%	0.332	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-20.7	174.9	-62.3	-175.3	12.4	0	0	113.6	E786 D787 D792 K793	E786-Q789 WeakPolarHBondContact O-CA 3.13Å; E786-Q789 WeakPolarHBondContact O-CB 3.26Å; E786-Q789 PolarHBondContact O-N 3.48Å; D787-Q789 PolarHBondContact O-N 3.01Å; Q789-D792 PolarHBondContact O-N 2.77Å; Q789-K793 HydrophobicContact CB-CD 4.39Å; Q789-K793 WeakPolarHBondContact O-CB 3.5Å; Q789-K793 WeakPolarHBondContact O-CG 3.47Å; Q789-K793 PolarHBondContact O-N 2.97Å; Q789-K793 VanDerWaalsContact OE1-CE 3.31Å
790	R	45.6	Very low	52	Low	168 Å²	168	102.2 Å²	102.2	63%	0.634	47%	0.47	S	S	*	.	H	α-helix	trans	-55.1	-50.8	176.3	-73	-172.4	-173.5	-131.2	1.6	113.5	E786 D787 D792 K793 E794	E786-R790 PolarHBondContact O-N 2.95Å; E786-R790 VanDerWaalsContact O-N 3.15Å; D787-R790 WeakPolarHBondContact O-CB 3.36Å; D787-R790 PolarHBondContact O-N 2.79Å; D787-R790 VanDerWaalsContact O-N 3.08Å; D787-R790 VanDerWaalsContact OD1-CD 3.22Å; D787-R790 WeakPolarHBondContact OD1-CD 3.39Å; D787-R790 IonicContact OD1-CZ 3.79Å; D787-R790 IonicContact OD1-NE 3.02Å; D787-R790 PolarHBondContact OD1-NE 3.09Å; D787-R790 IonicContact OD1-NH2 3.8Å; R790-D792 VanDerWaalsContact C-N 3.25Å; R790-D792 PolarHBondContact O-N 3.18Å; R790-K793 PolarHBondContact O-N 3.44Å; R790-E794 WeakPolarHBondContact O-CB 3.42Å; R790-E794 WeakPolarHBondContact O-CG 3.48Å; R790-E794 PolarHBondContact O-N 3.16Å
791	P	46.6	Very low	53.3	Low	75 Å²	75	104.5 Å²	104.5	49%	0.487	48%	0.482	S	S	.	.	H	α-helix	trans	-62.8	-31.8	-177.3	24	-34	0	0	0	112.6	D787 E788 R795	D787-P791 WeakPolarHBondContact O-CD 3.41Å; E788-P791 WeakPolarHBondContact O-CD 3.48Å; E788-P791 WeakPolarHBondContact O-CG 3.39Å; P791-R795 WeakPolarHBondContact O-CB 3.42Å; P791-R795 WeakPolarHBondContact O-CG 3.11Å; P791-R795 PolarHBondContact O-N 3.37Å
792	D	48.9	Very low	54.5	Low	69 Å²	69	112 Å²	112	37%	0.369	51%	0.508	S	S	.	.	H	α-helix	trans	-80.5	-35.9	179.7	-155.2	52.8	0	0	0	112.4	Q789 R790 E794 R795 K796	Q789-D792 PolarHBondContact O-N 2.77Å; R790-D792 VanDerWaalsContact C-N 3.25Å; R790-D792 PolarHBondContact O-N 3.18Å; D792-E794 VanDerWaalsContact C-N 3.34Å; D792-R795 PolarHBondContact O-N 3.36Å; D792-K796 WeakPolarHBondContact O-CB 3.46Å; D792-K796 WeakPolarHBondContact O-CG 3.43Å; D792-K796 PolarHBondContact O-N 3.43Å; D792-K796 WeakPolarHBondContact OD2-CE 3.29Å; D792-K796 IonicContact OD2-NZ 2.84Å; D792-K796 PolarHBondContact OD2-NZ 3.16Å
