A0A096MRQ9_PAPAN Loading...

Sulfate transporter

AlphaFold DB , UniProt , Accession A0A096MRQ9, Species PAPAN (Papio anubis, Olive baboon), Gene SLC26A2, Length 739 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29	Very low	25.2	Very low	251 Å²	251	155.5 Å²	155.5	100%	1.236	82%	0.818	S	S	*	*				0	149.8	0	-67.7	169.7	71.7	0	0	107.7
2	S	27.9	Very low	25.2	Very low	116 Å²	116	151.7 Å²	151.7	81%	0.811	81%	0.814	S	S	*	*			trans	-119	141.5	-166.1	46.9	0	0	0	0	112.8
3	S	24.2	Very low	25.8	Very low	112 Å²	112	148.3 Å²	148.3	78%	0.783	81%	0.805	S	S	*	*			trans	-164.1	115.9	155.3	37.3	0	0	0	0	104.4
4	E	28.4	Very low	25.7	Very low	174 Å²	174	153 Å²	153	81%	0.813	81%	0.805	S	S	*	*				56	110.1	54.1	-68.6	-155.2	116.9	0	0	114.2
5	S	24.7	Very low	25.5	Very low	127 Å²	127	151.8 Å²	151.8	89%	0.888	80%	0.8	S	S	*	*			trans	-142.2	139.5	146.3	45.9	0	0	0	0	107.4
6	K	25.6	Very low	25.4	Very low	164 Å²	164	148.9 Å²	148.9	71%	0.713	80%	0.796	S	S	*	*			trans	-105.9	156	178.8	-64.7	178.8	178	-178.7	0	109.9
7	E	24.9	Very low	25.3	Very low	200 Å²	200	146.4 Å²	146.4	94%	0.935	79%	0.787	S	S	*	*			trans	-148.5	157.3	141.2	-117.4	163.8	-164.2	0	0	109.2
8	Q	22.3	Very low	25.3	Very low	134 Å²	134	148.3 Å²	148.3	63%	0.626	79%	0.791	S	S	*	*			trans	-157.3	156.3	-152.6	-152.7	177.5	-57.9	0	0	111.2
9	H	25.5	Very low	25.2	Very low	141 Å²	141	143.9 Å²	143.9	65%	0.653	78%	0.784	S	S	*	*			trans	72.5	152.5	173.1	-68.1	-76.8	0	0	0	117
10	D	22.8	Very low	25.2	Very low	141 Å²	141	143.9 Å²	143.9	75%	0.754	78%	0.783	S	S	*	*			cis	-150.4	-174.2	-1.2	-124.1	-21.7	0	0	0	115
11	L	22.5	Very low	25.2	Very low	151 Å²	151	143.4 Å²	143.4	79%	0.791	78%	0.78	S	S	*	*			trans	-115.4	119	-167.1	-86.8	153.9	0	0	0	116.9
12	S	24.2	Very low	25	Very low	109 Å²	109	137 Å²	137	76%	0.762	76%	0.76	S	S	*	*			trans	64.5	179.2	147.9	81.3	0	0	0	0	118.4
13	P	34.1	Very low	24.8	Very low	108 Å²	108	136.6 Å²	136.6	70%	0.701	76%	0.757	S	S	*	*			cis	-136.2	174.8	-8.3	41.8	-25.5	0	0	0	117.1
14	R	23.7	Very low	25.2	Very low	214 Å²	214	137 Å²	137	81%	0.808	76%	0.757	S	S	*	*			trans	76.1	135.8	150	-86.7	-173	163.2	159.3	2	123.9
15	D	22.7	Very low	25	Very low	135 Å²	135	134.1 Å²	134.1	72%	0.722	76%	0.756	S	S	*	*			trans	51.2	138.6	134.5	-50.2	-16.1	0	0	0	120.3
16	S	23.2	Very low	25	Very low	106 Å²	106	131.5 Å²	131.5	74%	0.741	75%	0.75	S	S	*	*			cis	-154.6	-170.8	-4.4	58.1	0	0	0	0	108.7
17	T	24.3	Very low	25	Very low	105 Å²	105	131.9 Å²	131.9	64%	0.644	76%	0.757	S	S	*	*			cis	-156.6	174.9	15.5	-26.9	0	0	0	0	109.6
18	E	25.5	Very low	24.9	Very low	182 Å²	182	130.3 Å²	130.3	85%	0.85	75%	0.75	S	S	*	*			trans	65.1	169.7	166.7	-67.8	153	-95.8	0	0	115.2
19	G	24.1	Very low	25.2	Very low	65 Å²	65	131.7 Å²	131.7	67%	0.67	76%	0.76	S	S	*	*			cis	152.3	162.9	-8	0	0	0	0	0	110.1
20	N	23.6	Very low	25	Very low	143 Å²	143	133.3 Å²	133.3	77%	0.765	77%	0.768	S	S	*	*			cis	-163.1	154.6	-11.5	-114.4	42.4	0	0	0	106.5
21	D	26.3	Very low	25	Very low	134 Å²	134	133.9 Å²	133.9	72%	0.717	77%	0.771	S	S	*	*			cis	-161.3	-173.1	-5.9	-156.9	-11.7	0	0	0	109.9
22	S	24.8	Very low	25	Very low	115 Å²	115	135.8 Å²	135.8	80%	0.804	78%	0.775	S	S	*	*			trans	103.6	102.4	166.4	76.8	0	0	0	0	117.8
23	S	23.7	Very low	24.8	Very low	109 Å²	109	140.6 Å²	140.6	76%	0.762	78%	0.777	S	S	*	*			trans	-117.1	172.7	151.2	64.5	0	0	0	0	108.3
24	P	32.4	Very low	24.3	Very low	120 Å²	120	143.4 Å²	143.4	78%	0.779	78%	0.781	S	S	*	*				-146.8	179.4	94.9	35.4	-17.4	0	0	0	111.8
25	S	24.3	Very low	24.2	Very low	113 Å²	113	138.3 Å²	138.3	79%	0.79	78%	0.778	S	S	*	*			cis	-158.5	143.8	-17.1	40.5	0	0	0	0	105.1
26	G	24.7	Very low	24.3	Very low	73 Å²	73	136.1 Å²	136.1	75%	0.753	77%	0.773	S	S	*	*				99	101.4	73.9	0	0	0	0	0	110
27	I	25.3	Very low	24.3	Very low	171 Å²	171	136.9 Å²	136.9	88%	0.877	77%	0.774	S	S	*	*			trans	-91	124.6	178.6	-64.1	172	0	0	0	108.7
28	H	22.5	Very low	24.2	Very low	167 Å²	167	139.1 Å²	139.1	77%	0.773	78%	0.781	S	S	*	*			trans	-103.5	146.1	173.3	-123.4	-99	0	0	0	111.1
29	L	29	Very low	24.2	Very low	163 Å²	163	137.8 Å²	137.8	85%	0.853	77%	0.773	S	S	*	*			trans	-109.5	127.8	170.4	-141.4	90.4	0	0	0	107.8
30	E	21.7	Very low	24.2	Very low	175 Å²	175	144.6 Å²	144.6	82%	0.818	78%	0.784	S	S	*	*			trans	-156	157.6	168.8	-150	154.5	-143	0	0	111.9
31	L	23	Very low	24.3	Very low	153 Å²	153	144.2 Å²	144.2	80%	0.801	78%	0.778	S	S	*	*			trans	-106.6	134.8	-179.7	-75.7	81	0	0	0	110.9
32	Q	21.3	Very low	24.2	Very low	191 Å²	191	147.4 Å²	147.4	89%	0.893	79%	0.786	S	S	*	*			trans	169.4	170	137.5	-94.6	165.4	16.2	0	0	109.1
33	R	21.1	Very low	24.4	Very low	211 Å²	211	150.3 Å²	150.3	80%	0.796	79%	0.787	S	S	*	*			cis	-177.3	163.2	-45	-165.7	-177.4	-156.3	-173.8	7.3	105.4
34	E	22.8	Very low	24.5	Very low	167 Å²	167	151.1 Å²	151.1	78%	0.78	79%	0.787	S	S	*	*			trans	72.2	150.9	171.3	-48.7	-174.6	171.4	0	0	113
35	S	21.5	Very low	24.3	Very low	107 Å²	107	153.2 Å²	153.2	75%	0.748	79%	0.792	S	S	*	*			cis	-178.3	172.4	-22.4	63.6	0	0	0	0	103.4
36	S	24.5	Very low	24.4	Very low	89 Å²	89	155.6 Å²	155.6	62%	0.622	80%	0.796	S	S	*	*			cis	-158.9	152.4	19.4	55.1	0	0	0	0	110.8
37	T	24.1	Very low	24.9	Very low	122 Å²	122	161 Å²	161	75%	0.748	80%	0.802	S	S	*	*			trans	58	144.1	149.1	51.1	0	0	0	0	119.8
38	D	22.9	Very low	25.2	Very low	151 Å²	151	158 Å²	158	81%	0.807	79%	0.794	S	S	*	*			cis	-141.7	166.4	28.2	-142.2	-19.3	0	0	0	115.2
39	F	25.4	Very low	25.6	Very low	155 Å²	155	160.9 Å²	160.9	68%	0.68	80%	0.798	S	S	*	*			trans	-89.4	146.7	-171.9	-107.4	-115.3	0	0	0	113.8	Q41	F39-Q41 HydrophobicContact CD1-CG 4.14Å; F39-Q41 HydrophobicContact CE1-CG 4.03Å
40	K	23.5	Very low	26.2	Very low	207 Å²	207	158.3 Å²	158.3	90%	0.9	79%	0.791	S	S	*	*				-161.8	141	111.8	-111	166.5	-175.7	173.2	0	113.9
41	Q	25.6	Very low	27.6	Very low	136 Å²	136	157 Å²	157	64%	0.636	78%	0.78	S	S	*	*			trans	-84.6	156.1	179	-61.7	147.6	-85.6	0	0	111.5	F39	F39-Q41 HydrophobicContact CD1-CG 4.14Å; F39-Q41 HydrophobicContact CE1-CG 4.03Å
42	F	23.3	Very low	28.8	Very low	201 Å²	201	158.1 Å²	158.1	88%	0.882	78%	0.781	S	S	*	*				-147.3	109.4	129.6	-114.1	-77	0	0	0	109.3
43	E	30.5	Very low	30.6	Very low	176 Å²	176	153.6 Å²	153.6	82%	0.822	76%	0.755	S	S	*	*			trans	-98.7	125.7	161.6	-74.7	-173.9	124.7	0	0	108.5
44	T	25.4	Very low	32.5	Very low	125 Å²	125	147.1 Å²	147.1	77%	0.767	74%	0.736	S	S	*	*			trans	-148.3	135.7	153.6	43	0	0	0	0	108.6
45	N	27.4	Very low	34.3	Very low	164 Å²	164	146.6 Å²	146.6	88%	0.877	74%	0.737	S	S	*	*			trans	-29	138	179.4	-62.5	-29.8	0	0	0	116.6
46	D	27.2	Very low	36.5	Very low	164 Å²	164	146.3 Å²	146.3	88%	0.877	73%	0.726	S	S	*	*				-150.1	153	118.6	-139.2	-23.4	0	0	0	112.9	C48	D46-C48 PolarHBondContact O-N 3.44Å
47	Q	34.6	Very low	38.3	Very low	187 Å²	187	150.9 Å²	150.9	87%	0.874	74%	0.738	S	S	*	*			trans	-92.6	93.8	-175.3	-73.2	-171	-8	0	0	112.7
48	C	30.9	Very low	39.9	Very low	106 Å²	106	149.7 Å²	149.7	72%	0.716	73%	0.733	S	S	*	*			trans	-140.5	136.1	163.1	-97.5	0	0	0	0	111.6	D46	D46-C48 PolarHBondContact O-N 3.44Å
49	R	31.5	Very low	41.9	Very low	228 Å²	228	151.3 Å²	151.3	86%	0.86	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-68.1	128.4	176.8	-70.9	-176.2	177.7	-175.9	-0.8	110.1	Y51	R49-Y51 PolarHBondContact O-N 2.91Å
50	P	41.9	Very low	43.2	Very low	109 Å²	109	152.7 Å²	152.7	71%	0.708	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-75.5	117.2	179.6	29.6	-33.6	0	0	0	110.8	H52	P50-H52 PolarHBondContact O-N 3.32Å
51	Y	50.6	Low	44.8	Very low	149 Å²	149	152.1 Å²	152.1	58%	0.584	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-68.6	119.9	165.4	-77.1	-101.2	0	0	0	108.2	R49 R53 A717 V721	R49-Y51 PolarHBondContact O-N 2.91Å; Y51-R53 PolarHBondContact O-N 3.32Å; Y51-A717 HydrophobicContact CD1-CB 4.14Å; Y51-A717 HydrophobicContact CE1-CB 3.92Å; Y51-V721 HydrophobicContact CD2-CG2 3.88Å; Y51-V721 HydrophobicContact CE1-CG2 3.92Å; Y51-V721 HydrophobicContact CE2-CG2 3.2Å; Y51-V721 HydrophobicContact CG-CG2 4.49Å; Y51-V721 WeakPolarHBondContact OH-CG2 3.5Å
52	H	49.3	Very low	45.6	Very low	176 Å²	176	150.1 Å²	150.1	82%	0.815	74%	0.743	S	S	*	*			trans	-69.3	93.8	177.6	-98.2	48.6	0	0	0	109.8	P50	P50-H52 PolarHBondContact O-N 3.32Å
53	R	59.2	Low	46.9	Very low	95 Å²	95	147.9 Å²	147.9	36%	0.358	74%	0.74	S	S	.	*			trans	-67.1	132.2	169.9	-169	179.6	-168.8	172.5	7	109.1	Y51 L55 E705 N706 L708 E714	Y51-R53 PolarHBondContact O-N 3.32Å; R53-L55 PolarHBondContact O-N 3.05Å; R53-E705 PolarHBondContact NH2-O 2.94Å; R53-N706 PolarHBondContact NH1-OD1 3.09Å; R53-L708 PolarHBondContact NH2-O 3.48Å; R53-L708 VanDerWaalsContact NH2-O 3.12Å; R53-E714 WeakPolarHBondContact CA-OE1 3.49Å; R53-E714 WeakPolarHBondContact CG-OE1 3.41Å
54	I	61	Low	48	Very low	75 Å²	75	143.3 Å²	143.3	39%	0.385	73%	0.725	S	S	.	*			trans	-72.3	103	175.1	-65.2	174.1	0	0	0	108.1	I56 Y710 E714	I54-I56 HydrophobicContact CG2-CD1 3.7Å; I54-I56 HydrophobicContact CG2-CG1 3.81Å; I54-I56 PolarHBondContact O-N 2.9Å; I54-Y710 HydrophobicContact CB-CD2 3.9Å; I54-Y710 HydrophobicContact CB-CG 4.33Å; I54-Y710 HydrophobicContact CG2-CD2 3.85Å; I54-Y710 HydrophobicContact CG2-CE2 4.46Å; I54-Y710 HydrophobicContact CG2-CG 4.05Å; I54-Y710 WeakPolarHBondContact O-CD2 3.33Å; I54-Y710 WeakPolarHBondContact O-CE2 3.03Å; I54-E714 PolarHBondContact N-OE1 3.4Å
55	L	60.8	Low	49.6	Very low	156 Å²	156	142.4 Å²	142.4	82%	0.817	72%	0.715	S	S	*	*			trans	-84.7	107.8	166.6	-101.7	80.7	0	0	0	109.4	R53	R53-L55 PolarHBondContact O-N 3.05Å
56	I	66.4	Low	51.4	Low	101 Å²	101	142.1 Å²	142.1	52%	0.518	71%	0.706	S	S	.	*			trans	-113.6	117.6	162.3	-65	161.9	0	0	0	106.7	I54 Y710	I54-I56 HydrophobicContact CG2-CD1 3.7Å; I54-I56 HydrophobicContact CG2-CG1 3.81Å; I54-I56 PolarHBondContact O-N 2.9Å; I56-Y710 HydrophobicContact CB-CE1 4.16Å; I56-Y710 HydrophobicContact CB-CE2 4.39Å; I56-Y710 HydrophobicContact CD1-CD1 4.06Å; I56-Y710 HydrophobicContact CD1-CE1 4.03Å; I56-Y710 HydrophobicContact CD1-CG 4.44Å; I56-Y710 PolarHBondContact O-OH 2.99Å
57	E	62.1	Low	53.2	Low	186 Å²	186	141.6 Å²	141.6	87%	0.869	70%	0.696	S	S	*	*			trans	-73.3	138.2	173.4	-171.7	168.4	-151.2	0	0	110	Q59	E57-Q59 PolarHBondContact O-N 2.8Å
58	C	58.3	Low	54.9	Low	96 Å²	96	137.3 Å²	137.3	65%	0.649	68%	0.676	S	S	*	*			trans	-86	109.8	178.8	-165.5	0	0	0	0	108.9	E60	C58-E60 PolarHBondContact O-N 2.96Å
59	Q	63.9	Low	56.7	Low	186 Å²	186	137 Å²	137	87%	0.869	66%	0.663	S	S	*	*			trans	-63	106.8	172.9	-171.9	179.4	24.1	0	0	109.4	E57 K61	E57-Q59 PolarHBondContact O-N 2.8Å; Q59-K61 PolarHBondContact O-N 3.44Å; Q59-K61 VanDerWaalsContact O-N 3.15Å
60	E	54.4	Low	58.5	Low	183 Å²	183	128.6 Å²	128.6	86%	0.855	64%	0.637	S	S	*	*			trans	-57.2	121	-179.9	-74.1	-163.3	140.8	0	0	110.6	C58 S62	C58-E60 PolarHBondContact O-N 2.96Å; E60-S62 PolarHBondContact O-N 3.38Å
61	K	55.8	Low	60	Low	196 Å²	196	127 Å²	127	85%	0.852	62%	0.622	S	S	*	*			trans	-74.3	111.7	159.7	-71	178.3	-178	171.5	0	106.3	Q59 D63	Q59-K61 PolarHBondContact O-N 3.44Å; Q59-K61 VanDerWaalsContact O-N 3.15Å; K61-D63 PolarHBondContact O-N 2.83Å
62	S	43.4	Very low	60.9	Low	93 Å²	93	125.1 Å²	125.1	65%	0.65	62%	0.616	S	S	*	*			trans	-41.5	124.9	172.4	59.4	0	0	0	0	110.2	E60 T64	E60-S62 PolarHBondContact O-N 3.38Å; S62-T64 PolarHBondContact O-N 3.23Å
63	D	50.3	Low	61.8	Low	154 Å²	154	122.6 Å²	122.6	82%	0.824	60%	0.603	S	S	*	*			trans	-68.3	83.6	-176.7	-114.1	-26.2	0	0	0	110	K61 N65	K61-D63 PolarHBondContact O-N 2.83Å; D63-N65 PolarHBondContact O-N 3.17Å
64	T	53	Low	62.1	Low	81 Å²	81	122.8 Å²	122.8	50%	0.497	61%	0.611	S	S	.	*			trans	-71	84.7	176.3	55.1	0	0	0	0	108.1	S62 F66	S62-T64 PolarHBondContact O-N 3.23Å; T64-F66 PolarHBondContact O-N 3.38Å
65	N	60.2	Low	62.4	Low	106 Å²	106	124.5 Å²	124.5	57%	0.567	62%	0.617	S	S	*	*			trans	-33	119.4	178.4	-175.7	-31.6	0	0	0	110	D63 K67 E68 F69	D63-N65 PolarHBondContact O-N 3.17Å; N65-K67 CarbonylContact O-C 3.55Å; N65-K67 PolarHBondContact O-N 3.23Å; N65-K67 PolarHBondContact OD1-N 3.35Å; N65-E68 HydrophobicContact CB-CG 4.44Å; N65-E68 WeakPolarHBondContact O-CA 3.45Å; N65-E68 WeakPolarHBondContact O-CB 3.38Å; N65-E68 PolarHBondContact O-N 3.15Å; N65-F69 PolarHBondContact O-N 3.06Å
66	F	65.3	Low	62.5	Low	157 Å²	157	124.6 Å²	124.6	69%	0.689	61%	0.611	S	S	*	*	H	α-helix	trans	-53.4	-33.4	-166.3	-178.1	-98.9	0	0	0	112.6	T64 F69 V70	T64-F66 PolarHBondContact O-N 3.38Å; F66-F69 PolarHBondContact O-N 3.48Å; F66-V70 HydrophobicContact CD1-CG2 4.07Å; F66-V70 HydrophobicContact CE1-CG2 3.71Å; F66-V70 HydrophobicContact CE2-CG2 4.24Å; F66-V70 HydrophobicContact CG-CG2 4.49Å; F66-V70 HydrophobicContact CZ-CG2 3.81Å; F66-V70 WeakPolarHBondContact O-CB 3.42Å; F66-V70 VanDerWaalsContact O-CG2 3.31Å; F66-V70 WeakPolarHBondContact O-CG2 3.09Å; F66-V70 PolarHBondContact O-N 3.27Å
67	K	65.1	Low	62.2	Low	154 Å²	154	124.8 Å²	124.8	67%	0.67	61%	0.613	S	S	*	*	H	α-helix	trans	-62.5	-46	173.9	-167.5	175.6	-178	-179.4	0	112.3	N65 I71	N65-K67 CarbonylContact O-C 3.55Å; N65-K67 PolarHBondContact O-N 3.23Å; N65-K67 PolarHBondContact OD1-N 3.35Å; K67-I71 HydrophobicContact CG-CD1 4.02Å; K67-I71 WeakPolarHBondContact O-CB 3.36Å; K67-I71 WeakPolarHBondContact O-CD1 3.48Å; K67-I71 WeakPolarHBondContact O-CG1 3.26Å; K67-I71 PolarHBondContact O-N 2.93Å
68	E	69.5	Low	62	Low	97 Å²	97	120.6 Å²	120.6	45%	0.453	60%	0.603	S	S	.	*	H	α-helix	trans	-64.8	-42.1	172.2	-74.2	-149.5	147.2	0	0	112.5	N65 V70 I71 K72	N65-E68 HydrophobicContact CB-CG 4.44Å; N65-E68 WeakPolarHBondContact O-CA 3.45Å; N65-E68 WeakPolarHBondContact O-CB 3.38Å; N65-E68 PolarHBondContact O-N 3.15Å; E68-V70 VanDerWaalsContact C-N 3.33Å; E68-V70 PolarHBondContact O-N 3.48Å; E68-I71 PolarHBondContact O-N 3.02Å; E68-K72 HydrophobicContact CB-CD 4.46Å; E68-K72 VanDerWaalsContact O-CB 3.26Å; E68-K72 WeakPolarHBondContact O-CB 3.38Å; E68-K72 VanDerWaalsContact O-CG 3.31Å; E68-K72 WeakPolarHBondContact O-CG 3.33Å; E68-K72 PolarHBondContact O-N 3.03Å; E68-K72 IonicContact OE1-NZ 3.6Å; E68-K72 IonicContact OE2-NZ 3.64Å; E68-K72 PolarHBondContact OE2-NZ 3.21Å
69	F	68.5	Low	62.2	Low	98 Å²	98	122.4 Å²	122.4	43%	0.43	60%	0.602	S	S	.	*	H	α-helix	trans	-61.4	-44.1	179.5	-179.8	-96.5	0	0	0	110.9	N65 F66 K73	N65-F69 PolarHBondContact O-N 3.06Å; F66-F69 PolarHBondContact O-N 3.48Å; F69-K73 HydrophobicContact CE1-CD 4.03Å; F69-K73 HydrophobicContact CZ-CD 4.38Å; F69-K73 WeakPolarHBondContact O-CB 3.49Å; F69-K73 PolarHBondContact O-N 3.15Å
70	V	69.3	Low	62.1	Low	53 Å²	53	118.8 Å²	118.8	32%	0.321	60%	0.596	S	S	.	*	H	α-helix	trans	-64.5	-44.2	174.3	170.1	0	0	0	0	111.4	F66 E68 K73 L74	F66-V70 HydrophobicContact CD1-CG2 4.07Å; F66-V70 HydrophobicContact CE1-CG2 3.71Å; F66-V70 HydrophobicContact CE2-CG2 4.24Å; F66-V70 HydrophobicContact CG-CG2 4.49Å; F66-V70 HydrophobicContact CZ-CG2 3.81Å; F66-V70 WeakPolarHBondContact O-CB 3.42Å; F66-V70 VanDerWaalsContact O-CG2 3.31Å; F66-V70 WeakPolarHBondContact O-CG2 3.09Å; F66-V70 PolarHBondContact O-N 3.27Å; E68-V70 VanDerWaalsContact C-N 3.33Å; E68-V70 PolarHBondContact O-N 3.48Å; V70-K73 PolarHBondContact O-N 3.14Å; V70-L74 HydrophobicContact CG1-CD1 3.84Å; V70-L74 HydrophobicContact CG1-CG 4.41Å; V70-L74 WeakPolarHBondContact O-CB 3.43Å; V70-L74 WeakPolarHBondContact O-CG 3.35Å; V70-L74 PolarHBondContact O-N 3.3Å
71	I	73.3	Confident	63.3	Low	76 Å²	76	112.9 Å²	112.9	39%	0.39	58%	0.575	S	S	.	*	H	α-helix	trans	-62.7	-48	176.7	-72	165.7	0	0	0	111.3	K67 E68 K73 L74 Q75	K67-I71 HydrophobicContact CG-CD1 4.02Å; K67-I71 WeakPolarHBondContact O-CB 3.36Å; K67-I71 WeakPolarHBondContact O-CD1 3.48Å; K67-I71 WeakPolarHBondContact O-CG1 3.26Å; K67-I71 PolarHBondContact O-N 2.93Å; E68-I71 PolarHBondContact O-N 3.02Å; I71-K73 VanDerWaalsContact C-N 3.28Å; I71-K73 PolarHBondContact O-N 3.13Å; I71-L74 PolarHBondContact O-N 3.03Å; I71-Q75 HydrophobicContact CG2-CG 4.35Å; I71-Q75 WeakPolarHBondContact O-CB 3.28Å; I71-Q75 WeakPolarHBondContact O-CG 3.2Å; I71-Q75 PolarHBondContact O-N 3.17Å
72	K	70.6	Confident	64.5	Low	108 Å²	108	108.9 Å²	108.9	47%	0.47	57%	0.569	S	S	.	*	H	α-helix	trans	-62.7	-34.5	177.3	-73.6	165.8	176.3	166.7	0	111.5	E68 K76	E68-K72 HydrophobicContact CB-CD 4.46Å; E68-K72 VanDerWaalsContact O-CB 3.26Å; E68-K72 WeakPolarHBondContact O-CB 3.38Å; E68-K72 VanDerWaalsContact O-CG 3.31Å; E68-K72 WeakPolarHBondContact O-CG 3.33Å; E68-K72 PolarHBondContact O-N 3.03Å; E68-K72 IonicContact OE1-NZ 3.6Å; E68-K72 IonicContact OE2-NZ 3.64Å; E68-K72 PolarHBondContact OE2-NZ 3.21Å; K72-K76 WeakPolarHBondContact O-CB 3.49Å; K72-K76 PolarHBondContact O-N 3.1Å
73	K	67.8	Low	66.3	Low	124 Å²	124	107.4 Å²	107.4	54%	0.539	56%	0.563	S	S	.	*	H	α-helix	trans	-74.2	-37.3	175.3	-166	170.7	-175.2	178.7	0	112.6	F69 V70 I71 N77	F69-K73 HydrophobicContact CE1-CD 4.03Å; F69-K73 HydrophobicContact CZ-CD 4.38Å; F69-K73 WeakPolarHBondContact O-CB 3.49Å; F69-K73 PolarHBondContact O-N 3.15Å; V70-K73 PolarHBondContact O-N 3.14Å; I71-K73 VanDerWaalsContact C-N 3.28Å; I71-K73 PolarHBondContact O-N 3.13Å; K73-N77 WeakPolarHBondContact O-CB 3.29Å; K73-N77 PolarHBondContact O-N 2.94Å
74	L	65.6	Low	67.7	Low	99 Å²	99	103.2 Å²	103.2	52%	0.518	54%	0.537	S	S	.	.	H	α-helix	trans	-66.3	-46.4	171.1	-77.3	167.1	0	0	0	111.4	V70 I71 N77 C78	V70-L74 HydrophobicContact CG1-CD1 3.84Å; V70-L74 HydrophobicContact CG1-CG 4.41Å; V70-L74 WeakPolarHBondContact O-CB 3.43Å; V70-L74 WeakPolarHBondContact O-CG 3.35Å; V70-L74 PolarHBondContact O-N 3.3Å; I71-L74 PolarHBondContact O-N 3.03Å; L74-N77 CarbonylContact O-C 3.52Å; L74-N77 WeakPolarHBondContact O-CA 3.38Å; L74-N77 WeakPolarHBondContact O-CB 3.21Å; L74-N77 PolarHBondContact O-N 2.66Å; L74-C78 PolarHBondContact O-N 2.76Å; L74-C78 PolarHBondContact O-SG 3.43Å; L74-C78 VanDerWaalsContact O-SG 3.39Å
75	Q	66.3	Low	69.1	Low	111 Å²	111	101.5 Å²	101.5	52%	0.519	53%	0.531	S	S	.	.	H	α-helix	trans	-60.9	-46.3	175.7	-74	173.5	-23.5	0	0	111.8	I71 N77 C78 Q79	I71-Q75 HydrophobicContact CG2-CG 4.35Å; I71-Q75 WeakPolarHBondContact O-CB 3.28Å; I71-Q75 WeakPolarHBondContact O-CG 3.2Å; I71-Q75 PolarHBondContact O-N 3.17Å; Q75-N77 PolarHBondContact O-N 2.85Å; Q75-C78 PolarHBondContact O-N 3.27Å; Q75-Q79 WeakPolarHBondContact O-CB 3.41Å; Q75-Q79 WeakPolarHBondContact O-CG 3.48Å; Q75-Q79 PolarHBondContact O-N 2.97Å
76	K	63.1	Low	70.3	Confident	158 Å²	158	103 Å²	103	69%	0.687	53%	0.533	S	S	*	.	H	α-helix	trans	-61.1	-26.6	171	-85.5	-171.8	171.1	-178.6	0	113.2	K72 K84	K72-K76 WeakPolarHBondContact O-CB 3.49Å; K72-K76 PolarHBondContact O-N 3.1Å; K76-K84 PolarHBondContact O-NZ 3.32Å
77	N	59.5	Low	71.1	Confident	105 Å²	105	100.8 Å²	100.8	56%	0.561	53%	0.528	S	S	*	.	H	α-helix	trans	-77.2	-43.9	173.9	-83	-8.9	0	0	0	112.7	K73 L74 Q75 K84	K73-N77 WeakPolarHBondContact O-CB 3.29Å; K73-N77 PolarHBondContact O-N 2.94Å; L74-N77 CarbonylContact O-C 3.52Å; L74-N77 WeakPolarHBondContact O-CA 3.38Å; L74-N77 WeakPolarHBondContact O-CB 3.21Å; L74-N77 PolarHBondContact O-N 2.66Å; Q75-N77 PolarHBondContact O-N 2.85Å; N77-K84 VanDerWaalsContact CA-NZ 3.33Å; N77-K84 PolarHBondContact O-NZ 3.42Å
78	C	59.3	Low	72	Confident	98 Å²	98	97.8 Å²	97.8	66%	0.662	52%	0.523	S	S	*	.	H	α-helix	trans	-80.4	-15.5	-178.6	-60.8	0	0	0	0	114.6	L74 Q75 C80	L74-C78 PolarHBondContact O-N 2.76Å; L74-C78 PolarHBondContact O-SG 3.43Å; L74-C78 VanDerWaalsContact O-SG 3.39Å; Q75-C78 PolarHBondContact O-N 3.27Å; C78-C80 PolarHBondContact O-N 2.87Å
79	Q	61.6	Low	72.7	Confident	133 Å²	133	97.8 Å²	97.8	62%	0.621	53%	0.525	S	S	*	.			trans	-69	94.3	170.5	-80.4	178.4	-10.6	0	0	111.2	Q75 S81 K84	Q75-Q79 WeakPolarHBondContact O-CB 3.41Å; Q75-Q79 WeakPolarHBondContact O-CG 3.48Å; Q75-Q79 PolarHBondContact O-N 2.97Å; Q79-S81 PolarHBondContact O-N 2.79Å; Q79-S81 VanDerWaalsContact O-N 3.1Å; Q79-K84 WeakPolarHBondContact O-CD 3.44Å
80	C	61.8	Low	73.5	Confident	111 Å²	111	95.2 Å²	95.2	75%	0.75	52%	0.515	S	S	*	.			trans	-78.6	78.2	173.3	-73.3	0	0	0	0	111.7	C78	C78-C80 PolarHBondContact O-N 2.87Å
81	S	80.7	Confident	74.2	Confident	58 Å²	58	93.4 Å²	93.4	41%	0.406	51%	0.507	S	S	.	.			trans	-69.6	148.8	164.3	76	0	0	0	0	110.5	Q79 A83 K84 A85	Q79-S81 PolarHBondContact O-N 2.79Å; Q79-S81 VanDerWaalsContact O-N 3.1Å; S81-A83 PolarHBondContact O-N 2.8Å; S81-K84 WeakPolarHBondContact O-CA 3.3Å; S81-K84 WeakPolarHBondContact O-CB 3.47Å; S81-K84 PolarHBondContact O-N 3.26Å; S81-K84 WeakPolarHBondContact OG-CB 3.4Å; S81-K84 PolarHBondContact OG-N 3Å; S81-A85 PolarHBondContact O-N 2.8Å
82	P	80.6	Confident	74.9	Confident	112 Å²	112	93.4 Å²	93.4	73%	0.727	50%	0.504	S	S	*	.	H	α-helix	trans	-62.2	-32.8	-179.2	22.9	-33.2	0	0	0	112.5	K84 A85 K86	P82-K84 VanDerWaalsContact C-N 3.35Å; P82-A85 PolarHBondContact O-N 2.77Å; P82-K86 WeakPolarHBondContact O-CB 3.4Å; P82-K86 PolarHBondContact O-N 3.12Å
83	A	80.6	Confident	75.9	Confident	62 Å²	62	90.9 Å²	90.9	51%	0.512	50%	0.496	S	S	.	.	H	α-helix	trans	-63	-39.2	171.8	0	0	0	0	0	112.3	S81 N87	S81-A83 PolarHBondContact O-N 2.8Å; A83-N87 WeakPolarHBondContact O-CB 3.41Å; A83-N87 VanDerWaalsContact O-CG 3.26Å; A83-N87 PolarHBondContact O-N 3.45Å
84	K	80.2	Confident	77	Confident	66 Å²	66	85.4 Å²	85.4	29%	0.287	47%	0.473	S	S	.	.	H	α-helix	trans	-68.7	-43.8	175.8	-168.3	-176.6	-174.6	-174.4	0	111.6	K76 N77 Q79 S81 P82 K86 N87 T88	K76-K84 PolarHBondContact O-NZ 3.32Å; N77-K84 VanDerWaalsContact CA-NZ 3.33Å; N77-K84 PolarHBondContact O-NZ 3.42Å; Q79-K84 WeakPolarHBondContact O-CD 3.44Å; S81-K84 WeakPolarHBondContact O-CA 3.3Å; S81-K84 WeakPolarHBondContact O-CB 3.47Å; S81-K84 PolarHBondContact O-N 3.26Å; S81-K84 WeakPolarHBondContact OG-CB 3.4Å; S81-K84 PolarHBondContact OG-N 3Å; P82-K84 VanDerWaalsContact C-N 3.35Å; K84-K86 PolarHBondContact O-N 3.47Å; K84-N87 PolarHBondContact O-N 3.25Å; K84-T88 PolarHBondContact O-N 3.32Å; K84-T88 PolarHBondContact O-OG1 2.97Å
85	A	82	Confident	78.2	Confident	45 Å²	45	81.5 Å²	81.5	37%	0.372	45%	0.452	S	S	.	.	H	α-helix	trans	-58.9	-46.5	174.7	0	0	0	0	0	111.7	S81 P82 N87 T88 I89	S81-A85 PolarHBondContact O-N 2.8Å; P82-A85 PolarHBondContact O-N 2.77Å; A85-N87 VanDerWaalsContact C-N 3.35Å; A85-N87 PolarHBondContact O-N 2.9Å; A85-T88 PolarHBondContact O-N 3.48Å; A85-I89 WeakPolarHBondContact O-CG1 3.38Å; A85-I89 PolarHBondContact O-N 3.11Å
86	K	84.8	Confident	79.3	Confident	138 Å²	138	80.3 Å²	80.3	60%	0.6	45%	0.449	S	S	*	.	H	α-helix	trans	-56.7	-45.6	173.3	-176.3	176.3	-179.5	177.2	0	111.9	P82 K84 I89 L90	P82-K86 WeakPolarHBondContact O-CB 3.4Å; P82-K86 PolarHBondContact O-N 3.12Å; K84-K86 PolarHBondContact O-N 3.47Å; K86-I89 PolarHBondContact O-N 3.03Å; K86-L90 HydrophobicContact CG-CD1 3.97Å; K86-L90 HydrophobicContact CG-CG 4.47Å; K86-L90 WeakPolarHBondContact O-CB 3.48Å; K86-L90 VanDerWaalsContact O-CG 3.28Å; K86-L90 WeakPolarHBondContact O-CG 3.42Å; K86-L90 PolarHBondContact O-N 3.14Å
87	N	83.4	Confident	80.5	Confident	110 Å²	110	77.1 Å²	77.1	59%	0.588	44%	0.437	S	S	*	.	H	α-helix	trans	-67	-34.1	178	-72.8	-7.6	0	0	0	113	A83 K84 A85 G91	A83-N87 WeakPolarHBondContact O-CB 3.41Å; A83-N87 VanDerWaalsContact O-CG 3.26Å; A83-N87 PolarHBondContact O-N 3.45Å; K84-N87 PolarHBondContact O-N 3.25Å; A85-N87 VanDerWaalsContact C-N 3.35Å; A85-N87 PolarHBondContact O-N 2.9Å; N87-G91 WeakPolarHBondContact O-CA 3.42Å; N87-G91 PolarHBondContact O-N 3.33Å
88	T	83.1	Confident	82	Confident	91 Å²	91	74.2 Å²	74.2	56%	0.558	42%	0.418	S	S	*	.	H	α-helix	trans	-66.8	-45.5	172.6	-62.6	0	0	0	0	111.4	K84 A85 G91 F92	K84-T88 PolarHBondContact O-N 3.32Å; K84-T88 PolarHBondContact O-OG1 2.97Å; A85-T88 PolarHBondContact O-N 3.48Å; T88-G91 CarbonylContact O-C 3.57Å; T88-G91 WeakPolarHBondContact O-CA 3.5Å; T88-G91 PolarHBondContact O-N 3.5Å; T88-G91 VanDerWaalsContact O-N 3.11Å; T88-F92 WeakPolarHBondContact O-CB 3.49Å; T88-F92 PolarHBondContact O-N 2.86Å
89	I	85.3	Confident	83.5	Confident	98 Å²	98	73.4 Å²	73.4	50%	0.503	41%	0.407	S	S	.	.	H	α-helix	trans	-62.9	-49.3	178.2	-66.9	164.5	0	0	0	110.7	A85 K86 G91 F92 L93 L96	A85-I89 WeakPolarHBondContact O-CG1 3.38Å; A85-I89 PolarHBondContact O-N 3.11Å; K86-I89 PolarHBondContact O-N 3.03Å; I89-G91 PolarHBondContact O-N 3.1Å; I89-F92 PolarHBondContact O-N 2.84Å; I89-F92 VanDerWaalsContact O-N 3.15Å; I89-L93 PolarHBondContact O-N 3.26Å; I89-L96 HydrophobicContact CG2-CD1 4.45Å
90	L	84.4	Confident	84.9	Confident	44 Å²	44	72.1 Å²	72.1	23%	0.23	41%	0.41	C	S	.	.	H	α-helix	trans	-61.3	-31.1	173.3	-69	173.7	0	0	0	112	K86 L96 Q97	K86-L90 HydrophobicContact CG-CD1 3.97Å; K86-L90 HydrophobicContact CG-CG 4.47Å; K86-L90 WeakPolarHBondContact O-CB 3.48Å; K86-L90 VanDerWaalsContact O-CG 3.28Å; K86-L90 WeakPolarHBondContact O-CG 3.42Å; K86-L90 PolarHBondContact O-N 3.14Å; L90-L96 HydrophobicContact CD2-CB 3.62Å; L90-L96 HydrophobicContact CD2-CD1 4.36Å; L90-Q97 HydrophobicContact CB-CG 4.22Å; L90-Q97 PolarHBondContact O-NE2 2.97Å
91	G	83.6	Confident	86.3	Confident	14 Å²	14	75.3 Å²	75.3	14%	0.144	41%	0.411	C	S	.	.	H	α-helix	trans	-69.7	-35.8	175.3	0	0	0	0	0	113.2	N87 T88 I89 R413 Q416	N87-G91 WeakPolarHBondContact O-CA 3.42Å; N87-G91 PolarHBondContact O-N 3.33Å; T88-G91 CarbonylContact O-C 3.57Å; T88-G91 WeakPolarHBondContact O-CA 3.5Å; T88-G91 PolarHBondContact O-N 3.5Å; T88-G91 VanDerWaalsContact O-N 3.11Å; I89-G91 PolarHBondContact O-N 3.1Å; G91-R413 VanDerWaalsContact O-CZ 3.28Å; G91-R413 PolarHBondContact O-NH1 3.33Å; G91-R413 PolarHBondContact O-NH2 2.82Å; G91-Q416 PolarHBondContact O-OE1 3.13Å
92	F	88.3	Confident	86.8	Confident	76 Å²	76	74.1 Å²	74.1	33%	0.333	40%	0.398	S	S	.	.	H	α-helix	trans	-86.4	-26.1	-178.3	-175.7	-102.3	0	0	0	113.7	T88 I89 P94 L154 Q416 Y419 F423	T88-F92 WeakPolarHBondContact O-CB 3.49Å; T88-F92 PolarHBondContact O-N 2.86Å; I89-F92 PolarHBondContact O-N 2.84Å; I89-F92 VanDerWaalsContact O-N 3.15Å; F92-P94 WeakPolarHBondContact O-CD 3.35Å; F92-L154 HydrophobicContact CD1-CD2 4.43Å; F92-L154 HydrophobicContact CE1-CD2 4.07Å; F92-L154 HydrophobicContact CZ-CD2 4.3Å; F92-L154 WeakPolarHBondContact O-CD2 3.38Å; F92-Q416 PolarHBondContact O-NE2 3.36Å; F92-Y419 HydrophobicContact CE2-CD2 4.48Å; F92-Y419 HydrophobicContact CE2-CG 4.28Å; F92-F423 HydrophobicContact CE2-CE2 4.01Å; F92-F423 HydrophobicContact CZ-CD2 4.39Å; F92-F423 AromaticContact CZ-CE2 3.65Å; F92-F423 HydrophobicContact CZ-CE2 3.65Å; F92-F423 HydrophobicContact CZ-CZ 4.21Å
93	L	91.8	Very high	87.3	Confident	55 Å²	55	71.4 Å²	71.4	29%	0.288	38%	0.377	S	S	.	.			trans	-118	80.6	173.7	-74.8	163.9	0	0	0	110.6	I89 I95 L96 L154	I89-L93 PolarHBondContact O-N 3.26Å; L93-I95 HydrophobicContact CB-CG2 4.36Å; L93-I95 PolarHBondContact O-N 3.15Å; L93-I95 VanDerWaalsContact O-N 3.11Å; L93-L96 HydrophobicContact CB-CD1 3.94Å; L93-L96 HydrophobicContact CB-CG 4.11Å; L93-L96 HydrophobicContact CD1-CD1 4.19Å; L93-L96 PolarHBondContact O-N 3.41Å; L93-L96 VanDerWaalsContact O-N 3.09Å; L93-L154 HydrophobicContact CD2-CD2 3.85Å
94	P	90.5	Very high	87.8	Confident	9 Å²	9	73.9 Å²	73.9	6%	0.058	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.4	-177	-25.7	36.8	0	0	0	114.3	F92 L96 Q97 W98 L154 G155 T156 Q416	F92-P94 WeakPolarHBondContact O-CD 3.35Å; P94-L96 PolarHBondContact O-N 3.27Å; P94-Q97 WeakPolarHBondContact O-CB 3.32Å; P94-Q97 PolarHBondContact O-N 3.19Å; P94-W98 VanDerWaalsContact O-CD1 3.28Å; P94-W98 PolarHBondContact O-N 3.36Å; P94-L154 WeakPolarHBondContact CD-O 3.42Å; P94-L154 WeakPolarHBondContact CG-O 3.45Å; P94-G155 WeakPolarHBondContact CB-O 3.43Å; P94-G155 WeakPolarHBondContact CG-O 3.15Å; P94-T156 HydrophobicContact CB-CG2 4.49Å; P94-T156 HydrophobicContact CG-CG2 3.88Å; P94-Q416 HydrophobicContact CG-CG 4.16Å
95	I	91.8	Very high	88.2	Confident	17 Å²	17	80.5 Å²	80.5	9%	0.087	41%	0.41	C	S	.	.	H	α-helix	trans	-50.8	-39.4	173.3	-172.9	170.7	0	0	0	112.6	L93 Q97 W98 L99 F152 L153	L93-I95 HydrophobicContact CB-CG2 4.36Å; L93-I95 PolarHBondContact O-N 3.15Å; L93-I95 VanDerWaalsContact O-N 3.11Å; I95-Q97 PolarHBondContact O-N 3.12Å; I95-W98 HydrophobicContact CG1-CZ2 4.43Å; I95-W98 PolarHBondContact O-N 2.86Å; I95-L99 HydrophobicContact CD1-CD2 4.25Å; I95-L99 HydrophobicContact CG1-CB 4.06Å; I95-L99 HydrophobicContact CG1-CD2 4.09Å; I95-L99 WeakPolarHBondContact O-CB 3.38Å; I95-L99 PolarHBondContact O-N 3.18Å; I95-F152 HydrophobicContact CD1-CD1 4.09Å; I95-F152 HydrophobicContact CD1-CE1 3.42Å; I95-F152 VanDerWaalsContact CD1-CE1 3.42Å; I95-F152 HydrophobicContact CD1-CE2 4.13Å; I95-F152 HydrophobicContact CD1-CZ 3.45Å; I95-F152 VanDerWaalsContact CD1-CZ 3.45Å; I95-F152 HydrophobicContact CG1-CZ 4.5Å; I95-L153 HydrophobicContact CD1-CD2 3.79Å; I95-L153 WeakPolarHBondContact CG2-O 3.33Å
96	L	89.9	Confident	88.5	Confident	86 Å²	86	85.9 Å²	85.9	45%	0.45	43%	0.425	S	S	.	.	H	α-helix	trans	-68.4	-16.4	179.5	-59.1	178.8	0	0	0	113.2	I89 L90 L93 P94	I89-L96 HydrophobicContact CG2-CD1 4.45Å; L90-L96 HydrophobicContact CD2-CB 3.62Å; L90-L96 HydrophobicContact CD2-CD1 4.36Å; L93-L96 HydrophobicContact CB-CD1 3.94Å; L93-L96 HydrophobicContact CB-CG 4.11Å; L93-L96 HydrophobicContact CD1-CD1 4.19Å; L93-L96 PolarHBondContact O-N 3.41Å; L93-L96 VanDerWaalsContact O-N 3.09Å; P94-L96 PolarHBondContact O-N 3.27Å
97	Q	88.3	Confident	88.8	Confident	92 Å²	92	81 Å²	81	43%	0.43	41%	0.405	S	S	.	.	H	α-helix	trans	-90.9	-35	176.2	-55	-167.6	13.5	0	0	113.4	L90 P94 I95	L90-Q97 HydrophobicContact CB-CG 4.22Å; L90-Q97 PolarHBondContact O-NE2 2.97Å; P94-Q97 WeakPolarHBondContact O-CB 3.32Å; P94-Q97 PolarHBondContact O-N 3.19Å; I95-Q97 PolarHBondContact O-N 3.12Å
98	W	90	Very high	89.2	Confident	44 Å²	44	78.9 Å²	78.9	17%	0.167	39%	0.393	C	S	.	.	H	α-helix	trans	-101.3	-35.2	-171.8	77.6	-108.7	0	0	0	113.6	P94 I95 K101 Y102 F152 T453 Q454 L455	P94-W98 VanDerWaalsContact O-CD1 3.28Å; P94-W98 PolarHBondContact O-N 3.36Å; I95-W98 HydrophobicContact CG1-CZ2 4.43Å; I95-W98 PolarHBondContact O-N 2.86Å; W98-K101 CarbonylContact O-C 3.2Å; W98-K101 WeakPolarHBondContact O-CA 3.44Å; W98-K101 PolarHBondContact O-N 3.29Å; W98-Y102 HydrophobicContact CE3-CD2 4.39Å; W98-Y102 AromaticContact CZ3-CD2 3.92Å; W98-Y102 HydrophobicContact CZ3-CD2 3.92Å; W98-Y102 HydrophobicContact CZ3-CE2 4.45Å; W98-Y102 HydrophobicContact CZ3-CG 4.43Å; W98-F152 HydrophobicContact CH2-CD2 4.42Å; W98-F152 AromaticContact CH2-CE2 3.79Å; W98-F152 HydrophobicContact CH2-CE2 3.79Å; W98-F152 AromaticContact CZ2-CD2 3.95Å; W98-F152 HydrophobicContact CZ2-CD2 3.95Å; W98-F152 AromaticContact CZ2-CE2 3.63Å; W98-F152 HydrophobicContact CZ2-CE2 3.63Å; W98-T453 HydrophobicContact CE3-CG2 4.21Å; W98-T453 HydrophobicContact CZ3-CG2 4.14Å; W98-Q454 HydrophobicContact CZ2-CB 3.82Å; W98-L455 HydrophobicContact CH2-CB 4.22Å
99	L	90.9	Very high	89.6	Confident	81 Å²	81	80.7 Å²	80.7	42%	0.424	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-61.2	-40.3	-177.7	-173.1	65.7	0	0	0	113	I95 K101 Y102	I95-L99 HydrophobicContact CD1-CD2 4.25Å; I95-L99 HydrophobicContact CG1-CB 4.06Å; I95-L99 HydrophobicContact CG1-CD2 4.09Å; I95-L99 WeakPolarHBondContact O-CB 3.38Å; I95-L99 PolarHBondContact O-N 3.18Å; L99-K101 PolarHBondContact O-N 3.47Å; L99-K101 VanDerWaalsContact O-N 3.12Å; L99-Y102 WeakPolarHBondContact O-CB 3.44Å; L99-Y102 PolarHBondContact O-N 3.26Å
100	P	91.3	Very high	89.9	Confident	106 Å²	106	76.7 Å²	76.7	69%	0.688	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-67.9	-7.8	174.1	-20.1	34.2	0	0	0	114.6
101	K	90.8	Very high	90.4	Very high	178 Å²	178	74.6 Å²	74.6	77%	0.774	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-109.8	15.3	-179.9	-57	-176.4	-177.8	-178.3	0	112.2	W98 L99 D103	W98-K101 CarbonylContact O-C 3.2Å; W98-K101 WeakPolarHBondContact O-CA 3.44Å; W98-K101 PolarHBondContact O-N 3.29Å; L99-K101 PolarHBondContact O-N 3.47Å; L99-K101 VanDerWaalsContact O-N 3.12Å; K101-D103 PolarHBondContact O-N 2.98Å
102	Y	91.4	Very high	90.9	Very high	32 Å²	32	76.6 Å²	76.6	13%	0.125	38%	0.38	C	S	.	.			trans	-81.8	112.2	-174	-169.3	-110.3	0	0	0	112.6	W98 L99 L104 N107 I108 D111 T453 L455	W98-Y102 HydrophobicContact CE3-CD2 4.39Å; W98-Y102 AromaticContact CZ3-CD2 3.92Å; W98-Y102 HydrophobicContact CZ3-CD2 3.92Å; W98-Y102 HydrophobicContact CZ3-CE2 4.45Å; W98-Y102 HydrophobicContact CZ3-CG 4.43Å; L99-Y102 WeakPolarHBondContact O-CB 3.44Å; L99-Y102 PolarHBondContact O-N 3.26Å; Y102-L104 HydrophobicContact CD1-CD2 3.86Å; Y102-L104 HydrophobicContact CD1-CG 4.04Å; Y102-L104 HydrophobicContact CE1-CD2 3.91Å; Y102-L104 HydrophobicContact CE1-CG 4.42Å; Y102-L104 PolarHBondContact O-N 2.98Å; Y102-N107 HydrophobicContact CD2-CB 4.39Å; Y102-N107 HydrophobicContact CE1-CB 4.42Å; Y102-N107 HydrophobicContact CE2-CB 3.51Å; Y102-N107 VanDerWaalsContact OH-C 3.3Å; Y102-N107 WeakPolarHBondContact OH-CB 3.5Å; Y102-N107 PolarHBondContact OH-O 2.89Å; Y102-I108 HydrophobicContact CE1-CD1 4.39Å; Y102-I108 WeakPolarHBondContact OH-CA 3.5Å; Y102-I108 PolarHBondContact OH-N 3.11Å; Y102-D111 WeakPolarHBondContact CE2-OD2 3.24Å; Y102-D111 PolarHBondContact OH-OD2 2.89Å; Y102-T453 HydrophobicContact CD2-CG2 3.73Å; Y102-T453 HydrophobicContact CE2-CG2 3.51Å; Y102-T453 WeakPolarHBondContact CE2-OG1 3.41Å; Y102-L455 HydrophobicContact CE1-CD2 3.8Å