793	K	52.7	Low	56.1	Low	117 Å²	117	117.7 Å²	117.7	51%	0.509	53%	0.532	S	S	.	.	H	α-helix	trans	-63.8	-38.4	167.9	-72	170.8	-173.9	163.6	0	111.3	Q789 R790 K797	Q789-K793 HydrophobicContact CB-CD 4.39Å; Q789-K793 WeakPolarHBondContact O-CB 3.5Å; Q789-K793 WeakPolarHBondContact O-CG 3.47Å; Q789-K793 PolarHBondContact O-N 2.97Å; Q789-K793 VanDerWaalsContact OE1-CE 3.31Å; R790-K793 PolarHBondContact O-N 3.44Å; K793-K797 WeakPolarHBondContact O-CB 3.45Å; K793-K797 PolarHBondContact O-N 3.34Å
794	E	55.8	Low	57.5	Low	106 Å²	106	120.4 Å²	120.4	50%	0.495	54%	0.536	S	S	.	.	H	α-helix	trans	-66.7	-46.1	173.3	-82.3	-135.9	159.2	0	0	113.1	R790 D792 K796 K797 K798	R790-E794 WeakPolarHBondContact O-CB 3.42Å; R790-E794 WeakPolarHBondContact O-CG 3.48Å; R790-E794 PolarHBondContact O-N 3.16Å; D792-E794 VanDerWaalsContact C-N 3.34Å; E794-K796 VanDerWaalsContact C-N 3.34Å; E794-K796 PolarHBondContact O-N 2.9Å; E794-K797 WeakPolarHBondContact O-CB 3.45Å; E794-K797 PolarHBondContact O-N 2.82Å; E794-K798 WeakPolarHBondContact O-CB 3.24Å; E794-K798 WeakPolarHBondContact O-CG 3.24Å; E794-K798 PolarHBondContact O-N 2.85Å; E794-K798 IonicContact OE2-NZ 3.31Å; E794-K798 PolarHBondContact OE2-NZ 2.63Å
795	R	59.1	Low	58.7	Low	177 Å²	177	124.5 Å²	124.5	67%	0.668	55%	0.553	S	S	*	*	H	α-helix	trans	-57.2	-48.4	173.3	-80.7	178.2	104.5	-173.2	7.3	110.5	P791 D792 K797 K798 D799	P791-R795 WeakPolarHBondContact O-CB 3.42Å; P791-R795 WeakPolarHBondContact O-CG 3.11Å; P791-R795 PolarHBondContact O-N 3.37Å; D792-R795 PolarHBondContact O-N 3.36Å; R795-K797 VanDerWaalsContact C-N 3.32Å; R795-K797 PolarHBondContact O-N 3.36Å; R795-K798 PolarHBondContact O-N 3.38Å; R795-K798 VanDerWaalsContact O-N 3.14Å; R795-D799 PolarHBondContact O-N 2.82Å
796	K	68.2	Low	60	Low	134 Å²	134	127.3 Å²	127.3	58%	0.583	58%	0.576	S	S	*	*	H	α-helix	trans	-61.5	-35.1	176.6	-74.5	164.3	177	157.5	0	112.7	D792 E794 K800	D792-K796 WeakPolarHBondContact O-CB 3.46Å; D792-K796 WeakPolarHBondContact O-CG 3.43Å; D792-K796 PolarHBondContact O-N 3.43Å; D792-K796 WeakPolarHBondContact OD2-CE 3.29Å; D792-K796 IonicContact OD2-NZ 2.84Å; D792-K796 PolarHBondContact OD2-NZ 3.16Å; E794-K796 VanDerWaalsContact C-N 3.34Å; E794-K796 PolarHBondContact O-N 2.9Å; K796-K800 WeakPolarHBondContact O-CB 3.33Å; K796-K800 PolarHBondContact O-N 3.33Å
797	K	69.6	Low	61.5	Low	162 Å²	162	132.1 Å²	132.1	70%	0.704	59%	0.589	S	S	*	*	H	α-helix	trans	-65.9	-48.3	169.6	-92.9	-177	175.5	177.3	0	112.2	K793 E794 R795 D799 K800 M801	K793-K797 WeakPolarHBondContact O-CB 3.45Å; K793-K797 PolarHBondContact O-N 3.34Å; E794-K797 WeakPolarHBondContact O-CB 3.45Å; E794-K797 PolarHBondContact O-N 2.82Å; R795-K797 VanDerWaalsContact C-N 3.32Å; R795-K797 PolarHBondContact O-N 3.36Å; K797-D799 PolarHBondContact O-N 3.3Å; K797-K800 PolarHBondContact O-N 3.41Å; K797-M801 WeakPolarHBondContact O-CB 3.45Å; K797-M801 PolarHBondContact O-N 2.94Å
798	K	68.7	Low	62.5	Low	127 Å²	127	139.1 Å²	139.1	55%	0.552	61%	0.609	S	S	*	*	H	α-helix	trans	-62.7	-38.7	179.6	-78	166.6	174.3	151	0	111.5	E794 R795 M801 R802	E794-K798 WeakPolarHBondContact O-CB 3.24Å; E794-K798 WeakPolarHBondContact O-CG 3.24Å; E794-K798 PolarHBondContact O-N 2.85Å; E794-K798 IonicContact OE2-NZ 3.31Å; E794-K798 PolarHBondContact OE2-NZ 2.63Å; R795-K798 PolarHBondContact O-N 3.38Å; R795-K798 VanDerWaalsContact O-N 3.14Å; K798-M801 PolarHBondContact O-N 3.05Å; K798-R802 PolarHBondContact O-N 3.5Å
799	D	70.9	Confident	63.1	Low	86 Å²	86	146.7 Å²	146.7	46%	0.46	63%	0.632	S	S	.	*	H	α-helix	trans	-73.4	-38	174.5	-83.7	-12	0	0	0	113.4	R795 K797 M801 R802 K803	R795-D799 PolarHBondContact O-N 2.82Å; K797-D799 PolarHBondContact O-N 3.3Å; D799-M801 VanDerWaalsContact C-N 3.26Å; D799-M801 PolarHBondContact O-N 2.86Å; D799-R802 PolarHBondContact O-N 3.38Å; D799-K803 WeakPolarHBondContact O-CB 3.34Å; D799-K803 WeakPolarHBondContact O-CG 3.43Å; D799-K803 PolarHBondContact O-N 2.8Å
800	K	73	Confident	64	Low	161 Å²	161	150.5 Å²	150.5	70%	0.7	65%	0.647	S	S	*	*	H	α-helix	trans	-59.2	-39.4	167.4	-97.3	-177.6	173.1	176.5	0	111.2	K796 K797 R804	K796-K800 WeakPolarHBondContact O-CB 3.33Å; K796-K800 PolarHBondContact O-N 3.33Å; K797-K800 PolarHBondContact O-N 3.41Å; K800-R804 WeakPolarHBondContact O-CB 3.46Å; K800-R804 WeakPolarHBondContact O-CG 3.43Å; K800-R804 PolarHBondContact O-N 2.89Å
801	M	70.6	Confident	65	Low	122 Å²	122	149.5 Å²	149.5	60%	0.601	65%	0.648	S	S	*	*	H	α-helix	trans	-69.4	-41.4	177.6	-167.2	178.7	-66.7	0	0	112.1	K797 K798 D799 R804 K805	K797-M801 WeakPolarHBondContact O-CB 3.45Å; K797-M801 PolarHBondContact O-N 2.94Å; K798-M801 PolarHBondContact O-N 3.05Å; D799-M801 VanDerWaalsContact C-N 3.26Å; D799-M801 PolarHBondContact O-N 2.86Å; M801-R804 PolarHBondContact O-N 3.15Å; M801-K805 PolarHBondContact O-N 3.44Å
802	R	72.1	Confident	66	Low	187 Å²	187	153.7 Å²	153.7	71%	0.706	66%	0.657	S	S	*	*	H	α-helix	trans	-60.9	-48.3	172.2	-81.1	179.4	158.1	-169.5	-7.7	111.7	K798 D799 R804 K805 A806	K798-R802 PolarHBondContact O-N 3.5Å; D799-R802 PolarHBondContact O-N 3.38Å; R802-R804 VanDerWaalsContact C-N 3.32Å; R802-R804 PolarHBondContact O-N 3.3Å; R802-K805 PolarHBondContact O-N 3.38Å; R802-K805 VanDerWaalsContact O-N 3.15Å; R802-A806 WeakPolarHBondContact O-CB 3.42Å; R802-A806 PolarHBondContact O-N 2.93Å