103	D	91.1	Very high	91	Very high	55 Å²	55	76.9 Å²	76.9	29%	0.294	38%	0.384	S	S	.	.			trans	-74.6	93.2	169.9	-171.7	-25.5	0	0	0	110.5	K101 K105 K106 N107	K101-D103 PolarHBondContact O-N 2.98Å; D103-K105 PolarHBondContact O-N 2.85Å; D103-K105 PolarHBondContact OD1-N 2.9Å; D103-K106 HydrophobicContact CB-CB 4.44Å; D103-K106 PolarHBondContact O-N 2.59Å; D103-K106 PolarHBondContact OD1-N 2.94Å; D103-K106 VanDerWaalsContact OD1-N 3.11Å; D103-K106 WeakPolarHBondContact OD2-CD 2.93Å; D103-K106 WeakPolarHBondContact OD2-CG 3.49Å; D103-K106 IonicContact OD2-NZ 2.66Å; D103-K106 PolarHBondContact OD2-NZ 2.94Å; D103-N107 WeakPolarHBondContact O-CB 3.34Å; D103-N107 PolarHBondContact O-N 2.86Å
104	L	90.4	Very high	91.1	Very high	115 Å²	115	74.3 Å²	74.3	60%	0.602	37%	0.37	S	S	*	.	H	α-helix	trans	-53.4	-35.3	175.5	-76.4	164.1	0	0	0	113	Y102 I108	Y102-L104 HydrophobicContact CD1-CD2 3.86Å; Y102-L104 HydrophobicContact CD1-CG 4.04Å; Y102-L104 HydrophobicContact CE1-CD2 3.91Å; Y102-L104 HydrophobicContact CE1-CG 4.42Å; Y102-L104 PolarHBondContact O-N 2.98Å; L104-I108 VanDerWaalsContact O-CB 3.32Å; L104-I108 WeakPolarHBondContact O-CB 3.43Å; L104-I108 WeakPolarHBondContact O-CG2 3.43Å
105	K	88.4	Confident	91.2	Very high	204 Å²	204	73.9 Å²	73.9	89%	0.887	37%	0.367	S	S	*	.	H	α-helix	trans	-76.4	-32	-174.1	-68.5	-173.8	177.9	-178	0	112.4	D103	D103-K105 PolarHBondContact O-N 2.85Å; D103-K105 PolarHBondContact OD1-N 2.9Å
106	K	89.4	Confident	91.3	Very high	159 Å²	159	76.7 Å²	76.7	69%	0.691	38%	0.382	S	S	*	.	H	α-helix	trans	-91.7	-41.9	-179.7	-62.4	-169.6	-170.4	90.3	0	113.4	D103	D103-K106 HydrophobicContact CB-CB 4.44Å; D103-K106 PolarHBondContact O-N 2.59Å; D103-K106 PolarHBondContact OD1-N 2.94Å; D103-K106 VanDerWaalsContact OD1-N 3.11Å; D103-K106 WeakPolarHBondContact OD2-CD 2.93Å; D103-K106 WeakPolarHBondContact OD2-CG 3.49Å; D103-K106 IonicContact OD2-NZ 2.66Å; D103-K106 PolarHBondContact OD2-NZ 2.94Å
107	N	90.7	Very high	91.4	Very high	35 Å²	35	73 Å²	73	19%	0.187	36%	0.363	C	S	.	.	H	α-helix	trans	-95.3	-26.1	-163.1	-61.6	-19.2	0	0	0	114.1	Y102 D103 L109 G110 D111 Q452	Y102-N107 HydrophobicContact CD2-CB 4.39Å; Y102-N107 HydrophobicContact CE1-CB 4.42Å; Y102-N107 HydrophobicContact CE2-CB 3.51Å; Y102-N107 VanDerWaalsContact OH-C 3.3Å; Y102-N107 WeakPolarHBondContact OH-CB 3.5Å; Y102-N107 PolarHBondContact OH-O 2.89Å; D103-N107 WeakPolarHBondContact O-CB 3.34Å; D103-N107 PolarHBondContact O-N 2.86Å; N107-L109 VanDerWaalsContact C-N 3.32Å; N107-L109 PolarHBondContact O-N 3.11Å; N107-G110 PolarHBondContact O-N 2.79Å; N107-D111 PolarHBondContact O-N 2.72Å; N107-Q452 HydrophobicContact CB-CB 4.32Å
108	I	93.1	Very high	91.5	Very high	66 Å²	66	68.8 Å²	68.8	34%	0.338	34%	0.343	S	S	.	.	H	α-helix	trans	-60.7	-39.6	-169.2	-165.1	61.5	0	0	0	112.8	Y102 L104 D111 V112 L455	Y102-I108 HydrophobicContact CE1-CD1 4.39Å; Y102-I108 WeakPolarHBondContact OH-CA 3.5Å; Y102-I108 PolarHBondContact OH-N 3.11Å; L104-I108 VanDerWaalsContact O-CB 3.32Å; L104-I108 WeakPolarHBondContact O-CB 3.43Å; L104-I108 WeakPolarHBondContact O-CG2 3.43Å; I108-D111 PolarHBondContact O-N 2.9Å; I108-V112 HydrophobicContact CD1-CG2 3.88Å; I108-V112 HydrophobicContact CG1-CG2 4.02Å; I108-V112 VanDerWaalsContact O-CB 3.25Å; I108-V112 WeakPolarHBondContact O-CB 3.34Å; I108-V112 WeakPolarHBondContact O-CG2 3.25Å; I108-V112 PolarHBondContact O-N 2.95Å; I108-L455 HydrophobicContact CD1-CD2 3.6Å
109	L	91.4	Very high	91.7	Very high	128 Å²	128	66.7 Å²	66.7	67%	0.67	34%	0.335	S	S	*	.	H	α-helix	trans	-65.1	-43.5	-178.7	-176	64.6	0	0	0	111.4	N107 M113	N107-L109 VanDerWaalsContact C-N 3.32Å; N107-L109 PolarHBondContact O-N 3.11Å; L109-M113 HydrophobicContact CD1-CG 4.14Å; L109-M113 VanDerWaalsContact O-CB 3.23Å; L109-M113 WeakPolarHBondContact O-CB 3.48Å; L109-M113 VanDerWaalsContact O-CG 3.23Å; L109-M113 WeakPolarHBondContact O-CG 3.4Å; L109-M113 PolarHBondContact O-N 3.34Å
110	G	90.9	Very high	91.7	Very high	15 Å²	15	64.5 Å²	64.5	16%	0.155	32%	0.324	C	S	.	.	H	α-helix	trans	-66.9	-46.1	177.1	0	0	0	0	0	112.2	N107 S114	N107-G110 PolarHBondContact O-N 2.79Å; G110-S114 WeakPolarHBondContact O-CB 3.32Å; G110-S114 PolarHBondContact O-N 3Å
111	D	93.9	Very high	91.6	Very high	0 Å²	0	60 Å²	60	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-67.2	-38.1	-179.9	-72.5	-30.9	0	0	0	112.6	Y102 N107 I108 G115 C451 Q452 T453 L455 S456	Y102-D111 WeakPolarHBondContact CE2-OD2 3.24Å; Y102-D111 PolarHBondContact OH-OD2 2.89Å; N107-D111 PolarHBondContact O-N 2.72Å; I108-D111 PolarHBondContact O-N 2.9Å; D111-G115 PolarHBondContact O-N 2.84Å; D111-C451 WeakPolarHBondContact OD1-CA 3.44Å; D111-C451 PolarHBondContact OD1-SG 3.41Å; D111-Q452 PolarHBondContact OD1-N 3.05Å; D111-T453 PolarHBondContact OD1-N 3.15Å; D111-T453 PolarHBondContact OD2-N 3.37Å; D111-T453 PolarHBondContact OD2-OG1 2.9Å; D111-L455 HydrophobicContact CB-CB 4.32Å; D111-S456 VanDerWaalsContact O-CA 3.29Å; D111-S456 WeakPolarHBondContact O-CA 3.38Å; D111-S456 VanDerWaalsContact O-CB 3.22Å; D111-S456 WeakPolarHBondContact O-CB 3.48Å; D111-S456 PolarHBondContact O-OG 2.93Å
112	V	94.3	Very high	91.6	Very high	56 Å²	56	51.5 Å²	51.5	34%	0.339	26%	0.257	S	S	.	.	H	α-helix	trans	-71.3	-50	176.3	171.8	0	0	0	0	111.7	I108 S114 G115 L116 V459	I108-V112 HydrophobicContact CD1-CG2 3.88Å; I108-V112 HydrophobicContact CG1-CG2 4.02Å; I108-V112 VanDerWaalsContact O-CB 3.25Å; I108-V112 WeakPolarHBondContact O-CB 3.34Å; I108-V112 WeakPolarHBondContact O-CG2 3.25Å; I108-V112 PolarHBondContact O-N 2.95Å; V112-S114 VanDerWaalsContact C-N 3.3Å; V112-S114 PolarHBondContact O-N 2.74Å; V112-G115 PolarHBondContact O-N 3.09Å; V112-L116 WeakPolarHBondContact O-CB 3.27Å; V112-L116 PolarHBondContact O-N 2.87Å; V112-V459 HydrophobicContact CG1-CG1 4.5Å; V112-V459 HydrophobicContact CG2-CG2 4.13Å
113	M	91.7	Very high	91.6	Very high	82 Å²	82	50.3 Å²	50.3	40%	0.404	25%	0.253	S	S	.	.	H	α-helix	trans	-60.7	-42.3	178.1	-74.4	-61.2	-58.9	0	0	111.5	L109 I117	L109-M113 HydrophobicContact CD1-CG 4.14Å; L109-M113 VanDerWaalsContact O-CB 3.23Å; L109-M113 WeakPolarHBondContact O-CB 3.48Å; L109-M113 VanDerWaalsContact O-CG 3.23Å; L109-M113 WeakPolarHBondContact O-CG 3.4Å; L109-M113 PolarHBondContact O-N 3.34Å; M113-I117 HydrophobicContact CE-CD1 4.27Å; M113-I117 WeakPolarHBondContact O-CB 3.5Å; M113-I117 WeakPolarHBondContact O-CG1 3.45Å; M113-I117 PolarHBondContact O-N 2.73Å
114	S	92.5	Very high	91.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-57.4	-54.6	171.1	168.7	0	0	0	0	111.6	G110 V112 L116 I117 V118 K446 T449 S456	G110-S114 WeakPolarHBondContact O-CB 3.32Å; G110-S114 PolarHBondContact O-N 3Å; V112-S114 VanDerWaalsContact C-N 3.3Å; V112-S114 PolarHBondContact O-N 2.74Å; S114-L116 VanDerWaalsContact C-N 3.27Å; S114-L116 PolarHBondContact O-N 3.03Å; S114-I117 PolarHBondContact O-N 2.97Å; S114-V118 WeakPolarHBondContact O-CB 3.31Å; S114-V118 WeakPolarHBondContact O-CG2 3.38Å; S114-V118 PolarHBondContact O-N 3.21Å; S114-K446 WeakPolarHBondContact OG-CA 3.41Å; S114-K446 WeakPolarHBondContact OG-CG 3.22Å; S114-K446 PolarHBondContact OG-O 2.89Å; S114-T449 VanDerWaalsContact CA-OG1 3.29Å; S114-T449 WeakPolarHBondContact CA-OG1 3.41Å; S114-T449 WeakPolarHBondContact CB-OG1 3.44Å; S114-T449 PolarHBondContact OG-OG1 3.2Å; S114-S456 WeakPolarHBondContact CB-OG 3.34Å; S114-S456 PolarHBondContact OG-OG 3.09Å
115	G	93.8	Very high	91.5	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.5	-33.3	-176.2	0	0	0	0	0	113.7	D111 V112 G119 S456 T460	D111-G115 PolarHBondContact O-N 2.84Å; V112-G115 PolarHBondContact O-N 3.09Å; G115-G119 WeakPolarHBondContact O-CA 3.09Å; G115-G119 PolarHBondContact O-N 3.08Å; G115-S456 VanDerWaalsContact CA-O 3.24Å; G115-S456 WeakPolarHBondContact CA-O 3.4Å; G115-S456 WeakPolarHBondContact CA-OG 3.37Å; G115-S456 PolarHBondContact N-OG 3.47Å; G115-S456 VanDerWaalsContact N-OG 3.1Å; G115-T460 WeakPolarHBondContact O-CA 3.39Å; G115-T460 PolarHBondContact O-OG1 3.38Å
116	L	93.4	Very high	91.7	Very high	76 Å²	76	33.2 Å²	33.2	40%	0.398	17%	0.172	S	C	.	.	H	α-helix	trans	-69.4	-49.7	175.1	-178.2	144.8	0	0	0	111.8	V112 S114 G119 I120	V112-L116 WeakPolarHBondContact O-CB 3.27Å; V112-L116 PolarHBondContact O-N 2.87Å; S114-L116 VanDerWaalsContact C-N 3.27Å; S114-L116 PolarHBondContact O-N 3.03Å; L116-G119 PolarHBondContact O-N 3.09Å; L116-I120 HydrophobicContact CD2-CD1 3.69Å; L116-I120 HydrophobicContact CG-CD1 4.25Å; L116-I120 WeakPolarHBondContact O-CB 3.41Å; L116-I120 VanDerWaalsContact O-CG1 3.31Å; L116-I120 WeakPolarHBondContact O-CG1 3.34Å; L116-I120 PolarHBondContact O-N 3.19Å
117	I	91.1	Very high	91.8	Very high	10 Å²	10	25.7 Å²	25.7	5%	0.051	14%	0.139	C	C	.	.	H	α-helix	trans	-65.2	-42.1	179.1	-68.5	166.9	0	0	0	110.7	M113 S114 L121 A331 V445 T449	M113-I117 HydrophobicContact CE-CD1 4.27Å; M113-I117 WeakPolarHBondContact O-CB 3.5Å; M113-I117 WeakPolarHBondContact O-CG1 3.45Å; M113-I117 PolarHBondContact O-N 2.73Å; S114-I117 PolarHBondContact O-N 2.97Å; I117-L121 HydrophobicContact CG2-CD1 4.14Å; I117-L121 VanDerWaalsContact O-CG 3.29Å; I117-L121 WeakPolarHBondContact O-CG 3.47Å; I117-L121 PolarHBondContact O-N 3.16Å; I117-A331 HydrophobicContact CD1-CB 4.3Å; I117-V445 HydrophobicContact CG2-CG1 3.68Å; I117-T449 HydrophobicContact CB-CG2 4.4Å; I117-T449 HydrophobicContact CD1-CG2 3.58Å; I117-T449 HydrophobicContact CG2-CG2 4.36Å
118	V	92.1	Very high	91.8	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.012	13%	0.131	C	C	.	.	H	α-helix	trans	-64.2	-51.3	176.6	172	0	0	0	0	109.9	S114 I120 L121 L122 V445 K446 T460	S114-V118 WeakPolarHBondContact O-CB 3.31Å; S114-V118 WeakPolarHBondContact O-CG2 3.38Å; S114-V118 PolarHBondContact O-N 3.21Å; V118-I120 VanDerWaalsContact C-N 3.32Å; V118-I120 PolarHBondContact O-N 3.21Å; V118-L121 PolarHBondContact O-N 3.42Å; V118-L122 HydrophobicContact CB-CD1 4.43Å; V118-L122 HydrophobicContact CG1-CD1 3.36Å; V118-L122 WeakPolarHBondContact O-CD1 3.45Å; V118-L122 PolarHBondContact O-N 2.9Å; V118-V445 HydrophobicContact CG2-CG1 4.46Å; V118-K446 HydrophobicContact CG2-CB 3.81Å; V118-T460 HydrophobicContact CG1-CG2 4.07Å
119	G	93.2	Very high	91.7	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-53	-45.9	176.1	0	0	0	0	0	113.3	G115 L116 L121 L122 V123	G115-G119 WeakPolarHBondContact O-CA 3.09Å; G115-G119 PolarHBondContact O-N 3.08Å; L116-G119 PolarHBondContact O-N 3.09Å; G119-L121 PolarHBondContact O-N 2.64Å; G119-L122 PolarHBondContact O-N 2.83Å; G119-V123 PolarHBondContact O-N 3.02Å
120	I	90.8	Very high	91.7	Very high	36 Å²	36	15.9 Å²	15.9	19%	0.185	9%	0.087	C	C	.	.	H	α-helix	trans	-57.2	-47.7	173.9	-78.4	169.7	0	0	0	111.9	L116 V118 L122 V123 P124 P334 L337	L116-I120 HydrophobicContact CD2-CD1 3.69Å; L116-I120 HydrophobicContact CG-CD1 4.25Å; L116-I120 WeakPolarHBondContact O-CB 3.41Å; L116-I120 VanDerWaalsContact O-CG1 3.31Å; L116-I120 WeakPolarHBondContact O-CG1 3.34Å; L116-I120 PolarHBondContact O-N 3.19Å; V118-I120 VanDerWaalsContact C-N 3.32Å; V118-I120 PolarHBondContact O-N 3.21Å; I120-L122 VanDerWaalsContact C-N 3.34Å; I120-L122 PolarHBondContact O-N 3.47Å; I120-V123 PolarHBondContact O-N 3.09Å; I120-P124 WeakPolarHBondContact O-CD 3.35Å; I120-P334 HydrophobicContact CG2-CB 4.27Å; I120-L337 HydrophobicContact CD1-CD2 4.28Å; I120-L337 HydrophobicContact CG1-CD2 4.43Å; I120-L337 HydrophobicContact CG2-CB 3.66Å; I120-L337 HydrophobicContact CG2-CD1 4.31Å; I120-L337 HydrophobicContact CG2-CD2 3.64Å; I120-L337 HydrophobicContact CG2-CG 4.05Å
121	L	89.1	Confident	91.6	Very high	10 Å²	10	16.5 Å²	16.5	5%	0.052	9%	0.086	C	C	.	.	H	α-helix	trans	-68.5	-31.4	179.6	-69	171.3	0	0	0	112.6	I117 V118 G119 V123 Q125 E336 V445	I117-L121 HydrophobicContact CG2-CD1 4.14Å; I117-L121 VanDerWaalsContact O-CG 3.29Å; I117-L121 WeakPolarHBondContact O-CG 3.47Å; I117-L121 PolarHBondContact O-N 3.16Å; V118-L121 PolarHBondContact O-N 3.42Å; G119-L121 PolarHBondContact O-N 2.64Å; L121-V123 VanDerWaalsContact C-N 3.25Å; L121-V123 PolarHBondContact O-N 3.03Å; L121-Q125 WeakPolarHBondContact O-CB 3.26Å; L121-Q125 VanDerWaalsContact O-CD 3.24Å; L121-Q125 WeakPolarHBondContact O-CG 3.38Å; L121-E336 HydrophobicContact CD2-CB 3.78Å; L121-E336 HydrophobicContact CD2-CG 4.28Å; L121-V445 HydrophobicContact CD1-CB 4.24Å; L121-V445 HydrophobicContact CD1-CG1 3.79Å; L121-V445 HydrophobicContact CD1-CG2 4.03Å
122	L	91.1	Very high	91.3	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-65.6	-24.5	176.2	-89.4	83	0	0	0	112.7	V118 G119 I120 S126 K442 T460 L464	V118-L122 HydrophobicContact CB-CD1 4.43Å; V118-L122 HydrophobicContact CG1-CD1 3.36Å; V118-L122 WeakPolarHBondContact O-CD1 3.45Å; V118-L122 PolarHBondContact O-N 2.9Å; G119-L122 PolarHBondContact O-N 2.83Å; I120-L122 VanDerWaalsContact C-N 3.34Å; I120-L122 PolarHBondContact O-N 3.47Å; L122-S126 WeakPolarHBondContact O-CA 3.27Å; L122-S126 WeakPolarHBondContact O-CB 3.49Å; L122-S126 PolarHBondContact O-N 2.92Å; L122-S126 PolarHBondContact O-OG 2.88Å; L122-K442 HydrophobicContact CD1-CD 3.55Å; L122-K442 HydrophobicContact CD1-CG 4.23Å; L122-K442 HydrophobicContact CD2-CD 4.3Å; L122-K442 HydrophobicContact CG-CD 3.68Å; L122-T460 HydrophobicContact CD1-CG2 4.23Å; L122-T460 HydrophobicContact CD2-CG2 4.08Å; L122-L464 HydrophobicContact CB-CD1 4.49Å; L122-L464 HydrophobicContact CB-CD2 4.15Å; L122-L464 HydrophobicContact CD2-CD1 4.15Å
123	V	91.2	Very high	91.1	Very high	6 Å²	6	13.9 Å²	13.9	4%	0.036	7%	0.07	C	C	.	.	H	α-helix	trans	-62.8	-63.3	-176.5	176.8	0	0	0	0	112.9	G119 I120 L121 Q125 S126 I127 L141 L464 V467 F475	G119-V123 PolarHBondContact O-N 3.02Å; I120-V123 PolarHBondContact O-N 3.09Å; L121-V123 VanDerWaalsContact C-N 3.25Å; L121-V123 PolarHBondContact O-N 3.03Å; V123-Q125 VanDerWaalsContact C-N 3.29Å; V123-Q125 PolarHBondContact O-N 2.8Å; V123-S126 WeakPolarHBondContact O-CB 3.49Å; V123-S126 PolarHBondContact O-N 3.39Å; V123-S126 VanDerWaalsContact O-N 3.14Å; V123-I127 PolarHBondContact O-N 2.74Å; V123-L141 HydrophobicContact CG1-CD2 4.33Å; V123-L464 HydrophobicContact CG2-CD2 3.99Å; V123-V467 HydrophobicContact CG1-CG1 4.07Å; V123-V467 HydrophobicContact CG2-CB 4.35Å; V123-V467 HydrophobicContact CG2-CG1 4.14Å; V123-V467 HydrophobicContact CG2-CG2 3.76Å; V123-F475 HydrophobicContact CG1-CD2 4.42Å; V123-F475 HydrophobicContact CG1-CE1 4.47Å; V123-F475 HydrophobicContact CG1-CE2 3.63Å; V123-F475 HydrophobicContact CG1-CZ 3.65Å
124	P	89.8	Confident	91	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.013	7%	0.067	C	C	.	.	H	α-helix	trans	-67.2	-31.9	179.7	28.1	-35.5	0	0	0	112.1	I120 S126 I127 A128 V340 L483 I486	I120-P124 WeakPolarHBondContact O-CD 3.35Å; P124-S126 VanDerWaalsContact C-N 3.3Å; P124-S126 PolarHBondContact O-N 2.88Å; P124-I127 PolarHBondContact O-N 2.75Å; P124-A128 VanDerWaalsContact O-CB 3.31Å; P124-A128 WeakPolarHBondContact O-CB 3.41Å; P124-A128 PolarHBondContact O-N 3.49Å; P124-V340 HydrophobicContact CB-CG2 3.77Å; P124-V340 HydrophobicContact CG-CG2 4.16Å; P124-L483 HydrophobicContact CB-CD2 4.11Å; P124-L483 VanDerWaalsContact O-CD2 3.27Å; P124-L483 WeakPolarHBondContact O-CD2 3.37Å; P124-I486 HydrophobicContact CB-CD1 4.22Å
125	Q	90.1	Very high	90.9	Very high	13 Å²	13	11.8 Å²	11.8	6%	0.061	7%	0.068	C	C	.	.	H	α-helix	trans	-65.4	-34.5	174.5	-64.9	175.8	19.3	0	0	111.5	L121 V123 Y129 E336 N490	L121-Q125 WeakPolarHBondContact O-CB 3.26Å; L121-Q125 VanDerWaalsContact O-CD 3.24Å; L121-Q125 WeakPolarHBondContact O-CG 3.38Å; V123-Q125 VanDerWaalsContact C-N 3.29Å; V123-Q125 PolarHBondContact O-N 2.8Å; Q125-Y129 HydrophobicContact CB-CD2 4.41Å; Q125-Y129 HydrophobicContact CB-CE2 4.3Å; Q125-Y129 WeakPolarHBondContact O-CD2 2.94Å; Q125-Y129 PolarHBondContact O-N 2.92Å; Q125-Y129 VanDerWaalsContact O-N 3.12Å; Q125-E336 PolarHBondContact NE2-OE2 3.49Å; Q125-N490 PolarHBondContact NE2-ND2 2.9Å
126	S	91.9	Very high	90.8	Very high	1 Å²	1	15 Å²	15	1%	0.007	8%	0.083	C	C	.	.	H	α-helix	trans	-62.6	-47.5	176.1	-69.3	0	0	0	0	111.8	L122 V123 P124 S130 G140 S144 I164	L122-S126 WeakPolarHBondContact O-CA 3.27Å; L122-S126 WeakPolarHBondContact O-CB 3.49Å; L122-S126 PolarHBondContact O-N 2.92Å; L122-S126 PolarHBondContact O-OG 2.88Å; V123-S126 WeakPolarHBondContact O-CB 3.49Å; V123-S126 PolarHBondContact O-N 3.39Å; V123-S126 VanDerWaalsContact O-N 3.14Å; P124-S126 VanDerWaalsContact C-N 3.3Å; P124-S126 PolarHBondContact O-N 2.88Å; S126-S130 PolarHBondContact O-N 2.88Å; S126-S130 VanDerWaalsContact O-N 3.09Å; S126-G140 PolarHBondContact OG-O 2.97Å; S126-S144 PolarHBondContact OG-OG 3.33Å; S126-I164 WeakPolarHBondContact O-CD1 3.39Å
127	I	91.4	Very high	90.7	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-67.8	-43.8	179.2	-59.4	170.1	0	0	0	110.9	V123 P124 Y129 S130 L131 P137 I364 F475 L483	V123-I127 PolarHBondContact O-N 2.74Å; P124-I127 PolarHBondContact O-N 2.75Å; I127-Y129 PolarHBondContact O-N 3.41Å; I127-S130 PolarHBondContact O-OG 2.91Å; I127-L131 HydrophobicContact CG2-CD1 4.39Å; I127-L131 WeakPolarHBondContact O-CG 3.36Å; I127-L131 PolarHBondContact O-N 3.15Å; I127-P137 HydrophobicContact CG1-CB 4.23Å; I127-P137 HydrophobicContact CG2-CB 3.91Å; I127-P137 HydrophobicContact CG2-CG 4.11Å; I127-I364 HydrophobicContact CD1-CD1 4.24Å; I127-F475 HydrophobicContact CD1-CB 4.34Å; I127-F475 HydrophobicContact CD1-CD2 4.39Å; I127-F475 HydrophobicContact CD1-CG 4.29Å; I127-L483 HydrophobicContact CB-CD1 4.49Å; I127-L483 HydrophobicContact CB-CD2 4.15Å; I127-L483 HydrophobicContact CG2-CD1 3.63Å; I127-L483 HydrophobicContact CG2-CD2 4.17Å
128	A	90.3	Very high	90.7	Very high	2 Å²	2	11.4 Å²	11.4	2%	0.017	7%	0.065	C	C	.	.	H	α-helix	trans	-64.5	-39.6	-178	0	0	0	0	0	113.1	P124 L132 L483 T487	P124-A128 VanDerWaalsContact O-CB 3.31Å; P124-A128 WeakPolarHBondContact O-CB 3.41Å; P124-A128 PolarHBondContact O-N 3.49Å; A128-L132 PolarHBondContact O-N 2.86Å; A128-L483 HydrophobicContact CB-CB 3.93Å; A128-L483 HydrophobicContact CB-CD2 4.01Å; A128-T487 WeakPolarHBondContact CB-OG1 3.5Å
129	Y	91.1	Very high	90.8	Very high	22 Å²	22	12 Å²	12	9%	0.086	7%	0.067	C	C	.	.	H	α-helix	trans	-86.1	-24.2	-178.9	-66.7	-51.3	0	0	0	113.8	Q125 I127 L132 A133 I164 C169 T487	Q125-Y129 HydrophobicContact CB-CD2 4.41Å; Q125-Y129 HydrophobicContact CB-CE2 4.3Å; Q125-Y129 WeakPolarHBondContact O-CD2 2.94Å; Q125-Y129 PolarHBondContact O-N 2.92Å; Q125-Y129 VanDerWaalsContact O-N 3.12Å; I127-Y129 PolarHBondContact O-N 3.41Å; Y129-L132 HydrophobicContact CD1-CD2 3.86Å; Y129-L132 HydrophobicContact CE1-CD2 4.41Å; Y129-L132 WeakPolarHBondContact O-CB 3.31Å; Y129-L132 PolarHBondContact O-N 3.32Å; Y129-A133 PolarHBondContact O-N 3.03Å; Y129-I164 HydrophobicContact CD2-CD1 4.18Å; Y129-I164 HydrophobicContact CD2-CG1 4.2Å; Y129-I164 HydrophobicContact CG-CD1 4.39Å; Y129-C169 WeakPolarHBondContact O-CB 3.19Å; Y129-T487 HydrophobicContact CD1-CG2 4.42Å; Y129-T487 HydrophobicContact CE1-CG2 3.7Å
130	S	92.6	Very high	90.8	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-67.3	-41.1	170.6	73.2	0	0	0	0	111.1	S126 I127 L132 A133 G134 Q135 E136 P137	S126-S130 PolarHBondContact O-N 2.88Å; S126-S130 VanDerWaalsContact O-N 3.09Å; I127-S130 PolarHBondContact O-OG 2.91Å; S130-L132 PolarHBondContact O-N 3.13Å; S130-A133 CarbonylContact O-C 3.45Å; S130-A133 WeakPolarHBondContact O-CA 3.45Å; S130-A133 WeakPolarHBondContact O-CB 3.41Å; S130-A133 PolarHBondContact O-N 3.3Å; S130-G134 PolarHBondContact O-N 2.96Å; S130-Q135 CarbonylContact C-O 3.3Å; S130-Q135 VanDerWaalsContact C-O 3.3Å; S130-Q135 WeakPolarHBondContact O-CA 3.23Å; S130-Q135 PolarHBondContact O-N 2.88Å; S130-E136 VanDerWaalsContact CB-O 3.32Å; S130-E136 WeakPolarHBondContact CB-O 3.4Å; S130-E136 PolarHBondContact OG-O 3.38Å; S130-P137 WeakPolarHBondContact OG-CA 3.35Å
131	L	88.9	Confident	90.9	Very high	28 Å²	28	10.3 Å²	10.3	15%	0.147	6%	0.058	C	C	.	.	H	α-helix	trans	-57.2	-37.7	168.6	-67.2	172.7	0	0	0	111.8	I127 A133 G134 Q135 R279 K480 L483	I127-L131 HydrophobicContact CG2-CD1 4.39Å; I127-L131 WeakPolarHBondContact O-CG 3.36Å; I127-L131 PolarHBondContact O-N 3.15Å; L131-A133 VanDerWaalsContact C-N 3.31Å; L131-A133 PolarHBondContact O-N 2.93Å; L131-G134 PolarHBondContact O-N 2.89Å; L131-G134 VanDerWaalsContact O-N 3.08Å; L131-Q135 PolarHBondContact N-O 2.78Å; L131-R279 PolarHBondContact O-NH2 2.89Å; L131-K480 HydrophobicContact CD1-CD 4.45Å; L131-K480 HydrophobicContact CD1-CG 4.03Å; L131-L483 HydrophobicContact CD1-CD1 4.19Å
132	L	86.7	Confident	91.2	Very high	1 Å²	1	10 Å²	10	1%	0.005	6%	0.057	C	C	.	.	H	α-helix	trans	-65.4	-31.2	174	-168.2	63	0	0	0	113	A128 Y129 S130 G134 C169 L170 I264 R279	A128-L132 PolarHBondContact O-N 2.86Å; Y129-L132 HydrophobicContact CD1-CD2 3.86Å; Y129-L132 HydrophobicContact CE1-CD2 4.41Å; Y129-L132 WeakPolarHBondContact O-CB 3.31Å; Y129-L132 PolarHBondContact O-N 3.32Å; S130-L132 PolarHBondContact O-N 3.13Å; L132-G134 VanDerWaalsContact C-N 3.27Å; L132-G134 PolarHBondContact O-N 3.37Å; L132-C169 HydrophobicContact CB-CB 4.44Å; L132-C169 HydrophobicContact CD2-CB 4.48Å; L132-L170 HydrophobicContact CD1-CD2 3.6Å; L132-L170 HydrophobicContact CD1-CG 4.33Å; L132-L170 HydrophobicContact CD2-CD2 4.28Å; L132-L170 HydrophobicContact CD2-CG 4.1Å; L132-L170 HydrophobicContact CG-CD2 3.85Å; L132-L170 HydrophobicContact CG-CG 4.13Å; L132-I264 HydrophobicContact CD2-CG1 4.24Å; L132-I264 HydrophobicContact CD2-CG2 3.84Å; L132-R279 PolarHBondContact O-NH2 3.49Å
133	A	90.9	Very high	91.4	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	2.5	171.3	0	0	0	0	0	114.5	Y129 S130 L131 Q135 C169 I172 G173 F434	Y129-A133 PolarHBondContact O-N 3.03Å; S130-A133 CarbonylContact O-C 3.45Å; S130-A133 WeakPolarHBondContact O-CA 3.45Å; S130-A133 WeakPolarHBondContact O-CB 3.41Å; S130-A133 PolarHBondContact O-N 3.3Å; L131-A133 VanDerWaalsContact C-N 3.31Å; L131-A133 PolarHBondContact O-N 2.93Å; A133-Q135 HydrophobicContact CB-CG 3.92Å; A133-Q135 PolarHBondContact O-N 2.81Å; A133-C169 WeakPolarHBondContact CA-O 3.38Å; A133-C169 HydrophobicContact CB-CB 4.06Å; A133-C169 WeakPolarHBondContact CB-O 3.48Å; A133-I172 HydrophobicContact CB-CB 4.49Å; A133-I172 HydrophobicContact CB-CG2 4.33Å; A133-G173 WeakPolarHBondContact O-CA 3.17Å; A133-F434 HydrophobicContact CB-CE2 4.45Å
134	G	88.5	Confident	91.6	Very high	32 Å²	32	9.7 Å²	9.7	33%	0.33	6%	0.055	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.8	14.2	-174.9	0	0	0	0	0	114	S130 L131 L132	S130-G134 PolarHBondContact O-N 2.96Å; L131-G134 PolarHBondContact O-N 2.89Å; L131-G134 VanDerWaalsContact O-N 3.08Å; L132-G134 VanDerWaalsContact C-N 3.27Å; L132-G134 PolarHBondContact O-N 3.37Å
135	Q	91.3	Very high	91.9	Very high	5 Å²	5	10.6 Å²	10.6	2%	0.023	6%	0.058	C	C	.	.			trans	-103.4	161.6	-176.5	-54.3	-59.4	-23.2	0	0	111.5	S130 L131 A133 Y139 A218 I219 F434	S130-Q135 CarbonylContact C-O 3.3Å; S130-Q135 VanDerWaalsContact C-O 3.3Å; S130-Q135 WeakPolarHBondContact O-CA 3.23Å; S130-Q135 PolarHBondContact O-N 2.88Å; L131-Q135 PolarHBondContact N-O 2.78Å; A133-Q135 HydrophobicContact CB-CG 3.92Å; A133-Q135 PolarHBondContact O-N 2.81Å; Q135-Y139 HydrophobicContact CB-CD2 4.29Å; Q135-A218 PolarHBondContact NE2-O 3.04Å; Q135-I219 HydrophobicContact CG-CD1 4.32Å; Q135-I219 VanDerWaalsContact OE1-N 3.16Å; Q135-F434 HydrophobicContact CB-CE1 4.32Å; Q135-F434 HydrophobicContact CG-CD1 4.16Å; Q135-F434 HydrophobicContact CG-CE1 4.33Å
136	E	91.2	Very high	92.2	Very high	67 Å²	67	11.4 Å²	11.4	31%	0.313	6%	0.062	S	C	.	.			trans	-71.1	158.2	176.2	-58.3	-178.4	148.7	0	0	112.2	S130 V138 Y139 S215	S130-E136 VanDerWaalsContact CB-O 3.32Å; S130-E136 WeakPolarHBondContact CB-O 3.4Å; S130-E136 PolarHBondContact OG-O 3.38Å; E136-V138 VanDerWaalsContact C-N 3.27Å; E136-V138 PolarHBondContact O-N 3.27Å; E136-Y139 HydrophobicContact CB-CD2 3.84Å; E136-Y139 HydrophobicContact CB-CE2 3.67Å; E136-Y139 HydrophobicContact CG-CE2 4Å; E136-Y139 PolarHBondContact O-N 3.25Å; E136-Y139 WeakPolarHBondContact OE2-CE2 3.48Å; E136-Y139 PolarHBondContact OE2-OH 2.99Å; E136-S215 WeakPolarHBondContact OE1-CB 3.41Å; E136-S215 PolarHBondContact OE1-OG 3.21Å
137	P	91	Very high	92.3	Very high	10 Å²	10	11.4 Å²	11.4	7%	0.065	6%	0.062	C	C	.	.	H	α-helix	trans	-50.3	-39.5	179.7	-34.2	39.7	0	0	0	115.6	I127 S130 G140 I364	I127-P137 HydrophobicContact CG1-CB 4.23Å; I127-P137 HydrophobicContact CG2-CB 3.91Å; I127-P137 HydrophobicContact CG2-CG 4.11Å; S130-P137 WeakPolarHBondContact OG-CA 3.35Å; P137-G140 PolarHBondContact O-N 2.77Å; P137-I364 HydrophobicContact CB-CD1 3.65Å; P137-I364 HydrophobicContact CB-CG1 3.87Å; P137-I364 HydrophobicContact CB-CG2 4.41Å; P137-I364 HydrophobicContact CG-CD1 4.27Å; P137-I364 HydrophobicContact CG-CG1 4.24Å
138	V	92.4	Very high	92.5	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.006	6%	0.064	C	C	.	.	H	α-helix	trans	-65.8	-40.6	-171.8	64.1	0	0	0	0	113.2	E136 G140 L141 Y142 I364 P365 M369 L468	E136-V138 VanDerWaalsContact C-N 3.27Å; E136-V138 PolarHBondContact O-N 3.27Å; V138-G140 PolarHBondContact O-N 3.18Å; V138-L141 WeakPolarHBondContact O-CB 3.33Å; V138-L141 PolarHBondContact O-N 2.82Å; V138-Y142 HydrophobicContact CG2-CD1 4.3Å; V138-Y142 HydrophobicContact CG2-CD2 4.34Å; V138-Y142 HydrophobicContact CG2-CE1 3.78Å; V138-Y142 HydrophobicContact CG2-CE2 3.82Å; V138-Y142 VanDerWaalsContact CG2-CZ 3.5Å; V138-Y142 PolarHBondContact O-N 2.7Å; V138-I364 HydrophobicContact CB-CG2 4.1Å; V138-P365 HydrophobicContact CB-CG 4.32Å; V138-P365 HydrophobicContact CG1-CG 4.16Å; V138-P365 HydrophobicContact CG2-CG 4.31Å; V138-M369 HydrophobicContact CG1-CE 3.67Å; V138-M369 HydrophobicContact CG2-CE 4.48Å; V138-L468 HydrophobicContact CG2-CD2 4.28Å
139	Y	93.5	Very high	92.8	Very high	15 Å²	15	14.5 Å²	14.5	6%	0.059	8%	0.078	C	C	.	.	H	α-helix	trans	-64.7	-29.3	-177	-53.7	-60	0	0	0	112.5	Q135 E136 Y142 T143 I219 M369 H432	Q135-Y139 HydrophobicContact CB-CD2 4.29Å; E136-Y139 HydrophobicContact CB-CD2 3.84Å; E136-Y139 HydrophobicContact CB-CE2 3.67Å; E136-Y139 HydrophobicContact CG-CE2 4Å; E136-Y139 PolarHBondContact O-N 3.25Å; E136-Y139 WeakPolarHBondContact OE2-CE2 3.48Å; E136-Y139 PolarHBondContact OE2-OH 2.99Å; Y139-Y142 HydrophobicContact CD1-CD2 4.22Å; Y139-Y142 HydrophobicContact CD1-CE2 4.49Å; Y139-T143 VanDerWaalsContact O-CB 3.26Å; Y139-T143 WeakPolarHBondContact O-CB 3.5Å; Y139-T143 PolarHBondContact O-N 3.04Å; Y139-T143 PolarHBondContact O-OG1 2.63Å; Y139-I219 HydrophobicContact CD1-CD1 4.06Å; Y139-I219 HydrophobicContact CD1-CG1 3.8Å; Y139-I219 HydrophobicContact CD2-CB 4.27Å; Y139-I219 HydrophobicContact CD2-CD1 3.94Å; Y139-I219 HydrophobicContact CD2-CG1 3.97Å; Y139-I219 HydrophobicContact CE1-CB 4.48Å; Y139-I219 HydrophobicContact CE1-CG1 3.9Å; Y139-I219 HydrophobicContact CE1-CG2 4.36Å; Y139-I219 HydrophobicContact CE2-CB 4.02Å; Y139-I219 HydrophobicContact CE2-CG1 4.08Å; Y139-I219 HydrophobicContact CE2-CG2 4.23Å; Y139-I219 HydrophobicContact CG-CD1 3.69Å; Y139-I219 HydrophobicContact CG-CG1 3.84Å; Y139-M369 HydrophobicContact CE1-CE 3.73Å; Y139-M369 HydrophobicContact CE1-SD 3.63Å; Y139-H432 HydrophobicContact CD1-CB 3.69Å; Y139-H432 WeakPolarHBondContact CD1-O 3.29Å; Y139-H432 HydrophobicContact CE1-CB 3.65Å
140	G	93.4	Very high	93	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.6	-36.8	173.1	0	0	0	0	0	112.9	S126 P137 V138 S144	S126-G140 PolarHBondContact OG-O 2.97Å; P137-G140 PolarHBondContact O-N 2.77Å; V138-G140 PolarHBondContact O-N 3.18Å; G140-S144 WeakPolarHBondContact O-CB 3.28Å; G140-S144 PolarHBondContact O-N 3.43Å; G140-S144 VanDerWaalsContact O-N 3.09Å; G140-S144 PolarHBondContact O-OG 3.12Å
141	L	93.3	Very high	93.1	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-72.3	-44.9	177.5	-67.3	167.7	0	0	0	111.1	V123 V138 T143 S144 F145 L464 V467 L468	V123-L141 HydrophobicContact CG1-CD2 4.33Å; V138-L141 WeakPolarHBondContact O-CB 3.33Å; V138-L141 PolarHBondContact O-N 2.82Å; L141-T143 PolarHBondContact O-N 3.11Å; L141-S144 PolarHBondContact O-N 3.06Å; L141-F145 WeakPolarHBondContact O-CB 3.47Å; L141-F145 PolarHBondContact O-N 3.4Å; L141-L464 HydrophobicContact CD2-CD2 4.05Å; L141-V467 HydrophobicContact CD1-CG1 4.37Å; L141-V467 HydrophobicContact CD2-CG1 4.46Å; L141-L468 HydrophobicContact CB-CD2 3.59Å; L141-L468 HydrophobicContact CB-CG 4.14Å; L141-L468 HydrophobicContact CD1-CD2 4.11Å; L141-L468 HydrophobicContact CG-CD2 4.5Å
142	Y	94.8	Very high	93.4	Very high	4 Å²	4	14.6 Å²	14.6	2%	0.016	8%	0.078	C	C	.	.	H	α-helix	trans	-55.9	-49.8	171.9	-66.7	-19.3	0	0	0	111.4	V138 Y139 S144 F145 F146 G367 F368 M369 C433 L468	V138-Y142 HydrophobicContact CG2-CD1 4.3Å; V138-Y142 HydrophobicContact CG2-CD2 4.34Å; V138-Y142 HydrophobicContact CG2-CE1 3.78Å; V138-Y142 HydrophobicContact CG2-CE2 3.82Å; V138-Y142 VanDerWaalsContact CG2-CZ 3.5Å; V138-Y142 PolarHBondContact O-N 2.7Å; Y139-Y142 HydrophobicContact CD1-CD2 4.22Å; Y139-Y142 HydrophobicContact CD1-CE2 4.49Å; Y142-S144 VanDerWaalsContact C-N 3.35Å; Y142-S144 PolarHBondContact O-N 2.92Å; Y142-F145 WeakPolarHBondContact O-CB 3.3Å; Y142-F145 PolarHBondContact O-N 3.25Å; Y142-F145 VanDerWaalsContact O-N 3.11Å; Y142-F146 VanDerWaalsContact O-CD2 3.3Å; Y142-F146 WeakPolarHBondContact O-CD2 3.37Å; Y142-F146 PolarHBondContact O-N 2.9Å; Y142-G367 WeakPolarHBondContact CE1-O 3.41Å; Y142-G367 PolarHBondContact OH-O 2.91Å; Y142-F368 HydrophobicContact CD1-CD1 4.07Å; Y142-F368 HydrophobicContact CD1-CE1 4.09Å; Y142-F368 AromaticContact CE1-CD1 3.82Å; Y142-F368 HydrophobicContact CE1-CD1 3.82Å; Y142-F368 HydrophobicContact CE1-CE1 4.19Å; Y142-F368 WeakPolarHBondContact OH-CA 3.42Å; Y142-M369 HydrophobicContact CE2-CB 4.4Å; Y142-M369 HydrophobicContact CE2-CE 4.23Å; Y142-M369 HydrophobicContact CE2-CG 4.1Å; Y142-M369 HydrophobicContact CE2-SD 4.17Å; Y142-M369 PolarHBondContact OH-N 3.38Å; Y142-C433 VanDerWaalsContact C-SG 3.57Å; Y142-C433 VanDerWaalsContact CB-SG 3.57Å; Y142-L468 HydrophobicContact CD1-CD1 3.73Å; Y142-L468 HydrophobicContact CD1-CD2 3.66Å; Y142-L468 HydrophobicContact CD1-CG 4.34Å; Y142-L468 HydrophobicContact CE1-CD1 4.15Å; Y142-L468 HydrophobicContact CE1-CD2 3.63Å; Y142-L468 HydrophobicContact CE1-CG 4.44Å
143	T	95.4	Very high	93.8	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58.6	-46	-178.9	-58.7	0	0	0	0	111.5	Y139 L141 A147 I164 C433 F434 T436	Y139-T143 VanDerWaalsContact O-CB 3.26Å; Y139-T143 WeakPolarHBondContact O-CB 3.5Å; Y139-T143 PolarHBondContact O-N 3.04Å; Y139-T143 PolarHBondContact O-OG1 2.63Å; L141-T143 PolarHBondContact O-N 3.11Å; T143-A147 WeakPolarHBondContact O-CB 3.29Å; T143-A147 PolarHBondContact O-N 3.47Å; T143-I164 HydrophobicContact CG2-CG2 3.3Å; T143-C433 HydrophobicContact CG2-CB 4.32Å; T143-C433 PolarHBondContact N-SG 2.95Å; T143-C433 VanDerWaalsContact OG1-CA 3.31Å; T143-C433 WeakPolarHBondContact OG1-CA 3.44Å; T143-C433 VanDerWaalsContact OG1-CB 3.24Å; T143-C433 WeakPolarHBondContact OG1-CB 3.49Å; T143-F434 WeakPolarHBondContact CG2-O 3.5Å; T143-F434 PolarHBondContact OG1-N 2.94Å; T143-F434 VanDerWaalsContact OG1-N 3.08Å; T143-T436 HydrophobicContact CG2-CG2 3.54Å
144	S	95.2	Very high	93.9	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64.8	-36.2	175.9	-73.9	0	0	0	0	113.5	S126 G140 L141 Y142 S148	S126-S144 PolarHBondContact OG-OG 3.33Å; G140-S144 WeakPolarHBondContact O-CB 3.28Å; G140-S144 PolarHBondContact O-N 3.43Å; G140-S144 VanDerWaalsContact O-N 3.09Å; G140-S144 PolarHBondContact O-OG 3.12Å; L141-S144 PolarHBondContact O-N 3.06Å; Y142-S144 VanDerWaalsContact C-N 3.35Å; Y142-S144 PolarHBondContact O-N 2.92Å; S144-S148 WeakPolarHBondContact O-CB 3.2Å; S144-S148 PolarHBondContact O-N 2.93Å; S144-S148 PolarHBondContact O-OG 3.16Å
145	F	95.9	Very high	94.2	Very high	21 Å²	21	17 Å²	17	9%	0.092	8%	0.083	C	C	.	.	H	α-helix	trans	-65.9	-58.2	178.5	165.3	-102.3	0	0	0	111.8	L141 Y142 A147 S148 I149 F368 A461 L464 L465 L468	L141-F145 WeakPolarHBondContact O-CB 3.47Å; L141-F145 PolarHBondContact O-N 3.4Å; Y142-F145 WeakPolarHBondContact O-CB 3.3Å; Y142-F145 PolarHBondContact O-N 3.25Å; Y142-F145 VanDerWaalsContact O-N 3.11Å; F145-A147 PolarHBondContact O-N 3.24Å; F145-S148 PolarHBondContact O-N 3.47Å; F145-I149 HydrophobicContact CD2-CD1 4.24Å; F145-I149 HydrophobicContact CE1-CD1 4.05Å; F145-I149 HydrophobicContact CE2-CD1 3.62Å; F145-I149 HydrophobicContact CZ-CD1 3.51Å; F145-I149 PolarHBondContact O-N 3.36Å; F145-F368 AromaticContact CD1-CE1 3.88Å; F145-F368 HydrophobicContact CD1-CE1 3.88Å; F145-F368 AromaticContact CD1-CZ 3.99Å; F145-F368 HydrophobicContact CD1-CZ 3.99Å; F145-F368 AromaticContact CE1-CE1 3.76Å; F145-F368 HydrophobicContact CE1-CE1 3.76Å; F145-F368 AromaticContact CE1-CZ 3.57Å; F145-F368 HydrophobicContact CE1-CZ 3.57Å; F145-F368 AromaticContact CZ-CZ 3.93Å; F145-F368 HydrophobicContact CZ-CZ 3.93Å; F145-A461 HydrophobicContact CD2-CB 4.02Å; F145-A461 WeakPolarHBondContact CD2-O 3.47Å; F145-A461 HydrophobicContact CE2-CB 4.23Å; F145-L464 HydrophobicContact CB-CB 4.22Å; F145-L464 HydrophobicContact CB-CD1 4.45Å; F145-L465 HydrophobicContact CD2-CB 4.27Å; F145-L465 HydrophobicContact CE2-CB 3.89Å; F145-L465 HydrophobicContact CE2-CD1 4.24Å; F145-L465 HydrophobicContact CE2-CG 4.46Å; F145-L465 HydrophobicContact CZ-CD1 4.35Å; F145-L468 HydrophobicContact CB-CD1 4.28Å; F145-L468 HydrophobicContact CG-CD1 4.46Å
146	F	95.9	Very high	94.2	Very high	31 Å²	31	17.9 Å²	17.9	14%	0.136	9%	0.089	C	C	.	.	H	α-helix	trans	-64.7	-40.1	-176.7	-72	-73.9	0	0	0	112.3	Y142 S148 I149 I150 F368 P428 F431	Y142-F146 VanDerWaalsContact O-CD2 3.3Å; Y142-F146 WeakPolarHBondContact O-CD2 3.37Å; Y142-F146 PolarHBondContact O-N 2.9Å; F146-S148 VanDerWaalsContact C-N 3.27Å; F146-S148 PolarHBondContact O-N 3.01Å; F146-I149 PolarHBondContact O-N 2.73Å; F146-I149 VanDerWaalsContact O-N 3.17Å; F146-I150 HydrophobicContact CB-CD1 4.28Å; F146-I150 WeakPolarHBondContact O-CD1 3.25Å; F146-I150 WeakPolarHBondContact O-CG1 3.35Å; F146-I150 PolarHBondContact O-N 3.12Å; F146-F368 HydrophobicContact CE2-CD1 4.47Å; F146-F368 HydrophobicContact CE2-CE1 4.21Å; F146-F368 HydrophobicContact CZ-CD1 4.34Å; F146-F368 HydrophobicContact CZ-CE1 4.13Å; F146-P428 HydrophobicContact CB-CB 3.95Å; F146-P428 HydrophobicContact CB-CG 3.68Å; F146-P428 HydrophobicContact CG-CB 4.44Å; F146-F431 HydrophobicContact CD2-CB 4.25Å; F146-F431 HydrophobicContact CE1-CD1 4.5Å; F146-F431 HydrophobicContact CE1-CD2 4.26Å; F146-F431 HydrophobicContact CE1-CG 4.25Å; F146-F431 HydrophobicContact CE2-CB 3.53Å; F146-F431 HydrophobicContact CE2-CD1 4.41Å; F146-F431 HydrophobicContact CE2-CD2 4.46Å; F146-F431 AromaticContact CE2-CG 3.91Å; F146-F431 HydrophobicContact CE2-CG 3.91Å; F146-F431 HydrophobicContact CZ-CB 3.8Å; F146-F431 AromaticContact CZ-CD1 3.81Å; F146-F431 HydrophobicContact CZ-CD1 3.81Å; F146-F431 HydrophobicContact CZ-CD2 4.09Å; F146-F431 HydrophobicContact CZ-CE1 4.4Å; F146-F431 AromaticContact CZ-CG 3.63Å; F146-F431 HydrophobicContact CZ-CG 3.63Å
147	A	95.4	Very high	94.3	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-57.9	-39.8	177.3	0	0	0	0	0	112.7	T143 F145 I149 Y151 V162 T436	T143-A147 WeakPolarHBondContact O-CB 3.29Å; T143-A147 PolarHBondContact O-N 3.47Å; F145-A147 PolarHBondContact O-N 3.24Å; A147-I149 VanDerWaalsContact C-N 3.31Å; A147-I149 PolarHBondContact O-N 3.01Å; A147-Y151 VanDerWaalsContact O-CB 3.24Å; A147-Y151 WeakPolarHBondContact O-CB 3.3Å; A147-Y151 PolarHBondContact O-N 2.73Å; A147-V162 HydrophobicContact CB-CG1 4.29Å; A147-T436 HydrophobicContact CB-CG2 3.62Å
148	S	94.9	Very high	94.4	Very high	8 Å²	8	19.7 Å²	19.7	6%	0.056	9%	0.091	C	C	.	.	H	α-helix	trans	-65.3	-34.5	179.7	-61.8	0	0	0	0	112.4	S144 F145 F146 F152 G457	S144-S148 WeakPolarHBondContact O-CB 3.2Å; S144-S148 PolarHBondContact O-N 2.93Å; S144-S148 PolarHBondContact O-OG 3.16Å; F145-S148 PolarHBondContact O-N 3.47Å; F146-S148 VanDerWaalsContact C-N 3.27Å; F146-S148 PolarHBondContact O-N 3.01Å; S148-F152 WeakPolarHBondContact O-CB 3.39Å; S148-G457 WeakPolarHBondContact CB-O 3.49Å
149	I	95.6	Very high	94.4	Very high	59 Å²	59	19.7 Å²	19.7	30%	0.303	9%	0.091	S	C	.	.	H	α-helix	trans	-77.1	-49.1	177.7	-62.7	172.9	0	0	0	111	F145 F146 A147 Y151 F152 L153 A461	F145-I149 HydrophobicContact CD2-CD1 4.24Å; F145-I149 HydrophobicContact CE1-CD1 4.05Å; F145-I149 HydrophobicContact CE2-CD1 3.62Å; F145-I149 HydrophobicContact CZ-CD1 3.51Å; F145-I149 PolarHBondContact O-N 3.36Å; F146-I149 PolarHBondContact O-N 2.73Å; F146-I149 VanDerWaalsContact O-N 3.17Å; A147-I149 VanDerWaalsContact C-N 3.31Å; A147-I149 PolarHBondContact O-N 3.01Å; I149-Y151 PolarHBondContact O-N 3.35Å; I149-F152 WeakPolarHBondContact O-CB 3.36Å; I149-F152 PolarHBondContact O-N 3.33Å; I149-L153 PolarHBondContact O-N 3.02Å; I149-A461 HydrophobicContact CD1-CB 4.04Å; I149-A461 HydrophobicContact CG1-CB 3.59Å
150	I	96.2	Very high	94.4	Very high	15 Å²	15	19 Å²	19	8%	0.077	9%	0.089	C	C	.	.	H	α-helix	trans	-66.3	-40.4	-175.6	-62.3	158.9	0	0	0	110.6	F146 F152 L153 L154 F423 I427 P428	F146-I150 HydrophobicContact CB-CD1 4.28Å; F146-I150 WeakPolarHBondContact O-CD1 3.25Å; F146-I150 WeakPolarHBondContact O-CG1 3.35Å; F146-I150 PolarHBondContact O-N 3.12Å; I150-F152 VanDerWaalsContact C-N 3.31Å; I150-F152 PolarHBondContact O-N 2.92Å; I150-L153 PolarHBondContact O-N 3Å; I150-L153 VanDerWaalsContact O-N 3.16Å; I150-L154 HydrophobicContact CG2-CD1 3.89Å; I150-L154 PolarHBondContact O-N 3.35Å; I150-F423 HydrophobicContact CG2-CB 4.08Å; I150-I427 HydrophobicContact CD1-CB 3.87Å; I150-I427 HydrophobicContact CD1-CD1 4.43Å; I150-I427 HydrophobicContact CD1-CG2 4.1Å; I150-P428 HydrophobicContact CD1-CG 3.51Å
151	Y	95.6	Very high	94.3	Very high	8 Å²	8	19.4 Å²	19.4	3%	0.031	9%	0.091	C	C	.	.	H	α-helix	trans	-66.3	-32.4	177.4	-168.7	-95.4	0	0	0	112.9	A147 I149 L153 L154 G155 S157 I160 V162 E417 A420	A147-Y151 VanDerWaalsContact O-CB 3.24Å; A147-Y151 WeakPolarHBondContact O-CB 3.3Å; A147-Y151 PolarHBondContact O-N 2.73Å; I149-Y151 PolarHBondContact O-N 3.35Å; Y151-L153 PolarHBondContact O-N 3.3Å; Y151-L154 PolarHBondContact O-N 3.28Å; Y151-G155 WeakPolarHBondContact O-CA 3.37Å; Y151-G155 PolarHBondContact O-N 2.97Å; Y151-S157 WeakPolarHBondContact OH-CB 3.38Å; Y151-S157 PolarHBondContact OH-N 3.4Å; Y151-I160 HydrophobicContact CD1-CG1 4.33Å; Y151-I160 HydrophobicContact CE1-CD1 3.86Å; Y151-I160 HydrophobicContact CE1-CG1 3.5Å; Y151-I160 VanDerWaalsContact CE1-CG1 3.5Å; Y151-I160 HydrophobicContact CE2-CD1 3.92Å; Y151-I160 HydrophobicContact CE2-CG1 4.48Å; Y151-I160 VanDerWaalsContact CZ-CD1 3.46Å; Y151-I160 WeakPolarHBondContact OH-CD1 3.46Å; Y151-V162 HydrophobicContact CD1-CG2 4.01Å; Y151-V162 HydrophobicContact CD2-CB 4.39Å; Y151-V162 HydrophobicContact CD2-CG2 3.59Å; Y151-V162 HydrophobicContact CE1-CG2 4.36Å; Y151-V162 HydrophobicContact CE2-CG2 3.97Å; Y151-V162 HydrophobicContact CG-CB 4.15Å; Y151-V162 HydrophobicContact CG-CG2 3.62Å; Y151-E417 VanDerWaalsContact CE2-OE2 3.24Å; Y151-E417 WeakPolarHBondContact CE2-OE2 3.41Å; Y151-E417 VanDerWaalsContact OH-CD 3.27Å; Y151-E417 PolarHBondContact OH-OE1 3.31Å; Y151-E417 PolarHBondContact OH-OE2 3.13Å; Y151-A420 HydrophobicContact CD2-CB 4.13Å; Y151-A420 HydrophobicContact CE2-CB 4.1Å
152	F	94.7	Very high	94.3	Very high	29 Å²	29	19.6 Å²	19.6	13%	0.127	9%	0.092	C	C	.	.	H	α-helix	trans	-63.1	-26.8	173.9	158.6	-97.7	0	0	0	113.4	I95 W98 S148 I149 I150 Q454 L455 V458	I95-F152 HydrophobicContact CD1-CD1 4.09Å; I95-F152 HydrophobicContact CD1-CE1 3.42Å; I95-F152 VanDerWaalsContact CD1-CE1 3.42Å; I95-F152 HydrophobicContact CD1-CE2 4.13Å; I95-F152 HydrophobicContact CD1-CZ 3.45Å; I95-F152 VanDerWaalsContact CD1-CZ 3.45Å; I95-F152 HydrophobicContact CG1-CZ 4.5Å; W98-F152 HydrophobicContact CH2-CD2 4.42Å; W98-F152 AromaticContact CH2-CE2 3.79Å; W98-F152 HydrophobicContact CH2-CE2 3.79Å; W98-F152 AromaticContact CZ2-CD2 3.95Å; W98-F152 HydrophobicContact CZ2-CD2 3.95Å; W98-F152 AromaticContact CZ2-CE2 3.63Å; W98-F152 HydrophobicContact CZ2-CE2 3.63Å; S148-F152 WeakPolarHBondContact O-CB 3.39Å; I149-F152 WeakPolarHBondContact O-CB 3.36Å; I149-F152 PolarHBondContact O-N 3.33Å; I150-F152 VanDerWaalsContact C-N 3.31Å; I150-F152 PolarHBondContact O-N 2.92Å; F152-Q454 HydrophobicContact CD2-CB 3.94Å; F152-Q454 WeakPolarHBondContact CD2-O 3.36Å; F152-Q454 PolarHBondContact O-OE1 3.02Å; F152-L455 HydrophobicContact CE2-CD1 4.33Å; F152-V458 HydrophobicContact CB-CG2 4.29Å; F152-V458 HydrophobicContact CD1-CG2 3.55Å; F152-V458 HydrophobicContact CD2-CG2 3.5Å; F152-V458 HydrophobicContact CE1-CG2 3.58Å; F152-V458 HydrophobicContact CE2-CG2 3.52Å; F152-V458 HydrophobicContact CG-CG2 3.51Å; F152-V458 HydrophobicContact CZ-CG2 3.56Å
153	L	94.4	Very high	94.2	Very high	71 Å²	71	19.4 Å²	19.4	37%	0.372	9%	0.092	S	C	.	.	H	α-helix	trans	-84.9	-40.7	177.1	-60.1	175.5	0	0	0	112.8	I95 I149 I150 Y151	I95-L153 HydrophobicContact CD1-CD2 3.79Å; I95-L153 WeakPolarHBondContact CG2-O 3.33Å; I149-L153 PolarHBondContact O-N 3.02Å; I150-L153 PolarHBondContact O-N 3Å; I150-L153 VanDerWaalsContact O-N 3.16Å; Y151-L153 PolarHBondContact O-N 3.3Å
154	L	94.5	Very high	94	Very high	14 Å²	14	19.4 Å²	19.4	7%	0.073	9%	0.092	C	C	.	.	H	α-helix	trans	-110.1	-23.3	-164.5	-65.6	172	0	0	0	115.4	F92 L93 P94 I150 Y151 Q416 A420 F423	F92-L154 HydrophobicContact CD1-CD2 4.43Å; F92-L154 HydrophobicContact CE1-CD2 4.07Å; F92-L154 HydrophobicContact CZ-CD2 4.3Å; F92-L154 WeakPolarHBondContact O-CD2 3.38Å; L93-L154 HydrophobicContact CD2-CD2 3.85Å; P94-L154 WeakPolarHBondContact CD-O 3.42Å; P94-L154 WeakPolarHBondContact CG-O 3.45Å; I150-L154 HydrophobicContact CG2-CD1 3.89Å; I150-L154 PolarHBondContact O-N 3.35Å; Y151-L154 PolarHBondContact O-N 3.28Å; L154-Q416 PolarHBondContact O-NE2 3.28Å; L154-A420 HydrophobicContact CB-CB 3.77Å; L154-F423 HydrophobicContact CD1-CB 3.55Å; L154-F423 HydrophobicContact CD1-CD2 3.8Å; L154-F423 HydrophobicContact CD1-CG 3.92Å
155	G	93.1	Very high	93.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.098	C	C	.	.			trans	-71	153.9	-175.2	0	0	0	0	0	113.5	P94 Y151 Q454	P94-G155 WeakPolarHBondContact CB-O 3.43Å; P94-G155 WeakPolarHBondContact CG-O 3.15Å; Y151-G155 WeakPolarHBondContact O-CA 3.37Å; Y151-G155 PolarHBondContact O-N 2.97Å; G155-Q454 PolarHBondContact O-NE2 3.4Å
156	T	92.4	Very high	93.4	Very high	22 Å²	22	19.9 Å²	19.9	14%	0.135	9%	0.094	C	C	.	.			trans	-100.2	-26.1	171.3	67.4	0	0	0	0	113.2	P94 R413 Q416 E417	P94-T156 HydrophobicContact CB-CG2 4.49Å; P94-T156 HydrophobicContact CG-CG2 3.88Å; T156-R413 HydrophobicContact CG2-CB 4.44Å; T156-R413 PolarHBondContact OG1-N 3.41Å; T156-Q416 HydrophobicContact CG2-CB 3.82Å; T156-Q416 HydrophobicContact CG2-CG 3.44Å; T156-Q416 VanDerWaalsContact CG2-CG 3.44Å; T156-E417 VanDerWaalsContact CA-OE1 3.28Å; T156-E417 WeakPolarHBondContact CA-OE1 3.44Å; T156-E417 WeakPolarHBondContact CB-OE1 3.16Å; T156-E417 PolarHBondContact N-OE1 2.87Å; T156-E417 PolarHBondContact OG1-OE1 3.04Å
157	S	93.6	Very high	93	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.088	C	C	.	.			trans	-79.6	131.9	-179.4	-162.9	0	0	0	0	112.4	Y151 S401 Y410 E417 Q454	Y151-S157 WeakPolarHBondContact OH-CB 3.38Å; Y151-S157 PolarHBondContact OH-N 3.4Å; S157-S401 WeakPolarHBondContact CB-OG 3.47Å; S157-Y410 PolarHBondContact OG-OH 2.95Å; S157-E417 PolarHBondContact N-OE1 3.12Å; S157-E417 VanDerWaalsContact N-OE1 3.07Å; S157-Q454 WeakPolarHBondContact O-CG 3.31Å; S157-Q454 PolarHBondContact O-NE2 2.94Å
158	R	91.8	Very high	92.8	Very high	115 Å²	115	18.5 Å²	18.5	43%	0.434	9%	0.088	S	C	.	.	S	Bend	trans	-77.9	-44.8	-173.4	-60	-176	-168	166.7	4.6	112.1	Y410 K446 Q452 T453	R158-Y410 HydrophobicContact CB-CE1 4.49Å; R158-Y410 PolarHBondContact N-OH 3.02Å; R158-K446 PolarHBondContact O-NZ 3.27Å; R158-K446 VanDerWaalsContact O-NZ 3.14Å; R158-Q452 WeakPolarHBondContact CD-O 3.21Å; R158-T453 CarbonylContact O-C 3.59Å
159	H	92.2	Very high	92.7	Very high	2 Å²	2	18.1 Å²	18.1	1%	0.009	9%	0.086	C	C	.	.	S	Bend	trans	-89.7	-17.9	-165.5	-57.9	125.9	0	0	0	114.1	F404 H408 Y410 K446 C451	H159-F404 HydrophobicContact CB-CB 4.31Å; H159-F404 HydrophobicContact CB-CD1 4.39Å; H159-F404 HydrophobicContact CB-CG 4.4Å; H159-H408 AromaticContact CE1-CD2 3.63Å; H159-H408 AromaticContact CE1-CE1 3.73Å; H159-H408 AromaticContact CE1-CG 3.36Å; H159-H408 AromaticContact CE1-ND1 3.44Å; H159-H408 PolarHBondContact CE1-ND1 2.76Å; H159-H408 AromaticContact CE1-NE2 3.85Å; H159-H408 AromaticContact ND1-CD2 3.48Å; H159-H408 PolarHBondContact ND1-CD2 3.09Å; H159-H408 AromaticContact ND1-CG 3.69Å; H159-H408 AromaticContact ND1-NE2 3.78Å; H159-Y410 AromaticContact CE1-CE1 3.73Å; H159-Y410 AromaticContact ND1-CE1 3.63Å; H159-Y410 PolarHBondContact ND1-OH 3.37Å; H159-K446 WeakPolarHBondContact O-CD 3.36Å; H159-K446 VanDerWaalsContact O-CE 3.25Å; H159-K446 WeakPolarHBondContact O-CE 3.35Å; H159-K446 VanDerWaalsContact O-CG 3.24Å; H159-K446 WeakPolarHBondContact O-CG 3.41Å; H159-C451 PolarHBondContact CD2-O 3.14Å; H159-C451 PolarHBondContact NE2-O 2.83Å
160	I	93.2	Very high	92.3	Very high	1 Å²	1	15.7 Å²	15.7	1%	0.005	7%	0.073	C	C	.	.			trans	-69	151.2	-173.6	75.7	160.4	0	0	0	113.2	Y151 V162 T397 L400 A438 T443 K446	Y151-I160 HydrophobicContact CD1-CG1 4.33Å; Y151-I160 HydrophobicContact CE1-CD1 3.86Å; Y151-I160 HydrophobicContact CE1-CG1 3.5Å; Y151-I160 VanDerWaalsContact CE1-CG1 3.5Å; Y151-I160 HydrophobicContact CE2-CD1 3.92Å; Y151-I160 HydrophobicContact CE2-CG1 4.48Å; Y151-I160 VanDerWaalsContact CZ-CD1 3.46Å; Y151-I160 WeakPolarHBondContact OH-CD1 3.46Å; I160-V162 HydrophobicContact CD1-CG2 3.49Å; I160-V162 VanDerWaalsContact CD1-CG2 3.49Å; I160-V162 HydrophobicContact CG1-CG2 4.09Å; I160-T397 HydrophobicContact CD1-CG2 4.06Å; I160-L400 HydrophobicContact CG2-CD2 4.27Å; I160-L400 HydrophobicContact CG2-CG 4.34Å; I160-A438 HydrophobicContact CD1-CB 3.73Å; I160-T443 HydrophobicContact CB-CG2 4.33Å; I160-T443 HydrophobicContact CG2-CG2 4.19Å; I160-K446 PolarHBondContact O-NZ 3.23Å
161	S	91.8	Very high	92	Very high	7 Å²	7	15 Å²	15	5%	0.049	7%	0.07	C	C	.	.			trans	-112.1	110.3	168.5	174.2	0	0	0	0	108.6	A439 T443	S161-A439 PolarHBondContact O-N 3.46Å; S161-A439 VanDerWaalsContact O-N 3.12Å; S161-T443 PolarHBondContact N-OG1 3.18Å
162	V	93.4	Very high	91.9	Very high	4 Å²	4	14.6 Å²	14.6	2%	0.024	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	146.7	172.5	-175.8	0	0	0	0	109.2	A147 Y151 I160 I421 A438	A147-V162 HydrophobicContact CB-CG1 4.29Å; Y151-V162 HydrophobicContact CD1-CG2 4.01Å; Y151-V162 HydrophobicContact CD2-CB 4.39Å; Y151-V162 HydrophobicContact CD2-CG2 3.59Å; Y151-V162 HydrophobicContact CE1-CG2 4.36Å; Y151-V162 HydrophobicContact CE2-CG2 3.97Å; Y151-V162 HydrophobicContact CG-CB 4.15Å; Y151-V162 HydrophobicContact CG-CG2 3.62Å; I160-V162 HydrophobicContact CD1-CG2 3.49Å; I160-V162 VanDerWaalsContact CD1-CG2 3.49Å; I160-V162 HydrophobicContact CG1-CG2 4.09Å; V162-I421 HydrophobicContact CG1-CD1 3.66Å; V162-A438 HydrophobicContact CG2-CB 4.36Å
163	G	91.9	Very high	91.7	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.9	-148.3	177.7	0	0	0	0	0	107.3	T436 S437	G163-T436 CarbonylContact O-C 3.52Å; G163-T436 WeakPolarHBondContact O-CA 3.34Å; G163-T436 WeakPolarHBondContact O-CB 3.44Å; G163-S437 PolarHBondContact N-O 3.36Å; G163-S437 PolarHBondContact O-N 3.37Å
164	I	92.1	Very high	91.4	Very high	1 Å²	1	12.1 Å²	12.1	1%	0.005	6%	0.055	C	C	.	.			trans	-73.7	154.2	173.6	67.6	179	0	0	0	112.7	S126 Y129 T143 F434 K442	S126-I164 WeakPolarHBondContact O-CD1 3.39Å; Y129-I164 HydrophobicContact CD2-CD1 4.18Å; Y129-I164 HydrophobicContact CD2-CG1 4.2Å; Y129-I164 HydrophobicContact CG-CD1 4.39Å; T143-I164 HydrophobicContact CG2-CG2 3.3Å; I164-F434 HydrophobicContact CB-CE2 4.07Å; I164-F434 HydrophobicContact CD1-CE2 4.5Å; I164-F434 HydrophobicContact CD1-CZ 4.27Å; I164-F434 HydrophobicContact CG2-CD2 4.2Å; I164-F434 HydrophobicContact CG2-CE2 3.44Å; I164-F434 VanDerWaalsContact CG2-CE2 3.44Å; I164-F434 HydrophobicContact CG2-CZ 3.79Å; I164-K442 PolarHBondContact O-NZ 3.06Å
165	F	90.8	Very high	91.2	Very high	30 Å²	30	11.5 Å²	11.5	13%	0.132	5%	0.052	C	C	.	.			trans	-140.4	131.7	177.2	178.6	-113.8	0	0	0	110.9	V167 L168 C169 I396 A439	F165-V167 VanDerWaalsContact C-N 3.29Å; F165-V167 HydrophobicContact CD1-CB 3.98Å; F165-V167 HydrophobicContact CD1-CG2 4.21Å; F165-V167 HydrophobicContact CE1-CB 3.55Å; F165-V167 HydrophobicContact CE1-CG2 3.38Å; F165-V167 HydrophobicContact CZ-CB 4.41Å; F165-V167 HydrophobicContact CZ-CG2 3.75Å; F165-V167 PolarHBondContact O-N 3.15Å; F165-V167 VanDerWaalsContact O-N 3.11Å; F165-L168 PolarHBondContact O-N 3.25Å; F165-L168 VanDerWaalsContact O-N 3.14Å; F165-C169 PolarHBondContact O-N 3.06Å; F165-C169 VanDerWaalsContact O-N 3.09Å; F165-C169 PolarHBondContact O-SG 3.4Å; F165-I396 HydrophobicContact CD1-CD1 3.85Å; F165-I396 HydrophobicContact CE1-CD1 3.48Å; F165-I396 VanDerWaalsContact CE1-CD1 3.48Å; F165-I396 HydrophobicContact CZ-CD1 4.37Å; F165-A439 HydrophobicContact CD2-CB 3.93Å
166	G	88.4	Confident	91.1	Very high	1 Å²	1	11.5 Å²	11.5	1%	0.01	5%	0.052	C	C	.	.	H	α-helix	trans	-58.6	-29.5	-166	0	0	0	0	0	116.3	C169 L170	G166-C169 WeakPolarHBondContact O-CB 3.37Å; G166-C169 PolarHBondContact O-N 2.71Å; G166-L170 PolarHBondContact O-N 2.94Å
167	V	86.6	Confident	90.9	Very high	2 Å²	2	11.8 Å²	11.8	1%	0.012	5%	0.053	C	C	.	.	H	α-helix	trans	-72.5	-43.9	178.3	-173.8	0	0	0	0	111.4	F165 C169 L170 M171 F256 A260 I264 T527	F165-V167 VanDerWaalsContact C-N 3.29Å; F165-V167 HydrophobicContact CD1-CB 3.98Å; F165-V167 HydrophobicContact CD1-CG2 4.21Å; F165-V167 HydrophobicContact CE1-CB 3.55Å; F165-V167 HydrophobicContact CE1-CG2 3.38Å; F165-V167 HydrophobicContact CZ-CB 4.41Å; F165-V167 HydrophobicContact CZ-CG2 3.75Å; F165-V167 PolarHBondContact O-N 3.15Å; F165-V167 VanDerWaalsContact O-N 3.11Å; V167-C169 PolarHBondContact O-N 2.97Å; V167-L170 WeakPolarHBondContact O-CB 3.39Å; V167-L170 PolarHBondContact O-N 3.28Å; V167-M171 HydrophobicContact CG1-SD 4.46Å; V167-M171 WeakPolarHBondContact O-CG 3.37Å; V167-M171 PolarHBondContact O-N 2.87Å; V167-M171 VanDerWaalsContact O-N 3.12Å; V167-F256 HydrophobicContact CG1-CE2 4.41Å; V167-F256 HydrophobicContact CG1-CZ 3.82Å; V167-A260 HydrophobicContact CB-CB 4.36Å; V167-A260 HydrophobicContact CG1-CB 3.81Å; V167-A260 HydrophobicContact CG2-CB 3.58Å; V167-I264 HydrophobicContact CG2-CD1 4.02Å; V167-T527 HydrophobicContact CG1-CG2 4.23Å
168	L	91.8	Very high	90.7	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-63.9	-34.3	172.7	-66.7	-172.3	0	0	0	111.2	F165 L170 M171 I172 I389 I392 T435	F165-L168 PolarHBondContact O-N 3.25Å; F165-L168 VanDerWaalsContact O-N 3.14Å; L168-L170 VanDerWaalsContact C-N 3.34Å; L168-L170 PolarHBondContact O-N 2.84Å; L168-M171 HydrophobicContact CD2-SD 3.77Å; L168-M171 PolarHBondContact O-N 3.03Å; L168-I172 WeakPolarHBondContact O-CB 3.43Å; L168-I172 VanDerWaalsContact O-CD1 3.25Å; L168-I172 WeakPolarHBondContact O-CD1 3.37Å; L168-I172 WeakPolarHBondContact O-CG1 3.41Å; L168-I172 PolarHBondContact O-N 2.94Å; L168-I389 HydrophobicContact CD2-CG2 4.28Å; L168-I392 HydrophobicContact CD2-CB 4.1Å; L168-I392 HydrophobicContact CD2-CG2 3.61Å; L168-T435 HydrophobicContact CD1-CG2 3.91Å
169	C	92.5	Very high	90.6	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-63	-39.7	175.3	-57.8	0	0	0	0	111.6	Y129 L132 A133 F165 G166 V167 G173	Y129-C169 WeakPolarHBondContact O-CB 3.19Å; L132-C169 HydrophobicContact CB-CB 4.44Å; L132-C169 HydrophobicContact CD2-CB 4.48Å; A133-C169 WeakPolarHBondContact CA-O 3.38Å; A133-C169 HydrophobicContact CB-CB 4.06Å; A133-C169 WeakPolarHBondContact CB-O 3.48Å; F165-C169 PolarHBondContact O-N 3.06Å; F165-C169 VanDerWaalsContact O-N 3.09Å; F165-C169 PolarHBondContact O-SG 3.4Å; G166-C169 WeakPolarHBondContact O-CB 3.37Å; G166-C169 PolarHBondContact O-N 2.71Å; V167-C169 PolarHBondContact O-N 2.97Å; C169-G173 PolarHBondContact O-N 2.93Å
170	L	88.2	Confident	90.4	Very high	8 Å²	8	10.6 Å²	10.6	4%	0.042	5%	0.049	C	C	.	.	H	α-helix	trans	-61.7	-48.9	171.5	-81	179.3	0	0	0	112.4	L132 G166 V167 L168 I172 G173 E174 T263 I264	L132-L170 HydrophobicContact CD1-CD2 3.6Å; L132-L170 HydrophobicContact CD1-CG 4.33Å; L132-L170 HydrophobicContact CD2-CD2 4.28Å; L132-L170 HydrophobicContact CD2-CG 4.1Å; L132-L170 HydrophobicContact CG-CD2 3.85Å; L132-L170 HydrophobicContact CG-CG 4.13Å; G166-L170 PolarHBondContact O-N 2.94Å; V167-L170 WeakPolarHBondContact O-CB 3.39Å; V167-L170 PolarHBondContact O-N 3.28Å; L168-L170 VanDerWaalsContact C-N 3.34Å; L168-L170 PolarHBondContact O-N 2.84Å; L170-I172 PolarHBondContact O-N 3.3Å; L170-G173 CarbonylContact O-C 3.54Å; L170-G173 WeakPolarHBondContact O-CA 3.35Å; L170-G173 PolarHBondContact O-N 3.42Å; L170-E174 PolarHBondContact O-N 2.96Å; L170-T263 VanDerWaalsContact CD1-OG1 3.3Å; L170-T263 WeakPolarHBondContact CD1-OG1 3.28Å; L170-I264 HydrophobicContact CD1-CB 4.37Å; L170-I264 HydrophobicContact CD1-CG1 3.47Å; L170-I264 VanDerWaalsContact CD1-CG1 3.47Å; L170-I264 HydrophobicContact CG-CG1 4.12Å
171	M	89.5	Confident	90.1	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-59	-46.3	-179.3	-62.7	163.8	72.5	0	0	111.6	V167 L168 G173 E174 T175 A388 I389 I392 E528	V167-M171 HydrophobicContact CG1-SD 4.46Å; V167-M171 WeakPolarHBondContact O-CG 3.37Å; V167-M171 PolarHBondContact O-N 2.87Å; V167-M171 VanDerWaalsContact O-N 3.12Å; L168-M171 HydrophobicContact CD2-SD 3.77Å; L168-M171 PolarHBondContact O-N 3.03Å; M171-G173 VanDerWaalsContact C-N 3.3Å; M171-G173 PolarHBondContact O-N 2.95Å; M171-E174 PolarHBondContact O-N 2.75Å; M171-T175 PolarHBondContact O-N 2.97Å; M171-T175 PolarHBondContact O-OG1 2.79Å; M171-A388 HydrophobicContact CE-CB 3.96Å; M171-I389 HydrophobicContact CB-CD1 4.19Å; M171-I389 HydrophobicContact CB-CG1 4.01Å; M171-I389 HydrophobicContact CE-CB 4.28Å; M171-I389 HydrophobicContact CE-CG1 3.47Å; M171-I389 VanDerWaalsContact CE-CG1 3.47Å; M171-I389 HydrophobicContact SD-CG1 4.35Å; M171-I392 HydrophobicContact CE-CD1 3.39Å; M171-I392 HydrophobicContact CE-CG1 4.46Å; M171-I392 HydrophobicContact SD-CD1 3.75Å; M171-I392 HydrophobicContact SD-CG2 4.31Å; M171-E528 HydrophobicContact CE-CG 3.82Å; M171-E528 WeakPolarHBondContact CE-OE1 3.36Å; M171-E528 HydrophobicContact CG-CG 4.13Å
172	I	92.8	Very high	89.8	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.2	-40.7	174.5	-63.4	157.5	0	0	0	110.6	A133 L168 L170 T175 V176 I389 F434 T435	A133-I172 HydrophobicContact CB-CB 4.49Å; A133-I172 HydrophobicContact CB-CG2 4.33Å; L168-I172 WeakPolarHBondContact O-CB 3.43Å; L168-I172 VanDerWaalsContact O-CD1 3.25Å; L168-I172 WeakPolarHBondContact O-CD1 3.37Å; L168-I172 WeakPolarHBondContact O-CG1 3.41Å; L168-I172 PolarHBondContact O-N 2.94Å; L170-I172 PolarHBondContact O-N 3.3Å; I172-T175 PolarHBondContact O-N 3.28Å; I172-V176 HydrophobicContact CG2-CG2 4.05Å; I172-V176 VanDerWaalsContact O-CB 3.23Å; I172-V176 WeakPolarHBondContact O-CB 3.37Å; I172-V176 WeakPolarHBondContact O-CG2 3.31Å; I172-V176 PolarHBondContact O-N 3.39Å; I172-I389 HydrophobicContact CG1-CD1 4.15Å; I172-F434 HydrophobicContact CD1-CB 4.2Å; I172-F434 HydrophobicContact CD1-CD2 3.96Å; I172-T435 WeakPolarHBondContact CD1-OG1 3.3Å
173	G	90.7	Very high	89.3	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.01	12%	0.116	C	C	.	.	H	α-helix	trans	-60.8	-44.7	174.5	0	0	0	0	0	112.9	A133 C169 L170 M171 V176 D177	A133-G173 WeakPolarHBondContact O-CA 3.17Å; C169-G173 PolarHBondContact O-N 2.93Å; L170-G173 CarbonylContact O-C 3.54Å; L170-G173 WeakPolarHBondContact O-CA 3.35Å; L170-G173 PolarHBondContact O-N 3.42Å; M171-G173 VanDerWaalsContact C-N 3.3Å; M171-G173 PolarHBondContact O-N 2.95Å; G173-V176 PolarHBondContact O-N 2.97Å; G173-D177 WeakPolarHBondContact O-CB 3.38Å; G173-D177 PolarHBondContact O-N 3.1Å; G173-D177 VanDerWaalsContact O-OD2 3.11Å
174	E	87.2	Confident	88.8	Confident	46 Å²	46	25.8 Å²	25.8	22%	0.215	13%	0.131	C	C	.	.	H	α-helix	trans	-61.6	-43.2	176.7	-72.2	177.3	-147.8	0	0	111.7	L170 M171 R178	L170-E174 PolarHBondContact O-N 2.96Å; M171-E174 PolarHBondContact O-N 2.75Å; E174-R178 VanDerWaalsContact O-CB 3.28Å; E174-R178 WeakPolarHBondContact O-CB 3.35Å; E174-R178 PolarHBondContact O-N 2.91Å
175	T	90.5	Very high	88.2	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.012	14%	0.138	C	C	.	.	H	α-helix	trans	-63.6	-47.2	171.7	-60.7	0	0	0	0	112.5	M171 I172 R178 E179 V221 V225 V382 D385	M171-T175 PolarHBondContact O-N 2.97Å; M171-T175 PolarHBondContact O-OG1 2.79Å; I172-T175 PolarHBondContact O-N 3.28Å; T175-R178 WeakPolarHBondContact O-CB 3.41Å; T175-R178 PolarHBondContact O-N 3.26Å; T175-E179 HydrophobicContact CG2-CG 4.33Å; T175-E179 PolarHBondContact O-N 3.25Å; T175-V221 HydrophobicContact CG2-CG1 4.08Å; T175-V225 HydrophobicContact CG2-CG2 3.61Å; T175-V382 HydrophobicContact CG2-CG1 3.89Å; T175-D385 WeakPolarHBondContact CB-OD2 3.12Å; T175-D385 WeakPolarHBondContact CG2-OD2 3.19Å; T175-D385 WeakPolarHBondContact OG1-CB 3.39Å; T175-D385 VanDerWaalsContact OG1-CG 3.29Å; T175-D385 PolarHBondContact OG1-OD2 3.24Å
176	V	92.1	Very high	86.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-46.7	-176.2	164.2	0	0	0	0	111.2	I172 G173 R178 E179 L180 A218 V221	I172-V176 HydrophobicContact CG2-CG2 4.05Å; I172-V176 VanDerWaalsContact O-CB 3.23Å; I172-V176 WeakPolarHBondContact O-CB 3.37Å; I172-V176 WeakPolarHBondContact O-CG2 3.31Å; I172-V176 PolarHBondContact O-N 3.39Å; G173-V176 PolarHBondContact O-N 2.97Å; V176-R178 VanDerWaalsContact C-N 3.27Å; V176-R178 PolarHBondContact O-N 3.37Å; V176-E179 PolarHBondContact O-N 3.42Å; V176-L180 HydrophobicContact CG1-CD1 3.77Å; V176-L180 HydrophobicContact CG1-CG 4.42Å; V176-L180 VanDerWaalsContact O-CB 3.26Å; V176-L180 WeakPolarHBondContact O-CB 3.33Å; V176-L180 WeakPolarHBondContact O-CD1 3.02Å; V176-L180 VanDerWaalsContact O-CG 3.23Å; V176-L180 WeakPolarHBondContact O-CG 3.32Å; V176-L180 PolarHBondContact O-N 2.94Å; V176-A218 HydrophobicContact CG1-CB 3.77Å; V176-V221 HydrophobicContact CG2-CB 4.12Å; V176-V221 HydrophobicContact CG2-CG1 3.84Å
177	D	88.4	Confident	85.1	Confident	28 Å²	28	37.4 Å²	37.4	15%	0.15	19%	0.192	C	C	.	.	H	α-helix	trans	-63.1	-34.5	176.1	-73.4	-50.9	0	0	0	111.5	G173 Q181 R279	G173-D177 WeakPolarHBondContact O-CB 3.38Å; G173-D177 PolarHBondContact O-N 3.1Å; G173-D177 VanDerWaalsContact O-OD2 3.11Å; D177-Q181 WeakPolarHBondContact O-CB 3.47Å; D177-Q181 PolarHBondContact O-N 3.2Å; D177-Q181 VanDerWaalsContact O-N 3.12Å; D177-R279 IonicContact OD1-NH1 2.69Å; D177-R279 WeakPolarHBondContact OD2-CD 3.44Å; D177-R279 IonicContact OD2-CZ 3.85Å; D177-R279 IonicContact OD2-NE 2.63Å; D177-R279 IonicContact OD2-NH1 2.75Å; D177-R279 PolarHBondContact OD2-NH1 3.13Å
178	R	88.5	Confident	82.9	Confident	81 Å²	81	40.3 Å²	40.3	31%	0.306	22%	0.217	S	C	.	.	H	α-helix	trans	-68.3	-47.8	176.1	-172.4	-170.4	73.4	-152.1	-2.5	112.8	E174 T175 V176 Q181 K182 N381 D385	E174-R178 VanDerWaalsContact O-CB 3.28Å; E174-R178 WeakPolarHBondContact O-CB 3.35Å; E174-R178 PolarHBondContact O-N 2.91Å; T175-R178 WeakPolarHBondContact O-CB 3.41Å; T175-R178 PolarHBondContact O-N 3.26Å; V176-R178 VanDerWaalsContact C-N 3.27Å; V176-R178 PolarHBondContact O-N 3.37Å; R178-Q181 PolarHBondContact O-N 3.21Å; R178-K182 PolarHBondContact O-N 2.88Å; R178-K182 VanDerWaalsContact O-N 3.12Å; R178-N381 PolarHBondContact NH2-O 3.41Å; R178-D385 IonicContact CZ-OD1 2.64Å; R178-D385 IonicContact CZ-OD2 3.62Å; R178-D385 VanDerWaalsContact NH1-CG 3.28Å; R178-D385 IonicContact NH1-OD1 3.87Å; R178-D385 PolarHBondContact NH1-OD1 2.72Å; R178-D385 IonicContact NH1-OD2 3.71Å; R178-D385 PolarHBondContact NH1-OD2 2.69Å; R178-D385 IonicContact NH2-OD1 2.87Å; R178-D385 IonicContact NH2-OD2 2.74Å; R178-D385 PolarHBondContact NH2-OD2 2.72Å
179	E	89.7	Confident	80.3	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.009	25%	0.254	C	S	.	.	H	α-helix	trans	-72.2	-32.6	178.7	-57.7	-47.7	115.6	0	0	112	T175 V176 Q181 K182 A183 Y217 V221 N381 V382	T175-E179 HydrophobicContact CG2-CG 4.33Å; T175-E179 PolarHBondContact O-N 3.25Å; V176-E179 PolarHBondContact O-N 3.42Å; E179-Q181 VanDerWaalsContact C-N 3.32Å; E179-Q181 PolarHBondContact O-N 3.2Å; E179-K182 PolarHBondContact O-N 3.37Å; E179-K182 WeakPolarHBondContact OE1-CE 3.4Å; E179-K182 IonicContact OE1-NZ 2.65Å; E179-K182 PolarHBondContact OE1-NZ 3.49Å; E179-K182 VanDerWaalsContact OE2-CD 3.3Å; E179-K182 WeakPolarHBondContact OE2-CD 3.32Å; E179-K182 IonicContact OE2-NZ 2.82Å; E179-K182 PolarHBondContact OE2-NZ 2.75Å; E179-A183 WeakPolarHBondContact O-CB 3.19Å; E179-A183 PolarHBondContact O-N 2.92Å; E179-Y217 HydrophobicContact CB-CE1 4.46Å; E179-V221 HydrophobicContact CB-CG1 4.14Å; E179-V221 HydrophobicContact CB-CG2 3.93Å; E179-V221 HydrophobicContact CG-CG1 4.02Å; E179-N381 WeakPolarHBondContact OE2-CB 3.33Å; E179-N381 PolarHBondContact OE2-ND2 2.92Å; E179-V382 HydrophobicContact CG-CG1 4.33Å
180	L	89.1	Confident	77.5	Confident	8 Å²	8	54.7 Å²	54.7	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-58.6	-42.7	170	-81.8	168.1	0	0	0	112.1	V176 A183 G184 Y185 K214 Y217 A218	V176-L180 HydrophobicContact CG1-CD1 3.77Å; V176-L180 HydrophobicContact CG1-CG 4.42Å; V176-L180 VanDerWaalsContact O-CB 3.26Å; V176-L180 WeakPolarHBondContact O-CB 3.33Å; V176-L180 WeakPolarHBondContact O-CD1 3.02Å; V176-L180 VanDerWaalsContact O-CG 3.23Å; V176-L180 WeakPolarHBondContact O-CG 3.32Å; V176-L180 PolarHBondContact O-N 2.94Å; L180-A183 PolarHBondContact O-N 2.75Å; L180-G184 PolarHBondContact O-N 3.01Å; L180-Y185 HydrophobicContact CD2-CD2 3.8Å; L180-Y185 HydrophobicContact CD2-CG 3.91Å; L180-Y185 PolarHBondContact O-N 2.91Å; L180-K214 HydrophobicContact CD2-CG 3.82Å; L180-Y217 HydrophobicContact CD2-CD1 3.73Å; L180-Y217 HydrophobicContact CG-CD1 4.29Å; L180-A218 HydrophobicContact CD1-CB 4.24Å
181	Q	85.9	Confident	74.6	Confident	137 Å²	137	57.7 Å²	57.7	64%	0.64	32%	0.324	S	S	*	.	H	α-helix	trans	-65.4	-45	176.6	-170.1	178.3	8.4	0	0	111.6	D177 R178 E179 A183 G184	D177-Q181 WeakPolarHBondContact O-CB 3.47Å; D177-Q181 PolarHBondContact O-N 3.2Å; D177-Q181 VanDerWaalsContact O-N 3.12Å; R178-Q181 PolarHBondContact O-N 3.21Å; E179-Q181 VanDerWaalsContact C-N 3.32Å; E179-Q181 PolarHBondContact O-N 3.2Å; Q181-A183 VanDerWaalsContact C-N 3.26Å; Q181-A183 PolarHBondContact O-N 2.98Å; Q181-G184 PolarHBondContact O-N 2.96Å; Q181-G184 VanDerWaalsContact O-N 3.1Å
182	K	84.9	Confident	71.8	Confident	126 Å²	126	63.1 Å²	63.1	55%	0.548	36%	0.359	S	S	.	.	H	α-helix	trans	-58.8	-36.7	174.5	-70	175.5	-174.7	171.5	0	112.9	R178 E179 G184	R178-K182 PolarHBondContact O-N 2.88Å; R178-K182 VanDerWaalsContact O-N 3.12Å; E179-K182 PolarHBondContact O-N 3.37Å; E179-K182 WeakPolarHBondContact OE1-CE 3.4Å; E179-K182 IonicContact OE1-NZ 2.65Å; E179-K182 PolarHBondContact OE1-NZ 3.49Å; E179-K182 VanDerWaalsContact OE2-CD 3.3Å; E179-K182 WeakPolarHBondContact OE2-CD 3.32Å; E179-K182 IonicContact OE2-NZ 2.82Å; E179-K182 PolarHBondContact OE2-NZ 2.75Å; K182-G184 PolarHBondContact O-N 2.81Å
183	A	84.7	Confident	68.9	Low	37 Å²	37	69.2 Å²	69.2	31%	0.306	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	7	179	0	0	0	0	0	114	E179 L180 Q181 Y185 Y217	E179-A183 WeakPolarHBondContact O-CB 3.19Å; E179-A183 PolarHBondContact O-N 2.92Å; L180-A183 PolarHBondContact O-N 2.75Å; Q181-A183 VanDerWaalsContact C-N 3.26Å; Q181-A183 PolarHBondContact O-N 2.98Å; A183-Y185 HydrophobicContact CB-CD2 3.79Å; A183-Y185 HydrophobicContact CB-CE2 3.81Å; A183-Y185 PolarHBondContact O-N 2.77Å; A183-Y217 HydrophobicContact CB-CE1 3.77Å; A183-Y217 HydrophobicContact CB-CE2 4.43Å
184	G	81.1	Confident	66.2	Low	31 Å²	31	77 Å²	77	32%	0.32	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	34.7	176.5	0	0	0	0	0	113.9	L180 Q181 K182 D186 R210	L180-G184 PolarHBondContact O-N 3.01Å; Q181-G184 PolarHBondContact O-N 2.96Å; Q181-G184 VanDerWaalsContact O-N 3.1Å; K182-G184 PolarHBondContact O-N 2.81Å; G184-D186 VanDerWaalsContact C-N 3.33Å; G184-D186 PolarHBondContact O-N 3.32Å; G184-R210 PolarHBondContact O-NH1 2.85Å; G184-R210 PolarHBondContact O-NH2 3.3Å
185	Y	78.7	Confident	63.8	Low	37 Å²	37	78.8 Å²	78.8	15%	0.145	47%	0.473	C	S	.	.			trans	-93.4	65.3	165.5	-65.6	-84.5	0	0	0	109.9	L180 A183 C212 K214 Y217	L180-Y185 HydrophobicContact CD2-CD2 3.8Å; L180-Y185 HydrophobicContact CD2-CG 3.91Å; L180-Y185 PolarHBondContact O-N 2.91Å; A183-Y185 HydrophobicContact CB-CD2 3.79Å; A183-Y185 HydrophobicContact CB-CE2 3.81Å; A183-Y185 PolarHBondContact O-N 2.77Å; Y185-C212 PolarHBondContact OH-O 3.26Å; Y185-K214 HydrophobicContact CD1-CB 4.11Å; Y185-K214 HydrophobicContact CD1-CG 4.38Å; Y185-Y217 HydrophobicContact CD2-CD1 4.31Å; Y185-Y217 HydrophobicContact CE2-CD1 4.08Å; Y185-Y217 HydrophobicContact CE2-CD2 4.28Å; Y185-Y217 AromaticContact CE2-CG 3.89Å; Y185-Y217 HydrophobicContact CE2-CG 3.89Å
186	D	62.3	Low	60.9	Low	121 Å²	121	87.6 Å²	87.6	65%	0.647	52%	0.516	S	S	*	.			trans	-58.9	146.3	-179.7	-91.9	-46.9	0	0	0	112.6	G184 A188	G184-D186 VanDerWaalsContact C-N 3.33Å; G184-D186 PolarHBondContact O-N 3.32Å; D186-A188 PolarHBondContact O-N 3.28Å
187	N	53	Low	58.3	Low	119 Å²	119	94.2 Å²	94.2	64%	0.636	56%	0.557	S	S	*	*	S	Bend	trans	-84.3	20	-177.8	-72.1	-64.4	0	0	0	113.4	K214	N187-K214 PolarHBondContact OD1-NZ 2.95Å
188	A	39.6	Very low	55.7	Low	63 Å²	63	98.1 Å²	98.1	52%	0.521	59%	0.586	S	S	.	*	S	Bend	trans	-115.8	135.4	178.1	0	0	0	0	0	110.1	D186	D186-A188 PolarHBondContact O-N 3.28Å
189	H	37	Very low	53.4	Low	171 Å²	171	102.2 Å²	102.2	79%	0.792	61%	0.614	S	S	*	*			trans	65.8	71.8	174.4	-49	-71.3	0	0	0	116.7	A191	H189-A191 HydrophobicContact CB-CB 4.31Å; H189-A191 PolarHBondContact O-N 2.92Å
190	S	33.5	Very low	50.9	Low	130 Å²	130	105.6 Å²	105.6	91%	0.909	65%	0.65	S	S	*	*			trans	-65.6	76	130.5	58.1	0	0	0	0	108.5
191	A	26.6	Very low	48.8	Very low	72 Å²	72	111.2 Å²	111.2	60%	0.595	69%	0.689	S	S	*	*			trans	-71.5	139	177.1	0	0	0	0	0	109.9	H189	H189-A191 HydrophobicContact CB-CB 4.31Å; H189-A191 PolarHBondContact O-N 2.92Å