803	K	75.8	Confident	67	Low	160 Å²	160	158.6 Å²	158.6	70%	0.696	67%	0.673	S	S	*	*	H	α-helix	trans	-62.6	-33.6	175.5	-73.5	-176.6	177.3	-178.2	0	112.9	D799 R807	D799-K803 WeakPolarHBondContact O-CB 3.34Å; D799-K803 WeakPolarHBondContact O-CG 3.43Å; D799-K803 PolarHBondContact O-N 2.8Å; K803-R807 PolarHBondContact O-N 3.2Å
804	R	71.8	Confident	67.9	Low	194 Å²	194	161.3 Å²	161.3	73%	0.732	68%	0.684	S	S	*	*	H	α-helix	trans	-71.6	-35.6	172	-74.1	179	95.2	171.8	7.5	112.9	K800 M801 R802 R807 R808	K800-R804 WeakPolarHBondContact O-CB 3.46Å; K800-R804 WeakPolarHBondContact O-CG 3.43Å; K800-R804 PolarHBondContact O-N 2.89Å; M801-R804 PolarHBondContact O-N 3.15Å; R802-R804 VanDerWaalsContact C-N 3.32Å; R802-R804 PolarHBondContact O-N 3.3Å; R804-R807 PolarHBondContact O-N 3.28Å; R804-R808 PolarHBondContact O-N 3.28Å
805	K	70.8	Confident	68.8	Low	152 Å²	152	164.9 Å²	164.9	66%	0.661	70%	0.696	S	S	*	*	H	α-helix	trans	-68.4	-38.6	172.1	-79.4	-170.6	174.3	-174.8	0	112	M801 R802 R807 R808 R809	M801-K805 PolarHBondContact O-N 3.44Å; R802-K805 PolarHBondContact O-N 3.38Å; R802-K805 VanDerWaalsContact O-N 3.15Å; K805-R807 VanDerWaalsContact C-N 3.26Å; K805-R807 PolarHBondContact O-N 3.23Å; K805-R808 PolarHBondContact O-N 3.17Å; K805-R809 PolarHBondContact O-N 2.82Å
806	A	69	Low	69.4	Low	71 Å²	71	164.1 Å²	164.1	59%	0.587	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-8.7	177	0	0	0	0	0	114.8	R802	R802-A806 WeakPolarHBondContact O-CB 3.42Å; R802-A806 PolarHBondContact O-N 2.93Å
807	R	71.6	Confident	69.5	Low	229 Å²	229	166.4 Å²	166.4	86%	0.864	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-0.4	168.5	-82.7	-173.5	168.4	-168.5	-3.6	113.5	K803 R804 K805	K803-R807 PolarHBondContact O-N 3.2Å; R804-R807 PolarHBondContact O-N 3.28Å; K805-R807 VanDerWaalsContact C-N 3.26Å; K805-R807 PolarHBondContact O-N 3.23Å
808	R	63.8	Low	69.5	Low	232 Å²	232	166.8 Å²	166.8	88%	0.875	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	-7	176.9	-83.3	-173.7	167.4	-168.8	-4.2	112.7	R804 K805	R804-R808 PolarHBondContact O-N 3.28Å; K805-R808 PolarHBondContact O-N 3.17Å
809	R	56.3	Low	69.6	Low	280 Å²	280	170.4 Å²	170.4	100%	1.057	72%	0.722	S	S	*	*			trans	-99.5	0	155.9	-68.1	-179.8	171.9	-173	-5.3	106.6	K805	K805-R809 PolarHBondContact O-N 2.82Å

Retrieved 809 of 809 residues in 357.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).