192	P	32.3	Very low	46.3	Very low	113 Å²	113	113.4 Å²	113.4	73%	0.734	70%	0.702	S	S	*	*			trans	-67.2	141.4	172.1	29.4	-33.9	0	0	0	109.9	L194	P192-L194 VanDerWaalsContact C-N 3.25Å; P192-L194 PolarHBondContact O-N 3.46Å
193	S	31.6	Very low	44	Very low	129 Å²	129	115 Å²	115	90%	0.902	72%	0.716	S	S	*	*			trans	-73.1	78.2	173.2	55.7	0	0	0	0	110.6
194	L	32.5	Very low	41.7	Very low	163 Å²	163	120 Å²	120	85%	0.853	74%	0.737	S	S	*	*			trans	-126.7	121.8	171.4	-139.5	73.3	0	0	0	108.6	P192	P192-L194 VanDerWaalsContact C-N 3.25Å; P192-L194 PolarHBondContact O-N 3.46Å
195	G	37	Very low	39.5	Very low	84 Å²	84	124.9 Å²	124.9	87%	0.866	76%	0.755	S	S	*	*			trans	-77.9	156.3	-162	0	0	0	0	0	115.1
196	M	30	Very low	37.4	Very low	188 Å²	188	131.2 Å²	131.2	93%	0.926	79%	0.786	S	S	*	*			trans	-138	122.5	163	-166.3	170.2	-173.4	0	0	109.2
197	V	38.2	Very low	36	Very low	139 Å²	139	130.7 Å²	130.7	84%	0.842	79%	0.787	S	S	*	*			trans	-80	130.9	176.5	175.3	0	0	0	0	109.1
198	S	32.3	Very low	35.4	Very low	110 Å²	110	131.2 Å²	131.2	77%	0.769	80%	0.8	S	S	*	*			trans	-152.5	129.7	161.9	-167.7	0	0	0	0	110.4
199	N	42.1	Very low	35.3	Very low	166 Å²	166	133.7 Å²	133.7	89%	0.888	81%	0.805	S	S	*	*			trans	-80.6	120.1	174.1	-84.1	-24.6	0	0	0	109.7
200	G	36.1	Very low	36	Very low	74 Å²	74	132.7 Å²	132.7	76%	0.763	79%	0.794	S	S	*	*			trans	-161.8	102.5	175.3	0	0	0	0	0	111.1	M202	G200-M202 PolarHBondContact O-N 2.9Å
201	S	44.5	Very low	37.4	Very low	125 Å²	125	133.7 Å²	133.7	87%	0.874	79%	0.788	S	S	*	*			trans	-81.3	96.8	-173.4	56.1	0	0	0	0	112.6
202	M	33.1	Very low	39.8	Very low	184 Å²	184	131 Å²	131	91%	0.906	76%	0.764	S	S	*	*			trans	-131.4	114.5	153.6	-80.5	-146.2	151	0	0	110.4	G200 L204	G200-M202 PolarHBondContact O-N 2.9Å; M202-L204 PolarHBondContact O-N 3.34Å
203	L	37.7	Very low	42.3	Very low	160 Å²	160	131.9 Å²	131.9	84%	0.838	76%	0.762	S	S	*	*			trans	-85.6	95.2	-178.5	-163.6	171.9	0	0	0	108.8
204	L	35.8	Very low	44.9	Very low	142 Å²	142	129.7 Å²	129.7	74%	0.743	74%	0.737	S	S	*	*			trans	-123.9	114.8	171.7	-149.5	156.9	0	0	0	107.7	M202 H206	M202-L204 PolarHBondContact O-N 3.34Å; L204-H206 VanDerWaalsContact C-N 3.31Å; L204-H206 PolarHBondContact O-N 2.98Å
205	N	35.5	Very low	47.5	Very low	133 Å²	133	124.2 Å²	124.2	71%	0.711	71%	0.712	S	S	*	*			trans	-68.7	83.5	-174.2	-86.5	-12.1	0	0	0	111.5	T207	N205-T207 PolarHBondContact O-N 2.78Å; N205-T207 VanDerWaalsContact O-N 3.09Å
206	H	34.1	Very low	50	Low	170 Å²	170	122.7 Å²	122.7	79%	0.787	69%	0.688	S	S	*	*			trans	-75.2	85.4	154	-102.2	-64.1	0	0	0	108.6	L204 S208	L204-H206 VanDerWaalsContact C-N 3.31Å; L204-H206 PolarHBondContact O-N 2.98Å; H206-S208 PolarHBondContact O-N 2.96Å
207	T	34.1	Very low	52.9	Low	109 Å²	109	115.6 Å²	115.6	67%	0.669	65%	0.651	S	S	*	*			trans	-57.4	121.3	165.1	35.3	0	0	0	0	109	N205 D209	N205-T207 PolarHBondContact O-N 2.78Å; N205-T207 VanDerWaalsContact O-N 3.09Å; T207-D209 PolarHBondContact O-N 3.44Å
208	S	39.7	Very low	55.5	Low	131 Å²	131	109.1 Å²	109.1	92%	0.916	61%	0.612	S	S	*	*			trans	-75.7	48	176.4	-60.3	0	0	0	0	111.8	H206	H206-S208 PolarHBondContact O-N 2.96Å
209	D	37	Very low	58.4	Low	115 Å²	115	104.1 Å²	104.1	62%	0.615	58%	0.577	S	S	*	*			trans	-105.3	42.4	-169.6	-159.9	18.5	0	0	0	111.5	T207 I211	T207-D209 PolarHBondContact O-N 3.44Å; D209-I211 VanDerWaalsContact C-N 3.32Å; D209-I211 PolarHBondContact O-N 3.11Å; D209-I211 VanDerWaalsContact O-N 3.15Å; D209-I211 WeakPolarHBondContact OD1-CG1 3.42Å
210	R	53.2	Low	60.8	Low	149 Å²	149	97.7 Å²	97.7	56%	0.562	54%	0.542	S	S	*	.			trans	-80.1	87.2	163.6	-72.4	-162.7	-174.5	-155.3	5.8	108	G184 C212	G184-R210 PolarHBondContact O-NH1 2.85Å; G184-R210 PolarHBondContact O-NH2 3.3Å; R210-C212 PolarHBondContact O-N 2.78Å
211	I	62.6	Low	63.6	Low	152 Å²	152	94.2 Å²	94.2	78%	0.779	51%	0.505	S	S	*	.			trans	-55.1	-10.9	-178.7	-63.3	166.6	0	0	0	114	D209	D209-I211 VanDerWaalsContact C-N 3.32Å; D209-I211 PolarHBondContact O-N 3.11Å; D209-I211 VanDerWaalsContact O-N 3.15Å; D209-I211 WeakPolarHBondContact OD1-CG1 3.42Å
212	C	76.2	Confident	66	Low	14 Å²	14	88.2 Å²	88.2	10%	0.095	46%	0.464	C	S	.	.	S	Bend	trans	-153.1	122.6	-167.3	178.1	0	0	0	0	110.3	Y185 R210 C216 Y217 M220	Y185-C212 PolarHBondContact OH-O 3.26Å; R210-C212 PolarHBondContact O-N 2.78Å; C212-C216 HydrophobicContact CB-CB 4.13Å; C212-C216 WeakPolarHBondContact CB-SG 3.4Å; C212-C216 WeakPolarHBondContact SG-CB 3.33Å; C212-C216 CovalentContact SG-SG 2.04Å; C212-C216 PolarHBondContact SG-SG 2.93Å; C212-Y217 PolarHBondContact SG-N 3.22Å; C212-M220 HydrophobicContact CB-CE 4.45Å
213	D	85.1	Confident	69	Low	132 Å²	132	79.8 Å²	79.8	71%	0.706	42%	0.423	S	S	*	.			trans	-65.2	168.4	177.3	-82.9	-43.1	0	0	0	113.6	S215 C216 Y217	D213-S215 VanDerWaalsContact C-N 3.31Å; D213-S215 PolarHBondContact O-N 3.35Å; D213-C216 HydrophobicContact CB-CB 4.48Å; D213-C216 CarbonylContact O-C 3.59Å; D213-C216 WeakPolarHBondContact O-CA 3.32Å; D213-C216 WeakPolarHBondContact O-CB 3.4Å; D213-C216 PolarHBondContact O-N 3.32Å; D213-Y217 PolarHBondContact O-N 3.26Å
214	K	86.7	Confident	71.7	Confident	83 Å²	83	72.2 Å²	72.2	36%	0.361	38%	0.383	S	S	.	.	H	α-helix	trans	-50.5	-46.4	177.3	-169.2	-175.5	176.5	-179.1	0	113.1	L180 Y185 N187 Y217 A218	L180-K214 HydrophobicContact CD2-CG 3.82Å; Y185-K214 HydrophobicContact CD1-CB 4.11Å; Y185-K214 HydrophobicContact CD1-CG 4.38Å; N187-K214 PolarHBondContact OD1-NZ 2.95Å; K214-Y217 PolarHBondContact O-N 3.35Å; K214-A218 VanDerWaalsContact O-CB 3.31Å; K214-A218 WeakPolarHBondContact O-CB 3.43Å; K214-A218 PolarHBondContact O-N 2.66Å
215	S	86.8	Confident	74.6	Confident	49 Å²	49	65.4 Å²	65.4	34%	0.343	35%	0.348	S	S	.	.	H	α-helix	trans	-63.9	-42.2	176.1	-66.2	0	0	0	0	112.5	E136 D213 A218 I219	E136-S215 WeakPolarHBondContact OE1-CB 3.41Å; E136-S215 PolarHBondContact OE1-OG 3.21Å; D213-S215 VanDerWaalsContact C-N 3.31Å; D213-S215 PolarHBondContact O-N 3.35Å; S215-A218 PolarHBondContact O-N 3.49Å; S215-I219 PolarHBondContact O-N 3.46Å; S215-I219 VanDerWaalsContact O-N 3.09Å
216	C	89.3	Confident	77.5	Confident	52 Å²	52	59.1 Å²	59.1	35%	0.351	31%	0.314	S	S	.	.	H	α-helix	trans	-61.2	-43.8	177.5	164.3	0	0	0	0	111	C212 D213 I219 M220	C212-C216 HydrophobicContact CB-CB 4.13Å; C212-C216 WeakPolarHBondContact CB-SG 3.4Å; C212-C216 WeakPolarHBondContact SG-CB 3.33Å; C212-C216 CovalentContact SG-SG 2.04Å; C212-C216 PolarHBondContact SG-SG 2.93Å; D213-C216 HydrophobicContact CB-CB 4.48Å; D213-C216 CarbonylContact O-C 3.59Å; D213-C216 WeakPolarHBondContact O-CA 3.32Å; D213-C216 WeakPolarHBondContact O-CB 3.4Å; D213-C216 PolarHBondContact O-N 3.32Å; C216-I219 WeakPolarHBondContact O-CG2 3.22Å; C216-M220 WeakPolarHBondContact O-CB 3.36Å; C216-M220 PolarHBondContact O-N 3.22Å
217	Y	91.3	Very high	80.5	Confident	38 Å²	38	52 Å²	52	15%	0.149	28%	0.281	C	S	.	.	H	α-helix	trans	-72.1	-36.3	178.2	-167.3	-93.4	0	0	0	111.7	E179 L180 A183 Y185 C212 D213 K214 I219 M220 V221	E179-Y217 HydrophobicContact CB-CE1 4.46Å; L180-Y217 HydrophobicContact CD2-CD1 3.73Å; L180-Y217 HydrophobicContact CG-CD1 4.29Å; A183-Y217 HydrophobicContact CB-CE1 3.77Å; A183-Y217 HydrophobicContact CB-CE2 4.43Å; Y185-Y217 HydrophobicContact CD2-CD1 4.31Å; Y185-Y217 HydrophobicContact CE2-CD1 4.08Å; Y185-Y217 HydrophobicContact CE2-CD2 4.28Å; Y185-Y217 AromaticContact CE2-CG 3.89Å; Y185-Y217 HydrophobicContact CE2-CG 3.89Å; C212-Y217 PolarHBondContact SG-N 3.22Å; D213-Y217 PolarHBondContact O-N 3.26Å; K214-Y217 PolarHBondContact O-N 3.35Å; Y217-I219 PolarHBondContact O-N 2.67Å; Y217-M220 HydrophobicContact CD2-SD 3.75Å; Y217-M220 HydrophobicContact CE2-SD 4.04Å; Y217-M220 WeakPolarHBondContact O-CB 3.43Å; Y217-M220 PolarHBondContact O-N 2.93Å; Y217-V221 HydrophobicContact CD1-CG2 3.94Å; Y217-V221 HydrophobicContact CE1-CG2 3.6Å; Y217-V221 WeakPolarHBondContact O-CG2 3.35Å; Y217-V221 PolarHBondContact O-N 3.02Å
218	A	92.4	Very high	83.5	Confident	3 Å²	3	47.7 Å²	47.7	3%	0.025	25%	0.253	C	S	.	.	H	α-helix	trans	-58.8	-46.5	175.3	0	0	0	0	0	112.1	Q135 V176 L180 K214 S215 G222	Q135-A218 PolarHBondContact NE2-O 3.04Å; V176-A218 HydrophobicContact CG1-CB 3.77Å; L180-A218 HydrophobicContact CD1-CB 4.24Å; K214-A218 VanDerWaalsContact O-CB 3.31Å; K214-A218 WeakPolarHBondContact O-CB 3.43Å; K214-A218 PolarHBondContact O-N 2.66Å; S215-A218 PolarHBondContact O-N 3.49Å; A218-G222 PolarHBondContact O-N 2.93Å
219	I	93.4	Very high	86.2	Confident	6 Å²	6	41.5 Å²	41.5	3%	0.031	21%	0.21	C	C	.	.	H	α-helix	trans	-75.9	-31.1	179.8	-165.9	58.6	0	0	0	112.5	Q135 Y139 S215 C216 Y217 G222 S223 H432 F434	Q135-I219 HydrophobicContact CG-CD1 4.32Å; Q135-I219 VanDerWaalsContact OE1-N 3.16Å; Y139-I219 HydrophobicContact CD1-CD1 4.06Å; Y139-I219 HydrophobicContact CD1-CG1 3.8Å; Y139-I219 HydrophobicContact CD2-CB 4.27Å; Y139-I219 HydrophobicContact CD2-CD1 3.94Å; Y139-I219 HydrophobicContact CD2-CG1 3.97Å; Y139-I219 HydrophobicContact CE1-CB 4.48Å; Y139-I219 HydrophobicContact CE1-CG1 3.9Å; Y139-I219 HydrophobicContact CE1-CG2 4.36Å; Y139-I219 HydrophobicContact CE2-CB 4.02Å; Y139-I219 HydrophobicContact CE2-CG1 4.08Å; Y139-I219 HydrophobicContact CE2-CG2 4.23Å; Y139-I219 HydrophobicContact CG-CD1 3.69Å; Y139-I219 HydrophobicContact CG-CG1 3.84Å; S215-I219 PolarHBondContact O-N 3.46Å; S215-I219 VanDerWaalsContact O-N 3.09Å; C216-I219 WeakPolarHBondContact O-CG2 3.22Å; Y217-I219 PolarHBondContact O-N 2.67Å; I219-G222 PolarHBondContact O-N 3Å; I219-S223 WeakPolarHBondContact O-CB 3.42Å; I219-S223 PolarHBondContact O-N 3.1Å; I219-S223 PolarHBondContact O-OG 3.37Å; I219-S223 VanDerWaalsContact O-OG 3.1Å; I219-H432 WeakPolarHBondContact CD1-O 3.32Å; I219-H432 HydrophobicContact CG1-CB 4.02Å; I219-F434 HydrophobicContact CD1-CD1 4.42Å
220	M	92.9	Very high	89	Confident	31 Å²	31	36 Å²	36	15%	0.153	18%	0.18	C	C	.	.	H	α-helix	trans	-59.4	-43.5	171.4	176	-164.4	-78.3	0	0	112.4	C212 C216 Y217 S223 S224 E375 L378	C212-M220 HydrophobicContact CB-CE 4.45Å; C216-M220 WeakPolarHBondContact O-CB 3.36Å; C216-M220 PolarHBondContact O-N 3.22Å; Y217-M220 HydrophobicContact CD2-SD 3.75Å; Y217-M220 HydrophobicContact CE2-SD 4.04Å; Y217-M220 WeakPolarHBondContact O-CB 3.43Å; Y217-M220 PolarHBondContact O-N 2.93Å; M220-S223 PolarHBondContact O-OG 3.44Å; M220-S224 WeakPolarHBondContact O-CB 3.42Å; M220-S224 PolarHBondContact O-N 3.4Å; M220-S224 PolarHBondContact O-OG 3.26Å; M220-E375 HydrophobicContact CE-CG 4.13Å; M220-E375 HydrophobicContact CG-CB 4.27Å; M220-E375 HydrophobicContact CG-CG 3.44Å; M220-E375 VanDerWaalsContact CG-CG 3.44Å; M220-E375 HydrophobicContact SD-CG 3.79Å; M220-L378 HydrophobicContact CG-CD1 3.8Å; M220-L378 HydrophobicContact SD-CD1 4.04Å
221	V	94.4	Very high	91.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-66.4	-49.2	171.7	174.3	0	0	0	0	110	T175 V176 E179 Y217 S223 S224 V225 L378 V382	T175-V221 HydrophobicContact CG2-CG1 4.08Å; V176-V221 HydrophobicContact CG2-CB 4.12Å; V176-V221 HydrophobicContact CG2-CG1 3.84Å; E179-V221 HydrophobicContact CB-CG1 4.14Å; E179-V221 HydrophobicContact CB-CG2 3.93Å; E179-V221 HydrophobicContact CG-CG1 4.02Å; Y217-V221 HydrophobicContact CD1-CG2 3.94Å; Y217-V221 HydrophobicContact CE1-CG2 3.6Å; Y217-V221 WeakPolarHBondContact O-CG2 3.35Å; Y217-V221 PolarHBondContact O-N 3.02Å; V221-S223 PolarHBondContact O-N 3.37Å; V221-S224 PolarHBondContact O-N 3.48Å; V221-S224 VanDerWaalsContact O-N 3.15Å; V221-V225 HydrophobicContact CG1-CG2 4.23Å; V221-V225 VanDerWaalsContact O-CG2 3.28Å; V221-V225 WeakPolarHBondContact O-CG2 3.22Å; V221-V225 PolarHBondContact O-N 3.18Å; V221-L378 HydrophobicContact CG2-CD1 3.93Å; V221-V382 HydrophobicContact CG1-CG1 4.31Å
222	G	94.9	Very high	92.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-58.2	-42.9	-177.3	0	0	0	0	0	114.2	A218 I219 T226	A218-G222 PolarHBondContact O-N 2.93Å; I219-G222 PolarHBondContact O-N 3Å; G222-T226 WeakPolarHBondContact O-CB 3.32Å; G222-T226 PolarHBondContact O-N 3.11Å; G222-T226 VanDerWaalsContact O-N 3.12Å; G222-T226 PolarHBondContact O-OG1 3.31Å
223	S	95.2	Very high	93.6	Very high	7 Å²	7	26.4 Å²	26.4	5%	0.049	14%	0.138	C	C	.	.	H	α-helix	trans	-70.5	-34.9	176.5	64.9	0	0	0	0	112.4	I219 M220 V221 T226 F227 S429	I219-S223 WeakPolarHBondContact O-CB 3.42Å; I219-S223 PolarHBondContact O-N 3.1Å; I219-S223 PolarHBondContact O-OG 3.37Å; I219-S223 VanDerWaalsContact O-OG 3.1Å; M220-S223 PolarHBondContact O-OG 3.44Å; V221-S223 PolarHBondContact O-N 3.37Å; S223-T226 PolarHBondContact O-N 3.49Å; S223-F227 WeakPolarHBondContact O-CB 3.3Å; S223-F227 PolarHBondContact O-N 3.04Å; S223-S429 WeakPolarHBondContact O-CB 3.13Å
224	S	95.7	Very high	94.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-68.4	-41.6	177	-56.1	0	0	0	0	112.6	M220 V221 T226 M228 E375	M220-S224 WeakPolarHBondContact O-CB 3.42Å; M220-S224 PolarHBondContact O-N 3.4Å; M220-S224 PolarHBondContact O-OG 3.26Å; V221-S224 PolarHBondContact O-N 3.48Å; V221-S224 VanDerWaalsContact O-N 3.15Å; S224-T226 VanDerWaalsContact C-N 3.3Å; S224-T226 PolarHBondContact O-N 2.87Å; S224-M228 PolarHBondContact O-N 3.3Å; S224-E375 PolarHBondContact OG-N 3.19Å
225	V	95.8	Very high	94.6	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-56.4	-46.9	168.8	175	0	0	0	0	110.5	T175 V221 M228 A229 V382 I389	T175-V225 HydrophobicContact CG2-CG2 3.61Å; V221-V225 HydrophobicContact CG1-CG2 4.23Å; V221-V225 VanDerWaalsContact O-CG2 3.28Å; V221-V225 WeakPolarHBondContact O-CG2 3.22Å; V221-V225 PolarHBondContact O-N 3.18Å; V225-M228 PolarHBondContact O-N 2.76Å; V225-A229 WeakPolarHBondContact O-CB 3.44Å; V225-A229 PolarHBondContact O-N 3.27Å; V225-V382 HydrophobicContact CG2-CB 3.72Å; V225-V382 HydrophobicContact CG2-CG1 3.75Å; V225-V382 HydrophobicContact CG2-CG2 4.19Å; V225-I389 HydrophobicContact CG1-CD1 3.38Å
226	T	96.3	Very high	94.8	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-67.8	-44.2	-174.1	-61.1	0	0	0	0	112.5	G222 S223 S224 M228 A229 G230 N425 F434 T435	G222-T226 WeakPolarHBondContact O-CB 3.32Å; G222-T226 PolarHBondContact O-N 3.11Å; G222-T226 VanDerWaalsContact O-N 3.12Å; G222-T226 PolarHBondContact O-OG1 3.31Å; S223-T226 PolarHBondContact O-N 3.49Å; S224-T226 VanDerWaalsContact C-N 3.3Å; S224-T226 PolarHBondContact O-N 2.87Å; T226-M228 VanDerWaalsContact C-N 3.33Å; T226-M228 PolarHBondContact O-N 3.4Å; T226-A229 PolarHBondContact O-N 2.91Å; T226-G230 PolarHBondContact O-N 3.43Å; T226-N425 HydrophobicContact CG2-CB 4.01Å; T226-F434 VanDerWaalsContact OG1-C 3.29Å; T226-F434 WeakPolarHBondContact OG1-CA 3.1Å; T226-T435 PolarHBondContact OG1-N 3.3Å; T226-T435 PolarHBondContact OG1-OG1 2.67Å; T226-T435 VanDerWaalsContact OG1-OG1 3.12Å
227	F	97.1	Very high	94.9	Very high	22 Å²	22	15.7 Å²	15.7	10%	0.096	8%	0.082	C	C	.	.	H	α-helix	trans	-55.1	-49.9	173.1	177.1	-108.2	0	0	0	110.7	S223 G230 V231 P374 W376 I379 I426 S429 F430	S223-F227 WeakPolarHBondContact O-CB 3.3Å; S223-F227 PolarHBondContact O-N 3.04Å; F227-G230 PolarHBondContact O-N 2.93Å; F227-V231 HydrophobicContact CD1-CG2 4.47Å; F227-V231 HydrophobicContact CE1-CG2 4.15Å; F227-V231 HydrophobicContact CE2-CG2 4.28Å; F227-V231 HydrophobicContact CZ-CG2 4.05Å; F227-V231 WeakPolarHBondContact O-CG2 3.48Å; F227-V231 PolarHBondContact O-N 3.42Å; F227-P374 HydrophobicContact CB-CB 4.12Å; F227-P374 HydrophobicContact CB-CG 3.82Å; F227-P374 HydrophobicContact CD1-CB 4.47Å; F227-P374 HydrophobicContact CD2-CG 4.17Å; F227-P374 HydrophobicContact CG-CB 4.29Å; F227-P374 HydrophobicContact CG-CG 3.93Å; F227-W376 AromaticContact CE1-CH2 3.97Å; F227-W376 HydrophobicContact CE1-CH2 3.97Å; F227-W376 HydrophobicContact CE1-CZ2 4.42Å; F227-W376 HydrophobicContact CE1-CZ3 4.38Å; F227-W376 HydrophobicContact CZ-CH2 4.13Å; F227-W376 HydrophobicContact CZ-CZ2 4.44Å; F227-I379 HydrophobicContact CD1-CD1 4.22Å; F227-I379 HydrophobicContact CE1-CD1 4.28Å; F227-I426 HydrophobicContact CD2-CG2 4.25Å; F227-I426 HydrophobicContact CE2-CG2 4.09Å; F227-S429 WeakPolarHBondContact CB-OG 3.31Å; F227-F430 HydrophobicContact CD2-CE2 4.14Å; F227-F430 HydrophobicContact CD2-CZ 4.26Å; F227-F430 AromaticContact CE2-CE2 3.98Å; F227-F430 HydrophobicContact CE2-CE2 3.98Å; F227-F430 AromaticContact CE2-CZ 3.82Å; F227-F430 HydrophobicContact CE2-CZ 3.82Å
228	M	96.6	Very high	94.9	Very high	18 Å²	18	19.4 Å²	19.4	9%	0.089	10%	0.104	C	C	.	.	H	α-helix	trans	-66.6	-41.3	-178.3	-166.6	51.4	42.3	0	0	112.6	S224 V225 T226 G230 V231 Y232 I379 A386	S224-M228 PolarHBondContact O-N 3.3Å; V225-M228 PolarHBondContact O-N 2.76Å; T226-M228 VanDerWaalsContact C-N 3.33Å; T226-M228 PolarHBondContact O-N 3.4Å; M228-G230 VanDerWaalsContact C-N 3.3Å; M228-G230 PolarHBondContact O-N 3.48Å; M228-V231 PolarHBondContact O-N 2.84Å; M228-Y232 HydrophobicContact CG-CD2 4.32Å; M228-Y232 HydrophobicContact CG-CE1 4.49Å; M228-Y232 HydrophobicContact CG-CE2 3.64Å; M228-Y232 WeakPolarHBondContact O-CD2 3.32Å; M228-Y232 PolarHBondContact O-N 3.43Å; M228-Y232 HydrophobicContact SD-CE1 3.92Å; M228-Y232 HydrophobicContact SD-CE2 4.16Å; M228-I379 HydrophobicContact CE-CB 4.43Å; M228-I379 HydrophobicContact CE-CD1 3.8Å; M228-I379 HydrophobicContact CE-CG1 4.08Å; M228-I379 HydrophobicContact CE-CG2 3.53Å; M228-I379 HydrophobicContact SD-CG2 4.36Å; M228-A386 HydrophobicContact CB-CB 3.82Å; M228-A386 HydrophobicContact CG-CB 3.84Å
229	A	96.7	Very high	94.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.8	-36.9	174.3	0	0	0	0	0	112.4	V225 T226 Q233 A386 I389 S390	V225-A229 WeakPolarHBondContact O-CB 3.44Å; V225-A229 PolarHBondContact O-N 3.27Å; T226-A229 PolarHBondContact O-N 2.91Å; A229-Q233 WeakPolarHBondContact O-CG 3.25Å; A229-Q233 PolarHBondContact O-N 2.87Å; A229-A386 HydrophobicContact CB-CB 4.26Å; A229-I389 HydrophobicContact CB-CB 4.23Å; A229-I389 HydrophobicContact CB-CG2 3.67Å; A229-S390 VanDerWaalsContact O-CB 3.27Å; A229-S390 WeakPolarHBondContact O-CB 3.31Å
230	G	97.3	Very high	94.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67.7	-41.2	173.1	0	0	0	0	0	113.1	T226 F227 M228 Q233 V234 I426	T226-G230 PolarHBondContact O-N 3.43Å; F227-G230 PolarHBondContact O-N 2.93Å; M228-G230 VanDerWaalsContact C-N 3.3Å; M228-G230 PolarHBondContact O-N 3.48Å; G230-Q233 WeakPolarHBondContact O-CB 3.42Å; G230-Q233 PolarHBondContact O-N 3.2Å; G230-V234 PolarHBondContact O-N 2.74Å; G230-I426 VanDerWaalsContact C-CG1 3.5Å
231	V	96.8	Very high	94.3	Very high	49 Å²	49	33.6 Å²	33.6	30%	0.297	17%	0.169	S	C	.	.	H	α-helix	trans	-60.2	-44.1	173.3	167.8	0	0	0	0	110.8	F227 M228 V234 A235 I426	F227-V231 HydrophobicContact CD1-CG2 4.47Å; F227-V231 HydrophobicContact CE1-CG2 4.15Å; F227-V231 HydrophobicContact CE2-CG2 4.28Å; F227-V231 HydrophobicContact CZ-CG2 4.05Å; F227-V231 WeakPolarHBondContact O-CG2 3.48Å; F227-V231 PolarHBondContact O-N 3.42Å; M228-V231 PolarHBondContact O-N 2.84Å; V231-V234 PolarHBondContact O-N 3.1Å; V231-A235 WeakPolarHBondContact O-CB 3.3Å; V231-A235 PolarHBondContact O-N 3.43Å; V231-I426 HydrophobicContact CG2-CD1 4.12Å; V231-I426 HydrophobicContact CG2-CG1 4.24Å
232	Y	96	Very high	93.7	Very high	64 Å²	64	33.7 Å²	33.7	25%	0.251	17%	0.171	S	C	.	.	H	α-helix	trans	-64.3	-38.5	174.3	-64.2	-35.9	0	0	0	113	M228 A235 M236 A383 A386 I387	M228-Y232 HydrophobicContact CG-CD2 4.32Å; M228-Y232 HydrophobicContact CG-CE1 4.49Å; M228-Y232 HydrophobicContact CG-CE2 3.64Å; M228-Y232 WeakPolarHBondContact O-CD2 3.32Å; M228-Y232 PolarHBondContact O-N 3.43Å; M228-Y232 HydrophobicContact SD-CE1 3.92Å; M228-Y232 HydrophobicContact SD-CE2 4.16Å; Y232-A235 PolarHBondContact O-N 3.16Å; Y232-M236 WeakPolarHBondContact O-CB 3.33Å; Y232-M236 WeakPolarHBondContact O-CE 3.38Å; Y232-M236 WeakPolarHBondContact O-CG 3.37Å; Y232-M236 PolarHBondContact O-N 2.98Å; Y232-A383 WeakPolarHBondContact CE2-O 3.45Å; Y232-A383 PolarHBondContact OH-O 2.76Å; Y232-A386 HydrophobicContact CD2-CB 4.15Å; Y232-A386 HydrophobicContact CE2-CB 3.81Å; Y232-I387 HydrophobicContact CD2-CG1 3.84Å; Y232-I387 HydrophobicContact CE2-CB 4.48Å; Y232-I387 HydrophobicContact CE2-CD1 4.48Å; Y232-I387 HydrophobicContact CE2-CG1 3.48Å; Y232-I387 VanDerWaalsContact CE2-CG1 3.48Å
233	Q	95.9	Very high	93.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.2	-45.6	173	-79.4	162.4	-6.8	0	0	111.9	A229 G230 M236 G237 S390 M418 I421 N425	A229-Q233 WeakPolarHBondContact O-CG 3.25Å; A229-Q233 PolarHBondContact O-N 2.87Å; G230-Q233 WeakPolarHBondContact O-CB 3.42Å; G230-Q233 PolarHBondContact O-N 3.2Å; Q233-M236 HydrophobicContact CG-CE 4.44Å; Q233-M236 PolarHBondContact O-N 3.44Å; Q233-G237 PolarHBondContact O-N 2.71Å; Q233-S390 PolarHBondContact NE2-O 3.34Å; Q233-M418 WeakPolarHBondContact O-CG 3.44Å; Q233-I421 HydrophobicContact CG-CG2 4.26Å; Q233-I421 PolarHBondContact OE1-O 2.86Å; Q233-N425 PolarHBondContact OE1-ND2 2.95Å
234	V	95.9	Very high	92.3	Very high	23 Å²	23	41.4 Å²	41.4	14%	0.139	21%	0.207	C	C	.	.	H	α-helix	trans	-65.3	-41.2	175.8	174.7	0	0	0	0	111.6	G230 V231 G237 L238 Y419 F423 I426	G230-V234 PolarHBondContact O-N 2.74Å; V231-V234 PolarHBondContact O-N 3.1Å; V234-G237 WeakPolarHBondContact O-CA 3.36Å; V234-G237 PolarHBondContact O-N 3.32Å; V234-G237 VanDerWaalsContact O-N 3.15Å; V234-L238 HydrophobicContact CG1-CD1 4.39Å; V234-L238 WeakPolarHBondContact O-CG 3.19Å; V234-L238 PolarHBondContact O-N 2.94Å; V234-Y419 HydrophobicContact CG1-CD1 4.31Å; V234-Y419 HydrophobicContact CG1-CE1 4.38Å; V234-F423 HydrophobicContact CG2-CD2 4.4Å; V234-F423 HydrophobicContact CG2-CE2 4.16Å; V234-F423 HydrophobicContact CG2-CZ 4.21Å; V234-I426 HydrophobicContact CB-CD1 4.28Å; V234-I426 HydrophobicContact CG2-CD1 3.62Å
235	A	95.4	Very high	91.6	Very high	31 Å²	31	42 Å²	42	26%	0.256	21%	0.211	S	C	.	.	H	α-helix	trans	-62.6	-45.7	176.5	0	0	0	0	0	112.4	V231 Y232 G237 L238 F239	V231-A235 WeakPolarHBondContact O-CB 3.3Å; V231-A235 PolarHBondContact O-N 3.43Å; Y232-A235 PolarHBondContact O-N 3.16Å; A235-G237 PolarHBondContact O-N 2.91Å; A235-L238 WeakPolarHBondContact O-CB 3.31Å; A235-L238 PolarHBondContact O-N 2.9Å; A235-L238 VanDerWaalsContact O-N 3.16Å; A235-F239 WeakPolarHBondContact O-CD2 3.29Å; A235-F239 PolarHBondContact O-N 2.81Å
236	M	92.5	Very high	90.8	Very high	37 Å²	37	47.6 Å²	47.6	18%	0.182	25%	0.246	C	C	.	.	H	α-helix	trans	-61	-34.6	172.6	-75.2	-171.7	-71.7	0	0	111.8	Y232 Q233 Q240 V241 S390 I391 M418	Y232-M236 WeakPolarHBondContact O-CB 3.33Å; Y232-M236 WeakPolarHBondContact O-CE 3.38Å; Y232-M236 WeakPolarHBondContact O-CG 3.37Å; Y232-M236 PolarHBondContact O-N 2.98Å; Q233-M236 HydrophobicContact CG-CE 4.44Å; Q233-M236 PolarHBondContact O-N 3.44Å; M236-Q240 PolarHBondContact O-N 3.47Å; M236-Q240 VanDerWaalsContact O-N 3.14Å; M236-V241 HydrophobicContact CB-CB 4.02Å; M236-V241 HydrophobicContact CB-CG2 4.39Å; M236-V241 HydrophobicContact CG-CB 4.32Å; M236-V241 HydrophobicContact CG-CG1 4.39Å; M236-V241 WeakPolarHBondContact O-CB 3.11Å; M236-V241 PolarHBondContact O-N 2.89Å; M236-V241 HydrophobicContact SD-CG1 4.48Å; M236-S390 WeakPolarHBondContact CE-OG 3.18Å; M236-I391 HydrophobicContact CE-CG1 4.32Å; M236-I391 HydrophobicContact SD-CG1 4.37Å; M236-M418 HydrophobicContact CB-CE 3.84Å; M236-M418 HydrophobicContact CB-CG 4.45Å; M236-M418 HydrophobicContact CB-SD 3.5Å; M236-M418 WeakPolarHBondContact CB-SD 3.43Å; M236-M418 HydrophobicContact CE-SD 4.46Å
237	G	91.3	Very high	90	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-46.8	170.9	0	0	0	0	0	113	Q233 V234 A235 Q240 Y419	Q233-G237 PolarHBondContact O-N 2.71Å; V234-G237 WeakPolarHBondContact O-CA 3.36Å; V234-G237 PolarHBondContact O-N 3.32Å; V234-G237 VanDerWaalsContact O-N 3.15Å; A235-G237 PolarHBondContact O-N 2.91Å; G237-Q240 WeakPolarHBondContact O-CA 3.27Å; G237-Q240 PolarHBondContact O-N 3.47Å; G237-Y419 VanDerWaalsContact C-CZ 3.45Å; G237-Y419 PolarHBondContact O-OH 3.42Å; G237-Y419 VanDerWaalsContact O-OH 3.09Å
238	L	91.3	Very high	89.3	Confident	116 Å²	116	54 Å²	54	61%	0.607	27%	0.271	S	S	*	.	H	α-helix	trans	-61.6	-44.5	178	-70	169.6	0	0	0	111.9	V234 A235 Q240 Y419	V234-L238 HydrophobicContact CG1-CD1 4.39Å; V234-L238 WeakPolarHBondContact O-CG 3.19Å; V234-L238 PolarHBondContact O-N 2.94Å; A235-L238 WeakPolarHBondContact O-CB 3.31Å; A235-L238 PolarHBondContact O-N 2.9Å; A235-L238 VanDerWaalsContact O-N 3.16Å; L238-Q240 PolarHBondContact O-N 2.91Å; L238-Y419 WeakPolarHBondContact CA-OH 3.5Å; L238-Y419 HydrophobicContact CD2-CE1 4.28Å; L238-Y419 HydrophobicContact CG-CE1 4.22Å; L238-Y419 PolarHBondContact N-OH 2.88Å
239	F	91	Very high	88.9	Confident	168 Å²	168	54.8 Å²	54.8	74%	0.737	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	4.2	174.5	-65.7	-61.3	0	0	0	113.9	A235 V241	A235-F239 WeakPolarHBondContact O-CD2 3.29Å; A235-F239 PolarHBondContact O-N 2.81Å; F239-V241 HydrophobicContact CB-CG2 3.71Å; F239-V241 PolarHBondContact O-N 2.98Å
240	Q	87.3	Confident	88.4	Confident	133 Å²	133	60.6 Å²	60.6	62%	0.621	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	31.2	178.7	-56.4	-169.2	14.1	0	0	114.7	M236 G237 L238 G242 N415	M236-Q240 PolarHBondContact O-N 3.47Å; M236-Q240 VanDerWaalsContact O-N 3.14Å; G237-Q240 WeakPolarHBondContact O-CA 3.27Å; G237-Q240 PolarHBondContact O-N 3.47Å; L238-Q240 PolarHBondContact O-N 2.91Å; Q240-G242 PolarHBondContact O-N 3.13Å; Q240-N415 WeakPolarHBondContact CB-ND2 3.47Å
241	V	86.6	Confident	88.1	Confident	37 Å²	37	61.2 Å²	61.2	22%	0.224	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-68.4	-0.7	-175.8	-176.9	0	0	0	0	112.7	M236 F239 F243 V244 M418	M236-V241 HydrophobicContact CB-CB 4.02Å; M236-V241 HydrophobicContact CB-CG2 4.39Å; M236-V241 HydrophobicContact CG-CB 4.32Å; M236-V241 HydrophobicContact CG-CG1 4.39Å; M236-V241 WeakPolarHBondContact O-CB 3.11Å; M236-V241 PolarHBondContact O-N 2.89Å; M236-V241 HydrophobicContact SD-CG1 4.48Å; F239-V241 HydrophobicContact CB-CG2 3.71Å; F239-V241 PolarHBondContact O-N 2.98Å; V241-F243 HydrophobicContact CG1-CE1 4.37Å; V241-F243 PolarHBondContact O-N 2.93Å; V241-V244 HydrophobicContact CG1-CB 4.4Å; V241-V244 HydrophobicContact CG1-CG2 3.58Å; V241-V244 WeakPolarHBondContact O-CB 3.35Å; V241-V244 WeakPolarHBondContact O-CG2 3.38Å; V241-V244 PolarHBondContact O-N 3.41Å; V241-M418 HydrophobicContact CB-CE 4.33Å
242	G	82.8	Confident	87.8	Confident	3 Å²	3	58.9 Å²	58.9	3%	0.031	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-59.6	-13.1	179	0	0	0	0	0	114.8	Q240 V244 S245 N415	Q240-G242 PolarHBondContact O-N 3.13Å; G242-V244 PolarHBondContact O-N 3.42Å; G242-S245 PolarHBondContact O-N 3.48Å; G242-S245 PolarHBondContact O-OG 3.15Å; G242-S245 VanDerWaalsContact O-OG 3.08Å; G242-N415 WeakPolarHBondContact CA-OD1 3.35Å; G242-N415 PolarHBondContact N-OD1 3.07Å
243	F	81.6	Confident	87.3	Confident	119 Å²	119	57 Å²	57	52%	0.522	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-59.1	-21.5	167.3	78.5	-89	0	0	0	113.2	V241 S245 V246 Y247	V241-F243 HydrophobicContact CG1-CE1 4.37Å; V241-F243 PolarHBondContact O-N 2.93Å; F243-S245 PolarHBondContact O-N 2.88Å; F243-V246 WeakPolarHBondContact O-CB 3.45Å; F243-V246 WeakPolarHBondContact O-CG2 3.43Å; F243-V246 PolarHBondContact O-N 3.13Å; F243-V246 VanDerWaalsContact O-N 3.08Å; F243-Y247 AromaticContact CD2-CE2 3.92Å; F243-Y247 HydrophobicContact CD2-CE2 3.92Å; F243-Y247 AromaticContact CE2-CE2 3.96Å; F243-Y247 HydrophobicContact CE2-CE2 3.96Å
244	V	79.5	Confident	86.9	Confident	50 Å²	50	58.5 Å²	58.5	30%	0.303	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-59.9	-24.8	176	170.9	0	0	0	0	112.2	V241 G242 V246 Y247	V241-V244 HydrophobicContact CG1-CB 4.4Å; V241-V244 HydrophobicContact CG1-CG2 3.58Å; V241-V244 WeakPolarHBondContact O-CB 3.35Å; V241-V244 WeakPolarHBondContact O-CG2 3.38Å; V241-V244 PolarHBondContact O-N 3.41Å; G242-V244 PolarHBondContact O-N 3.42Å; V244-V246 PolarHBondContact O-N 3.32Å; V244-V246 VanDerWaalsContact O-N 3.16Å; V244-Y247 PolarHBondContact O-N 2.89Å
245	S	79.4	Confident	86.8	Confident	12 Å²	12	57.4 Å²	57.4	8%	0.084	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-58.7	-27.9	174.8	71.3	0	0	0	0	113.2	G242 F243 Y247 L248	G242-S245 PolarHBondContact O-N 3.48Å; G242-S245 PolarHBondContact O-OG 3.15Å; G242-S245 VanDerWaalsContact O-OG 3.08Å; F243-S245 PolarHBondContact O-N 2.88Å; S245-Y247 VanDerWaalsContact C-N 3.25Å; S245-Y247 PolarHBondContact O-N 3.05Å; S245-L248 PolarHBondContact O-N 3.05Å
246	V	80.1	Confident	86.5	Confident	118 Å²	118	56 Å²	56	72%	0.715	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-67.4	-24	-178.1	-177	0	0	0	0	112.5	F243 V244	F243-V246 WeakPolarHBondContact O-CB 3.45Å; F243-V246 WeakPolarHBondContact O-CG2 3.43Å; F243-V246 PolarHBondContact O-N 3.13Å; F243-V246 VanDerWaalsContact O-N 3.08Å; V244-V246 PolarHBondContact O-N 3.32Å; V244-V246 VanDerWaalsContact O-N 3.16Å
247	Y	80.1	Confident	86.3	Confident	135 Å²	135	55.9 Å²	55.9	53%	0.529	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-86.9	-8.8	177.6	-57.6	-76.3	0	0	0	113.6	F243 V244 S245 S249	F243-Y247 AromaticContact CD2-CE2 3.92Å; F243-Y247 HydrophobicContact CD2-CE2 3.92Å; F243-Y247 AromaticContact CE2-CE2 3.96Å; F243-Y247 HydrophobicContact CE2-CE2 3.96Å; V244-Y247 PolarHBondContact O-N 2.89Å; S245-Y247 VanDerWaalsContact C-N 3.25Å; S245-Y247 PolarHBondContact O-N 3.05Å; Y247-S249 PolarHBondContact O-N 3.33Å
248	L	82.4	Confident	86.3	Confident	21 Å²	21	56 Å²	56	11%	0.11	29%	0.288	C	S	.	.			trans	-89.1	89	-179.5	-62.2	174.5	0	0	0	110.2	S245 L252 A395 V535	S245-L248 PolarHBondContact O-N 3.05Å; L248-L252 HydrophobicContact CD2-CD2 4.14Å; L248-A395 HydrophobicContact CD1-CB 3.44Å; L248-A395 VanDerWaalsContact CD1-CB 3.44Å; L248-V535 HydrophobicContact CD2-CG2 3.94Å
249	S	87.5	Confident	86.4	Confident	34 Å²	34	50.4 Å²	50.4	24%	0.238	26%	0.26	C	S	.	.			trans	-67.9	148.2	179.4	66.7	0	0	0	0	112.5	Y247 A251 L252 L253	Y247-S249 PolarHBondContact O-N 3.33Å; S249-A251 PolarHBondContact O-N 3.36Å; S249-A251 VanDerWaalsContact O-N 3.17Å; S249-L252 WeakPolarHBondContact O-CB 3.47Å; S249-L252 PolarHBondContact O-N 3Å; S249-L252 VanDerWaalsContact O-N 3.07Å; S249-L252 VanDerWaalsContact OG-CB 3.31Å; S249-L252 WeakPolarHBondContact OG-CB 3.38Å; S249-L252 PolarHBondContact OG-N 2.84Å; S249-L253 PolarHBondContact O-N 3.4Å
250	D	85.1	Confident	86.3	Confident	123 Å²	123	42.4 Å²	42.4	66%	0.658	22%	0.224	S	C	*	.	H	α-helix	trans	-56.6	-32.9	176.8	-71.8	-47.2	0	0	0	112.3	S254	D250-S254 WeakPolarHBondContact O-CB 3.48Å; D250-S254 PolarHBondContact O-N 3.01Å
251	A	91.3	Very high	86.5	Confident	12 Å²	12	36.3 Å²	36.3	10%	0.099	20%	0.196	C	C	.	.	H	α-helix	trans	-66.9	-44.6	176.1	0	0	0	0	0	112.3	S249 G255 D511 W515	S249-A251 PolarHBondContact O-N 3.36Å; S249-A251 VanDerWaalsContact O-N 3.17Å; A251-G255 PolarHBondContact O-N 2.92Å; A251-D511 HydrophobicContact CB-CB 4.06Å; A251-W515 HydrophobicContact CB-CB 4.47Å
252	L	90.9	Very high	86.7	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.2	-50.1	174.4	171.6	166.9	0	0	0	110.9	L248 S249 S254 G255 F256 I514 T518 L531 G534 V535	L248-L252 HydrophobicContact CD2-CD2 4.14Å; S249-L252 WeakPolarHBondContact O-CB 3.47Å; S249-L252 PolarHBondContact O-N 3Å; S249-L252 VanDerWaalsContact O-N 3.07Å; S249-L252 VanDerWaalsContact OG-CB 3.31Å; S249-L252 WeakPolarHBondContact OG-CB 3.38Å; S249-L252 PolarHBondContact OG-N 2.84Å; L252-S254 PolarHBondContact O-N 3.39Å; L252-G255 PolarHBondContact O-N 3.1Å; L252-F256 WeakPolarHBondContact O-CB 3.41Å; L252-F256 PolarHBondContact O-N 3.47Å; L252-I514 HydrophobicContact CB-CG2 4.07Å; L252-T518 HydrophobicContact CG-CG2 4.37Å; L252-L531 HydrophobicContact CD2-CD1 3.49Å; L252-L531 VanDerWaalsContact CD2-CD1 3.49Å; L252-L531 HydrophobicContact CG-CD1 4.43Å; L252-G534 WeakPolarHBondContact CD1-O 3.46Å; L252-V535 HydrophobicContact CD1-CB 4.32Å; L252-V535 HydrophobicContact CD1-CG2 3.84Å
253	L	85.5	Confident	87.1	Confident	24 Å²	24	38 Å²	38	13%	0.126	20%	0.201	C	C	.	.	H	α-helix	trans	-65.8	-41	-177.6	-174.4	65.9	0	0	0	111.8	S249 F256 V257 I396	S249-L253 PolarHBondContact O-N 3.4Å; L253-F256 HydrophobicContact CD1-CD1 4.34Å; L253-V257 HydrophobicContact CD1-CG2 4.44Å; L253-V257 WeakPolarHBondContact O-CB 3.5Å; L253-V257 VanDerWaalsContact O-CG2 3.32Å; L253-V257 WeakPolarHBondContact O-CG2 3.5Å; L253-V257 PolarHBondContact O-N 2.9Å; L253-I396 HydrophobicContact CD1-CG1 4.25Å
254	S	88.1	Confident	87.5	Confident	33 Å²	33	32.5 Å²	32.5	23%	0.231	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-41.4	173.6	178.5	0	0	0	0	111.9	D250 L252 T258 W515	D250-S254 WeakPolarHBondContact O-CB 3.48Å; D250-S254 PolarHBondContact O-N 3.01Å; L252-S254 PolarHBondContact O-N 3.39Å; S254-T258 WeakPolarHBondContact O-CB 3.29Å; S254-T258 PolarHBondContact O-N 3.27Å; S254-T258 PolarHBondContact O-OG1 3.25Å; S254-W515 PolarHBondContact OG-NE1 3.33Å
255	G	92.3	Very high	88.1	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.2	-51.4	176.2	0	0	0	0	0	111.6	A251 L252 T258 G259 W515 M519	A251-G255 PolarHBondContact O-N 2.92Å; L252-G255 PolarHBondContact O-N 3.1Å; G255-T258 PolarHBondContact O-N 3.4Å; G255-T258 VanDerWaalsContact O-N 3.17Å; G255-G259 PolarHBondContact O-N 3.16Å; G255-W515 VanDerWaalsContact N-CD1 3.31Å; G255-M519 VanDerWaalsContact O-CA 3.32Å; G255-M519 WeakPolarHBondContact O-CA 3.16Å; G255-M519 WeakPolarHBondContact O-CB 3.46Å
256	F	89.7	Confident	88.7	Confident	1 Å²	1	31.7 Å²	31.7	0%	0.004	17%	0.17	C	C	.	.	H	α-helix	trans	-55.8	-52.1	176.3	168.9	-114.8	0	0	0	112.6	V167 L252 L253 T258 G259 A260 I392 I396 T518 T527 L531	V167-F256 HydrophobicContact CG1-CE2 4.41Å; V167-F256 HydrophobicContact CG1-CZ 3.82Å; L252-F256 WeakPolarHBondContact O-CB 3.41Å; L252-F256 PolarHBondContact O-N 3.47Å; L253-F256 HydrophobicContact CD1-CD1 4.34Å; F256-T258 PolarHBondContact O-N 3.38Å; F256-G259 PolarHBondContact O-N 3.23Å; F256-A260 WeakPolarHBondContact O-CB 3.46Å; F256-A260 PolarHBondContact O-N 3.35Å; F256-I392 HydrophobicContact CE1-CG2 4.09Å; F256-I392 HydrophobicContact CZ-CD1 4.05Å; F256-I392 HydrophobicContact CZ-CG1 4.21Å; F256-I392 HydrophobicContact CZ-CG2 3.97Å; F256-I396 HydrophobicContact CE1-CD1 4.33Å; F256-T518 HydrophobicContact CB-CG2 3.85Å; F256-T527 WeakPolarHBondContact CE2-O 3.37Å; F256-L531 HydrophobicContact CB-CD1 4.36Å; F256-L531 HydrophobicContact CD1-CD1 4.47Å; F256-L531 HydrophobicContact CD2-CB 3.94Å; F256-L531 HydrophobicContact CD2-CD1 4.47Å; F256-L531 HydrophobicContact CE2-CB 4Å; F256-L531 HydrophobicContact CG-CB 4.49Å; F256-L531 HydrophobicContact CG-CD1 4.19Å
257	V	87.8	Confident	89.1	Confident	35 Å²	35	27.4 Å²	27.4	21%	0.212	15%	0.145	C	C	.	.	H	α-helix	trans	-62.9	-31.5	179	172	0	0	0	0	111.6	L253 S261 A494	L253-V257 HydrophobicContact CD1-CG2 4.44Å; L253-V257 WeakPolarHBondContact O-CB 3.5Å; L253-V257 VanDerWaalsContact O-CG2 3.32Å; L253-V257 WeakPolarHBondContact O-CG2 3.5Å; L253-V257 PolarHBondContact O-N 2.9Å; V257-S261 WeakPolarHBondContact O-CB 3.47Å; V257-S261 PolarHBondContact O-N 3.01Å; V257-S261 VanDerWaalsContact O-N 3.08Å; V257-S261 PolarHBondContact O-OG 2.88Å; V257-A494 HydrophobicContact CG1-CB 4.04Å
258	T	92.5	Very high	89.6	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.006	12%	0.121	C	C	.	.	H	α-helix	trans	-72.4	-44.1	174.4	-53.7	0	0	0	0	111.8	S254 G255 F256 S261 F262 F498 W515 M519	S254-T258 WeakPolarHBondContact O-CB 3.29Å; S254-T258 PolarHBondContact O-N 3.27Å; S254-T258 PolarHBondContact O-OG1 3.25Å; G255-T258 PolarHBondContact O-N 3.4Å; G255-T258 VanDerWaalsContact O-N 3.17Å; F256-T258 PolarHBondContact O-N 3.38Å; T258-S261 WeakPolarHBondContact O-CB 3.43Å; T258-S261 PolarHBondContact O-N 2.98Å; T258-S261 VanDerWaalsContact O-N 3.15Å; T258-F262 HydrophobicContact CG2-CE2 4.37Å; T258-F262 WeakPolarHBondContact O-CD2 3.44Å; T258-F262 PolarHBondContact O-N 3.27Å; T258-F498 HydrophobicContact CG2-CD2 4.03Å; T258-F498 HydrophobicContact CG2-CE2 3.41Å; T258-F498 VanDerWaalsContact CG2-CE2 3.41Å; T258-F498 HydrophobicContact CG2-CZ 4.15Å; T258-W515 HydrophobicContact CG2-CH2 4Å; T258-W515 HydrophobicContact CG2-CZ2 3.81Å; T258-M519 HydrophobicContact CG2-CG 4Å
259	G	92.6	Very high	90.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-62.8	-47.7	177.3	0	0	0	0	0	112.2	G255 F256 S261 F262 T263 M519	G255-G259 PolarHBondContact O-N 3.16Å; F256-G259 PolarHBondContact O-N 3.23Å; G259-S261 PolarHBondContact O-N 2.99Å; G259-F262 WeakPolarHBondContact O-CB 3.48Å; G259-F262 PolarHBondContact O-N 3.05Å; G259-T263 PolarHBondContact O-N 3.44Å; G259-M519 WeakPolarHBondContact CA-O 3.41Å
260	A	88.9	Confident	90.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-66.2	-20.8	174.1	0	0	0	0	0	113.3	V167 F256 F262 T263 I264 S522 T527	V167-A260 HydrophobicContact CB-CB 4.36Å; V167-A260 HydrophobicContact CG1-CB 3.81Å; V167-A260 HydrophobicContact CG2-CB 3.58Å; F256-A260 WeakPolarHBondContact O-CB 3.46Å; F256-A260 PolarHBondContact O-N 3.35Å; A260-F262 VanDerWaalsContact C-N 3.34Å; A260-T263 WeakPolarHBondContact CA-OG1 3.43Å; A260-T263 PolarHBondContact O-N 3.12Å; A260-T263 PolarHBondContact O-OG1 3.01Å; A260-I264 VanDerWaalsContact O-CG1 3.25Å; A260-I264 WeakPolarHBondContact O-CG1 3.38Å; A260-I264 PolarHBondContact O-N 3.49Å; A260-I264 VanDerWaalsContact O-N 3.09Å; A260-S522 PolarHBondContact N-OG 2.83Å; A260-T527 HydrophobicContact CB-CG2 3.83Å
261	S	91.4	Very high	90.4	Very high	4 Å²	4	16 Å²	16	3%	0.028	9%	0.088	C	C	.	.	H	α-helix	trans	-69.7	-30	169.9	-64	0	0	0	0	112.3	V257 T258 G259 L265 A494	V257-S261 WeakPolarHBondContact O-CB 3.47Å; V257-S261 PolarHBondContact O-N 3.01Å; V257-S261 VanDerWaalsContact O-N 3.08Å; V257-S261 PolarHBondContact O-OG 2.88Å; T258-S261 WeakPolarHBondContact O-CB 3.43Å; T258-S261 PolarHBondContact O-N 2.98Å; T258-S261 VanDerWaalsContact O-N 3.15Å; G259-S261 PolarHBondContact O-N 2.99Å; S261-L265 WeakPolarHBondContact O-CB 3.42Å; S261-L265 PolarHBondContact O-N 2.92Å; S261-A494 VanDerWaalsContact OG-CB 3.26Å; S261-A494 WeakPolarHBondContact OG-CB 3.37Å
262	F	92.3	Very high	90.5	Very high	65 Å²	65	17.5 Å²	17.5	29%	0.285	9%	0.094	S	C	.	.	H	α-helix	trans	-72.6	-36.2	172.3	-75.5	-74.9	0	0	0	113.1	T258 G259 A260 L265 T266 L286 L495 F498 M519 A523	T258-F262 HydrophobicContact CG2-CE2 4.37Å; T258-F262 WeakPolarHBondContact O-CD2 3.44Å; T258-F262 PolarHBondContact O-N 3.27Å; G259-F262 WeakPolarHBondContact O-CB 3.48Å; G259-F262 PolarHBondContact O-N 3.05Å; A260-F262 VanDerWaalsContact C-N 3.34Å; F262-L265 HydrophobicContact CD1-CD2 4.41Å; F262-L265 PolarHBondContact O-N 3.15Å; F262-T266 VanDerWaalsContact O-CB 3.32Å; F262-T266 WeakPolarHBondContact O-CB 3.26Å; F262-T266 PolarHBondContact O-N 3.15Å; F262-T266 PolarHBondContact O-OG1 2.84Å; F262-L286 HydrophobicContact CB-CD1 3.94Å; F262-L495 HydrophobicContact CD1-CD2 4.46Å; F262-L495 HydrophobicContact CD2-CD2 4.38Å; F262-L495 HydrophobicContact CE1-CD2 4.25Å; F262-L495 HydrophobicContact CE2-CD2 4.17Å; F262-L495 HydrophobicContact CZ-CD2 4.1Å; F262-F498 AromaticContact CE2-CE2 3.52Å; F262-F498 HydrophobicContact CE2-CE2 3.52Å; F262-F498 AromaticContact CE2-CZ 3.66Å; F262-F498 HydrophobicContact CE2-CZ 3.66Å; F262-F498 AromaticContact CZ-CE2 3.71Å; F262-F498 HydrophobicContact CZ-CE2 3.71Å; F262-F498 AromaticContact CZ-CZ 3.94Å; F262-F498 HydrophobicContact CZ-CZ 3.94Å; F262-M519 HydrophobicContact CD2-SD 4.39Å; F262-M519 HydrophobicContact CE2-SD 4.15Å; F262-A523 HydrophobicContact CB-CB 4.46Å
263	T	90	Very high	90.5	Very high	11 Å²	11	18.9 Å²	18.9	7%	0.067	10%	0.101	C	C	.	.	H	α-helix	trans	-66.3	-46.3	175.7	60.7	0	0	0	0	110.1	L170 G259 A260 L265 T266 S267 L286 T527	L170-T263 VanDerWaalsContact CD1-OG1 3.3Å; L170-T263 WeakPolarHBondContact CD1-OG1 3.28Å; G259-T263 PolarHBondContact O-N 3.44Å; A260-T263 WeakPolarHBondContact CA-OG1 3.43Å; A260-T263 PolarHBondContact O-N 3.12Å; A260-T263 PolarHBondContact O-OG1 3.01Å; T263-L265 PolarHBondContact O-N 2.88Å; T263-T266 PolarHBondContact O-N 3.34Å; T263-S267 PolarHBondContact O-N 3.29Å; T263-S267 PolarHBondContact O-OG 3.09Å; T263-S267 VanDerWaalsContact O-OG 3.04Å; T263-L286 HydrophobicContact CG2-CD1 4.5Å; T263-T527 HydrophobicContact CG2-CG2 4.37Å
264	I	90.1	Very high	90.6	Very high	3 Å²	3	18.3 Å²	18.3	2%	0.015	10%	0.101	C	C	.	.	H	α-helix	trans	-59.6	-48.1	174	-58.6	164.4	0	0	0	111.1	L132 V167 L170 A260 T266 S267 Q268 T487 L491	L132-I264 HydrophobicContact CD2-CG1 4.24Å; L132-I264 HydrophobicContact CD2-CG2 3.84Å; V167-I264 HydrophobicContact CG2-CD1 4.02Å; L170-I264 HydrophobicContact CD1-CB 4.37Å; L170-I264 HydrophobicContact CD1-CG1 3.47Å; L170-I264 VanDerWaalsContact CD1-CG1 3.47Å; L170-I264 HydrophobicContact CG-CG1 4.12Å; A260-I264 VanDerWaalsContact O-CG1 3.25Å; A260-I264 WeakPolarHBondContact O-CG1 3.38Å; A260-I264 PolarHBondContact O-N 3.49Å; A260-I264 VanDerWaalsContact O-N 3.09Å; I264-T266 VanDerWaalsContact C-N 3.27Å; I264-T266 PolarHBondContact O-N 3.39Å; I264-S267 PolarHBondContact O-N 2.81Å; I264-Q268 HydrophobicContact CG2-CG 4.11Å; I264-Q268 WeakPolarHBondContact O-CB 3.45Å; I264-Q268 VanDerWaalsContact O-CG 3.26Å; I264-Q268 WeakPolarHBondContact O-CG 3.42Å; I264-Q268 PolarHBondContact O-N 3.11Å; I264-T487 HydrophobicContact CG2-CG2 3.75Å; I264-L491 HydrophobicContact CB-CD1 3.85Å; I264-L491 HydrophobicContact CB-CD2 4.42Å; I264-L491 HydrophobicContact CD1-CD2 3.95Å; I264-L491 HydrophobicContact CG2-CD1 3.74Å; I264-L491 HydrophobicContact CG2-CD2 4.43Å
265	L	92.4	Very high	90.7	Very high	42 Å²	42	17.1 Å²	17.1	22%	0.22	9%	0.092	C	C	.	.	H	α-helix	trans	-54.4	-44.3	177	172.1	60.5	0	0	0	111.8	S261 F262 T263 Q268 A269 I488 L491 L495	S261-L265 WeakPolarHBondContact O-CB 3.42Å; S261-L265 PolarHBondContact O-N 2.92Å; F262-L265 HydrophobicContact CD1-CD2 4.41Å; F262-L265 PolarHBondContact O-N 3.15Å; T263-L265 PolarHBondContact O-N 2.88Å; L265-Q268 PolarHBondContact O-N 2.79Å; L265-A269 PolarHBondContact O-N 3.18Å; L265-A269 VanDerWaalsContact O-N 3.08Å; L265-I488 HydrophobicContact CD1-CB 4.41Å; L265-I488 HydrophobicContact CD1-CD1 3.73Å; L265-I488 HydrophobicContact CD1-CG1 3.71Å; L265-I488 HydrophobicContact CD1-CG2 3.88Å; L265-L491 HydrophobicContact CB-CD1 4.32Å; L265-L495 HydrophobicContact CD2-CD1 4.33Å
266	T	90.9	Very high	90.2	Very high	4 Å²	4	24.6 Å²	24.6	3%	0.025	13%	0.132	C	C	.	.	H	α-helix	trans	-66.7	-42.6	178.3	-58.2	0	0	0	0	111.8	F262 T263 I264 Q268 A269 L286 T289 W290	F262-T266 VanDerWaalsContact O-CB 3.32Å; F262-T266 WeakPolarHBondContact O-CB 3.26Å; F262-T266 PolarHBondContact O-N 3.15Å; F262-T266 PolarHBondContact O-OG1 2.84Å; T263-T266 PolarHBondContact O-N 3.34Å; I264-T266 VanDerWaalsContact C-N 3.27Å; I264-T266 PolarHBondContact O-N 3.39Å; T266-Q268 VanDerWaalsContact C-N 3.27Å; T266-Q268 PolarHBondContact O-N 3.15Å; T266-A269 WeakPolarHBondContact O-CB 3.47Å; T266-A269 PolarHBondContact O-N 3.42Å; T266-L286 HydrophobicContact CG2-CG 4.25Å; T266-T289 HydrophobicContact CG2-CG2 3.69Å; T266-W290 VanDerWaalsContact CG2-CD1 3.49Å; T266-W290 HydrophobicContact CG2-CG 4.32Å; T266-W290 VanDerWaalsContact CG2-NE1 3.34Å; T266-W290 PolarHBondContact OG1-NE1 2.88Å
267	S	88.4	Confident	89.8	Confident	27 Å²	27	25.5 Å²	25.5	19%	0.189	14%	0.137	C	C	.	.	H	α-helix	trans	-65.2	-28.4	175.2	-56	0	0	0	0	113.4	T263 I264	T263-S267 PolarHBondContact O-N 3.29Å; T263-S267 PolarHBondContact O-OG 3.09Å; T263-S267 VanDerWaalsContact O-OG 3.04Å; I264-S267 PolarHBondContact O-N 2.81Å
268	Q	92.3	Very high	89.1	Confident	5 Å²	5	27.7 Å²	27.7	2%	0.023	15%	0.152	C	C	.	.	H	α-helix	trans	-83.7	-22.2	177.8	-67	-64.9	-13.9	0	0	113.4	I264 L265 T266 K270 Y271 L272 A484 T487 I488	I264-Q268 HydrophobicContact CG2-CG 4.11Å; I264-Q268 WeakPolarHBondContact O-CB 3.45Å; I264-Q268 VanDerWaalsContact O-CG 3.26Å; I264-Q268 WeakPolarHBondContact O-CG 3.42Å; I264-Q268 PolarHBondContact O-N 3.11Å; L265-Q268 PolarHBondContact O-N 2.79Å; T266-Q268 VanDerWaalsContact C-N 3.27Å; T266-Q268 PolarHBondContact O-N 3.15Å; Q268-K270 PolarHBondContact O-N 2.84Å; Q268-K270 VanDerWaalsContact O-N 3.17Å; Q268-Y271 PolarHBondContact O-N 3.3Å; Q268-L272 PolarHBondContact O-N 3.34Å; Q268-A484 HydrophobicContact CB-CB 4.3Å; Q268-A484 VanDerWaalsContact OE1-CB 3.32Å; Q268-T487 HydrophobicContact CG-CG2 3.87Å; Q268-I488 HydrophobicContact CB-CD1 3.88Å; Q268-I488 HydrophobicContact CB-CG1 4.03Å
269	A	91.7	Very high	88.1	Confident	7 Å²	7	30.8 Å²	30.8	6%	0.058	16%	0.163	C	C	.	.	H	α-helix	trans	-56.2	-34.7	-178.3	0	0	0	0	0	113.6	L265 T266 Y271 L272 L273 W290	L265-A269 PolarHBondContact O-N 3.18Å; L265-A269 VanDerWaalsContact O-N 3.08Å; T266-A269 WeakPolarHBondContact O-CB 3.47Å; T266-A269 PolarHBondContact O-N 3.42Å; A269-Y271 VanDerWaalsContact C-N 3.33Å; A269-Y271 PolarHBondContact O-N 3.21Å; A269-L272 PolarHBondContact O-N 2.98Å; A269-L273 PolarHBondContact O-N 2.84Å; A269-W290 HydrophobicContact CB-CH2 4.18Å; A269-W290 HydrophobicContact CB-CZ2 4.37Å
270	K	89.9	Confident	87.2	Confident	21 Å²	21	31.8 Å²	31.8	9%	0.091	17%	0.17	C	C	.	.	H	α-helix	trans	-65.7	-33.5	176.9	72.9	-179.7	-176.6	178.3	0	113.2	Q268 L273 G274 L275 L277	Q268-K270 PolarHBondContact O-N 2.84Å; Q268-K270 VanDerWaalsContact O-N 3.17Å; K270-L273 PolarHBondContact O-N 2.9Å; K270-G274 PolarHBondContact O-N 2.84Å; K270-L275 HydrophobicContact CB-CB 4.36Å; K270-L275 PolarHBondContact O-N 2.57Å; K270-L277 HydrophobicContact CB-CD1 4.26Å; K270-L277 HydrophobicContact CD-CB 4.1Å; K270-L277 PolarHBondContact NZ-O 2.75Å
271	Y	90.2	Very high	86.4	Confident	41 Å²	41	35.3 Å²	35.3	16%	0.161	19%	0.189	C	C	.	.	H	α-helix	trans	-77.8	-29.9	179.2	-63	-64.2	0	0	0	112.7	Q268 A269 L273 G274 K480 S481	Q268-Y271 PolarHBondContact O-N 3.3Å; A269-Y271 VanDerWaalsContact C-N 3.33Å; A269-Y271 PolarHBondContact O-N 3.21Å; Y271-L273 PolarHBondContact O-N 3.07Å; Y271-G274 PolarHBondContact O-N 3.24Å; Y271-K480 HydrophobicContact CD1-CB 4.2Å; Y271-S481 WeakPolarHBondContact O-CA 3.35Å; Y271-S481 WeakPolarHBondContact O-CB 3.18Å
272	L	92.1	Very high	85.5	Confident	43 Å²	43	36.8 Å²	36.8	23%	0.225	21%	0.205	C	C	.	.	H	α-helix	trans	-58.6	-39.4	169	-65.4	178.8	0	0	0	111.8	Q268 A269 D304 S308 A484 V485 I488	Q268-L272 PolarHBondContact O-N 3.34Å; A269-L272 PolarHBondContact O-N 2.98Å; L272-D304 CarbonylContact O-C 3.56Å; L272-S308 PolarHBondContact O-OG 2.55Å; L272-A484 HydrophobicContact CD2-CB 4.12Å; L272-A484 HydrophobicContact CG-CB 4.41Å; L272-V485 HydrophobicContact CD2-CB 4.44Å; L272-V485 HydrophobicContact CD2-CG2 3.44Å; L272-V485 VanDerWaalsContact CD2-CG2 3.44Å; L272-I488 HydrophobicContact CD1-CD1 3.58Å; L272-I488 HydrophobicContact CD2-CD1 4.19Å; L272-I488 HydrophobicContact CG-CD1 4.01Å
273	L	91.3	Very high	85.1	Confident	29 Å²	29	38.9 Å²	38.9	15%	0.152	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	0.6	-177.4	-60.6	168.5	0	0	0	113.3	A269 K270 Y271 L275 V293 I297 T300 N301 L305	A269-L273 PolarHBondContact O-N 2.84Å; K270-L273 PolarHBondContact O-N 2.9Å; Y271-L273 PolarHBondContact O-N 3.07Å; L273-L275 HydrophobicContact CB-CB 4.41Å; L273-L275 HydrophobicContact CB-CD1 3.73Å; L273-L275 HydrophobicContact CB-CG 3.69Å; L273-L275 HydrophobicContact CD1-CD1 3.74Å; L273-L275 HydrophobicContact CG-CD1 4.39Å; L273-L275 PolarHBondContact O-N 2.89Å; L273-V293 HydrophobicContact CD1-CG1 3.57Å; L273-I297 HydrophobicContact CD1-CD1 3.74Å; L273-I297 HydrophobicContact CD2-CD1 4.02Å; L273-I297 HydrophobicContact CG-CD1 4.5Å; L273-T300 HydrophobicContact CB-CG2 4.12Å; L273-T300 HydrophobicContact CD2-CG2 4.01Å; L273-T300 WeakPolarHBondContact O-CA 3.23Å; L273-T300 WeakPolarHBondContact O-CG2 3.44Å; L273-N301 PolarHBondContact O-N 2.87Å; L273-L305 HydrophobicContact CD2-CD1 4.24Å
274	G	88.5	Confident	84.7	Confident	12 Å²	12	39 Å²	39	12%	0.124	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	58	25.5	-172.7	0	0	0	0	0	114.3	K270 Y271	K270-G274 PolarHBondContact O-N 2.84Å; Y271-G274 PolarHBondContact O-N 3.24Å
275	L	88.8	Confident	84.4	Confident	8 Å²	8	39.5 Å²	39.5	4%	0.042	23%	0.23	C	C	.	.			trans	-88.2	117.2	-174.5	-71	175.5	0	0	0	112.1	K270 L273 L277 V293 N296 K299	K270-L275 HydrophobicContact CB-CB 4.36Å; K270-L275 PolarHBondContact O-N 2.57Å; L273-L275 HydrophobicContact CB-CB 4.41Å; L273-L275 HydrophobicContact CB-CD1 3.73Å; L273-L275 HydrophobicContact CB-CG 3.69Å; L273-L275 HydrophobicContact CD1-CD1 3.74Å; L273-L275 HydrophobicContact CG-CD1 4.39Å; L273-L275 PolarHBondContact O-N 2.89Å; L275-L277 VanDerWaalsContact C-N 3.33Å; L275-L277 HydrophobicContact CB-CD1 4.18Å; L275-L277 HydrophobicContact CB-CG 4.09Å; L275-L277 HydrophobicContact CD1-CD1 4.27Å; L275-L277 PolarHBondContact O-N 3.48Å; L275-V293 HydrophobicContact CD1-CG1 4.48Å; L275-N296 WeakPolarHBondContact CD2-O 3.38Å; L275-K299 VanDerWaalsContact CD2-C 3.46Å; L275-K299 HydrophobicContact CD2-CB 3.97Å; L275-K299 WeakPolarHBondContact CD2-O 3.23Å
276	N	81.9	Confident	84.3	Confident	158 Å²	158	38.8 Å²	38.8	85%	0.845	23%	0.227	S	C	*	.			trans	-75.8	81.1	171.1	-71.5	-37.7	0	0	0	111
277	L	82.3	Confident	84.2	Confident	19 Å²	19	42.8 Å²	42.8	10%	0.099	25%	0.247	C	C	.	.			trans	-106.1	140.4	176.3	-64.1	172.8	0	0	0	112.1	K270 L275 V293 N296	K270-L277 HydrophobicContact CB-CD1 4.26Å; K270-L277 HydrophobicContact CD-CB 4.1Å; K270-L277 PolarHBondContact NZ-O 2.75Å; L275-L277 VanDerWaalsContact C-N 3.33Å; L275-L277 HydrophobicContact CB-CD1 4.18Å; L275-L277 HydrophobicContact CB-CG 4.09Å; L275-L277 HydrophobicContact CD1-CD1 4.27Å; L275-L277 PolarHBondContact O-N 3.48Å; L277-V293 HydrophobicContact CD1-CB 4.43Å; L277-V293 HydrophobicContact CD1-CG2 3.7Å; L277-N296 HydrophobicContact CD2-CB 3.95Å
278	P	73.1	Confident	84.3	Confident	81 Å²	81	44.2 Å²	44.2	53%	0.526	26%	0.255	S	S	.	.			trans	-61.2	157.7	166.7	29.6	-35.3	0	0	0	110.2
279	R	71.8	Confident	84.1	Confident	66 Å²	66	44.9 Å²	44.9	25%	0.249	26%	0.259	C	S	.	.			trans	-77.5	139.3	169.8	-78.6	169.2	176.3	150.7	7.5	109.7	L131 L132 D177 N281	L131-R279 PolarHBondContact O-NH2 2.89Å; L132-R279 PolarHBondContact O-NH2 3.49Å; D177-R279 IonicContact OD1-NH1 2.69Å; D177-R279 WeakPolarHBondContact OD2-CD 3.44Å; D177-R279 IonicContact OD2-CZ 3.85Å; D177-R279 IonicContact OD2-NE 2.63Å; D177-R279 IonicContact OD2-NH1 2.75Å; D177-R279 PolarHBondContact OD2-NH1 3.13Å; R279-N281 WeakPolarHBondContact CB-OD1 3.42Å
280	S	73.6	Confident	84.1	Confident	21 Å²	21	48.7 Å²	48.7	15%	0.147	27%	0.272	C	S	.	.			trans	-93.2	115.3	167.5	-54.1	0	0	0	0	107.9	S285 T288	S280-S285 WeakPolarHBondContact O-CB 3.33Å; S280-T288 WeakPolarHBondContact CB-OG1 3.49Å
281	N	71.4	Confident	84.2	Confident	74 Å²	74	52.4 Å²	52.4	40%	0.396	29%	0.292	S	S	.	.			trans	-103.2	155.4	-177.4	-65.4	3.7	0	0	0	110.9	R279	R279-N281 WeakPolarHBondContact CB-OD1 3.42Å
282	G	73.1	Confident	84.2	Confident	36 Å²	36	53 Å²	53	37%	0.371	30%	0.296	S	S	.	.	S	Bend	trans	88.5	-169.2	177.5	0	0	0	0	0	115.3	G284 S285	G282-G284 PolarHBondContact O-N 3.12Å; G282-S285 WeakPolarHBondContact O-CB 3.4Å; G282-S285 PolarHBondContact O-N 3.37Å; G282-S285 PolarHBondContact O-OG 3.16Å
283	V	83.7	Confident	84.2	Confident	108 Å²	108	51.1 Å²	51.1	66%	0.655	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	127.2	-173.5	177.1	0	0	0	0	111.1	L525	V283-L525 WeakPolarHBondContact CA-O 3.36Å; V283-L525 HydrophobicContact CG1-CD2 3.88Å
284	G	82.6	Confident	84.3	Confident	14 Å²	14	56 Å²	56	14%	0.144	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	13.9	-174.5	0	0	0	0	0	114.6	G282 L286 I287 T288 L524	G282-G284 PolarHBondContact O-N 3.12Å; G284-L286 PolarHBondContact O-N 3.14Å; G284-I287 PolarHBondContact O-N 3.02Å; G284-I287 VanDerWaalsContact O-N 3.09Å; G284-T288 PolarHBondContact O-N 3.26Å; G284-T288 PolarHBondContact O-OG1 2.96Å; G284-L524 WeakPolarHBondContact CA-O 3.34Å; G284-L524 PolarHBondContact N-O 2.82Å
285	S	83.8	Confident	84.4	Confident	14 Å²	14	63.2 Å²	63.2	10%	0.098	33%	0.33	C	S	.	.	H	α-helix	trans	-46.5	-42.4	172.8	51.6	0	0	0	0	113.4	S280 G282 T288 T289	S280-S285 WeakPolarHBondContact O-CB 3.33Å; G282-S285 WeakPolarHBondContact O-CB 3.4Å; G282-S285 PolarHBondContact O-N 3.37Å; G282-S285 PolarHBondContact O-OG 3.16Å; S285-T288 WeakPolarHBondContact CA-OG1 3.28Å; S285-T288 PolarHBondContact O-OG1 2.91Å; S285-T288 VanDerWaalsContact O-OG1 3.09Å; S285-T289 WeakPolarHBondContact O-CB 3.22Å; S285-T289 PolarHBondContact O-N 3.41Å; S285-T289 PolarHBondContact O-OG1 3.45Å
286	L	88.4	Confident	84.6	Confident	27 Å²	27	64.2 Å²	64.2	14%	0.141	34%	0.335	C	S	.	.	H	α-helix	trans	-60.2	-52.4	176.9	-176.8	150.2	0	0	0	111.7	F262 T263 T266 G284 T289 W290 A523	F262-L286 HydrophobicContact CB-CD1 3.94Å; T263-L286 HydrophobicContact CG2-CD1 4.5Å; T266-L286 HydrophobicContact CG2-CG 4.25Å; G284-L286 PolarHBondContact O-N 3.14Å; L286-T289 PolarHBondContact O-N 2.81Å; L286-W290 VanDerWaalsContact O-CD1 3.27Å; L286-W290 PolarHBondContact O-N 3.2Å; L286-W290 VanDerWaalsContact O-N 3.09Å; L286-A523 WeakPolarHBondContact CB-O 3.41Å; L286-A523 HydrophobicContact CD1-CB 4.44Å; L286-A523 WeakPolarHBondContact CD1-O 3.2Å
287	I	90.8	Very high	85.1	Confident	88 Å²	88	60.5 Å²	60.5	45%	0.451	31%	0.314	S	S	.	.	H	α-helix	trans	-66.3	-46.7	-176.2	-59.5	176.4	0	0	0	110.3	G284 T289 W290 I291 L524	G284-I287 PolarHBondContact O-N 3.02Å; G284-I287 VanDerWaalsContact O-N 3.09Å; I287-T289 VanDerWaalsContact C-N 3.33Å; I287-T289 PolarHBondContact O-N 3.46Å; I287-W290 PolarHBondContact O-N 3.16Å; I287-I291 HydrophobicContact CG2-CD1 3.96Å; I287-I291 WeakPolarHBondContact O-CG1 3.25Å; I287-I291 PolarHBondContact O-N 2.84Å; I287-L524 HydrophobicContact CD1-CD2 4.22Å; I287-L524 HydrophobicContact CG1-CD2 4.37Å
288	T	88.7	Confident	85.5	Confident	57 Å²	57	66.2 Å²	66.2	35%	0.35	34%	0.341	S	S	.	.	H	α-helix	trans	-64.2	-36.3	178.9	53.2	0	0	0	0	112.3	S280 G284 S285 I291 H292	S280-T288 WeakPolarHBondContact CB-OG1 3.49Å; G284-T288 PolarHBondContact O-N 3.26Å; G284-T288 PolarHBondContact O-OG1 2.96Å; S285-T288 WeakPolarHBondContact CA-OG1 3.28Å; S285-T288 PolarHBondContact O-OG1 2.91Å; S285-T288 VanDerWaalsContact O-OG1 3.09Å; T288-I291 PolarHBondContact O-N 3.08Å; T288-H292 WeakPolarHBondContact O-CB 3.48Å; T288-H292 PolarHBondContact O-N 2.89Å
289	T	89.3	Confident	86.4	Confident	19 Å²	19	68.8 Å²	68.8	12%	0.117	34%	0.343	C	S	.	.	H	α-helix	trans	-63.7	-45	173.1	-60.1	0	0	0	0	111.6	T266 S285 L286 I287 I291 H292 V293	T266-T289 HydrophobicContact CG2-CG2 3.69Å; S285-T289 WeakPolarHBondContact O-CB 3.22Å; S285-T289 PolarHBondContact O-N 3.41Å; S285-T289 PolarHBondContact O-OG1 3.45Å; L286-T289 PolarHBondContact O-N 2.81Å; I287-T289 VanDerWaalsContact C-N 3.33Å; I287-T289 PolarHBondContact O-N 3.46Å; T289-I291 PolarHBondContact O-N 3.47Å; T289-H292 PolarHBondContact O-N 2.93Å; T289-V293 HydrophobicContact CG2-CG2 4.5Å; T289-V293 WeakPolarHBondContact O-CG2 3.45Å; T289-V293 PolarHBondContact O-N 3.4Å
290	W	92.3	Very high	87.3	Confident	86 Å²	86	67.3 Å²	67.3	33%	0.326	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-41.5	175.7	-82.7	105.1	0	0	0	112.6	T266 A269 L286 I287 H292 V293 F294	T266-W290 VanDerWaalsContact CG2-CD1 3.49Å; T266-W290 HydrophobicContact CG2-CG 4.32Å; T266-W290 VanDerWaalsContact CG2-NE1 3.34Å; T266-W290 PolarHBondContact OG1-NE1 2.88Å; A269-W290 HydrophobicContact CB-CH2 4.18Å; A269-W290 HydrophobicContact CB-CZ2 4.37Å; L286-W290 VanDerWaalsContact O-CD1 3.27Å; L286-W290 PolarHBondContact O-N 3.2Å; L286-W290 VanDerWaalsContact O-N 3.09Å; I287-W290 PolarHBondContact O-N 3.16Å; W290-H292 VanDerWaalsContact C-N 3.3Å; W290-H292 PolarHBondContact O-N 3.49Å; W290-V293 PolarHBondContact O-N 3.27Å; W290-F294 HydrophobicContact CB-CD2 4.46Å; W290-F294 HydrophobicContact CB-CE2 4.24Å; W290-F294 HydrophobicContact CD2-CE2 4.39Å; W290-F294 HydrophobicContact CE3-CD2 4.39Å; W290-F294 HydrophobicContact CE3-CE1 4.49Å; W290-F294 AromaticContact CE3-CE2 3.63Å; W290-F294 HydrophobicContact CE3-CE2 3.63Å; W290-F294 AromaticContact CE3-CZ 3.69Å; W290-F294 HydrophobicContact CE3-CZ 3.69Å; W290-F294 HydrophobicContact CZ3-CE2 4.41Å; W290-F294 HydrophobicContact CZ3-CZ 4.01Å; W290-F294 WeakPolarHBondContact O-CD2 3.29Å; W290-F294 PolarHBondContact O-N 3Å
291	I	91.7	Very high	88.3	Confident	99 Å²	99	67.8 Å²	67.8	51%	0.508	34%	0.343	S	S	.	.	H	α-helix	trans	-59.2	-42	173	-67.2	166.5	0	0	0	110.9	I287 T288 T289 R295	I287-I291 HydrophobicContact CG2-CD1 3.96Å; I287-I291 WeakPolarHBondContact O-CG1 3.25Å; I287-I291 PolarHBondContact O-N 2.84Å; T288-I291 PolarHBondContact O-N 3.08Å; T289-I291 PolarHBondContact O-N 3.47Å; I291-R295 VanDerWaalsContact O-CB 3.27Å; I291-R295 WeakPolarHBondContact O-CB 3.19Å; I291-R295 PolarHBondContact O-N 2.95Å
292	H	89.3	Confident	89.3	Confident	55 Å²	55	69.7 Å²	69.7	26%	0.255	35%	0.352	S	S	.	.	H	α-helix	trans	-66.8	-36.7	175.9	-77.5	179.6	0	0	0	113.8	T288 T289 W290 R295 N296	T288-H292 WeakPolarHBondContact O-CB 3.48Å; T288-H292 PolarHBondContact O-N 2.89Å; T289-H292 PolarHBondContact O-N 2.93Å; W290-H292 VanDerWaalsContact C-N 3.3Å; W290-H292 PolarHBondContact O-N 3.49Å; H292-R295 PolarHBondContact NE2-NH2 3.46Å; H292-N296 PolarHBondContact O-N 3.05Å; H292-N296 PolarHBondContact O-ND2 2.85Å
293	V	91.8	Very high	90.2	Very high	2 Å²	2	68.7 Å²	68.7	1%	0.012	34%	0.34	C	S	.	.	H	α-helix	trans	-64.3	-54.3	173.1	168.5	0	0	0	0	110.6	L273 L275 L277 T289 W290 R295 N296 I297	L273-V293 HydrophobicContact CD1-CG1 3.57Å; L275-V293 HydrophobicContact CD1-CG1 4.48Å; L277-V293 HydrophobicContact CD1-CB 4.43Å; L277-V293 HydrophobicContact CD1-CG2 3.7Å; T289-V293 HydrophobicContact CG2-CG2 4.5Å; T289-V293 WeakPolarHBondContact O-CG2 3.45Å; T289-V293 PolarHBondContact O-N 3.4Å; W290-V293 PolarHBondContact O-N 3.27Å; V293-R295 VanDerWaalsContact C-N 3.34Å; V293-R295 PolarHBondContact O-N 3Å; V293-N296 CarbonylContact O-C 3.5Å; V293-N296 PolarHBondContact O-N 3.19Å; V293-N296 VanDerWaalsContact O-N 3.12Å; V293-I297 PolarHBondContact O-N 3.18Å
294	F	93	Very high	90.6	Very high	132 Å²	132	63.6 Å²	63.6	58%	0.579	31%	0.309	S	S	*	.	H	α-helix	trans	-61.5	-39.7	-179.5	-69	-57.6	0	0	0	112.4	W290 N296 I297	W290-F294 HydrophobicContact CB-CD2 4.46Å; W290-F294 HydrophobicContact CB-CE2 4.24Å; W290-F294 HydrophobicContact CD2-CE2 4.39Å; W290-F294 HydrophobicContact CE3-CD2 4.39Å; W290-F294 HydrophobicContact CE3-CE1 4.49Å; W290-F294 AromaticContact CE3-CE2 3.63Å; W290-F294 HydrophobicContact CE3-CE2 3.63Å; W290-F294 AromaticContact CE3-CZ 3.69Å; W290-F294 HydrophobicContact CE3-CZ 3.69Å; W290-F294 HydrophobicContact CZ3-CE2 4.41Å; W290-F294 HydrophobicContact CZ3-CZ 4.01Å; W290-F294 WeakPolarHBondContact O-CD2 3.29Å; W290-F294 PolarHBondContact O-N 3Å; F294-N296 VanDerWaalsContact C-N 3.28Å; F294-N296 PolarHBondContact O-N 2.96Å; F294-I297 VanDerWaalsContact O-CG2 3.28Å; F294-I297 WeakPolarHBondContact O-CG2 3.38Å; F294-I297 PolarHBondContact O-N 2.85Å
295	R	92	Very high	91.2	Very high	163 Å²	163	66 Å²	66	62%	0.615	32%	0.317	S	S	*	.	H	α-helix	trans	-63.2	-30.7	176.3	-175.8	167.3	65.8	140.3	-6.4	113.4	I291 H292 V293 H298	I291-R295 VanDerWaalsContact O-CB 3.27Å; I291-R295 WeakPolarHBondContact O-CB 3.19Å; I291-R295 PolarHBondContact O-N 2.95Å; H292-R295 PolarHBondContact NE2-NH2 3.46Å; V293-R295 VanDerWaalsContact C-N 3.34Å; V293-R295 PolarHBondContact O-N 3Å; R295-H298 PolarHBondContact O-CE1 3.1Å; R295-H298 PolarHBondContact O-ND1 2.75Å
296	N	92.1	Very high	91.7	Very high	30 Å²	30	69.9 Å²	69.9	16%	0.16	34%	0.337	C	S	.	.	H	α-helix	trans	-105.3	9.9	-178	-68.6	-84.1	0	0	0	113.8	L275 L277 H292 V293 F294 H298 K299	L275-N296 WeakPolarHBondContact CD2-O 3.38Å; L277-N296 HydrophobicContact CD2-CB 3.95Å; H292-N296 PolarHBondContact O-N 3.05Å; H292-N296 PolarHBondContact O-ND2 2.85Å; V293-N296 CarbonylContact O-C 3.5Å; V293-N296 PolarHBondContact O-N 3.19Å; V293-N296 VanDerWaalsContact O-N 3.12Å; F294-N296 VanDerWaalsContact C-N 3.28Å; F294-N296 PolarHBondContact O-N 2.96Å; N296-H298 PolarHBondContact O-N 3.4Å; N296-K299 WeakPolarHBondContact O-CB 3.38Å; N296-K299 PolarHBondContact O-N 2.87Å
297	I	92.3	Very high	91.9	Very high	79 Å²	79	69.7 Å²	69.7	41%	0.405	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-57.8	-25.9	-175.4	-161.6	63.1	0	0	0	113.2	L273 V293 F294 K299 T300	L273-I297 HydrophobicContact CD1-CD1 3.74Å; L273-I297 HydrophobicContact CD2-CD1 4.02Å; L273-I297 HydrophobicContact CG-CD1 4.5Å; V293-I297 PolarHBondContact O-N 3.18Å; F294-I297 VanDerWaalsContact O-CG2 3.28Å; F294-I297 WeakPolarHBondContact O-CG2 3.38Å; F294-I297 PolarHBondContact O-N 2.85Å; I297-K299 PolarHBondContact O-N 2.69Å; I297-T300 WeakPolarHBondContact O-CB 3.37Å; I297-T300 PolarHBondContact O-N 3.16Å; I297-T300 PolarHBondContact O-OG1 3.1Å
298	H	91.6	Very high	92.1	Very high	140 Å²	140	65.8 Å²	65.8	65%	0.648	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-70.2	-9.7	174.7	64.7	-91.3	0	0	0	114.6	R295 N296	R295-H298 PolarHBondContact O-CE1 3.1Å; R295-H298 PolarHBondContact O-ND1 2.75Å; N296-H298 PolarHBondContact O-N 3.4Å
299	K	90.6	Very high	92.4	Very high	135 Å²	135	68.3 Å²	68.3	59%	0.587	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-102.8	11.7	176.7	-54.7	-173.6	179.9	173.9	0	113.1	L275 N296 I297 N301	L275-K299 VanDerWaalsContact CD2-C 3.46Å; L275-K299 HydrophobicContact CD2-CB 3.97Å; L275-K299 WeakPolarHBondContact CD2-O 3.23Å; N296-K299 WeakPolarHBondContact O-CB 3.38Å; N296-K299 PolarHBondContact O-N 2.87Å; I297-K299 PolarHBondContact O-N 2.69Å; K299-N301 PolarHBondContact O-N 3.01Å
300	T	92.1	Very high	92.7	Very high	35 Å²	35	72.4 Å²	72.4	22%	0.215	35%	0.348	C	S	.	.			trans	-60.1	131.6	-178.3	-66.3	0	0	0	0	110.9	L273 I297 L302 L305	L273-T300 HydrophobicContact CB-CG2 4.12Å; L273-T300 HydrophobicContact CD2-CG2 4.01Å; L273-T300 WeakPolarHBondContact O-CA 3.23Å; L273-T300 WeakPolarHBondContact O-CG2 3.44Å; I297-T300 WeakPolarHBondContact O-CB 3.37Å; I297-T300 PolarHBondContact O-N 3.16Å; I297-T300 PolarHBondContact O-OG1 3.1Å; T300-L302 PolarHBondContact O-N 3.02Å; T300-L305 HydrophobicContact CG2-CB 4.05Å; T300-L305 HydrophobicContact CG2-CD2 3.98Å
301	N	93.6	Very high	92.8	Very high	30 Å²	30	68.7 Å²	68.7	16%	0.16	34%	0.336	C	S	.	.			trans	-77.4	114.3	173.6	-172.3	-45.2	0	0	0	109.3	L273 K299 C303 D304 L305 Y356 N357	L273-N301 PolarHBondContact O-N 2.87Å; K299-N301 PolarHBondContact O-N 3.01Å; N301-C303 VanDerWaalsContact C-N 3.26Å; N301-C303 PolarHBondContact O-N 2.95Å; N301-C303 VanDerWaalsContact OD1-CB 3.31Å; N301-C303 WeakPolarHBondContact OD1-CB 3.21Å; N301-C303 PolarHBondContact OD1-N 3.05Å; N301-D304 HydrophobicContact CB-CB 4.31Å; N301-D304 PolarHBondContact O-N 3.22Å; N301-D304 PolarHBondContact OD1-N 2.75Å; N301-L305 WeakPolarHBondContact O-CB 3.21Å; N301-L305 PolarHBondContact O-N 2.74Å; N301-Y356 PolarHBondContact ND2-O 3.34Å; N301-N357 PolarHBondContact ND2-O 3.29Å; N301-N357 VanDerWaalsContact ND2-O 3.09Å
302	L	92.3	Very high	92.9	Very high	114 Å²	114	66.8 Å²	66.8	60%	0.597	33%	0.326	S	S	*	.	H	α-helix	trans	-62.3	-32	-176.5	-175.1	60.8	0	0	0	112.9	T300 L305 I306	T300-L302 PolarHBondContact O-N 3.02Å; L302-L305 HydrophobicContact CD1-CD2 4.46Å; L302-I306 HydrophobicContact CD1-CD1 3.93Å; L302-I306 HydrophobicContact CD1-CG1 4.13Å; L302-I306 HydrophobicContact CD2-CD1 4.48Å; L302-I306 HydrophobicContact CG-CD1 3.82Å; L302-I306 HydrophobicContact CG-CG1 4.41Å; L302-I306 WeakPolarHBondContact O-CB 3.04Å; L302-I306 VanDerWaalsContact O-CG1 3.27Å; L302-I306 WeakPolarHBondContact O-CG1 3.43Å; L302-I306 PolarHBondContact O-N 3.33Å
303	C	92.8	Very high	93.1	Very high	16 Å²	16	69.7 Å²	69.7	11%	0.108	34%	0.343	C	S	.	.	H	α-helix	trans	-68	-48.6	177.5	-179.8	0	0	0	0	111.2	N301 L305 I306 T307 Y356	N301-C303 VanDerWaalsContact C-N 3.26Å; N301-C303 PolarHBondContact O-N 2.95Å; N301-C303 VanDerWaalsContact OD1-CB 3.31Å; N301-C303 WeakPolarHBondContact OD1-CB 3.21Å; N301-C303 PolarHBondContact OD1-N 3.05Å; C303-L305 VanDerWaalsContact C-N 3.32Å; C303-L305 PolarHBondContact O-N 3.3Å; C303-I306 PolarHBondContact O-N 3.05Å; C303-T307 WeakPolarHBondContact O-CB 3.25Å; C303-T307 PolarHBondContact O-N 3.16Å; C303-T307 PolarHBondContact O-OG1 2.96Å; C303-T307 VanDerWaalsContact O-OG1 3.09Å; C303-Y356 HydrophobicContact CB-CD2 4.42Å; C303-Y356 HydrophobicContact CB-CG 4.1Å
304	D	92.6	Very high	93.2	Very high	1 Å²	1	72.1 Å²	72.1	1%	0.005	36%	0.357	C	S	.	.	H	α-helix	trans	-65.8	-33.1	176.1	-85.8	-33.5	0	0	0	112.5	L272 N301 S308 S359 Q479 S481	L272-D304 CarbonylContact O-C 3.56Å; N301-D304 HydrophobicContact CB-CB 4.31Å; N301-D304 PolarHBondContact O-N 3.22Å; N301-D304 PolarHBondContact OD1-N 2.75Å; D304-S308 VanDerWaalsContact O-CB 3.27Å; D304-S308 WeakPolarHBondContact O-CB 3.09Å; D304-S308 PolarHBondContact O-N 3.31Å; D304-S308 PolarHBondContact O-OG 3.33Å; D304-S359 WeakPolarHBondContact OD2-CB 3.2Å; D304-S359 PolarHBondContact OD2-N 3.08Å; D304-S359 PolarHBondContact OD2-OG 3.23Å; D304-Q479 PolarHBondContact OD1-NE2 3.1Å; D304-S481 WeakPolarHBondContact OD1-CB 3.44Å; D304-S481 PolarHBondContact OD1-OG 3.08Å
305	L	93.9	Very high	93.1	Very high	63 Å²	63	65.8 Å²	65.8	33%	0.33	33%	0.33	S	S	.	.	H	α-helix	trans	-65.8	-48.3	173.2	175.5	60.7	0	0	0	112.3	L273 T300 N301 L302 C303 S308 L309	L273-L305 HydrophobicContact CD2-CD1 4.24Å; T300-L305 HydrophobicContact CG2-CB 4.05Å; T300-L305 HydrophobicContact CG2-CD2 3.98Å; N301-L305 WeakPolarHBondContact O-CB 3.21Å; N301-L305 PolarHBondContact O-N 2.74Å; L302-L305 HydrophobicContact CD1-CD2 4.46Å; C303-L305 VanDerWaalsContact C-N 3.32Å; C303-L305 PolarHBondContact O-N 3.3Å; L305-S308 PolarHBondContact O-N 3.43Å; L305-S308 PolarHBondContact O-OG 3.05Å; L305-S308 VanDerWaalsContact O-OG 3.09Å; L305-L309 VanDerWaalsContact O-CB 3.32Å; L305-L309 WeakPolarHBondContact O-CB 3.03Å; L305-L309 PolarHBondContact O-N 3.45Å
306	I	94.5	Very high	93	Very high	97 Å²	97	61 Å²	61	50%	0.497	32%	0.316	S	S	.	.	H	α-helix	trans	-65	-45.1	179	-70.1	169.6	0	0	0	110.2	L302 C303 S308 L309 L310	L302-I306 HydrophobicContact CD1-CD1 3.93Å; L302-I306 HydrophobicContact CD1-CG1 4.13Å; L302-I306 HydrophobicContact CD2-CD1 4.48Å; L302-I306 HydrophobicContact CG-CD1 3.82Å; L302-I306 HydrophobicContact CG-CG1 4.41Å; L302-I306 WeakPolarHBondContact O-CB 3.04Å; L302-I306 VanDerWaalsContact O-CG1 3.27Å; L302-I306 WeakPolarHBondContact O-CG1 3.43Å; L302-I306 PolarHBondContact O-N 3.33Å; C303-I306 PolarHBondContact O-N 3.05Å; I306-S308 PolarHBondContact O-N 3.5Å; I306-L309 PolarHBondContact O-N 3.29Å; I306-L310 WeakPolarHBondContact O-CB 3.33Å; I306-L310 PolarHBondContact O-N 3.39Å
307	T	93.4	Very high	92.9	Very high	23 Å²	23	63.1 Å²	63.1	14%	0.141	33%	0.331	C	S	.	.	H	α-helix	trans	-59.7	-46.2	176.7	-63.7	0	0	0	0	111.3	C303 L310 C311 Q479 V482	C303-T307 WeakPolarHBondContact O-CB 3.25Å; C303-T307 PolarHBondContact O-N 3.16Å; C303-T307 PolarHBondContact O-OG1 2.96Å; C303-T307 VanDerWaalsContact O-OG1 3.09Å; T307-L310 PolarHBondContact O-N 3.49Å; T307-C311 WeakPolarHBondContact O-CB 3.46Å; T307-C311 PolarHBondContact O-N 2.89Å; T307-C311 PolarHBondContact O-SG 3.29Å; T307-Q479 PolarHBondContact OG1-NE2 3.11Å; T307-Q479 PolarHBondContact OG1-OE1 3.09Å; T307-V482 HydrophobicContact CG2-CG2 3.57Å
308	S	94.7	Very high	92.6	Very high	6 Å²	6	61.7 Å²	61.7	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-68.7	-39.6	-179.3	60.7	0	0	0	0	113	L272 D304 L305 I306 C311 L312 V485	L272-S308 PolarHBondContact O-OG 2.55Å; D304-S308 VanDerWaalsContact O-CB 3.27Å; D304-S308 WeakPolarHBondContact O-CB 3.09Å; D304-S308 PolarHBondContact O-N 3.31Å; D304-S308 PolarHBondContact O-OG 3.33Å; L305-S308 PolarHBondContact O-N 3.43Å; L305-S308 PolarHBondContact O-OG 3.05Å; L305-S308 VanDerWaalsContact O-OG 3.09Å; I306-S308 PolarHBondContact O-N 3.5Å; S308-C311 PolarHBondContact O-N 2.89Å; S308-L312 VanDerWaalsContact O-CB 3.31Å; S308-L312 WeakPolarHBondContact O-CB 3.24Å; S308-L312 PolarHBondContact O-N 2.98Å; S308-V485 WeakPolarHBondContact O-CG2 3.28Å
309	L	95.3	Very high	92.2	Very high	109 Å²	109	56.9 Å²	56.9	57%	0.571	30%	0.303	S	S	*	.	H	α-helix	trans	-61.8	-45.2	174.7	-179.5	60.7	0	0	0	111.7	L305 I306 L312 L313	L305-L309 VanDerWaalsContact O-CB 3.32Å; L305-L309 WeakPolarHBondContact O-CB 3.03Å; L305-L309 PolarHBondContact O-N 3.45Å; I306-L309 PolarHBondContact O-N 3.29Å; L309-L312 PolarHBondContact O-N 3.18Å; L309-L313 WeakPolarHBondContact O-CB 3.39Å; L309-L313 PolarHBondContact O-N 3.38Å
310	L	95.3	Very high	91.8	Very high	105 Å²	105	54.3 Å²	54.3	55%	0.55	29%	0.294	S	S	.	.	H	α-helix	trans	-63.5	-45.3	176.5	-178.6	61.5	0	0	0	111.6	I306 T307 L312 L313 V314	I306-L310 WeakPolarHBondContact O-CB 3.33Å; I306-L310 PolarHBondContact O-N 3.39Å; T307-L310 PolarHBondContact O-N 3.49Å; L310-L312 VanDerWaalsContact C-N 3.3Å; L310-L312 PolarHBondContact O-N 3.24Å; L310-L313 PolarHBondContact O-N 3.23Å; L310-V314 WeakPolarHBondContact O-CG2 3.39Å; L310-V314 PolarHBondContact O-N 2.8Å
311	C	94.7	Very high	91.5	Very high	9 Å²	9	57.7 Å²	57.7	6%	0.061	31%	0.31	C	S	.	.	H	α-helix	trans	-61.7	-37.9	176.4	-69.5	0	0	0	0	112.1	T307 S308 V314 L315 V339 V485	T307-C311 WeakPolarHBondContact O-CB 3.46Å; T307-C311 PolarHBondContact O-N 2.89Å; T307-C311 PolarHBondContact O-SG 3.29Å; S308-C311 PolarHBondContact O-N 2.89Å; C311-V314 PolarHBondContact O-N 3.11Å; C311-L315 VanDerWaalsContact O-CB 3.25Å; C311-L315 WeakPolarHBondContact O-CB 3.36Å; C311-L315 VanDerWaalsContact O-CG 3.29Å; C311-L315 WeakPolarHBondContact O-CG 3.36Å; C311-L315 PolarHBondContact O-N 3.32Å; C311-V339 HydrophobicContact CB-CG1 4.15Å; C311-V485 HydrophobicContact CB-CB 4.32Å; C311-V485 HydrophobicContact CB-CG1 4.06Å; C311-V485 HydrophobicContact CB-CG2 4.23Å
312	L	93.6	Very high	90.9	Very high	58 Å²	58	58.1 Å²	58.1	30%	0.304	31%	0.312	S	S	.	.	H	α-helix	trans	-68.1	-42.1	177.3	-169.2	72.9	0	0	0	111.5	S308 L309 L310 V314 L315 L316 V485 V489	S308-L312 VanDerWaalsContact O-CB 3.31Å; S308-L312 WeakPolarHBondContact O-CB 3.24Å; S308-L312 PolarHBondContact O-N 2.98Å; L309-L312 PolarHBondContact O-N 3.18Å; L310-L312 VanDerWaalsContact C-N 3.3Å; L310-L312 PolarHBondContact O-N 3.24Å; L312-V314 VanDerWaalsContact C-N 3.29Å; L312-V314 PolarHBondContact O-N 3.36Å; L312-L315 PolarHBondContact O-N 3.1Å; L312-L316 HydrophobicContact CD1-CD1 3.7Å; L312-L316 HydrophobicContact CD1-CG 3.9Å; L312-L316 HydrophobicContact CD2-CD1 4.41Å; L312-L316 HydrophobicContact CG-CD1 3.79Å; L312-L316 HydrophobicContact CG-CG 4.23Å; L312-L316 WeakPolarHBondContact O-CB 3.4Å; L312-L316 PolarHBondContact O-N 2.86Å; L312-V485 HydrophobicContact CB-CG1 4.16Å; L312-V485 HydrophobicContact CD1-CG1 4.02Å; L312-V489 HydrophobicContact CD1-CG2 4.08Å
313	L	93.9	Very high	90.2	Very high	116 Å²	116	57.3 Å²	57.3	61%	0.607	31%	0.305	S	S	*	.	H	α-helix	trans	-65	-29.8	177.2	-175.2	148.5	0	0	0	112.7	L309 L310 P317	L309-L313 WeakPolarHBondContact O-CB 3.39Å; L309-L313 PolarHBondContact O-N 3.38Å; L310-L313 PolarHBondContact O-N 3.23Å; L313-P317 WeakPolarHBondContact O-CD 3.44Å; L313-P317 WeakPolarHBondContact O-CG 3.32Å
314	V	93.1	Very high	89.7	Confident	53 Å²	53	63.6 Å²	63.6	32%	0.321	33%	0.333	S	S	.	.	H	α-helix	trans	-80.4	-51.9	171.1	174.4	0	0	0	0	111.4	L310 C311 L312 T318 V339	L310-V314 WeakPolarHBondContact O-CG2 3.39Å; L310-V314 PolarHBondContact O-N 2.8Å; C311-V314 PolarHBondContact O-N 3.11Å; L312-V314 VanDerWaalsContact C-N 3.29Å; L312-V314 PolarHBondContact O-N 3.36Å; V314-T318 WeakPolarHBondContact O-CB 3.42Å; V314-T318 PolarHBondContact O-N 3.27Å; V314-T318 PolarHBondContact O-OG1 3.19Å; V314-V339 HydrophobicContact CG1-CG2 3.9Å
315	L	91	Very high	89.2	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-70.5	-37.2	-169	-73.8	169.1	0	0	0	114	C311 L312 K319 I335 V339 V485 I486 V489	C311-L315 VanDerWaalsContact O-CB 3.25Å; C311-L315 WeakPolarHBondContact O-CB 3.36Å; C311-L315 VanDerWaalsContact O-CG 3.29Å; C311-L315 WeakPolarHBondContact O-CG 3.36Å; C311-L315 PolarHBondContact O-N 3.32Å; L312-L315 PolarHBondContact O-N 3.1Å; L315-K319 WeakPolarHBondContact O-CB 3.39Å; L315-K319 WeakPolarHBondContact O-CG 3.36Å; L315-K319 PolarHBondContact O-N 3.46Å; L315-I335 HydrophobicContact CD2-CB 4.5Å; L315-I335 HydrophobicContact CD2-CG1 4.04Å; L315-I335 HydrophobicContact CD2-CG2 3.96Å; L315-V339 HydrophobicContact CD1-CG1 4.13Å; L315-V339 HydrophobicContact CD2-CB 4.22Å; L315-V339 HydrophobicContact CD2-CG2 3.81Å; L315-V339 HydrophobicContact CG-CB 4.43Å; L315-V339 HydrophobicContact CG-CG1 4.36Å; L315-V339 HydrophobicContact CG-CG2 4.04Å; L315-V485 HydrophobicContact CD1-CG1 3.84Å; L315-I486 HydrophobicContact CD1-CG1 4.09Å; L315-V489 HydrophobicContact CB-CG1 4.31Å; L315-V489 HydrophobicContact CB-CG2 4.02Å
316	L	89.7	Confident	88.2	Confident	62 Å²	62	70.5 Å²	70.5	33%	0.325	36%	0.36	S	S	.	.	H	α-helix	trans	-68.1	-50.9	-178.5	-72.6	-179.9	0	0	0	113	L312 K319 E320 V489	L312-L316 HydrophobicContact CD1-CD1 3.7Å; L312-L316 HydrophobicContact CD1-CG 3.9Å; L312-L316 HydrophobicContact CD2-CD1 4.41Å; L312-L316 HydrophobicContact CG-CD1 3.79Å; L312-L316 HydrophobicContact CG-CG 4.23Å; L312-L316 WeakPolarHBondContact O-CB 3.4Å; L312-L316 PolarHBondContact O-N 2.86Å; L316-K319 PolarHBondContact O-N 3.16Å; L316-E320 PolarHBondContact O-N 3.44Å; L316-E320 VanDerWaalsContact O-N 3.16Å; L316-V489 HydrophobicContact CD2-CG2 3.95Å; L316-V489 HydrophobicContact CG-CG2 4.3Å
317	P	90.2	Very high	87.2	Confident	74 Å²	74	71.3 Å²	71.3	48%	0.481	37%	0.374	S	S	.	.	H	α-helix	trans	-64.9	-42.4	177	-22.8	36.6	0	0	0	112.3	L313 K319 E320 L321	L313-P317 WeakPolarHBondContact O-CD 3.44Å; L313-P317 WeakPolarHBondContact O-CG 3.32Å; P317-K319 VanDerWaalsContact C-N 3.3Å; P317-K319 PolarHBondContact O-N 3.33Å; P317-E320 PolarHBondContact O-N 3.45Å; P317-L321 VanDerWaalsContact O-CB 3.29Å; P317-L321 WeakPolarHBondContact O-CB 3.45Å; P317-L321 PolarHBondContact O-N 3.28Å
318	T	86.3	Confident	86.5	Confident	49 Å²	49	78.2 Å²	78.2	30%	0.301	40%	0.402	S	S	.	.	H	α-helix	trans	-64.3	-34	179.3	-55.5	0	0	0	0	112.2	V314 N322 I335	V314-T318 WeakPolarHBondContact O-CB 3.42Å; V314-T318 PolarHBondContact O-N 3.27Å; V314-T318 PolarHBondContact O-OG1 3.19Å; T318-N322 WeakPolarHBondContact O-CB 3.08Å; T318-N322 PolarHBondContact O-N 3.04Å; T318-I335 HydrophobicContact CG2-CB 4.07Å; T318-I335 HydrophobicContact CG2-CD1 4Å; T318-I335 HydrophobicContact CG2-CG1 3.72Å; T318-I335 HydrophobicContact CG2-CG2 4.26Å
319	K	82.3	Confident	85.6	Confident	39 Å²	39	81 Å²	81	17%	0.17	42%	0.417	C	S	.	.	H	α-helix	trans	-68.2	-40.7	172.1	-76.5	-151.3	-178.9	-165.8	0	113.2	L315 L316 P317 N322 E323 E336 V489 N490	L315-K319 WeakPolarHBondContact O-CB 3.39Å; L315-K319 WeakPolarHBondContact O-CG 3.36Å; L315-K319 PolarHBondContact O-N 3.46Å; L316-K319 PolarHBondContact O-N 3.16Å; P317-K319 VanDerWaalsContact C-N 3.3Å; P317-K319 PolarHBondContact O-N 3.33Å; K319-N322 PolarHBondContact O-N 3.14Å; K319-E323 PolarHBondContact O-N 3.24Å; K319-E336 VanDerWaalsContact CE-OE1 3.3Å; K319-E336 WeakPolarHBondContact CE-OE1 3.36Å; K319-E336 IonicContact NZ-OE1 2.71Å; K319-E336 PolarHBondContact NZ-OE1 2.79Å; K319-V489 HydrophobicContact CD-CG1 3.59Å; K319-V489 HydrophobicContact CG-CG1 4.29Å; K319-N490 PolarHBondContact NZ-OD1 3.45Å
320	E	83.5	Confident	84.2	Confident	82 Å²	82	86.1 Å²	86.1	38%	0.383	43%	0.434	S	S	.	.	H	α-helix	trans	-66.2	-39.5	176.1	-162.4	74.6	148.6	0	0	111.8	L316 P317 E323 H324 R492 R496	L316-E320 PolarHBondContact O-N 3.44Å; L316-E320 VanDerWaalsContact O-N 3.16Å; P317-E320 PolarHBondContact O-N 3.45Å; E320-E323 PolarHBondContact O-N 2.98Å; E320-H324 WeakPolarHBondContact O-CB 3.49Å; E320-H324 PolarHBondContact O-N 3.33Å; E320-R492 IonicContact OE1-NH2 2.88Å; E320-R492 PolarHBondContact OE1-NH2 3.02Å; E320-R492 IonicContact OE2-CZ 3Å; E320-R492 IonicContact OE2-NH1 2.7Å; E320-R492 PolarHBondContact OE2-NH1 2.88Å; E320-R492 IonicContact OE2-NH2 3.66Å; E320-R492 PolarHBondContact OE2-NH2 2.87Å; E320-R496 VanDerWaalsContact CD-NH2 3.35Å; E320-R496 IonicContact OE1-NH2 3.28Å; E320-R496 PolarHBondContact OE1-NH2 3.49Å; E320-R496 VanDerWaalsContact OE1-NH2 3.11Å; E320-R496 IonicContact OE2-CZ 3.57Å; E320-R496 IonicContact OE2-NH2 2.83Å; E320-R496 PolarHBondContact OE2-NH2 3.09Å
321	L	84.5	Confident	83	Confident	105 Å²	105	82.8 Å²	82.8	55%	0.55	42%	0.422	S	S	.	.	H	α-helix	trans	-67.3	-39.9	177.8	-159.4	146.7	0	0	0	111	P317 H324 F325	P317-L321 VanDerWaalsContact O-CB 3.29Å; P317-L321 WeakPolarHBondContact O-CB 3.45Å; P317-L321 PolarHBondContact O-N 3.28Å; L321-H324 PolarHBondContact O-N 3.42Å; L321-F325 HydrophobicContact CD2-CD2 3.55Å; L321-F325 HydrophobicContact CD2-CE2 3.93Å; L321-F325 HydrophobicContact CG-CD2 3.83Å; L321-F325 HydrophobicContact CG-CE2 3.94Å; L321-F325 WeakPolarHBondContact O-CD2 3.27Å; L321-F325 PolarHBondContact O-N 3.15Å
322	N	81.3	Confident	82	Confident	40 Å²	40	83.6 Å²	83.6	21%	0.214	43%	0.427	C	S	.	.	H	α-helix	trans	-67.5	-32.5	172.5	-176.1	70.8	0	0	0	112.9	T318 K319 K326 L329 I333	T318-N322 WeakPolarHBondContact O-CB 3.08Å; T318-N322 PolarHBondContact O-N 3.04Å; K319-N322 PolarHBondContact O-N 3.14Å; N322-K326 PolarHBondContact O-N 2.95Å; N322-L329 WeakPolarHBondContact OD1-CD1 3.02Å; N322-I333 PolarHBondContact OD1-N 2.89Å
323	E	77.4	Confident	81.3	Confident	97 Å²	97	85.4 Å²	85.4	45%	0.453	44%	0.436	S	S	.	.	H	α-helix	trans	-67.6	-42.4	169.3	-76.7	-170.9	143.5	0	0	111.8	K319 E320 K326 R492 R496	K319-E323 PolarHBondContact O-N 3.24Å; E320-E323 PolarHBondContact O-N 2.98Å; E323-K326 VanDerWaalsContact O-CB 3.27Å; E323-K326 WeakPolarHBondContact O-CB 3.36Å; E323-K326 PolarHBondContact O-N 2.89Å; E323-R492 IonicContact OE2-NH1 3.11Å; E323-R492 PolarHBondContact OE2-NH1 2.9Å; E323-R496 IonicContact OE1-NH1 3.96Å; E323-R496 PolarHBondContact OE1-NH1 3.24Å; E323-R496 IonicContact OE2-CZ 2.67Å; E323-R496 IonicContact OE2-NH1 3.21Å; E323-R496 PolarHBondContact OE2-NH1 2.87Å; E323-R496 IonicContact OE2-NH2 3.4Å; E323-R496 PolarHBondContact OE2-NH2 3.3Å
324	H	82.3	Confident	80.7	Confident	148 Å²	148	81.7 Å²	81.7	69%	0.685	42%	0.419	S	S	*	.	H	α-helix	trans	-69.4	-42.9	-178.5	-166.4	86.5	0	0	0	112.9	E320 L321 K326	E320-H324 WeakPolarHBondContact O-CB 3.49Å; E320-H324 PolarHBondContact O-N 3.33Å; L321-H324 PolarHBondContact O-N 3.42Å; H324-K326 VanDerWaalsContact C-N 3.29Å; H324-K326 PolarHBondContact O-N 3.27Å
325	F	82.3	Confident	80.3	Confident	85 Å²	85	80.5 Å²	80.5	37%	0.373	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-87.5	10.7	178.8	-71.6	-76.8	0	0	0	114.1	L321 S327 K328 L329	L321-F325 HydrophobicContact CD2-CD2 3.55Å; L321-F325 HydrophobicContact CD2-CE2 3.93Å; L321-F325 HydrophobicContact CG-CD2 3.83Å; L321-F325 HydrophobicContact CG-CE2 3.94Å; L321-F325 WeakPolarHBondContact O-CD2 3.27Å; L321-F325 PolarHBondContact O-N 3.15Å; F325-S327 PolarHBondContact O-N 3.29Å; F325-K328 HydrophobicContact CD1-CD 4.36Å; F325-K328 PolarHBondContact O-N 2.95Å; F325-L329 HydrophobicContact CB-CD1 4.25Å; F325-L329 HydrophobicContact CB-CG 4.48Å; F325-L329 PolarHBondContact O-N 3Å; F325-L329 VanDerWaalsContact O-N 3.13Å
326	K	72.6	Confident	80	Confident	123 Å²	123	81 Å²	81	54%	0.535	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-55.4	-24.5	178.1	-173.2	175.2	179.5	-178.6	0	114.1	N322 E323 H324 K328	N322-K326 PolarHBondContact O-N 2.95Å; E323-K326 VanDerWaalsContact O-CB 3.27Å; E323-K326 WeakPolarHBondContact O-CB 3.36Å; E323-K326 PolarHBondContact O-N 2.89Å; H324-K326 VanDerWaalsContact C-N 3.29Å; H324-K326 PolarHBondContact O-N 3.27Å; K326-K328 VanDerWaalsContact C-N 3.35Å
327	S	74.9	Confident	79.8	Confident	114 Å²	114	80.5 Å²	80.5	80%	0.797	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-75.6	-17.3	174.8	55.2	0	0	0	0	114.5	F325	F325-S327 PolarHBondContact O-N 3.29Å
328	K	78.6	Confident	79.8	Confident	168 Å²	168	80.9 Å²	80.9	73%	0.73	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-23.2	178.9	-65.1	-169.6	178.6	-176.1	0	113.4	F325 K326	F325-K328 HydrophobicContact CD1-CD 4.36Å; F325-K328 PolarHBondContact O-N 2.95Å; K326-K328 VanDerWaalsContact C-N 3.35Å
329	L	74.1	Confident	80.1	Confident	66 Å²	66	79.2 Å²	79.2	35%	0.346	40%	0.401	S	S	.	.			trans	-88.8	121	-178.6	-65.7	172	0	0	0	111.3	N322 F325 A331	N322-L329 WeakPolarHBondContact OD1-CD1 3.02Å; F325-L329 HydrophobicContact CB-CD1 4.25Å; F325-L329 HydrophobicContact CB-CG 4.48Å; F325-L329 PolarHBondContact O-N 3Å; F325-L329 VanDerWaalsContact O-N 3.13Å; L329-A331 PolarHBondContact O-N 2.94Å
330	K	67.3	Low	80.5	Confident	215 Å²	215	77.4 Å²	77.4	94%	0.935	39%	0.393	S	S	*	.	S	Bend	trans	-66.8	-20.3	177	-70	-173.3	178.3	-178.9	0	114
331	A	69	Low	80.9	Confident	36 Å²	36	76.6 Å²	76.6	30%	0.298	39%	0.394	S	S	.	.	S	Bend	trans	-151.1	148.7	175	0	0	0	0	0	109.8	I117 L329	I117-A331 HydrophobicContact CD1-CB 4.3Å; L329-A331 PolarHBondContact O-N 2.94Å
332	P	73.4	Confident	81.3	Confident	26 Å²	26	74.4 Å²	74.4	17%	0.169	39%	0.39	C	S	.	.			trans	-68.4	134	173.8	29.1	-34	0	0	0	110.9	V445 T449	P332-V445 HydrophobicContact CG-CG1 4.23Å; P332-T449 HydrophobicContact CG-CG2 3.88Å
333	I	79.5	Confident	81.9	Confident	95 Å²	95	73 Å²	73	49%	0.487	39%	0.385	S	S	.	.			trans	-73.1	127.1	178.8	-58.5	174.6	0	0	0	109.3	N322 I335	N322-I333 PolarHBondContact OD1-N 2.89Å; I333-I335 PolarHBondContact O-N 2.72Å
334	P	81.1	Confident	82.6	Confident	39 Å²	39	69 Å²	69	25%	0.253	37%	0.367	S	S	.	.			trans	-77.8	61.9	-179.6	33.2	-36.4	0	0	0	111.8	I120 E336 L337 V338	I120-P334 HydrophobicContact CG2-CB 4.27Å; P334-E336 PolarHBondContact O-N 3.25Å; P334-E336 VanDerWaalsContact O-N 3.14Å; P334-L337 WeakPolarHBondContact O-CB 3.34Å; P334-L337 PolarHBondContact O-N 3.14Å; P334-V338 PolarHBondContact O-N 2.81Å
335	I	85.5	Confident	83.1	Confident	27 Å²	27	66.2 Å²	66.2	14%	0.138	36%	0.357	C	S	.	.	H	α-helix	trans	-57.5	-28.3	-178	-170.7	67.5	0	0	0	113.1	L315 T318 I333 L337 V338 V339	L315-I335 HydrophobicContact CD2-CB 4.5Å; L315-I335 HydrophobicContact CD2-CG1 4.04Å; L315-I335 HydrophobicContact CD2-CG2 3.96Å; T318-I335 HydrophobicContact CG2-CB 4.07Å; T318-I335 HydrophobicContact CG2-CD1 4Å; T318-I335 HydrophobicContact CG2-CG1 3.72Å; T318-I335 HydrophobicContact CG2-CG2 4.26Å; I333-I335 PolarHBondContact O-N 2.72Å; I335-L337 VanDerWaalsContact C-N 3.31Å; I335-L337 PolarHBondContact O-N 2.72Å; I335-V338 HydrophobicContact CD1-CB 4.27Å; I335-V338 PolarHBondContact O-N 3.19Å; I335-V339 HydrophobicContact CG1-CG2 4.32Å; I335-V339 WeakPolarHBondContact O-CG2 3.33Å; I335-V339 PolarHBondContact O-N 3.08Å
336	E	84.8	Confident	83.6	Confident	10 Å²	10	64.9 Å²	64.9	5%	0.047	36%	0.362	C	S	.	.	H	α-helix	trans	-55.8	-42.3	171.6	-78.4	165.9	-111.6	0	0	112	L121 Q125 K319 P334 V340 I486 N490	L121-E336 HydrophobicContact CD2-CB 3.78Å; L121-E336 HydrophobicContact CD2-CG 4.28Å; Q125-E336 PolarHBondContact NE2-OE2 3.49Å; K319-E336 VanDerWaalsContact CE-OE1 3.3Å; K319-E336 WeakPolarHBondContact CE-OE1 3.36Å; K319-E336 IonicContact NZ-OE1 2.71Å; K319-E336 PolarHBondContact NZ-OE1 2.79Å; P334-E336 PolarHBondContact O-N 3.25Å; P334-E336 VanDerWaalsContact O-N 3.14Å; E336-V340 WeakPolarHBondContact O-CB 3.44Å; E336-V340 WeakPolarHBondContact O-CG2 3.48Å; E336-V340 PolarHBondContact O-N 2.93Å; E336-V340 VanDerWaalsContact O-N 3.08Å; E336-I486 HydrophobicContact CG-CG2 4.23Å; E336-N490 PolarHBondContact OE1-OD1 2.59Å; E336-N490 PolarHBondContact OE2-ND2 2.93Å
337	L	85.9	Confident	84.7	Confident	52 Å²	52	59.2 Å²	59.2	27%	0.272	34%	0.337	S	S	.	.	H	α-helix	trans	-67.9	-44.3	176.2	178.9	66.7	0	0	0	111.4	I120 P334 I335 V339 V340 V341	I120-L337 HydrophobicContact CD1-CD2 4.28Å; I120-L337 HydrophobicContact CG1-CD2 4.43Å; I120-L337 HydrophobicContact CG2-CB 3.66Å; I120-L337 HydrophobicContact CG2-CD1 4.31Å; I120-L337 HydrophobicContact CG2-CD2 3.64Å; I120-L337 HydrophobicContact CG2-CG 4.05Å; P334-L337 WeakPolarHBondContact O-CB 3.34Å; P334-L337 PolarHBondContact O-N 3.14Å; I335-L337 VanDerWaalsContact C-N 3.31Å; I335-L337 PolarHBondContact O-N 2.72Å; L337-V339 VanDerWaalsContact C-N 3.3Å; L337-V339 PolarHBondContact O-N 2.85Å; L337-V340 PolarHBondContact O-N 3.21Å; L337-V341 HydrophobicContact CD1-CG2 3.91Å; L337-V341 HydrophobicContact CG-CG2 4.17Å; L337-V341 WeakPolarHBondContact O-CG2 3.23Å; L337-V341 PolarHBondContact O-N 3.22Å
338	V	89.7	Confident	85.5	Confident	82 Å²	82	59.1 Å²	59.1	50%	0.497	32%	0.324	S	S	.	.	H	α-helix	trans	-59.6	-43.6	-177.8	-178.2	0	0	0	0	110.6	P334 I335 A342	P334-V338 PolarHBondContact O-N 2.81Å; I335-V338 HydrophobicContact CD1-CB 4.27Å; I335-V338 PolarHBondContact O-N 3.19Å; V338-A342 VanDerWaalsContact O-CB 3.26Å; V338-A342 WeakPolarHBondContact O-CB 3.41Å; V338-A342 PolarHBondContact O-N 3.1Å
339	V	91.8	Very high	86.2	Confident	15 Å²	15	59 Å²	59	9%	0.091	32%	0.324	C	S	.	.	H	α-helix	trans	-68.8	-39.6	177	173.5	0	0	0	0	111.8	C311 V314 L315 I335 L337 A343 V482	C311-V339 HydrophobicContact CB-CG1 4.15Å; V314-V339 HydrophobicContact CG1-CG2 3.9Å; L315-V339 HydrophobicContact CD1-CG1 4.13Å; L315-V339 HydrophobicContact CD2-CB 4.22Å; L315-V339 HydrophobicContact CD2-CG2 3.81Å; L315-V339 HydrophobicContact CG-CB 4.43Å; L315-V339 HydrophobicContact CG-CG1 4.36Å; L315-V339 HydrophobicContact CG-CG2 4.04Å; I335-V339 HydrophobicContact CG1-CG2 4.32Å; I335-V339 WeakPolarHBondContact O-CG2 3.33Å; I335-V339 PolarHBondContact O-N 3.08Å; L337-V339 VanDerWaalsContact C-N 3.3Å; L337-V339 PolarHBondContact O-N 2.85Å; V339-A343 WeakPolarHBondContact O-CB 3.08Å; V339-A343 PolarHBondContact O-N 2.85Å; V339-V482 HydrophobicContact CG1-CG1 4.45Å
340	V	91.7	Very high	87	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60.4	-48.7	173.8	168.3	0	0	0	0	111.4	P124 E336 L337 T344 F475 L478 I486	P124-V340 HydrophobicContact CB-CG2 3.77Å; P124-V340 HydrophobicContact CG-CG2 4.16Å; E336-V340 WeakPolarHBondContact O-CB 3.44Å; E336-V340 WeakPolarHBondContact O-CG2 3.48Å; E336-V340 PolarHBondContact O-N 2.93Å; E336-V340 VanDerWaalsContact O-N 3.08Å; L337-V340 PolarHBondContact O-N 3.21Å; V340-T344 VanDerWaalsContact O-CB 3.26Å; V340-T344 WeakPolarHBondContact O-CB 3.49Å; V340-T344 PolarHBondContact O-N 3.05Å; V340-T344 PolarHBondContact O-OG1 3.28Å; V340-F475 HydrophobicContact CG1-CD1 4.16Å; V340-F475 HydrophobicContact CG1-CE1 3.81Å; V340-L478 HydrophobicContact CG1-CD1 4.22Å; V340-L478 HydrophobicContact CG1-CD2 4.12Å; V340-I486 HydrophobicContact CG2-CD1 3.31Å
341	V	91.9	Very high	88.2	Confident	66 Å²	66	51.9 Å²	51.9	40%	0.4	30%	0.299	S	S	.	.	H	α-helix	trans	-64.1	-49.3	-179.8	172.6	0	0	0	0	110.5	L337 A343 T344 L345	L337-V341 HydrophobicContact CD1-CG2 3.91Å; L337-V341 HydrophobicContact CG-CG2 4.17Å; L337-V341 WeakPolarHBondContact O-CG2 3.23Å; L337-V341 PolarHBondContact O-N 3.22Å; V341-A343 PolarHBondContact O-N 2.9Å; V341-T344 PolarHBondContact O-N 3.29Å; V341-L345 HydrophobicContact CG1-CD1 3.85Å; V341-L345 HydrophobicContact CG1-CG 4.41Å; V341-L345 VanDerWaalsContact O-CG 3.31Å; V341-L345 WeakPolarHBondContact O-CG 3.49Å; V341-L345 PolarHBondContact O-N 3.18Å
342	A	93.1	Very high	89.2	Confident	58 Å²	58	51.5 Å²	51.5	48%	0.479	29%	0.292	S	S	.	.	H	α-helix	trans	-59.9	-45.8	179.3	0	0	0	0	0	112.4	V338 L345 A346	V338-A342 VanDerWaalsContact O-CB 3.26Å; V338-A342 WeakPolarHBondContact O-CB 3.41Å; V338-A342 PolarHBondContact O-N 3.1Å; A342-L345 PolarHBondContact O-N 3.01Å; A342-A346 WeakPolarHBondContact O-CB 3.49Å; A342-A346 PolarHBondContact O-N 2.81Å
343	A	92.4	Very high	90	Very high	12 Å²	12	54 Å²	54	10%	0.099	30%	0.301	C	S	.	.	H	α-helix	trans	-69.5	-33.8	178.4	0	0	0	0	0	112.8	V339 V341 S347 V482	V339-A343 WeakPolarHBondContact O-CB 3.08Å; V339-A343 PolarHBondContact O-N 2.85Å; V341-A343 PolarHBondContact O-N 2.9Å; A343-S347 WeakPolarHBondContact O-CB 3.44Å; A343-S347 PolarHBondContact O-N 3.06Å; A343-V482 HydrophobicContact CB-CG1 4.31Å; A343-V482 HydrophobicContact CB-CG2 3.75Å
344	T	92.5	Very high	90.5	Very high	13 Å²	13	55.9 Å²	55.9	8%	0.08	31%	0.308	C	S	.	.	H	α-helix	trans	-67.3	-44.1	175.7	-55.9	0	0	0	0	111.1	V340 V341 S347 H348 L474	V340-T344 VanDerWaalsContact O-CB 3.26Å; V340-T344 WeakPolarHBondContact O-CB 3.49Å; V340-T344 PolarHBondContact O-N 3.05Å; V340-T344 PolarHBondContact O-OG1 3.28Å; V341-T344 PolarHBondContact O-N 3.29Å; T344-S347 PolarHBondContact O-N 2.98Å; T344-H348 VanDerWaalsContact O-CB 3.3Å; T344-H348 WeakPolarHBondContact O-CB 3.46Å; T344-H348 PolarHBondContact O-N 2.76Å; T344-L474 WeakPolarHBondContact CG2-O 3.18Å
345	L	93.8	Very high	91	Very high	88 Å²	88	58.7 Å²	58.7	46%	0.461	32%	0.321	S	S	.	.	H	α-helix	trans	-64	-44.1	175.4	-67.3	171.1	0	0	0	111.5	V341 A342 S347 H348 F349	V341-L345 HydrophobicContact CG1-CD1 3.85Å; V341-L345 HydrophobicContact CG1-CG 4.41Å; V341-L345 VanDerWaalsContact O-CG 3.31Å; V341-L345 WeakPolarHBondContact O-CG 3.49Å; V341-L345 PolarHBondContact O-N 3.18Å; A342-L345 PolarHBondContact O-N 3.01Å; L345-S347 PolarHBondContact O-N 3.18Å; L345-H348 PolarHBondContact O-N 3.44Å; L345-F349 HydrophobicContact CB-CD2 4.42Å; L345-F349 HydrophobicContact CD2-CE2 4.1Å; L345-F349 VanDerWaalsContact O-CD2 3.26Å; L345-F349 WeakPolarHBondContact O-CD2 3.48Å; L345-F349 PolarHBondContact O-N 2.99Å
346	A	93.2	Very high	91.1	Very high	58 Å²	58	64.4 Å²	64.4	48%	0.479	34%	0.342	S	S	.	.	H	α-helix	trans	-62.4	-41.5	176	0	0	0	0	0	112.4	A342 G350	A342-A346 WeakPolarHBondContact O-CB 3.49Å; A342-A346 PolarHBondContact O-N 2.81Å; A346-G350 WeakPolarHBondContact O-CA 3.49Å; A346-G350 PolarHBondContact O-N 3.19Å
347	S	94.3	Very high	91.3	Very high	4 Å²	4	69.8 Å²	69.8	3%	0.028	37%	0.371	C	S	.	.	H	α-helix	trans	-64.2	-41.9	175.5	179.4	0	0	0	0	112.6	A343 T344 L345 K351 L352 S477	A343-S347 WeakPolarHBondContact O-CB 3.44Å; A343-S347 PolarHBondContact O-N 3.06Å; T344-S347 PolarHBondContact O-N 2.98Å; L345-S347 PolarHBondContact O-N 3.18Å; S347-K351 PolarHBondContact O-N 3.46Å; S347-K351 VanDerWaalsContact O-N 3.11Å; S347-L352 PolarHBondContact O-N 3.13Å; S347-L352 VanDerWaalsContact O-N 3.16Å; S347-S477 WeakPolarHBondContact CB-O 3.21Å; S347-S477 PolarHBondContact OG-O 2.86Å
348	H	92.8	Very high	91.5	Very high	112 Å²	112	67.3 Å²	67.3	52%	0.519	36%	0.358	S	S	.	.	H	α-helix	trans	-68.1	-56.4	180	-170.2	81.6	0	0	0	112	T344 L345 K351 S477	T344-H348 VanDerWaalsContact O-CB 3.3Å; T344-H348 WeakPolarHBondContact O-CB 3.46Å; T344-H348 PolarHBondContact O-N 2.76Å; L345-H348 PolarHBondContact O-N 3.44Å; H348-K351 PolarHBondContact O-N 3.18Å; H348-S477 PolarHBondContact ND1-OG 3.19Å; H348-S477 VanDerWaalsContact ND1-OG 3.15Å
349	F	93.6	Very high	91.4	Very high	165 Å²	165	64.5 Å²	64.5	72%	0.724	34%	0.342	S	S	*	.	H	α-helix	trans	-70.9	-31.9	-179.3	-68.3	-60.7	0	0	0	113	L345 K351	L345-F349 HydrophobicContact CB-CD2 4.42Å; L345-F349 HydrophobicContact CD2-CE2 4.1Å; L345-F349 VanDerWaalsContact O-CD2 3.26Å; L345-F349 WeakPolarHBondContact O-CD2 3.48Å; L345-F349 PolarHBondContact O-N 2.99Å; F349-K351 VanDerWaalsContact C-N 3.27Å; F349-K351 PolarHBondContact O-N 3.31Å
350	G	90.1	Very high	91.4	Very high	32 Å²	32	64.6 Å²	64.6	33%	0.33	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-4.5	174.5	0	0	0	0	0	114.7	A346 L352 N355	A346-G350 WeakPolarHBondContact O-CA 3.49Å; A346-G350 PolarHBondContact O-N 3.19Å; G350-L352 PolarHBondContact O-N 3.4Å; G350-L352 VanDerWaalsContact O-N 3.16Å; G350-N355 PolarHBondContact O-ND2 2.96Å
351	K	91.6	Very high	91.1	Very high	100 Å²	100	65.1 Å²	65.1	44%	0.435	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.6	41.4	-177.1	-76.6	171.4	158	-78.2	0	112.8	S347 H348 F349 H353 E354 N355	S347-K351 PolarHBondContact O-N 3.46Å; S347-K351 VanDerWaalsContact O-N 3.11Å; H348-K351 PolarHBondContact O-N 3.18Å; F349-K351 VanDerWaalsContact C-N 3.27Å; F349-K351 PolarHBondContact O-N 3.31Å; K351-H353 PolarHBondContact O-N 3.29Å; K351-H353 VanDerWaalsContact O-N 3.12Å; K351-E354 HydrophobicContact CB-CB 4.36Å; K351-E354 IonicContact NZ-OE1 2.67Å; K351-E354 PolarHBondContact NZ-OE1 3.35Å; K351-E354 IonicContact NZ-OE2 2.7Å; K351-E354 PolarHBondContact NZ-OE2 2.98Å; K351-E354 PolarHBondContact O-N 3.03Å; K351-N355 PolarHBondContact O-N 3.16Å; K351-N355 PolarHBondContact O-ND2 3.07Å
352	L	89.8	Confident	90.8	Very high	27 Å²	27	62.7 Å²	62.7	14%	0.141	34%	0.335	C	S	.	.	H	α-helix	trans	-62.4	-28.7	-167.1	-61.6	-178	0	0	0	113.4	S347 G350 Y356 S358	S347-L352 PolarHBondContact O-N 3.13Å; S347-L352 VanDerWaalsContact O-N 3.16Å; G350-L352 PolarHBondContact O-N 3.4Å; G350-L352 VanDerWaalsContact O-N 3.16Å; L352-Y356 HydrophobicContact CD2-CD2 3.87Å; L352-Y356 HydrophobicContact CD2-CE2 4.03Å; L352-Y356 WeakPolarHBondContact O-CA 3.45Å; L352-Y356 WeakPolarHBondContact O-CB 3.36Å; L352-Y356 PolarHBondContact O-N 3.17Å; L352-S358 PolarHBondContact O-N 3.13Å; L352-S358 PolarHBondContact O-OG 3.44Å
353	H	90.5	Very high	90.4	Very high	80 Å²	80	67.1 Å²	67.1	37%	0.37	35%	0.345	S	S	.	.	H	α-helix	trans	-69	-43.8	173.6	-173.4	56.2	0	0	0	112.7	K351 N357 S358 I360	K351-H353 PolarHBondContact O-N 3.29Å; K351-H353 VanDerWaalsContact O-N 3.12Å; H353-N357 WeakPolarHBondContact O-CA 3.34Å; H353-N357 PolarHBondContact O-N 2.83Å; H353-S358 WeakPolarHBondContact CA-OG 3.49Å; H353-S358 PolarHBondContact N-OG 3.45Å; H353-S358 PolarHBondContact ND1-O 3.32Å; H353-I360 HydrophobicContact CB-CD1 4.17Å; H353-I360 HydrophobicContact CB-CG1 4.49Å; H353-I360 HydrophobicContact CB-CG2 3.9Å
354	E	89.9	Confident	90.1	Very high	133 Å²	133	66.7 Å²	66.7	62%	0.621	34%	0.341	S	S	*	.	H	α-helix	trans	-69.7	-45.4	178.7	-61.9	169.8	-144.4	0	0	111.1	K351	K351-E354 HydrophobicContact CB-CB 4.36Å; K351-E354 IonicContact NZ-OE1 2.67Å; K351-E354 PolarHBondContact NZ-OE1 3.35Å; K351-E354 IonicContact NZ-OE2 2.7Å; K351-E354 PolarHBondContact NZ-OE2 2.98Å; K351-E354 PolarHBondContact O-N 3.03Å
355	N	91.4	Very high	89.7	Confident	99 Å²	99	68 Å²	68	53%	0.529	35%	0.35	S	S	.	.	H	α-helix	trans	-79.9	-32.7	-172.2	-69	-33.3	0	0	0	113.9	G350 K351	G350-N355 PolarHBondContact O-ND2 2.96Å; K351-N355 PolarHBondContact O-N 3.16Å; K351-N355 PolarHBondContact O-ND2 3.07Å
356	Y	88.4	Confident	89.4	Confident	146 Å²	146	67.4 Å²	67.4	57%	0.573	35%	0.35	S	S	*	.	H	α-helix	trans	-130.7	6.4	-171.8	-57.4	-72.3	0	0	0	114.1	N301 C303 L352 S358	N301-Y356 PolarHBondContact ND2-O 3.34Å; C303-Y356 HydrophobicContact CB-CD2 4.42Å; C303-Y356 HydrophobicContact CB-CG 4.1Å; L352-Y356 HydrophobicContact CD2-CD2 3.87Å; L352-Y356 HydrophobicContact CD2-CE2 4.03Å; L352-Y356 WeakPolarHBondContact O-CA 3.45Å; L352-Y356 WeakPolarHBondContact O-CB 3.36Å; L352-Y356 PolarHBondContact O-N 3.17Å; Y356-S358 PolarHBondContact O-N 3Å
357	N	89.1	Confident	89.1	Confident	123 Å²	123	65.5 Å²	65.5	66%	0.658	34%	0.336	S	S	*	.			trans	51.8	37.5	-176.1	-162.1	5.3	0	0	0	112.9	N301 H353	N301-N357 PolarHBondContact ND2-O 3.29Å; N301-N357 VanDerWaalsContact ND2-O 3.09Å; H353-N357 WeakPolarHBondContact O-CA 3.34Å; H353-N357 PolarHBondContact O-N 2.83Å
358	S	89	Confident	88.8	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	35%	0.353	C	S	.	.			trans	-64.4	143.5	178.3	67.2	0	0	0	0	111.1	L352 H353 Y356 I360	L352-S358 PolarHBondContact O-N 3.13Å; L352-S358 PolarHBondContact O-OG 3.44Å; H353-S358 WeakPolarHBondContact CA-OG 3.49Å; H353-S358 PolarHBondContact N-OG 3.45Å; H353-S358 PolarHBondContact ND1-O 3.32Å; Y356-S358 PolarHBondContact O-N 3Å; S358-I360 PolarHBondContact O-N 3.1Å; S358-I360 VanDerWaalsContact O-N 3.09Å
359	S	88.4	Confident	88.5	Confident	23 Å²	23	66.5 Å²	66.5	16%	0.161	34%	0.34	C	S	.	.			trans	-77.1	95.4	-174.7	59.7	0	0	0	0	112.7	D304 Q479 K480	D304-S359 WeakPolarHBondContact OD2-CB 3.2Å; D304-S359 PolarHBondContact OD2-N 3.08Å; D304-S359 PolarHBondContact OD2-OG 3.23Å; S359-Q479 CarbonylContact O-C 3.57Å; S359-Q479 WeakPolarHBondContact O-CA 3.45Å; S359-K480 WeakPolarHBondContact O-CB 3.32Å; S359-K480 WeakPolarHBondContact O-CG 3.35Å; S359-K480 PolarHBondContact O-N 3.47Å
360	I	91.4	Very high	88.3	Confident	17 Å²	17	63.6 Å²	63.6	9%	0.087	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-88.5	162.4	-179.4	61.3	169.3	0	0	0	114	H353 S358 Y476 L478 K480	H353-I360 HydrophobicContact CB-CD1 4.17Å; H353-I360 HydrophobicContact CB-CG1 4.49Å; H353-I360 HydrophobicContact CB-CG2 3.9Å; S358-I360 PolarHBondContact O-N 3.1Å; S358-I360 VanDerWaalsContact O-N 3.09Å; I360-Y476 HydrophobicContact CD1-CD1 4.45Å; I360-Y476 HydrophobicContact CD1-CE1 3.94Å; I360-L478 CarbonylContact C-O 3.49Å; I360-L478 WeakPolarHBondContact CA-O 3.1Å; I360-K480 WeakPolarHBondContact O-CD 3.45Å; I360-K480 WeakPolarHBondContact O-CE 3.24Å; I360-K480 PolarHBondContact O-NZ 3.18Å
361	A	85.4	Confident	88.5	Confident	11 Å²	11	66.2 Å²	66.2	9%	0.091	35%	0.349	C	S	.	.			trans	-62	-44.2	175	0	0	0	0	0	112.4	L478	A361-L478 HydrophobicContact CB-CB 4.4Å; A361-L478 PolarHBondContact N-O 3.26Å
362	G	85.4	Confident	88.4	Confident	16 Å²	16	65.6 Å²	65.6	17%	0.165	35%	0.346	C	S	.	.			trans	91.1	-165.2	179	0	0	0	0	0	113.6	I364 Y476	G362-I364 PolarHBondContact O-N 3.45Å; G362-Y476 PolarHBondContact N-O 3.23Å; G362-Y476 WeakPolarHBondContact O-CA 3.45Å; G362-Y476 WeakPolarHBondContact O-CD2 3.45Å
363	H	85	Confident	88.5	Confident	150 Å²	150	68.4 Å²	68.4	69%	0.694	36%	0.364	S	S	*	.			trans	-66.4	123.7	-176.8	-174.6	-92.9	0	0	0	112	Y476	H363-Y476 HydrophobicContact CB-CD2 4.48Å; H363-Y476 HydrophobicContact CB-CE2 4.33Å
364	I	87.2	Confident	88.6	Confident	4 Å²	4	64.8 Å²	64.8	2%	0.021	35%	0.348	C	S	.	.			trans	-113.4	111.9	173.6	-49.4	-176	0	0	0	107.2	I127 P137 V138 G362 A472 F475	I127-I364 HydrophobicContact CD1-CD1 4.24Å; P137-I364 HydrophobicContact CB-CD1 3.65Å; P137-I364 HydrophobicContact CB-CG1 3.87Å; P137-I364 HydrophobicContact CB-CG2 4.41Å; P137-I364 HydrophobicContact CG-CD1 4.27Å; P137-I364 HydrophobicContact CG-CG1 4.24Å; V138-I364 HydrophobicContact CB-CG2 4.1Å; G362-I364 PolarHBondContact O-N 3.45Å; I364-A472 HydrophobicContact CB-CB 4.48Å; I364-A472 HydrophobicContact CG2-CB 4.04Å; I364-F475 HydrophobicContact CD1-CB 4.01Å
365	P	83.9	Confident	88.5	Confident	40 Å²	40	61 Å²	61	26%	0.26	33%	0.33	S	S	.	.			trans	-66.6	143.7	179.3	27.9	-33.9	0	0	0	111.2	V138 M369	V138-P365 HydrophobicContact CB-CG 4.32Å; V138-P365 HydrophobicContact CG1-CG 4.16Å; V138-P365 HydrophobicContact CG2-CG 4.31Å; P365-M369 HydrophobicContact CG-CE 3.94Å
366	T	86.4	Confident	88.3	Confident	75 Å²	75	64.2 Å²	64.2	46%	0.46	34%	0.335	S	S	.	.			trans	-88.6	158.4	173.4	44.1	0	0	0	0	111.7	L468 A472 P473	T366-L468 WeakPolarHBondContact CA-O 3.24Å; T366-A472 HydrophobicContact CG2-CB 4.34Å; T366-P473 HydrophobicContact CG2-CG 3.55Å
367	G	86.9	Confident	88.4	Confident	18 Å²	18	64.1 Å²	64.1	19%	0.186	34%	0.344	C	S	.	.	S	Bend	trans	82.4	-166.2	179.9	0	0	0	0	0	113.8	Y142 L468	Y142-G367 WeakPolarHBondContact CE1-O 3.41Å; Y142-G367 PolarHBondContact OH-O 2.91Å; G367-L468 PolarHBondContact N-O 2.93Å
368	F	87.6	Confident	88.4	Confident	89 Å²	89	59 Å²	59	39%	0.39	32%	0.317	S	S	.	.			trans	-109.9	133.9	178.2	-70.5	-80.6	0	0	0	110.7	Y142 F145 F146 L465 L468	Y142-F368 HydrophobicContact CD1-CD1 4.07Å; Y142-F368 HydrophobicContact CD1-CE1 4.09Å; Y142-F368 AromaticContact CE1-CD1 3.82Å; Y142-F368 HydrophobicContact CE1-CD1 3.82Å; Y142-F368 HydrophobicContact CE1-CE1 4.19Å; Y142-F368 WeakPolarHBondContact OH-CA 3.42Å; F145-F368 AromaticContact CD1-CE1 3.88Å; F145-F368 HydrophobicContact CD1-CE1 3.88Å; F145-F368 AromaticContact CD1-CZ 3.99Å; F145-F368 HydrophobicContact CD1-CZ 3.99Å; F145-F368 AromaticContact CE1-CE1 3.76Å; F145-F368 HydrophobicContact CE1-CE1 3.76Å; F145-F368 AromaticContact CE1-CZ 3.57Å; F145-F368 HydrophobicContact CE1-CZ 3.57Å; F145-F368 AromaticContact CZ-CZ 3.93Å; F145-F368 HydrophobicContact CZ-CZ 3.93Å; F146-F368 HydrophobicContact CE2-CD1 4.47Å; F146-F368 HydrophobicContact CE2-CE1 4.21Å; F146-F368 HydrophobicContact CZ-CD1 4.34Å; F146-F368 HydrophobicContact CZ-CE1 4.13Å; F368-L465 HydrophobicContact CE2-CD1 3.57Å; F368-L465 HydrophobicContact CZ-CD1 3.74Å; F368-L468 HydrophobicContact CE1-CD1 4.17Å; F368-L468 HydrophobicContact CZ-CD1 4.22Å
369	M	87.6	Confident	88.5	Confident	49 Å²	49	60.1 Å²	60.1	24%	0.241	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-68.6	149.4	167.2	-63.4	176.8	-163.3	0	0	110.5	V138 Y139 Y142 P365	V138-M369 HydrophobicContact CG1-CE 3.67Å; V138-M369 HydrophobicContact CG2-CE 4.48Å; Y139-M369 HydrophobicContact CE1-CE 3.73Å; Y139-M369 HydrophobicContact CE1-SD 3.63Å; Y142-M369 HydrophobicContact CE2-CB 4.4Å; Y142-M369 HydrophobicContact CE2-CE 4.23Å; Y142-M369 HydrophobicContact CE2-CG 4.1Å; Y142-M369 HydrophobicContact CE2-SD 4.17Å; Y142-M369 PolarHBondContact OH-N 3.38Å; P365-M369 HydrophobicContact CG-CE 3.94Å
370	P	89.8	Confident	88.7	Confident	104 Å²	104	63.5 Å²	63.5	68%	0.675	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-61.4	144.2	173.6	27	-34.7	0	0	0	110.6	H432	P370-H432 PolarHBondContact O-NE2 2.94Å
371	P	92.9	Very high	88.6	Confident	87 Å²	87	66.5 Å²	66.5	57%	0.565	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-65	140.5	179.7	27	-33.9	0	0	0	111.1	F430 F431	P371-F430 CarbonylContact C-O 3.42Å; P371-F430 WeakPolarHBondContact CA-O 3.45Å; P371-F430 VanDerWaalsContact CB-O 3.31Å; P371-F430 WeakPolarHBondContact CB-O 3.34Å; P371-F431 HydrophobicContact CB-CD1 4.02Å; P371-F431 HydrophobicContact CB-CE1 3.87Å; P371-F431 HydrophobicContact CB-CZ 4.39Å; P371-F431 HydrophobicContact CG-CE1 4.31Å
372	K	90.8	Very high	88.9	Confident	87 Å²	87	66 Å²	66	38%	0.378	36%	0.356	S	S	.	.			trans	-128.3	138.6	175.1	-169.7	-174.7	169.9	-177.6	0	109.6	E375 F430	K372-E375 WeakPolarHBondContact CE-OE1 3.4Å; K372-E375 IonicContact NZ-OE1 3.84Å; K372-E375 PolarHBondContact NZ-OE1 2.85Å; K372-F430 PolarHBondContact N-O 3.42Å; K372-F430 CarbonylContact O-C 3.57Å; K372-F430 WeakPolarHBondContact O-CA 3.4Å
373	V	92.1	Very high	89.2	Confident	86 Å²	86	66.1 Å²	66.1	52%	0.521	36%	0.356	S	S	.	.			trans	-65.8	140.1	172.2	-63.3	0	0	0	0	111	F430	V373-F430 HydrophobicContact CG1-CD1 4.27Å; V373-F430 HydrophobicContact CG1-CE1 4.17Å
374	P	91.1	Very high	89.5	Confident	4 Å²	4	64.2 Å²	64.2	3%	0.026	35%	0.354	C	S	.	.			trans	-58.5	147.4	167.8	-23.8	34.3	0	0	0	111.8	F227 W376	F227-P374 HydrophobicContact CB-CB 4.12Å; F227-P374 HydrophobicContact CB-CG 3.82Å; F227-P374 HydrophobicContact CD1-CB 4.47Å; F227-P374 HydrophobicContact CD2-CG 4.17Å; F227-P374 HydrophobicContact CG-CB 4.29Å; F227-P374 HydrophobicContact CG-CG 3.93Å; P374-W376 PolarHBondContact O-N 2.9Å
375	E	88.4	Confident	89.6	Confident	52 Å²	52	64.6 Å²	64.6	24%	0.243	36%	0.356	C	S	.	.			trans	-82.7	108.6	-171.7	-65.9	-68.1	177.5	0	0	111.4	M220 S224 K372 N377 L378	M220-E375 HydrophobicContact CE-CG 4.13Å; M220-E375 HydrophobicContact CG-CB 4.27Å; M220-E375 HydrophobicContact CG-CG 3.44Å; M220-E375 VanDerWaalsContact CG-CG 3.44Å; M220-E375 HydrophobicContact SD-CG 3.79Å; S224-E375 PolarHBondContact OG-N 3.19Å; K372-E375 WeakPolarHBondContact CE-OE1 3.4Å; K372-E375 IonicContact NZ-OE1 3.84Å; K372-E375 PolarHBondContact NZ-OE1 2.85Å; E375-N377 PolarHBondContact O-N 2.69Å; E375-N377 VanDerWaalsContact O-N 3.09Å; E375-L378 HydrophobicContact CB-CD1 4.07Å; E375-L378 HydrophobicContact CB-CG 4.11Å; E375-L378 PolarHBondContact O-N 2.97Å
376	W	88.3	Confident	90.1	Very high	167 Å²	167	62.7 Å²	62.7	63%	0.633	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-28.9	-179	-65.2	91.6	0	0	0	113.7	F227 P374 L378 I379	F227-W376 AromaticContact CE1-CH2 3.97Å; F227-W376 HydrophobicContact CE1-CH2 3.97Å; F227-W376 HydrophobicContact CE1-CZ2 4.42Å; F227-W376 HydrophobicContact CE1-CZ3 4.38Å; F227-W376 HydrophobicContact CZ-CH2 4.13Å; F227-W376 HydrophobicContact CZ-CZ2 4.44Å; P374-W376 PolarHBondContact O-N 2.9Å; W376-L378 VanDerWaalsContact C-N 3.29Å; W376-L378 PolarHBondContact O-N 3.01Å; W376-I379 HydrophobicContact CD2-CD1 4.06Å; W376-I379 HydrophobicContact CE3-CD1 3.53Å; W376-I379 HydrophobicContact CZ3-CD1 3.93Å; W376-I379 PolarHBondContact O-N 3.14Å
377	N	89.9	Confident	90.3	Very high	144 Å²	144	63 Å²	63	77%	0.77	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-24.4	177.7	-63.9	-22.6	0	0	0	113.5	E375	E375-N377 PolarHBondContact O-N 2.69Å; E375-N377 VanDerWaalsContact O-N 3.09Å
378	L	88.9	Confident	90.3	Very high	17 Å²	17	63.2 Å²	63.2	9%	0.089	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-23.3	178.3	-63.9	178.7	0	0	0	112.7	M220 V221 E375 W376 N381 V382	M220-L378 HydrophobicContact CG-CD1 3.8Å; M220-L378 HydrophobicContact SD-CD1 4.04Å; V221-L378 HydrophobicContact CG2-CD1 3.93Å; E375-L378 HydrophobicContact CB-CD1 4.07Å; E375-L378 HydrophobicContact CB-CG 4.11Å; E375-L378 PolarHBondContact O-N 2.97Å; W376-L378 VanDerWaalsContact C-N 3.29Å; W376-L378 PolarHBondContact O-N 3.01Å; L378-N381 PolarHBondContact O-N 2.9Å; L378-V382 PolarHBondContact O-N 3.27Å
379	I	90.6	Very high	90.5	Very high	22 Å²	22	59 Å²	59	11%	0.113	32%	0.324	C	S	.	.	H	α-helix	trans	-50.3	-47.1	-175.1	-74.3	174.9	0	0	0	113.3	F227 M228 W376 N381 V382 A383	F227-I379 HydrophobicContact CD1-CD1 4.22Å; F227-I379 HydrophobicContact CE1-CD1 4.28Å; M228-I379 HydrophobicContact CE-CB 4.43Å; M228-I379 HydrophobicContact CE-CD1 3.8Å; M228-I379 HydrophobicContact CE-CG1 4.08Å; M228-I379 HydrophobicContact CE-CG2 3.53Å; M228-I379 HydrophobicContact SD-CG2 4.36Å; W376-I379 HydrophobicContact CD2-CD1 4.06Å; W376-I379 HydrophobicContact CE3-CD1 3.53Å; W376-I379 HydrophobicContact CZ3-CD1 3.93Å; W376-I379 PolarHBondContact O-N 3.14Å; I379-N381 VanDerWaalsContact C-N 3.26Å; I379-N381 PolarHBondContact O-N 3.38Å; I379-V382 PolarHBondContact O-N 3.43Å; I379-A383 WeakPolarHBondContact O-CB 3.48Å; I379-A383 PolarHBondContact O-N 3.44Å
380	P	92.4	Very high	90.8	Very high	95 Å²	95	56.7 Å²	56.7	62%	0.617	31%	0.313	S	S	*	.	H	α-helix	trans	-59.4	-33.4	179.5	-25.6	35.8	0	0	0	114
381	N	90.1	Very high	90.7	Very high	79 Å²	79	54.9 Å²	54.9	42%	0.422	30%	0.297	S	S	.	.	H	α-helix	trans	-77.4	-27.2	-179.1	-69.4	0	0	0	0	113.1	R178 E179 L378 I379	R178-N381 PolarHBondContact NH2-O 3.41Å; E179-N381 WeakPolarHBondContact OE2-CB 3.33Å; E179-N381 PolarHBondContact OE2-ND2 2.92Å; L378-N381 PolarHBondContact O-N 2.9Å; I379-N381 VanDerWaalsContact C-N 3.26Å; I379-N381 PolarHBondContact O-N 3.38Å
382	V	92.5	Very high	90.5	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-105	-7.3	-176.1	-57.6	0	0	0	0	113.8	T175 E179 V221 V225 L378 I379 V384 D385 A386	T175-V382 HydrophobicContact CG2-CG1 3.89Å; E179-V382 HydrophobicContact CG-CG1 4.33Å; V221-V382 HydrophobicContact CG1-CG1 4.31Å; V225-V382 HydrophobicContact CG2-CB 3.72Å; V225-V382 HydrophobicContact CG2-CG1 3.75Å; V225-V382 HydrophobicContact CG2-CG2 4.19Å; L378-V382 PolarHBondContact O-N 3.27Å; I379-V382 PolarHBondContact O-N 3.43Å; V382-V384 VanDerWaalsContact C-N 3.25Å; V382-V384 PolarHBondContact O-N 3.46Å; V382-D385 PolarHBondContact O-N 2.93Å; V382-A386 VanDerWaalsContact O-CB 3.29Å; V382-A386 WeakPolarHBondContact O-CB 3.5Å; V382-A386 PolarHBondContact O-N 2.91Å
383	A	91.7	Very high	90.5	Very high	20 Å²	20	46.8 Å²	46.8	17%	0.165	25%	0.253	C	S	.	.	H	α-helix	trans	-55.2	-36.2	-178.1	0	0	0	0	0	113.5	Y232 I379 I387	Y232-A383 WeakPolarHBondContact CE2-O 3.45Å; Y232-A383 PolarHBondContact OH-O 2.76Å; I379-A383 WeakPolarHBondContact O-CB 3.48Å; I379-A383 PolarHBondContact O-N 3.44Å; A383-I387 WeakPolarHBondContact O-CG1 3.29Å; A383-I387 PolarHBondContact O-N 2.87Å
384	V	90.1	Very high	90.5	Very high	109 Å²	109	43 Å²	43	66%	0.661	23%	0.229	S	C	*	.	H	α-helix	trans	-71.2	-52.4	-178.9	-178.2	0	0	0	0	111.2	V382 A386 I387	V382-V384 VanDerWaalsContact C-N 3.25Å; V382-V384 PolarHBondContact O-N 3.46Å; V384-A386 PolarHBondContact O-N 3.03Å; V384-I387 WeakPolarHBondContact O-CB 3.34Å; V384-I387 PolarHBondContact O-N 2.76Å
385	D	89.6	Confident	90.3	Very high	13 Å²	13	43 Å²	43	7%	0.07	23%	0.23	C	C	.	.	H	α-helix	trans	-58.6	-39.7	178	-39.8	-23.1	0	0	0	110.9	T175 R178 V382 I387 A388 I389	T175-D385 WeakPolarHBondContact CB-OD2 3.12Å; T175-D385 WeakPolarHBondContact CG2-OD2 3.19Å; T175-D385 WeakPolarHBondContact OG1-CB 3.39Å; T175-D385 VanDerWaalsContact OG1-CG 3.29Å; T175-D385 PolarHBondContact OG1-OD2 3.24Å; R178-D385 IonicContact CZ-OD1 2.64Å; R178-D385 IonicContact CZ-OD2 3.62Å; R178-D385 VanDerWaalsContact NH1-CG 3.28Å; R178-D385 IonicContact NH1-OD1 3.87Å; R178-D385 PolarHBondContact NH1-OD1 2.72Å; R178-D385 IonicContact NH1-OD2 3.71Å; R178-D385 PolarHBondContact NH1-OD2 2.69Å; R178-D385 IonicContact NH2-OD1 2.87Å; R178-D385 IonicContact NH2-OD2 2.74Å; R178-D385 PolarHBondContact NH2-OD2 2.72Å; V382-D385 PolarHBondContact O-N 2.93Å; D385-I387 PolarHBondContact O-N 3.11Å; D385-A388 PolarHBondContact O-N 3.09Å; D385-I389 WeakPolarHBondContact O-CG1 3.47Å; D385-I389 PolarHBondContact O-N 3.35Å
386	A	93.9	Very high	90.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.8	-28.4	177.1	0	0	0	0	0	113.1	M228 A229 Y232 V382 V384 S390	M228-A386 HydrophobicContact CB-CB 3.82Å; M228-A386 HydrophobicContact CG-CB 3.84Å; A229-A386 HydrophobicContact CB-CB 4.26Å; Y232-A386 HydrophobicContact CD2-CB 4.15Å; Y232-A386 HydrophobicContact CE2-CB 3.81Å; V382-A386 VanDerWaalsContact O-CB 3.29Å; V382-A386 WeakPolarHBondContact O-CB 3.5Å; V382-A386 PolarHBondContact O-N 2.91Å; V384-A386 PolarHBondContact O-N 3.03Å; A386-S390 WeakPolarHBondContact O-CB 3.44Å; A386-S390 PolarHBondContact O-N 2.96Å; A386-S390 PolarHBondContact O-OG 3.41Å
387	I	90.8	Very high	90.5	Very high	80 Å²	80	33.2 Å²	33.2	41%	0.41	19%	0.191	S	C	.	.	H	α-helix	trans	-66.2	-50.6	172.3	-63.6	167.7	0	0	0	110.2	Y232 A383 V384 D385 I389 S390 I391	Y232-I387 HydrophobicContact CD2-CG1 3.84Å; Y232-I387 HydrophobicContact CE2-CB 4.48Å; Y232-I387 HydrophobicContact CE2-CD1 4.48Å; Y232-I387 HydrophobicContact CE2-CG1 3.48Å; Y232-I387 VanDerWaalsContact CE2-CG1 3.48Å; A383-I387 WeakPolarHBondContact O-CG1 3.29Å; A383-I387 PolarHBondContact O-N 2.87Å; V384-I387 WeakPolarHBondContact O-CB 3.34Å; V384-I387 PolarHBondContact O-N 2.76Å; D385-I387 PolarHBondContact O-N 3.11Å; I387-I389 VanDerWaalsContact C-N 3.35Å; I387-I389 PolarHBondContact O-N 3.24Å; I387-S390 PolarHBondContact O-N 3.15Å; I387-S390 PolarHBondContact O-OG 2.91Å; I387-I391 HydrophobicContact CG2-CD1 3.86Å; I387-I391 WeakPolarHBondContact O-CG1 3.46Å; I387-I391 PolarHBondContact O-N 3.48Å
388	A	87.6	Confident	90.6	Very high	24 Å²	24	26.4 Å²	26.4	20%	0.198	15%	0.154	C	C	.	.	H	α-helix	trans	-59.9	-45.8	179	0	0	0	0	0	111.5	M171 D385 S390 I391 I392 E528	M171-A388 HydrophobicContact CE-CB 3.96Å; D385-A388 PolarHBondContact O-N 3.09Å; A388-S390 PolarHBondContact O-N 3.3Å; A388-I391 PolarHBondContact O-N 3.2Å; A388-I392 WeakPolarHBondContact O-CB 3.25Å; A388-I392 WeakPolarHBondContact O-CG1 3.37Å; A388-I392 PolarHBondContact O-N 3.42Å; A388-E528 HydrophobicContact CB-CB 4.26Å
389	I	92.4	Very high	90.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-59.8	-43	175.5	-69	172.4	0	0	0	111.3	L168 M171 I172 V225 A229 D385 I387 G393 T435	L168-I389 HydrophobicContact CD2-CG2 4.28Å; M171-I389 HydrophobicContact CB-CD1 4.19Å; M171-I389 HydrophobicContact CB-CG1 4.01Å; M171-I389 HydrophobicContact CE-CB 4.28Å; M171-I389 HydrophobicContact CE-CG1 3.47Å; M171-I389 VanDerWaalsContact CE-CG1 3.47Å; M171-I389 HydrophobicContact SD-CG1 4.35Å; I172-I389 HydrophobicContact CG1-CD1 4.15Å; V225-I389 HydrophobicContact CG1-CD1 3.38Å; A229-I389 HydrophobicContact CB-CB 4.23Å; A229-I389 HydrophobicContact CB-CG2 3.67Å; D385-I389 WeakPolarHBondContact O-CG1 3.47Å; D385-I389 PolarHBondContact O-N 3.35Å; I387-I389 VanDerWaalsContact C-N 3.35Å; I387-I389 PolarHBondContact O-N 3.24Å; I389-G393 PolarHBondContact O-N 2.94Å; I389-T435 HydrophobicContact CG2-CG2 3.64Å
390	S	93.1	Very high	90.4	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.007	15%	0.152	C	C	.	.	H	α-helix	trans	-62.3	-45.1	179.3	77	0	0	0	0	112.1	A229 Q233 M236 A386 I387 A388 F394	A229-S390 VanDerWaalsContact O-CB 3.27Å; A229-S390 WeakPolarHBondContact O-CB 3.31Å; Q233-S390 PolarHBondContact NE2-O 3.34Å; M236-S390 WeakPolarHBondContact CE-OG 3.18Å; A386-S390 WeakPolarHBondContact O-CB 3.44Å; A386-S390 PolarHBondContact O-N 2.96Å; A386-S390 PolarHBondContact O-OG 3.41Å; I387-S390 PolarHBondContact O-N 3.15Å; I387-S390 PolarHBondContact O-OG 2.91Å; A388-S390 PolarHBondContact O-N 3.3Å; S390-F394 WeakPolarHBondContact O-CB 3.45Å; S390-F394 PolarHBondContact O-N 2.92Å; S390-F394 VanDerWaalsContact O-N 3.12Å
391	I	88.6	Confident	90.4	Very high	66 Å²	66	21.2 Å²	21.2	34%	0.338	12%	0.123	S	C	.	.	H	α-helix	trans	-69	-46.4	-179.6	-66	169.1	0	0	0	110.3	M236 I387 A388 F394 A395	M236-I391 HydrophobicContact CE-CG1 4.32Å; M236-I391 HydrophobicContact SD-CG1 4.37Å; I387-I391 HydrophobicContact CG2-CD1 3.86Å; I387-I391 WeakPolarHBondContact O-CG1 3.46Å; I387-I391 PolarHBondContact O-N 3.48Å; A388-I391 PolarHBondContact O-N 3.2Å; I391-F394 PolarHBondContact O-N 3.37Å; I391-A395 WeakPolarHBondContact O-CB 3.39Å; I391-A395 PolarHBondContact O-N 2.87Å
392	I	87.4	Confident	90.3	Very high	4 Å²	4	20.3 Å²	20.3	2%	0.021	12%	0.116	C	C	.	.	H	α-helix	trans	-65	-42.6	179.9	-73.9	163.6	0	0	0	111.5	L168 M171 F256 A388 A395 I396 L531	L168-I392 HydrophobicContact CD2-CB 4.1Å; L168-I392 HydrophobicContact CD2-CG2 3.61Å; M171-I392 HydrophobicContact CE-CD1 3.39Å; M171-I392 HydrophobicContact CE-CG1 4.46Å; M171-I392 HydrophobicContact SD-CD1 3.75Å; M171-I392 HydrophobicContact SD-CG2 4.31Å; F256-I392 HydrophobicContact CE1-CG2 4.09Å; F256-I392 HydrophobicContact CZ-CD1 4.05Å; F256-I392 HydrophobicContact CZ-CG1 4.21Å; F256-I392 HydrophobicContact CZ-CG2 3.97Å; A388-I392 WeakPolarHBondContact O-CB 3.25Å; A388-I392 WeakPolarHBondContact O-CG1 3.37Å; A388-I392 PolarHBondContact O-N 3.42Å; I392-A395 PolarHBondContact O-N 2.84Å; I392-I396 HydrophobicContact CG2-CD1 3.71Å; I392-I396 WeakPolarHBondContact O-CD1 3.19Å; I392-I396 WeakPolarHBondContact O-CG1 3.31Å; I392-I396 PolarHBondContact O-N 2.87Å; I392-I396 VanDerWaalsContact O-N 3.13Å; I392-L531 HydrophobicContact CD1-CD2 3.96Å; I392-L531 HydrophobicContact CG1-CD2 3.36Å
393	G	91.3	Very high	90	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.4	-43.4	176.4	0	0	0	0	0	112.8	I389 T397 S437	I389-G393 PolarHBondContact O-N 2.94Å; G393-T397 VanDerWaalsContact O-CB 3.3Å; G393-T397 WeakPolarHBondContact O-CB 3.45Å; G393-T397 PolarHBondContact O-N 3.33Å; G393-T397 PolarHBondContact O-OG1 3.37Å; G393-S437 PolarHBondContact O-OG 3.16Å
394	F	91.4	Very high	89.9	Confident	7 Å²	7	23.7 Å²	23.7	3%	0.031	13%	0.13	C	C	.	.	H	α-helix	trans	-67	-51.3	174.3	168.8	-118.7	0	0	0	111.9	S390 I391 I396 T397 V398 A414 M418	S390-F394 WeakPolarHBondContact O-CB 3.45Å; S390-F394 PolarHBondContact O-N 2.92Å; S390-F394 VanDerWaalsContact O-N 3.12Å; I391-F394 PolarHBondContact O-N 3.37Å; F394-I396 PolarHBondContact O-N 3.15Å; F394-T397 PolarHBondContact O-N 2.94Å; F394-V398 HydrophobicContact CD2-CB 4.26Å; F394-V398 HydrophobicContact CD2-CG1 4.35Å; F394-V398 HydrophobicContact CE1-CG1 4.21Å; F394-V398 HydrophobicContact CE2-CB 3.69Å; F394-V398 HydrophobicContact CE2-CG1 3.89Å; F394-V398 HydrophobicContact CE2-CG2 4.15Å; F394-V398 HydrophobicContact CZ-CB 4.03Å; F394-V398 HydrophobicContact CZ-CG1 3.82Å; F394-V398 HydrophobicContact CZ-CG2 4.26Å; F394-V398 WeakPolarHBondContact O-CG1 3.01Å; F394-V398 PolarHBondContact O-N 3.13Å; F394-A414 WeakPolarHBondContact CE2-O 3.49Å; F394-A414 HydrophobicContact CZ-CB 4.36Å; F394-M418 HydrophobicContact CB-SD 4.41Å; F394-M418 HydrophobicContact CD1-SD 3.78Å; F394-M418 HydrophobicContact CD2-CB 3.72Å; F394-M418 HydrophobicContact CD2-CG 4.1Å; F394-M418 HydrophobicContact CD2-SD 3.87Å; F394-M418 HydrophobicContact CE1-CE 4.18Å; F394-M418 HydrophobicContact CE1-SD 3.97Å; F394-M418 HydrophobicContact CE2-CB 3.69Å; F394-M418 HydrophobicContact CE2-CE 4.39Å; F394-M418 HydrophobicContact CE2-CG 4.37Å; F394-M418 HydrophobicContact CE2-SD 4.06Å; F394-M418 HydrophobicContact CG-CG 4.43Å; F394-M418 HydrophobicContact CG-SD 3.73Å; F394-M418 HydrophobicContact CZ-CB 4.45Å; F394-M418 HydrophobicContact CZ-CE 4.09Å; F394-M418 HydrophobicContact CZ-SD 4.11Å
395	A	88.1	Confident	90	Very high	4 Å²	4	18.7 Å²	18.7	3%	0.033	10%	0.1	C	C	.	.	H	α-helix	trans	-49.8	-53.7	-178.4	0	0	0	0	0	112.8	L248 I391 I392 T397 V398 S399	L248-A395 HydrophobicContact CD1-CB 3.44Å; L248-A395 VanDerWaalsContact CD1-CB 3.44Å; I391-A395 WeakPolarHBondContact O-CB 3.39Å; I391-A395 PolarHBondContact O-N 2.87Å; I392-A395 PolarHBondContact O-N 2.84Å; A395-T397 VanDerWaalsContact C-N 3.34Å; A395-T397 PolarHBondContact O-N 3.48Å; A395-V398 WeakPolarHBondContact O-CG1 3.41Å; A395-S399 WeakPolarHBondContact O-CB 3.39Å; A395-S399 PolarHBondContact O-N 3.45Å; A395-S399 PolarHBondContact O-OG 3Å; A395-S399 VanDerWaalsContact O-OG 3.13Å
396	I	88	Confident	89.9	Confident	13 Å²	13	25.2 Å²	25.2	7%	0.067	13%	0.127	C	C	.	.	H	α-helix	trans	-64	-42.5	179.7	-63.2	162.6	0	0	0	110.4	F165 L253 F256 I392 F394 L400 A438	F165-I396 HydrophobicContact CD1-CD1 3.85Å; F165-I396 HydrophobicContact CE1-CD1 3.48Å; F165-I396 VanDerWaalsContact CE1-CD1 3.48Å; F165-I396 HydrophobicContact CZ-CD1 4.37Å; L253-I396 HydrophobicContact CD1-CG1 4.25Å; F256-I396 HydrophobicContact CE1-CD1 4.33Å; I392-I396 HydrophobicContact CG2-CD1 3.71Å; I392-I396 WeakPolarHBondContact O-CD1 3.19Å; I392-I396 WeakPolarHBondContact O-CG1 3.31Å; I392-I396 PolarHBondContact O-N 2.87Å; I392-I396 VanDerWaalsContact O-N 3.13Å; F394-I396 PolarHBondContact O-N 3.15Å; I396-L400 WeakPolarHBondContact O-CB 3.41Å; I396-L400 PolarHBondContact O-N 2.96Å; I396-A438 WeakPolarHBondContact CG2-O 3.35Å
397	T	92.3	Very high	89.7	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-66.2	-42.9	-177.1	-60.4	0	0	0	0	112.2	I160 G393 F394 A395 S401 I421 S437 A438	I160-T397 HydrophobicContact CD1-CG2 4.06Å; G393-T397 VanDerWaalsContact O-CB 3.3Å; G393-T397 WeakPolarHBondContact O-CB 3.45Å; G393-T397 PolarHBondContact O-N 3.33Å; G393-T397 PolarHBondContact O-OG1 3.37Å; F394-T397 PolarHBondContact O-N 2.94Å; A395-T397 VanDerWaalsContact C-N 3.34Å; A395-T397 PolarHBondContact O-N 3.48Å; T397-S401 WeakPolarHBondContact O-CB 3.46Å; T397-S401 PolarHBondContact O-N 3.44Å; T397-S401 PolarHBondContact O-OG 3.26Å; T397-I421 HydrophobicContact CG2-CB 4.46Å; T397-S437 PolarHBondContact OG1-OG 3.32Å; T397-A438 HydrophobicContact CG2-CB 4.21Å; T397-A438 PolarHBondContact OG1-N 2.89Å
398	V	91.5	Very high	89.7	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-72.9	-45.4	179	69.8	0	0	0	0	112	F394 A395 L400 S401 E402 A414	F394-V398 HydrophobicContact CD2-CB 4.26Å; F394-V398 HydrophobicContact CD2-CG1 4.35Å; F394-V398 HydrophobicContact CE1-CG1 4.21Å; F394-V398 HydrophobicContact CE2-CB 3.69Å; F394-V398 HydrophobicContact CE2-CG1 3.89Å; F394-V398 HydrophobicContact CE2-CG2 4.15Å; F394-V398 HydrophobicContact CZ-CB 4.03Å; F394-V398 HydrophobicContact CZ-CG1 3.82Å; F394-V398 HydrophobicContact CZ-CG2 4.26Å; F394-V398 WeakPolarHBondContact O-CG1 3.01Å; F394-V398 PolarHBondContact O-N 3.13Å; A395-V398 WeakPolarHBondContact O-CG1 3.41Å; V398-L400 PolarHBondContact O-N 3.46Å; V398-S401 WeakPolarHBondContact O-CB 3.3Å; V398-S401 PolarHBondContact O-N 3.44Å; V398-E402 PolarHBondContact O-N 3.35Å; V398-A414 HydrophobicContact CG2-CB 3.77Å
399	S	87.4	Confident	89.8	Confident	15 Å²	15	33.5 Å²	33.5	11%	0.105	18%	0.18	C	C	.	.	H	α-helix	trans	-64.6	-39.7	179.1	-61.9	0	0	0	0	112.1	A395 M403	A395-S399 WeakPolarHBondContact O-CB 3.39Å; A395-S399 PolarHBondContact O-N 3.45Å; A395-S399 PolarHBondContact O-OG 3Å; A395-S399 VanDerWaalsContact O-OG 3.13Å; S399-M403 WeakPolarHBondContact O-CB 3.44Å; S399-M403 PolarHBondContact O-N 3.1Å
400	L	88.6	Confident	89.8	Confident	11 Å²	11	34.7 Å²	34.7	6%	0.058	18%	0.184	C	C	.	.	H	α-helix	trans	-66.1	-42	173.5	-163.8	72.7	0	0	0	111.1	I160 I396 V398 M403 F404 A438 L440 T443	I160-L400 HydrophobicContact CG2-CD2 4.27Å; I160-L400 HydrophobicContact CG2-CG 4.34Å; I396-L400 WeakPolarHBondContact O-CB 3.41Å; I396-L400 PolarHBondContact O-N 2.96Å; V398-L400 PolarHBondContact O-N 3.46Å; L400-M403 WeakPolarHBondContact O-CB 3.18Å; L400-M403 PolarHBondContact O-N 3.17Å; L400-F404 HydrophobicContact CD1-CD2 4.31Å; L400-F404 HydrophobicContact CD1-CE2 3.78Å; L400-F404 HydrophobicContact CG-CD2 4.14Å; L400-F404 HydrophobicContact CG-CE2 4.03Å; L400-F404 WeakPolarHBondContact O-CD2 3.46Å; L400-F404 PolarHBondContact O-N 3.01Å; L400-F404 VanDerWaalsContact O-N 3.16Å; L400-A438 HydrophobicContact CB-CB 4.49Å; L400-A438 HydrophobicContact CD2-CB 3.69Å; L400-L440 HydrophobicContact CD1-CB 4.06Å; L400-L440 HydrophobicContact CD1-CD1 3.66Å; L400-L440 HydrophobicContact CD1-CG 4.44Å; L400-T443 HydrophobicContact CD2-CG2 4.25Å
401	S	91.5	Very high	89.6	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.1	-46.4	177.2	-68.3	0	0	0	0	112.1	S157 T397 V398 M403 F404 A405	S157-S401 WeakPolarHBondContact CB-OG 3.47Å; T397-S401 WeakPolarHBondContact O-CB 3.46Å; T397-S401 PolarHBondContact O-N 3.44Å; T397-S401 PolarHBondContact O-OG 3.26Å; V398-S401 WeakPolarHBondContact O-CB 3.3Å; V398-S401 PolarHBondContact O-N 3.44Å; S401-M403 PolarHBondContact O-N 3.32Å; S401-F404 PolarHBondContact O-N 3.01Å; S401-A405 VanDerWaalsContact O-CB 3.22Å; S401-A405 WeakPolarHBondContact O-CB 3.29Å; S401-A405 PolarHBondContact O-N 3.02Å
402	E	88.9	Confident	89.7	Confident	59 Å²	59	39 Å²	39	28%	0.276	21%	0.214	S	C	.	.	H	α-helix	trans	-62.4	-38.8	174.8	-79.6	-168.3	-144	0	0	112.8	V398 A405 K406	V398-E402 PolarHBondContact O-N 3.35Å; E402-A405 PolarHBondContact O-N 3.1Å; E402-K406 WeakPolarHBondContact O-CB 3.4Å; E402-K406 WeakPolarHBondContact O-CD 3.45Å; E402-K406 WeakPolarHBondContact O-CG 3.43Å; E402-K406 PolarHBondContact O-N 3.02Å; E402-K406 WeakPolarHBondContact OE2-CE 3.4Å; E402-K406 IonicContact OE2-NZ 2.74Å; E402-K406 PolarHBondContact OE2-NZ 3.43Å
403	M	86	Confident	89.9	Confident	87 Å²	87	43.9 Å²	43.9	43%	0.429	23%	0.232	S	C	.	.	H	α-helix	trans	-58.9	-48.6	177.6	-175.2	-173.2	-60.3	0	0	111.6	S399 L400 S401 K407	S399-M403 WeakPolarHBondContact O-CB 3.44Å; S399-M403 PolarHBondContact O-N 3.1Å; L400-M403 WeakPolarHBondContact O-CB 3.18Å; L400-M403 PolarHBondContact O-N 3.17Å; S401-M403 PolarHBondContact O-N 3.32Å; M403-K407 VanDerWaalsContact O-CB 3.31Å; M403-K407 WeakPolarHBondContact O-CB 3.41Å; M403-K407 PolarHBondContact O-N 3.47Å; M403-K407 VanDerWaalsContact O-N 3.1Å
404	F	89.3	Confident	89.9	Confident	5 Å²	5	44.9 Å²	44.9	2%	0.022	24%	0.24	C	C	.	.	H	α-helix	trans	-75.7	-27.2	177.5	-73	-81	0	0	0	113.2	H159 L400 S401 H408 L440 T443 E447	H159-F404 HydrophobicContact CB-CB 4.31Å; H159-F404 HydrophobicContact CB-CD1 4.39Å; H159-F404 HydrophobicContact CB-CG 4.4Å; L400-F404 HydrophobicContact CD1-CD2 4.31Å; L400-F404 HydrophobicContact CD1-CE2 3.78Å; L400-F404 HydrophobicContact CG-CD2 4.14Å; L400-F404 HydrophobicContact CG-CE2 4.03Å; L400-F404 WeakPolarHBondContact O-CD2 3.46Å; L400-F404 PolarHBondContact O-N 3.01Å; L400-F404 VanDerWaalsContact O-N 3.16Å; S401-F404 PolarHBondContact O-N 3.01Å; F404-H408 WeakPolarHBondContact O-CB 3.45Å; F404-H408 PolarHBondContact O-CD2 3.18Å; F404-H408 VanDerWaalsContact O-CD2 3.3Å; F404-H408 PolarHBondContact O-N 2.92Å; F404-H408 VanDerWaalsContact O-N 3.11Å; F404-L440 HydrophobicContact CE2-CD1 4.47Å; F404-T443 HydrophobicContact CD1-CG2 4.5Å; F404-T443 HydrophobicContact CD2-CG2 3.62Å; F404-T443 HydrophobicContact CE1-CG2 4.21Å; F404-T443 HydrophobicContact CE2-CG2 3.3Å; F404-T443 HydrophobicContact CG-CG2 4.24Å; F404-T443 HydrophobicContact CZ-CG2 3.64Å; F404-E447 WeakPolarHBondContact CD1-OE1 3.21Å; F404-E447 HydrophobicContact CE1-CB 4.15Å; F404-E447 HydrophobicContact CE1-CG 4.34Å; F404-E447 WeakPolarHBondContact CE1-OE1 3.32Å
405	A	91.5	Very high	89.9	Confident	4 Å²	4	46.7 Å²	46.7	3%	0.033	25%	0.25	C	S	.	.	H	α-helix	trans	-64.8	-50.9	172.7	0	0	0	0	0	111.6	S401 E402 K407 H408 G409 Y410 V412	S401-A405 VanDerWaalsContact O-CB 3.22Å; S401-A405 WeakPolarHBondContact O-CB 3.29Å; S401-A405 PolarHBondContact O-N 3.02Å; E402-A405 PolarHBondContact O-N 3.1Å; A405-K407 VanDerWaalsContact C-N 3.32Å; A405-K407 PolarHBondContact O-N 3.4Å; A405-H408 CarbonylContact O-C 3.6Å; A405-H408 PolarHBondContact O-N 3.42Å; A405-G409 PolarHBondContact O-N 3.17Å; A405-Y410 CarbonylContact C-O 3.56Å; A405-Y410 HydrophobicContact CB-CD2 3.67Å; A405-Y410 HydrophobicContact CB-CE2 3.59Å; A405-Y410 HydrophobicContact CB-CG 4.27Å; A405-Y410 WeakPolarHBondContact CB-O 3.36Å; A405-Y410 PolarHBondContact O-N 3.19Å; A405-V412 HydrophobicContact CB-CB 4.25Å; A405-V412 HydrophobicContact CB-CG2 3.66Å
406	K	89.2	Confident	90.2	Very high	149 Å²	149	46.9 Å²	46.9	65%	0.648	25%	0.25	S	S	*	.	H	α-helix	trans	-59.3	-40.8	175.2	-69.1	163.2	-169.8	166.7	0	111.6	E402 H408	E402-K406 WeakPolarHBondContact O-CB 3.4Å; E402-K406 WeakPolarHBondContact O-CD 3.45Å; E402-K406 WeakPolarHBondContact O-CG 3.43Å; E402-K406 PolarHBondContact O-N 3.02Å; E402-K406 WeakPolarHBondContact OE2-CE 3.4Å; E402-K406 IonicContact OE2-NZ 2.74Å; E402-K406 PolarHBondContact OE2-NZ 3.43Å; K406-H408 PolarHBondContact O-N 3.09Å
407	K	89.3	Confident	90.4	Very high	126 Å²	126	46.3 Å²	46.3	55%	0.548	25%	0.247	S	C	.	.	H	α-helix	trans	-68.2	-30.1	179.4	-175.3	176	177.3	-171	0	114.4	M403 A405 E447	M403-K407 VanDerWaalsContact O-CB 3.31Å; M403-K407 WeakPolarHBondContact O-CB 3.41Å; M403-K407 PolarHBondContact O-N 3.47Å; M403-K407 VanDerWaalsContact O-N 3.1Å; A405-K407 VanDerWaalsContact C-N 3.32Å; A405-K407 PolarHBondContact O-N 3.4Å; K407-E447 VanDerWaalsContact CD-OE1 3.3Å; K407-E447 WeakPolarHBondContact CD-OE1 3.41Å; K407-E447 WeakPolarHBondContact CE-OE1 3.37Å; K407-E447 IonicContact NZ-OE1 2.72Å; K407-E447 PolarHBondContact NZ-OE1 2.97Å; K407-E447 IonicContact NZ-OE2 2.69Å; K407-E447 PolarHBondContact NZ-OE2 3.3Å
408	H	89.8	Confident	90.5	Very high	74 Å²	74	46.3 Å²	46.3	34%	0.343	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	16.8	-175.5	-70.6	-96.3	0	0	0	113.7	H159 F404 A405 K406 Y410 E447	H159-H408 AromaticContact CE1-CD2 3.63Å; H159-H408 AromaticContact CE1-CE1 3.73Å; H159-H408 AromaticContact CE1-CG 3.36Å; H159-H408 AromaticContact CE1-ND1 3.44Å; H159-H408 PolarHBondContact CE1-ND1 2.76Å; H159-H408 AromaticContact CE1-NE2 3.85Å; H159-H408 AromaticContact ND1-CD2 3.48Å; H159-H408 PolarHBondContact ND1-CD2 3.09Å; H159-H408 AromaticContact ND1-CG 3.69Å; H159-H408 AromaticContact ND1-NE2 3.78Å; F404-H408 WeakPolarHBondContact O-CB 3.45Å; F404-H408 PolarHBondContact O-CD2 3.18Å; F404-H408 VanDerWaalsContact O-CD2 3.3Å; F404-H408 PolarHBondContact O-N 2.92Å; F404-H408 VanDerWaalsContact O-N 3.11Å; A405-H408 CarbonylContact O-C 3.6Å; A405-H408 PolarHBondContact O-N 3.42Å; K406-H408 PolarHBondContact O-N 3.09Å; H408-Y410 VanDerWaalsContact C-N 3.35Å; H408-Y410 HydrophobicContact CB-CD1 3.74Å; H408-Y410 HydrophobicContact CB-CE1 3.67Å; H408-Y410 PolarHBondContact O-N 3.35Å; H408-E447 IonicContact CD2-OE1 3.03Å; H408-E447 IonicContact CE1-OE1 3.36Å; H408-E447 IonicContact NE2-OE1 3.46Å; H408-E447 PolarHBondContact NE2-OE1 3.23Å
409	G	90.3	Very high	90.7	Very high	79 Å²	79	48.4 Å²	48.4	81%	0.814	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	29.1	173.3	0	0	0	0	0	115.5	A405	A405-G409 PolarHBondContact O-N 3.17Å
410	Y	91.4	Very high	91.1	Very high	25 Å²	25	47.7 Å²	47.7	10%	0.098	25%	0.25	C	S	.	.			trans	-119.1	171.7	172.5	66.9	-94.4	0	0	0	112.3	S157 R158 H159 A405 H408 V412	S157-Y410 PolarHBondContact OG-OH 2.95Å; R158-Y410 HydrophobicContact CB-CE1 4.49Å; R158-Y410 PolarHBondContact N-OH 3.02Å; H159-Y410 AromaticContact CE1-CE1 3.73Å; H159-Y410 AromaticContact ND1-CE1 3.63Å; H159-Y410 PolarHBondContact ND1-OH 3.37Å; A405-Y410 CarbonylContact C-O 3.56Å; A405-Y410 HydrophobicContact CB-CD2 3.67Å; A405-Y410 HydrophobicContact CB-CE2 3.59Å; A405-Y410 HydrophobicContact CB-CG 4.27Å; A405-Y410 WeakPolarHBondContact CB-O 3.36Å; A405-Y410 PolarHBondContact O-N 3.19Å; H408-Y410 VanDerWaalsContact C-N 3.35Å; H408-Y410 HydrophobicContact CB-CD1 3.74Å; H408-Y410 HydrophobicContact CB-CE1 3.67Å; H408-Y410 PolarHBondContact O-N 3.35Å; Y410-V412 HydrophobicContact CD2-CG2 4.25Å; Y410-V412 HydrophobicContact CE2-CG2 3.86Å
411	T	89.9	Confident	91.4	Very high	129 Å²	129	47.1 Å²	47.1	79%	0.791	25%	0.248	S	C	*	.			trans	-112.3	148.7	178.9	54.7	0	0	0	0	111.4
412	V	91.3	Very high	91.7	Very high	28 Å²	28	47.1 Å²	47.1	17%	0.17	25%	0.248	C	C	.	.			trans	-121.6	145.7	178.5	157.1	0	0	0	0	108.5	A405 Y410 E417	A405-V412 HydrophobicContact CB-CB 4.25Å; A405-V412 HydrophobicContact CB-CG2 3.66Å; Y410-V412 HydrophobicContact CD2-CG2 4.25Å; Y410-V412 HydrophobicContact CE2-CG2 3.86Å; V412-E417 HydrophobicContact CG1-CG 3.61Å
413	R	90.3	Very high	92.1	Very high	106 Å²	106	46.9 Å²	46.9	40%	0.4	25%	0.246	S	C	.	.			trans	-107.5	105.2	178	-72.8	-176.7	-74.9	122.9	-2.7	109.9	G91 T156 N415 Q416 E417	G91-R413 VanDerWaalsContact O-CZ 3.28Å; G91-R413 PolarHBondContact O-NH1 3.33Å; G91-R413 PolarHBondContact O-NH2 2.82Å; T156-R413 HydrophobicContact CG2-CB 4.44Å; T156-R413 PolarHBondContact OG1-N 3.41Å; R413-N415 VanDerWaalsContact C-N 3.34Å; R413-N415 PolarHBondContact O-N 3.26Å; R413-Q416 HydrophobicContact CB-CB 3.87Å; R413-Q416 WeakPolarHBondContact O-CA 3.42Å; R413-Q416 WeakPolarHBondContact O-CB 3.16Å; R413-Q416 PolarHBondContact O-N 2.77Å; R413-E417 PolarHBondContact O-N 3.46Å
414	A	91.7	Very high	92.6	Very high	21 Å²	21	42.7 Å²	42.7	17%	0.174	23%	0.225	C	C	.	.	H	α-helix	trans	-49.3	-48.2	-177.6	0	0	0	0	0	113.7	F394 V398 Q416 E417 M418	F394-A414 WeakPolarHBondContact CE2-O 3.49Å; F394-A414 HydrophobicContact CZ-CB 4.36Å; V398-A414 HydrophobicContact CG2-CB 3.77Å; A414-Q416 VanDerWaalsContact C-N 3.26Å; A414-Q416 PolarHBondContact O-N 3.36Å; A414-E417 PolarHBondContact O-N 2.98Å; A414-M418 WeakPolarHBondContact O-CB 3.46Å; A414-M418 PolarHBondContact O-N 3.06Å
415	N	92.3	Very high	92.9	Very high	46 Å²	46	42.5 Å²	42.5	25%	0.246	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-29	176.5	-70.3	-26.9	0	0	0	113.4	Q240 G242 R413 Y419	Q240-N415 WeakPolarHBondContact CB-ND2 3.47Å; G242-N415 WeakPolarHBondContact CA-OD1 3.35Å; G242-N415 PolarHBondContact N-OD1 3.07Å; R413-N415 VanDerWaalsContact C-N 3.34Å; R413-N415 PolarHBondContact O-N 3.26Å; N415-Y419 WeakPolarHBondContact O-CD2 3.24Å; N415-Y419 PolarHBondContact O-N 3.49Å; N415-Y419 VanDerWaalsContact O-N 3.15Å
416	Q	92.8	Very high	93.2	Very high	8 Å²	8	43.6 Å²	43.6	4%	0.037	23%	0.229	C	C	.	.	H	α-helix	trans	-78.7	-38.6	176.2	-174.9	62.4	32.9	0	0	111.9	G91 F92 P94 L154 T156 R413 A414 M418 Y419 A420	G91-Q416 PolarHBondContact O-OE1 3.13Å; F92-Q416 PolarHBondContact O-NE2 3.36Å; P94-Q416 HydrophobicContact CG-CG 4.16Å; L154-Q416 PolarHBondContact O-NE2 3.28Å; T156-Q416 HydrophobicContact CG2-CB 3.82Å; T156-Q416 HydrophobicContact CG2-CG 3.44Å; T156-Q416 VanDerWaalsContact CG2-CG 3.44Å; R413-Q416 HydrophobicContact CB-CB 3.87Å; R413-Q416 WeakPolarHBondContact O-CA 3.42Å; R413-Q416 WeakPolarHBondContact O-CB 3.16Å; R413-Q416 PolarHBondContact O-N 2.77Å; A414-Q416 VanDerWaalsContact C-N 3.26Å; A414-Q416 PolarHBondContact O-N 3.36Å; Q416-M418 PolarHBondContact O-N 3.12Å; Q416-Y419 PolarHBondContact O-N 3.4Å; Q416-A420 WeakPolarHBondContact O-CB 3.09Å; Q416-A420 PolarHBondContact O-N 3.02Å
417	E	93.9	Very high	93.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.4	-37.5	169.8	-64.2	-57.4	138.2	0	0	111.1	Y151 T156 S157 V412 R413 A414 A420 I421	Y151-E417 VanDerWaalsContact CE2-OE2 3.24Å; Y151-E417 WeakPolarHBondContact CE2-OE2 3.41Å; Y151-E417 VanDerWaalsContact OH-CD 3.27Å; Y151-E417 PolarHBondContact OH-OE1 3.31Å; Y151-E417 PolarHBondContact OH-OE2 3.13Å; T156-E417 VanDerWaalsContact CA-OE1 3.28Å; T156-E417 WeakPolarHBondContact CA-OE1 3.44Å; T156-E417 WeakPolarHBondContact CB-OE1 3.16Å; T156-E417 PolarHBondContact N-OE1 2.87Å; T156-E417 PolarHBondContact OG1-OE1 3.04Å; S157-E417 PolarHBondContact N-OE1 3.12Å; S157-E417 VanDerWaalsContact N-OE1 3.07Å; V412-E417 HydrophobicContact CG1-CG 3.61Å; R413-E417 PolarHBondContact O-N 3.46Å; A414-E417 PolarHBondContact O-N 2.98Å; E417-A420 PolarHBondContact O-N 3.32Å; E417-I421 WeakPolarHBondContact O-CG2 3.43Å; E417-I421 PolarHBondContact O-N 3.46Å
418	M	93.8	Very high	93.9	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-63.7	-43.6	175.5	-173.4	134.2	59.7	0	0	112.9	Q233 M236 V241 F394 A414 Q416 G422	Q233-M418 WeakPolarHBondContact O-CG 3.44Å; M236-M418 HydrophobicContact CB-CE 3.84Å; M236-M418 HydrophobicContact CB-CG 4.45Å; M236-M418 HydrophobicContact CB-SD 3.5Å; M236-M418 WeakPolarHBondContact CB-SD 3.43Å; M236-M418 HydrophobicContact CE-SD 4.46Å; V241-M418 HydrophobicContact CB-CE 4.33Å; F394-M418 HydrophobicContact CB-SD 4.41Å; F394-M418 HydrophobicContact CD1-SD 3.78Å; F394-M418 HydrophobicContact CD2-CB 3.72Å; F394-M418 HydrophobicContact CD2-CG 4.1Å; F394-M418 HydrophobicContact CD2-SD 3.87Å; F394-M418 HydrophobicContact CE1-CE 4.18Å; F394-M418 HydrophobicContact CE1-SD 3.97Å; F394-M418 HydrophobicContact CE2-CB 3.69Å; F394-M418 HydrophobicContact CE2-CE 4.39Å; F394-M418 HydrophobicContact CE2-CG 4.37Å; F394-M418 HydrophobicContact CE2-SD 4.06Å; F394-M418 HydrophobicContact CG-CG 4.43Å; F394-M418 HydrophobicContact CG-SD 3.73Å; F394-M418 HydrophobicContact CZ-CB 4.45Å; F394-M418 HydrophobicContact CZ-CE 4.09Å; F394-M418 HydrophobicContact CZ-SD 4.11Å; A414-M418 WeakPolarHBondContact O-CB 3.46Å; A414-M418 PolarHBondContact O-N 3.06Å; Q416-M418 PolarHBondContact O-N 3.12Å; M418-G422 PolarHBondContact O-N 2.96Å
419	Y	95	Very high	94.2	Very high	43 Å²	43	30.4 Å²	30.4	17%	0.169	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-47.4	169.9	-69.3	-55.8	0	0	0	111.7	F92 V234 G237 L238 N415 Q416 I421 G422 F423	F92-Y419 HydrophobicContact CE2-CD2 4.48Å; F92-Y419 HydrophobicContact CE2-CG 4.28Å; V234-Y419 HydrophobicContact CG1-CD1 4.31Å; V234-Y419 HydrophobicContact CG1-CE1 4.38Å; G237-Y419 VanDerWaalsContact C-CZ 3.45Å; G237-Y419 PolarHBondContact O-OH 3.42Å; G237-Y419 VanDerWaalsContact O-OH 3.09Å; L238-Y419 WeakPolarHBondContact CA-OH 3.5Å; L238-Y419 HydrophobicContact CD2-CE1 4.28Å; L238-Y419 HydrophobicContact CG-CE1 4.22Å; L238-Y419 PolarHBondContact N-OH 2.88Å; N415-Y419 WeakPolarHBondContact O-CD2 3.24Å; N415-Y419 PolarHBondContact O-N 3.49Å; N415-Y419 VanDerWaalsContact O-N 3.15Å; Q416-Y419 PolarHBondContact O-N 3.4Å; Y419-I421 PolarHBondContact O-N 2.87Å; Y419-G422 PolarHBondContact O-N 3.34Å; Y419-F423 WeakPolarHBondContact O-CD2 3.34Å; Y419-F423 PolarHBondContact O-N 2.83Å
420	A	95.6	Very high	94.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-58.6	-47.1	-176.8	0	0	0	0	0	111.9	Y151 L154 Q416 E417 C424	Y151-A420 HydrophobicContact CD2-CB 4.13Å; Y151-A420 HydrophobicContact CE2-CB 4.1Å; L154-A420 HydrophobicContact CB-CB 3.77Å; Q416-A420 WeakPolarHBondContact O-CB 3.09Å; Q416-A420 PolarHBondContact O-N 3.02Å; E417-A420 PolarHBondContact O-N 3.32Å; A420-C424 PolarHBondContact O-N 3.14Å; A420-C424 PolarHBondContact O-SG 2.72Å
421	I	96.3	Very high	94.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-71.1	-35.1	177.4	-161.9	65.4	0	0	0	112.2	V162 Q233 T397 E417 Y419 F423 C424 N425 T436	V162-I421 HydrophobicContact CG1-CD1 3.66Å; Q233-I421 HydrophobicContact CG-CG2 4.26Å; Q233-I421 PolarHBondContact OE1-O 2.86Å; T397-I421 HydrophobicContact CG2-CB 4.46Å; E417-I421 WeakPolarHBondContact O-CG2 3.43Å; E417-I421 PolarHBondContact O-N 3.46Å; Y419-I421 PolarHBondContact O-N 2.87Å; I421-F423 PolarHBondContact O-N 3.49Å; I421-C424 HydrophobicContact CD1-CB 4.26Å; I421-C424 CarbonylContact O-C 3.45Å; I421-C424 WeakPolarHBondContact O-CB 3.5Å; I421-C424 PolarHBondContact O-N 2.67Å; I421-N425 PolarHBondContact O-N 3.46Å; I421-N425 VanDerWaalsContact O-N 3.15Å; I421-N425 PolarHBondContact O-ND2 3.05Å; I421-N425 VanDerWaalsContact O-ND2 3.14Å; I421-T436 WeakPolarHBondContact CD1-OG1 3.32Å
422	G	97	Very high	94.7	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-57.7	-48.2	172.8	0	0	0	0	0	112.5	M418 Y419 N425 I426	M418-G422 PolarHBondContact O-N 2.96Å; Y419-G422 PolarHBondContact O-N 3.34Å; G422-N425 PolarHBondContact O-N 3.28Å; G422-I426 WeakPolarHBondContact O-CG1 3.48Å; G422-I426 PolarHBondContact O-N 3.23Å
423	F	97	Very high	94.9	Very high	53 Å²	53	25.7 Å²	25.7	23%	0.232	12%	0.119	C	C	.	.	H	α-helix	trans	-69.7	-30.4	175.1	-72.7	-66.9	0	0	0	113.4	F92 I150 L154 V234 Y419 I421 N425 I427	F92-F423 HydrophobicContact CE2-CE2 4.01Å; F92-F423 HydrophobicContact CZ-CD2 4.39Å; F92-F423 AromaticContact CZ-CE2 3.65Å; F92-F423 HydrophobicContact CZ-CE2 3.65Å; F92-F423 HydrophobicContact CZ-CZ 4.21Å; I150-F423 HydrophobicContact CG2-CB 4.08Å; L154-F423 HydrophobicContact CD1-CB 3.55Å; L154-F423 HydrophobicContact CD1-CD2 3.8Å; L154-F423 HydrophobicContact CD1-CG 3.92Å; V234-F423 HydrophobicContact CG2-CD2 4.4Å; V234-F423 HydrophobicContact CG2-CE2 4.16Å; V234-F423 HydrophobicContact CG2-CZ 4.21Å; Y419-F423 WeakPolarHBondContact O-CD2 3.34Å; Y419-F423 PolarHBondContact O-N 2.83Å; I421-F423 PolarHBondContact O-N 3.49Å; F423-N425 PolarHBondContact O-N 2.95Å; F423-I427 HydrophobicContact CB-CD1 4.18Å; F423-I427 HydrophobicContact CD1-CD1 4.21Å; F423-I427 HydrophobicContact CD1-CG1 4.41Å; F423-I427 WeakPolarHBondContact O-CB 3.44Å; F423-I427 PolarHBondContact O-N 3.48Å; F423-I427 VanDerWaalsContact O-N 3.09Å
424	C	96.6	Very high	95.1	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-65.4	-9.9	168.9	-67.1	0	0	0	0	113.7	A420 I421 P428 T436	A420-C424 PolarHBondContact O-N 3.14Å; A420-C424 PolarHBondContact O-SG 2.72Å; I421-C424 HydrophobicContact CD1-CB 4.26Å; I421-C424 CarbonylContact O-C 3.45Å; I421-C424 WeakPolarHBondContact O-CB 3.5Å; I421-C424 PolarHBondContact O-N 2.67Å; C424-P428 VanDerWaalsContact O-CD 3.31Å; C424-P428 WeakPolarHBondContact O-CD 3.47Å; C424-P428 VanDerWaalsContact O-CG 3.24Å; C424-P428 WeakPolarHBondContact O-CG 3.3Å; C424-T436 WeakPolarHBondContact CB-OG1 3.42Å; C424-T436 PolarHBondContact O-OG1 3.44Å
425	N	97.1	Very high	95.2	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-109.2	-43.9	175.5	-68.6	-36.1	0	0	0	111.9	T226 Q233 I421 G422 F423 S429 T435 T436	T226-N425 HydrophobicContact CG2-CB 4.01Å; Q233-N425 PolarHBondContact OE1-ND2 2.95Å; I421-N425 PolarHBondContact O-N 3.46Å; I421-N425 VanDerWaalsContact O-N 3.15Å; I421-N425 PolarHBondContact O-ND2 3.05Å; I421-N425 VanDerWaalsContact O-ND2 3.14Å; G422-N425 PolarHBondContact O-N 3.28Å; F423-N425 PolarHBondContact O-N 2.95Å; N425-S429 PolarHBondContact O-N 3.01Å; N425-T435 WeakPolarHBondContact ND2-CG2 3.37Å; N425-T435 WeakPolarHBondContact OD1-CG2 3.46Å; N425-T436 WeakPolarHBondContact OD1-CB 3.49Å; N425-T436 PolarHBondContact OD1-N 2.69Å; N425-T436 PolarHBondContact OD1-OG1 2.89Å
426	I	97.3	Very high	95.3	Very high	28 Å²	28	17.4 Å²	17.4	14%	0.144	8%	0.08	C	C	.	.	H	α-helix	trans	-63.2	-50.6	177.2	-64.6	173.3	0	0	0	112	F227 G230 V231 V234 G422 S429 F430	F227-I426 HydrophobicContact CD2-CG2 4.25Å; F227-I426 HydrophobicContact CE2-CG2 4.09Å; G230-I426 VanDerWaalsContact C-CG1 3.5Å; V231-I426 HydrophobicContact CG2-CD1 4.12Å; V231-I426 HydrophobicContact CG2-CG1 4.24Å; V234-I426 HydrophobicContact CB-CD1 4.28Å; V234-I426 HydrophobicContact CG2-CD1 3.62Å; G422-I426 WeakPolarHBondContact O-CG1 3.48Å; G422-I426 PolarHBondContact O-N 3.23Å; I426-S429 PolarHBondContact O-OG 3.06Å; I426-F430 HydrophobicContact CG2-CE2 4.27Å; I426-F430 WeakPolarHBondContact O-CD2 2.97Å; I426-F430 VanDerWaalsContact O-CE2 3.3Å; I426-F430 WeakPolarHBondContact O-CE2 3.35Å
427	I	96.5	Very high	95.3	Very high	70 Å²	70	17 Å²	17	36%	0.359	8%	0.078	S	C	.	.	H	α-helix	trans	-69.7	-44.8	-172.4	-58.3	170	0	0	0	110.8	I150 F423 S429 F430 F431	I150-I427 HydrophobicContact CD1-CB 3.87Å; I150-I427 HydrophobicContact CD1-CD1 4.43Å; I150-I427 HydrophobicContact CD1-CG2 4.1Å; F423-I427 HydrophobicContact CB-CD1 4.18Å; F423-I427 HydrophobicContact CD1-CD1 4.21Å; F423-I427 HydrophobicContact CD1-CG1 4.41Å; F423-I427 WeakPolarHBondContact O-CB 3.44Å; F423-I427 PolarHBondContact O-N 3.48Å; F423-I427 VanDerWaalsContact O-N 3.09Å; I427-S429 VanDerWaalsContact C-N 3.34Å; I427-S429 PolarHBondContact O-N 3.5Å; I427-F430 PolarHBondContact O-N 3.46Å; I427-F431 WeakPolarHBondContact O-CD2 3.38Å
428	P	95.5	Very high	95.2	Very high	1 Å²	1	17 Å²	17	1%	0.006	8%	0.078	C	C	.	.	H	α-helix	trans	-72.5	-20.9	-178.3	-24	40.3	0	0	0	114.4	F146 I150 C424 F430 F431 C433	F146-P428 HydrophobicContact CB-CB 3.95Å; F146-P428 HydrophobicContact CB-CG 3.68Å; F146-P428 HydrophobicContact CG-CB 4.44Å; I150-P428 HydrophobicContact CD1-CG 3.51Å; C424-P428 VanDerWaalsContact O-CD 3.31Å; C424-P428 WeakPolarHBondContact O-CD 3.47Å; C424-P428 VanDerWaalsContact O-CG 3.24Å; C424-P428 WeakPolarHBondContact O-CG 3.3Å; P428-F430 PolarHBondContact O-N 3.08Å; P428-F431 CarbonylContact O-C 3.57Å; P428-F431 WeakPolarHBondContact O-CA 3.48Å; P428-F431 PolarHBondContact O-N 2.93Å; P428-C433 HydrophobicContact CB-CB 3.43Å; P428-C433 VanDerWaalsContact CB-CB 3.43Å; P428-C433 WeakPolarHBondContact O-CB 3.33Å; P428-C433 PolarHBondContact O-N 2.7Å; P428-C433 PolarHBondContact O-SG 2.89Å
429	S	95.8	Very high	94.8	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.007	8%	0.08	C	C	.	.	H	α-helix	trans	-60.2	-27.8	177.7	61.2	0	0	0	0	112.8	S223 F227 N425 I426 I427 F431	S223-S429 WeakPolarHBondContact O-CB 3.13Å; F227-S429 WeakPolarHBondContact CB-OG 3.31Å; N425-S429 PolarHBondContact O-N 3.01Å; I426-S429 PolarHBondContact O-OG 3.06Å; I427-S429 VanDerWaalsContact C-N 3.34Å; I427-S429 PolarHBondContact O-N 3.5Å; S429-F431 PolarHBondContact O-N 3.18Å
430	F	95.3	Very high	94.2	Very high	67 Å²	67	19.5 Å²	19.5	29%	0.294	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-14	172.8	-64.4	-86.3	0	0	0	113.9	F227 P371 K372 V373 I426 I427 P428	F227-F430 HydrophobicContact CD2-CE2 4.14Å; F227-F430 HydrophobicContact CD2-CZ 4.26Å; F227-F430 AromaticContact CE2-CE2 3.98Å; F227-F430 HydrophobicContact CE2-CE2 3.98Å; F227-F430 AromaticContact CE2-CZ 3.82Å; F227-F430 HydrophobicContact CE2-CZ 3.82Å; P371-F430 CarbonylContact C-O 3.42Å; P371-F430 WeakPolarHBondContact CA-O 3.45Å; P371-F430 VanDerWaalsContact CB-O 3.31Å; P371-F430 WeakPolarHBondContact CB-O 3.34Å; K372-F430 PolarHBondContact N-O 3.42Å; K372-F430 CarbonylContact O-C 3.57Å; K372-F430 WeakPolarHBondContact O-CA 3.4Å; V373-F430 HydrophobicContact CG1-CD1 4.27Å; V373-F430 HydrophobicContact CG1-CE1 4.17Å; I426-F430 HydrophobicContact CG2-CE2 4.27Å; I426-F430 WeakPolarHBondContact O-CD2 2.97Å; I426-F430 VanDerWaalsContact O-CE2 3.3Å; I426-F430 WeakPolarHBondContact O-CE2 3.35Å; I427-F430 PolarHBondContact O-N 3.46Å; P428-F430 PolarHBondContact O-N 3.08Å
431	F	94.9	Very high	93.5	Very high	64 Å²	64	21.5 Å²	21.5	28%	0.281	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.9	35.5	-179.5	-59.8	-87.5	0	0	0	111.4	F146 P371 I427 P428 S429 C433	F146-F431 HydrophobicContact CD2-CB 4.25Å; F146-F431 HydrophobicContact CE1-CD1 4.5Å; F146-F431 HydrophobicContact CE1-CD2 4.26Å; F146-F431 HydrophobicContact CE1-CG 4.25Å; F146-F431 HydrophobicContact CE2-CB 3.53Å; F146-F431 HydrophobicContact CE2-CD1 4.41Å; F146-F431 HydrophobicContact CE2-CD2 4.46Å; F146-F431 AromaticContact CE2-CG 3.91Å; F146-F431 HydrophobicContact CE2-CG 3.91Å; F146-F431 HydrophobicContact CZ-CB 3.8Å; F146-F431 AromaticContact CZ-CD1 3.81Å; F146-F431 HydrophobicContact CZ-CD1 3.81Å; F146-F431 HydrophobicContact CZ-CD2 4.09Å; F146-F431 HydrophobicContact CZ-CE1 4.4Å; F146-F431 AromaticContact CZ-CG 3.63Å; F146-F431 HydrophobicContact CZ-CG 3.63Å; P371-F431 HydrophobicContact CB-CD1 4.02Å; P371-F431 HydrophobicContact CB-CE1 3.87Å; P371-F431 HydrophobicContact CB-CZ 4.39Å; P371-F431 HydrophobicContact CG-CE1 4.31Å; I427-F431 WeakPolarHBondContact O-CD2 3.38Å; P428-F431 CarbonylContact O-C 3.57Å; P428-F431 WeakPolarHBondContact O-CA 3.48Å; P428-F431 PolarHBondContact O-N 2.93Å; S429-F431 PolarHBondContact O-N 3.18Å; F431-C433 PolarHBondContact O-N 3.49Å; F431-C433 PolarHBondContact O-SG 3.27Å; F431-C433 VanDerWaalsContact O-SG 3.37Å
432	H	92.8	Very high	93	Very high	30 Å²	30	21.9 Å²	21.9	14%	0.139	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	35.8	177.9	-46.3	-84.8	0	0	0	113.5	Y139 I219 P370	Y139-H432 HydrophobicContact CD1-CB 3.69Å; Y139-H432 WeakPolarHBondContact CD1-O 3.29Å; Y139-H432 HydrophobicContact CE1-CB 3.65Å; I219-H432 WeakPolarHBondContact CD1-O 3.32Å; I219-H432 HydrophobicContact CG1-CB 4.02Å; P370-H432 PolarHBondContact O-NE2 2.94Å
433	C	94.8	Very high	92.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.113	C	C	.	.			trans	-98.9	161.2	175	-58.7	0	0	0	0	111.8	Y142 T143 P428 F431	Y142-C433 VanDerWaalsContact C-SG 3.57Å; Y142-C433 VanDerWaalsContact CB-SG 3.57Å; T143-C433 HydrophobicContact CG2-CB 4.32Å; T143-C433 PolarHBondContact N-SG 2.95Å; T143-C433 VanDerWaalsContact OG1-CA 3.31Å; T143-C433 WeakPolarHBondContact OG1-CA 3.44Å; T143-C433 VanDerWaalsContact OG1-CB 3.24Å; T143-C433 WeakPolarHBondContact OG1-CB 3.49Å; P428-C433 HydrophobicContact CB-CB 3.43Å; P428-C433 VanDerWaalsContact CB-CB 3.43Å; P428-C433 WeakPolarHBondContact O-CB 3.33Å; P428-C433 PolarHBondContact O-N 2.7Å; P428-C433 PolarHBondContact O-SG 2.89Å; F431-C433 PolarHBondContact O-N 3.49Å; F431-C433 PolarHBondContact O-SG 3.27Å; F431-C433 VanDerWaalsContact O-SG 3.37Å
434	F	94.5	Very high	92.2	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.121	C	C	.	.			trans	-121.4	176.6	178	60.6	-99.3	0	0	0	112.3	A133 Q135 T143 I164 I172 I219 T226 T436	A133-F434 HydrophobicContact CB-CE2 4.45Å; Q135-F434 HydrophobicContact CB-CE1 4.32Å; Q135-F434 HydrophobicContact CG-CD1 4.16Å; Q135-F434 HydrophobicContact CG-CE1 4.33Å; T143-F434 WeakPolarHBondContact CG2-O 3.5Å; T143-F434 PolarHBondContact OG1-N 2.94Å; T143-F434 VanDerWaalsContact OG1-N 3.08Å; I164-F434 HydrophobicContact CB-CE2 4.07Å; I164-F434 HydrophobicContact CD1-CE2 4.5Å; I164-F434 HydrophobicContact CD1-CZ 4.27Å; I164-F434 HydrophobicContact CG2-CD2 4.2Å; I164-F434 HydrophobicContact CG2-CE2 3.44Å; I164-F434 VanDerWaalsContact CG2-CE2 3.44Å; I164-F434 HydrophobicContact CG2-CZ 3.79Å; I172-F434 HydrophobicContact CD1-CB 4.2Å; I172-F434 HydrophobicContact CD1-CD2 3.96Å; I219-F434 HydrophobicContact CD1-CD1 4.42Å; T226-F434 VanDerWaalsContact OG1-C 3.29Å; T226-F434 WeakPolarHBondContact OG1-CA 3.1Å; F434-T436 PolarHBondContact O-N 2.88Å
435	T	95.1	Very high	91.6	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.13	C	C	.	.			trans	-62.2	134.3	-164.3	-36.2	0	0	0	0	115	L168 I172 T226 I389 N425	L168-T435 HydrophobicContact CD1-CG2 3.91Å; I172-T435 WeakPolarHBondContact CD1-OG1 3.3Å; T226-T435 PolarHBondContact OG1-N 3.3Å; T226-T435 PolarHBondContact OG1-OG1 2.67Å; T226-T435 VanDerWaalsContact OG1-OG1 3.12Å; I389-T435 HydrophobicContact CG2-CG2 3.64Å; N425-T435 WeakPolarHBondContact ND2-CG2 3.37Å; N425-T435 WeakPolarHBondContact OD1-CG2 3.46Å
436	T	94.1	Very high	91.2	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.131	C	C	.	.			trans	-98.5	155.3	179	68	0	0	0	0	112.2	T143 A147 G163 I421 C424 N425 F434	T143-T436 HydrophobicContact CG2-CG2 3.54Å; A147-T436 HydrophobicContact CB-CG2 3.62Å; G163-T436 CarbonylContact O-C 3.52Å; G163-T436 WeakPolarHBondContact O-CA 3.34Å; G163-T436 WeakPolarHBondContact O-CB 3.44Å; I421-T436 WeakPolarHBondContact CD1-OG1 3.32Å; C424-T436 WeakPolarHBondContact CB-OG1 3.42Å; C424-T436 PolarHBondContact O-OG1 3.44Å; N425-T436 WeakPolarHBondContact OD1-CB 3.49Å; N425-T436 PolarHBondContact OD1-N 2.69Å; N425-T436 PolarHBondContact OD1-OG1 2.89Å; F434-T436 PolarHBondContact O-N 2.88Å
437	S	92.8	Very high	90.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	165.8	168.4	-172.4	0	0	0	0	110.8	G163 G393 T397	G163-S437 PolarHBondContact N-O 3.36Å; G163-S437 PolarHBondContact O-N 3.37Å; G393-S437 PolarHBondContact O-OG 3.16Å; T397-S437 PolarHBondContact OG1-OG 3.32Å
438	A	91.6	Very high	90.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	142.2	169.2	0	0	0	0	0	111.4	I160 V162 I396 T397 L400	I160-A438 HydrophobicContact CD1-CB 3.73Å; V162-A438 HydrophobicContact CG2-CB 4.36Å; I396-A438 WeakPolarHBondContact CG2-O 3.35Å; T397-A438 HydrophobicContact CG2-CB 4.21Å; T397-A438 PolarHBondContact OG1-N 2.89Å; L400-A438 HydrophobicContact CB-CB 4.49Å; L400-A438 HydrophobicContact CD2-CB 3.69Å
439	A	86	Confident	89.8	Confident	7 Å²	7	23.9 Å²	23.9	6%	0.058	13%	0.13	C	C	.	.			trans	-121.2	131.1	175.3	0	0	0	0	0	112.6	S161 F165 A441 K442 T443	S161-A439 PolarHBondContact O-N 3.46Å; S161-A439 VanDerWaalsContact O-N 3.12Å; F165-A439 HydrophobicContact CD2-CB 3.93Å; A439-A441 PolarHBondContact O-N 3.49Å; A439-K442 HydrophobicContact CB-CB 4.4Å; A439-K442 HydrophobicContact CB-CD 4.4Å; A439-K442 HydrophobicContact CB-CG 4.35Å; A439-T443 VanDerWaalsContact O-CB 3.25Å; A439-T443 WeakPolarHBondContact O-CB 3.35Å; A439-T443 PolarHBondContact O-N 3.42Å; A439-T443 PolarHBondContact O-OG1 3.16Å
440	L	82.4	Confident	89.3	Confident	88 Å²	88	25.6 Å²	25.6	46%	0.461	15%	0.148	S	C	.	.	H	α-helix	trans	-58.8	-48.5	-179	175.5	61.2	0	0	0	112.9	L400 F404 T443 L444	L400-L440 HydrophobicContact CD1-CB 4.06Å; L400-L440 HydrophobicContact CD1-CD1 3.66Å; L400-L440 HydrophobicContact CD1-CG 4.44Å; F404-L440 HydrophobicContact CE2-CD1 4.47Å; L440-T443 PolarHBondContact O-N 3.24Å; L440-L444 WeakPolarHBondContact O-CB 3.43Å; L440-L444 PolarHBondContact O-N 3.4Å
441	A	80.6	Confident	89	Confident	43 Å²	43	22.5 Å²	22.5	36%	0.355	13%	0.134	S	C	.	.	H	α-helix	trans	-61.9	-49	-176.6	0	0	0	0	0	112.4	A439 T443 L444 V445	A439-A441 PolarHBondContact O-N 3.49Å; A441-T443 VanDerWaalsContact C-N 3.33Å; A441-T443 PolarHBondContact O-N 3.03Å; A441-L444 PolarHBondContact O-N 3.35Å; A441-V445 PolarHBondContact O-N 3.09Å; A441-V445 VanDerWaalsContact O-N 3.13Å
442	K	86.4	Confident	88.7	Confident	8 Å²	8	23.2 Å²	23.2	4%	0.035	14%	0.139	C	C	.	.	H	α-helix	trans	-60.1	-43.3	176.4	-62.7	-174.2	-78.8	-176.5	0	111.5	L122 I164 A439 V445 K446	L122-K442 HydrophobicContact CD1-CD 3.55Å; L122-K442 HydrophobicContact CD1-CG 4.23Å; L122-K442 HydrophobicContact CD2-CD 4.3Å; L122-K442 HydrophobicContact CG-CD 3.68Å; I164-K442 PolarHBondContact O-NZ 3.06Å; A439-K442 HydrophobicContact CB-CB 4.4Å; A439-K442 HydrophobicContact CB-CD 4.4Å; A439-K442 HydrophobicContact CB-CG 4.35Å; K442-V445 PolarHBondContact O-N 2.86Å; K442-K446 WeakPolarHBondContact O-CB 3.19Å; K442-K446 PolarHBondContact O-N 3.07Å
443	T	90.5	Very high	88.7	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65.8	-37.9	177.7	-59.8	0	0	0	0	112.9	I160 S161 L400 F404 A439 L440 A441 K446 E447	I160-T443 HydrophobicContact CB-CG2 4.33Å; I160-T443 HydrophobicContact CG2-CG2 4.19Å; S161-T443 PolarHBondContact N-OG1 3.18Å; L400-T443 HydrophobicContact CD2-CG2 4.25Å; F404-T443 HydrophobicContact CD1-CG2 4.5Å; F404-T443 HydrophobicContact CD2-CG2 3.62Å; F404-T443 HydrophobicContact CE1-CG2 4.21Å; F404-T443 HydrophobicContact CE2-CG2 3.3Å; F404-T443 HydrophobicContact CG-CG2 4.24Å; F404-T443 HydrophobicContact CZ-CG2 3.64Å; A439-T443 VanDerWaalsContact O-CB 3.25Å; A439-T443 WeakPolarHBondContact O-CB 3.35Å; A439-T443 PolarHBondContact O-N 3.42Å; A439-T443 PolarHBondContact O-OG1 3.16Å; L440-T443 PolarHBondContact O-N 3.24Å; A441-T443 VanDerWaalsContact C-N 3.33Å; A441-T443 PolarHBondContact O-N 3.03Å; T443-K446 WeakPolarHBondContact O-CB 3.14Å; T443-K446 PolarHBondContact O-N 2.88Å; T443-E447 PolarHBondContact O-N 3.23Å
444	L	85.1	Confident	88.6	Confident	76 Å²	76	22.7 Å²	22.7	40%	0.398	14%	0.137	S	C	.	.	H	α-helix	trans	-69.3	-35.6	177.7	-175.4	63.1	0	0	0	111.7	L440 A441 S448	L440-L444 WeakPolarHBondContact O-CB 3.43Å; L440-L444 PolarHBondContact O-N 3.4Å; A441-L444 PolarHBondContact O-N 3.35Å; L444-S448 WeakPolarHBondContact O-CB 3.42Å; L444-S448 PolarHBondContact O-N 2.83Å; L444-S448 PolarHBondContact O-OG 3.18Å
445	V	85.3	Confident	88.5	Confident	31 Å²	31	24.3 Å²	24.3	19%	0.188	15%	0.146	C	C	.	.	H	α-helix	trans	-66.7	-45.8	171.3	178.3	0	0	0	0	110.7	I117 V118 L121 P332 A441 K442 E447 S448 T449	I117-V445 HydrophobicContact CG2-CG1 3.68Å; V118-V445 HydrophobicContact CG2-CG1 4.46Å; L121-V445 HydrophobicContact CD1-CB 4.24Å; L121-V445 HydrophobicContact CD1-CG1 3.79Å; L121-V445 HydrophobicContact CD1-CG2 4.03Å; P332-V445 HydrophobicContact CG-CG1 4.23Å; A441-V445 PolarHBondContact O-N 3.09Å; A441-V445 VanDerWaalsContact O-N 3.13Å; K442-V445 PolarHBondContact O-N 2.86Å; V445-E447 PolarHBondContact O-N 2.93Å; V445-S448 WeakPolarHBondContact CA-OG 3.44Å; V445-S448 PolarHBondContact O-N 3.29Å; V445-S448 PolarHBondContact O-OG 3.2Å; V445-T449 HydrophobicContact CG1-CG2 4.36Å; V445-T449 PolarHBondContact O-N 3.43Å; V445-T449 PolarHBondContact O-OG1 3Å
446	K	88.7	Confident	88.4	Confident	6 Å²	6	24.3 Å²	24.3	3%	0.026	15%	0.146	C	C	.	.	H	α-helix	trans	-53.9	-46.5	174.2	175.4	156.8	171.2	-166.2	0	112.5	S114 V118 R158 H159 I160 K442 T443 T449 C451	S114-K446 WeakPolarHBondContact OG-CA 3.41Å; S114-K446 WeakPolarHBondContact OG-CG 3.22Å; S114-K446 PolarHBondContact OG-O 2.89Å; V118-K446 HydrophobicContact CG2-CB 3.81Å; R158-K446 PolarHBondContact O-NZ 3.27Å; R158-K446 VanDerWaalsContact O-NZ 3.14Å; H159-K446 WeakPolarHBondContact O-CD 3.36Å; H159-K446 VanDerWaalsContact O-CE 3.25Å; H159-K446 WeakPolarHBondContact O-CE 3.35Å; H159-K446 VanDerWaalsContact O-CG 3.24Å; H159-K446 WeakPolarHBondContact O-CG 3.41Å; I160-K446 PolarHBondContact O-NZ 3.23Å; K442-K446 WeakPolarHBondContact O-CB 3.19Å; K442-K446 PolarHBondContact O-N 3.07Å; T443-K446 WeakPolarHBondContact O-CB 3.14Å; T443-K446 PolarHBondContact O-N 2.88Å; K446-T449 PolarHBondContact O-OG1 3.38Å; K446-C451 WeakPolarHBondContact CE-SG 3.5Å; K446-C451 HydrophobicContact CG-CB 3.76Å; K446-C451 WeakPolarHBondContact O-CB 3.42Å; K446-C451 PolarHBondContact O-N 2.79Å
447	E	88.7	Confident	88.4	Confident	24 Å²	24	24.8 Å²	24.8	11%	0.112	15%	0.151	C	C	.	.	H	α-helix	trans	-62.8	-52.6	173.2	-179.6	-168.5	-117.8	0	0	112.1	F404 K407 H408 T443 V445 T449 G450	F404-E447 WeakPolarHBondContact CD1-OE1 3.21Å; F404-E447 HydrophobicContact CE1-CB 4.15Å; F404-E447 HydrophobicContact CE1-CG 4.34Å; F404-E447 WeakPolarHBondContact CE1-OE1 3.32Å; K407-E447 VanDerWaalsContact CD-OE1 3.3Å; K407-E447 WeakPolarHBondContact CD-OE1 3.41Å; K407-E447 WeakPolarHBondContact CE-OE1 3.37Å; K407-E447 IonicContact NZ-OE1 2.72Å; K407-E447 PolarHBondContact NZ-OE1 2.97Å; K407-E447 IonicContact NZ-OE2 2.69Å; K407-E447 PolarHBondContact NZ-OE2 3.3Å; H408-E447 IonicContact CD2-OE1 3.03Å; H408-E447 IonicContact CE1-OE1 3.36Å; H408-E447 IonicContact NE2-OE1 3.46Å; H408-E447 PolarHBondContact NE2-OE1 3.23Å; T443-E447 PolarHBondContact O-N 3.23Å; V445-E447 PolarHBondContact O-N 2.93Å; E447-T449 PolarHBondContact O-N 3.21Å; E447-T449 VanDerWaalsContact O-N 3.1Å; E447-G450 PolarHBondContact O-N 2.78Å
448	S	84.4	Confident	88.5	Confident	39 Å²	39	26.7 Å²	26.7	27%	0.273	16%	0.162	S	C	.	.	H	α-helix	trans	-70.6	-6.4	-172.3	61.1	0	0	0	0	115.2	L444 V445	L444-S448 WeakPolarHBondContact O-CB 3.42Å; L444-S448 PolarHBondContact O-N 2.83Å; L444-S448 PolarHBondContact O-OG 3.18Å; V445-S448 WeakPolarHBondContact CA-OG 3.44Å; V445-S448 PolarHBondContact O-N 3.29Å; V445-S448 PolarHBondContact O-OG 3.2Å
449	T	86.6	Confident	88.7	Confident	17 Å²	17	27.9 Å²	27.9	10%	0.104	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	3.8	170.8	42.6	0	0	0	0	113.1	S114 I117 P332 V445 K446 E447	S114-T449 VanDerWaalsContact CA-OG1 3.29Å; S114-T449 WeakPolarHBondContact CA-OG1 3.41Å; S114-T449 WeakPolarHBondContact CB-OG1 3.44Å; S114-T449 PolarHBondContact OG-OG1 3.2Å; I117-T449 HydrophobicContact CB-CG2 4.4Å; I117-T449 HydrophobicContact CD1-CG2 3.58Å; I117-T449 HydrophobicContact CG2-CG2 4.36Å; P332-T449 HydrophobicContact CG-CG2 3.88Å; V445-T449 HydrophobicContact CG1-CG2 4.36Å; V445-T449 PolarHBondContact O-N 3.43Å; V445-T449 PolarHBondContact O-OG1 3Å; K446-T449 PolarHBondContact O-OG1 3.38Å; E447-T449 PolarHBondContact O-N 3.21Å; E447-T449 VanDerWaalsContact O-N 3.1Å
450	G	84.6	Confident	89.1	Confident	37 Å²	37	27.7 Å²	27.7	38%	0.381	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	17.3	173.9	0	0	0	0	0	115.2	E447	E447-G450 PolarHBondContact O-N 2.78Å
451	C	90.1	Very high	89.8	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.014	15%	0.147	C	C	.	.			trans	-54.5	140	171.9	-179.3	0	0	0	0	111.8	D111 H159 K446 T453	D111-C451 WeakPolarHBondContact OD1-CA 3.44Å; D111-C451 PolarHBondContact OD1-SG 3.41Å; H159-C451 PolarHBondContact CD2-O 3.14Å; H159-C451 PolarHBondContact NE2-O 2.83Å; K446-C451 WeakPolarHBondContact CE-SG 3.5Å; K446-C451 HydrophobicContact CG-CB 3.76Å; K446-C451 WeakPolarHBondContact O-CB 3.42Å; K446-C451 PolarHBondContact O-N 2.79Å; C451-T453 PolarHBondContact SG-O 3.42Å
452	Q	88.8	Confident	90.5	Very high	80 Å²	80	26.5 Å²	26.5	37%	0.374	16%	0.156	S	C	.	.			trans	-120.3	-23.2	176.2	-65.6	-60.8	-44.5	0	0	112.4	N107 D111 R158	N107-Q452 HydrophobicContact CB-CB 4.32Å; D111-Q452 PolarHBondContact OD1-N 3.05Å; R158-Q452 WeakPolarHBondContact CD-O 3.21Å
453	T	92	Very high	91	Very high	13 Å²	13	27.5 Å²	27.5	8%	0.08	16%	0.162	C	C	.	.	S	Bend	trans	-143	172.6	-174.3	76.9	0	0	0	0	114.7	W98 Y102 D111 R158 C451 L455	W98-T453 HydrophobicContact CE3-CG2 4.21Å; W98-T453 HydrophobicContact CZ3-CG2 4.14Å; Y102-T453 HydrophobicContact CD2-CG2 3.73Å; Y102-T453 HydrophobicContact CE2-CG2 3.51Å; Y102-T453 WeakPolarHBondContact CE2-OG1 3.41Å; D111-T453 PolarHBondContact OD1-N 3.15Å; D111-T453 PolarHBondContact OD2-N 3.37Å; D111-T453 PolarHBondContact OD2-OG1 2.9Å; R158-T453 CarbonylContact O-C 3.59Å; C451-T453 PolarHBondContact SG-O 3.42Å; T453-L455 PolarHBondContact O-N 3.38Å; T453-L455 WeakPolarHBondContact OG1-CB 3.49Å; T453-L455 PolarHBondContact OG1-N 2.7Å
454	Q	91.8	Very high	91.1	Very high	5 Å²	5	27.5 Å²	27.5	2%	0.023	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-11.9	177.4	-66.8	165.7	-20.5	0	0	113.2	W98 F152 G155 S157 S456 G457	W98-Q454 HydrophobicContact CZ2-CB 3.82Å; F152-Q454 HydrophobicContact CD2-CB 3.94Å; F152-Q454 WeakPolarHBondContact CD2-O 3.36Å; F152-Q454 PolarHBondContact O-OE1 3.02Å; G155-Q454 PolarHBondContact O-NE2 3.4Å; S157-Q454 WeakPolarHBondContact O-CG 3.31Å; S157-Q454 PolarHBondContact O-NE2 2.94Å; Q454-S456 PolarHBondContact O-N 3.3Å; Q454-S456 VanDerWaalsContact O-N 3.13Å; Q454-G457 WeakPolarHBondContact O-CA 3.32Å; Q454-G457 PolarHBondContact O-N 2.9Å
455	L	93.4	Very high	91.6	Very high	35 Å²	35	26.1 Å²	26.1	18%	0.183	16%	0.155	C	C	.	.	H	α-helix	trans	-55.9	-31.5	177.9	-173.9	62.4	0	0	0	112.7	W98 Y102 I108 D111 F152 T453 G457 V458 V459	W98-L455 HydrophobicContact CH2-CB 4.22Å; Y102-L455 HydrophobicContact CE1-CD2 3.8Å; I108-L455 HydrophobicContact CD1-CD2 3.6Å; D111-L455 HydrophobicContact CB-CB 4.32Å; F152-L455 HydrophobicContact CE2-CD1 4.33Å; T453-L455 PolarHBondContact O-N 3.38Å; T453-L455 WeakPolarHBondContact OG1-CB 3.49Å; T453-L455 PolarHBondContact OG1-N 2.7Å; L455-G457 PolarHBondContact O-N 2.94Å; L455-G457 VanDerWaalsContact O-N 3.14Å; L455-V458 HydrophobicContact CD1-CB 4.38Å; L455-V458 HydrophobicContact CD1-CG2 4.34Å; L455-V458 WeakPolarHBondContact O-CB 3.34Å; L455-V458 PolarHBondContact O-N 3.39Å; L455-V459 PolarHBondContact O-N 3.43Å
456	S	93.6	Very high	92.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-54.6	-28.7	171.1	174.7	0	0	0	0	113.5	D111 S114 G115 Q454 T460	D111-S456 VanDerWaalsContact O-CA 3.29Å; D111-S456 WeakPolarHBondContact O-CA 3.38Å; D111-S456 VanDerWaalsContact O-CB 3.22Å; D111-S456 WeakPolarHBondContact O-CB 3.48Å; D111-S456 PolarHBondContact O-OG 2.93Å; S114-S456 WeakPolarHBondContact CB-OG 3.34Å; S114-S456 PolarHBondContact OG-OG 3.09Å; G115-S456 VanDerWaalsContact CA-O 3.24Å; G115-S456 WeakPolarHBondContact CA-O 3.4Å; G115-S456 WeakPolarHBondContact CA-OG 3.37Å; G115-S456 PolarHBondContact N-OG 3.47Å; G115-S456 VanDerWaalsContact N-OG 3.1Å; Q454-S456 PolarHBondContact O-N 3.3Å; Q454-S456 VanDerWaalsContact O-N 3.13Å; S456-T460 WeakPolarHBondContact O-CB 3.49Å; S456-T460 PolarHBondContact O-N 3.05Å; S456-T460 PolarHBondContact O-OG1 3.4Å
457	G	93.3	Very high	92.3	Very high	10 Å²	10	29.3 Å²	29.3	10%	0.103	17%	0.171	C	C	.	.	H	α-helix	trans	-69.6	-35.6	173.4	0	0	0	0	0	113.7	S148 Q454 L455 T460 A461	S148-G457 WeakPolarHBondContact CB-O 3.49Å; Q454-G457 WeakPolarHBondContact O-CA 3.32Å; Q454-G457 PolarHBondContact O-N 2.9Å; L455-G457 PolarHBondContact O-N 2.94Å; L455-G457 VanDerWaalsContact O-N 3.14Å; G457-T460 WeakPolarHBondContact O-CB 3.45Å; G457-T460 PolarHBondContact O-N 2.89Å; G457-A461 PolarHBondContact O-N 3.18Å
458	V	95.1	Very high	92.4	Very high	40 Å²	40	28.2 Å²	28.2	24%	0.242	17%	0.166	C	C	.	.	H	α-helix	trans	-66.4	-43.9	173.6	-176.1	0	0	0	0	110.2	F152 L455 T460 A461 L462	F152-V458 HydrophobicContact CB-CG2 4.29Å; F152-V458 HydrophobicContact CD1-CG2 3.55Å; F152-V458 HydrophobicContact CD2-CG2 3.5Å; F152-V458 HydrophobicContact CE1-CG2 3.58Å; F152-V458 HydrophobicContact CE2-CG2 3.52Å; F152-V458 HydrophobicContact CG-CG2 3.51Å; F152-V458 HydrophobicContact CZ-CG2 3.56Å; L455-V458 HydrophobicContact CD1-CB 4.38Å; L455-V458 HydrophobicContact CD1-CG2 4.34Å; L455-V458 WeakPolarHBondContact O-CB 3.34Å; L455-V458 PolarHBondContact O-N 3.39Å; V458-T460 VanDerWaalsContact C-N 3.32Å; V458-T460 PolarHBondContact O-N 3.09Å; V458-A461 WeakPolarHBondContact O-CB 3.24Å; V458-A461 PolarHBondContact O-N 2.82Å; V458-A461 VanDerWaalsContact O-N 3.13Å; V458-L462 HydrophobicContact CG1-CD1 4.43Å; V458-L462 WeakPolarHBondContact O-CG 3.49Å; V458-L462 PolarHBondContact O-N 3.43Å
459	V	96	Very high	92.8	Very high	25 Å²	25	30.6 Å²	30.6	15%	0.152	18%	0.175	C	C	.	.	H	α-helix	trans	-64.1	-38.3	175.9	-179.6	0	0	0	0	111.2	V112 L455 A461 L462 V463	V112-V459 HydrophobicContact CG1-CG1 4.5Å; V112-V459 HydrophobicContact CG2-CG2 4.13Å; L455-V459 PolarHBondContact O-N 3.43Å; V459-A461 VanDerWaalsContact C-N 3.34Å; V459-A461 PolarHBondContact O-N 2.91Å; V459-L462 PolarHBondContact O-N 3.44Å; V459-V463 WeakPolarHBondContact O-CG2 3.42Å; V459-V463 PolarHBondContact O-N 2.62Å; V459-V463 VanDerWaalsContact O-N 3.1Å
460	T	94.6	Very high	93.1	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-57.7	-46.1	170.9	-57.4	0	0	0	0	111.1	G115 V118 L122 S456 G457 V458 V463 L464	G115-T460 WeakPolarHBondContact O-CA 3.39Å; G115-T460 PolarHBondContact O-OG1 3.38Å; V118-T460 HydrophobicContact CG1-CG2 4.07Å; L122-T460 HydrophobicContact CD1-CG2 4.23Å; L122-T460 HydrophobicContact CD2-CG2 4.08Å; S456-T460 WeakPolarHBondContact O-CB 3.49Å; S456-T460 PolarHBondContact O-N 3.05Å; S456-T460 PolarHBondContact O-OG1 3.4Å; G457-T460 WeakPolarHBondContact O-CB 3.45Å; G457-T460 PolarHBondContact O-N 2.89Å; V458-T460 VanDerWaalsContact C-N 3.32Å; V458-T460 PolarHBondContact O-N 3.09Å; T460-V463 PolarHBondContact O-N 2.77Å; T460-L464 HydrophobicContact CG2-CD1 4.32Å; T460-L464 WeakPolarHBondContact O-CG 3.35Å; T460-L464 PolarHBondContact O-N 3.06Å; T460-L464 VanDerWaalsContact O-N 3.09Å
461	A	95.9	Very high	93.4	Very high	3 Å²	3	35.4 Å²	35.4	3%	0.025	19%	0.194	C	C	.	.	H	α-helix	trans	-66	-38.1	178.2	0	0	0	0	0	112.9	F145 I149 G457 V458 V459 L464 L465	F145-A461 HydrophobicContact CD2-CB 4.02Å; F145-A461 WeakPolarHBondContact CD2-O 3.47Å; F145-A461 HydrophobicContact CE2-CB 4.23Å; I149-A461 HydrophobicContact CD1-CB 4.04Å; I149-A461 HydrophobicContact CG1-CB 3.59Å; G457-A461 PolarHBondContact O-N 3.18Å; V458-A461 WeakPolarHBondContact O-CB 3.24Å; V458-A461 PolarHBondContact O-N 2.82Å; V458-A461 VanDerWaalsContact O-N 3.13Å; V459-A461 VanDerWaalsContact C-N 3.34Å; V459-A461 PolarHBondContact O-N 2.91Å; A461-L464 PolarHBondContact O-N 2.87Å; A461-L465 WeakPolarHBondContact O-CB 3.16Å; A461-L465 PolarHBondContact O-N 3.46Å
462	L	96.6	Very high	93.3	Very high	104 Å²	104	35.3 Å²	35.3	55%	0.545	19%	0.194	S	C	.	.	H	α-helix	trans	-64.1	-38.6	175.7	-70.9	171.4	0	0	0	112.3	V458 V459 L465 L466	V458-L462 HydrophobicContact CG1-CD1 4.43Å; V458-L462 WeakPolarHBondContact O-CG 3.49Å; V458-L462 PolarHBondContact O-N 3.43Å; V459-L462 PolarHBondContact O-N 3.44Å; L462-L465 PolarHBondContact O-N 3.35Å; L462-L466 PolarHBondContact O-N 3.33Å
463	V	95.3	Very high	93.4	Very high	29 Å²	29	34.5 Å²	34.5	18%	0.176	20%	0.196	C	C	.	.	H	α-helix	trans	-65.2	-43.8	173.2	172.7	0	0	0	0	111.1	V459 T460 L465 L466 V467	V459-V463 WeakPolarHBondContact O-CG2 3.42Å; V459-V463 PolarHBondContact O-N 2.62Å; V459-V463 VanDerWaalsContact O-N 3.1Å; T460-V463 PolarHBondContact O-N 2.77Å; V463-L465 VanDerWaalsContact C-N 3.34Å; V463-L465 PolarHBondContact O-N 3.48Å; V463-L466 PolarHBondContact O-N 3.49Å; V463-V467 VanDerWaalsContact O-CG2 3.28Å; V463-V467 WeakPolarHBondContact O-CG2 3.5Å; V463-V467 PolarHBondContact O-N 3.29Å
464	L	93.9	Very high	93.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.7	-35.2	176.6	-68.3	172.8	0	0	0	112.6	L122 V123 L141 F145 T460 A461 V467 L468	L122-L464 HydrophobicContact CB-CD1 4.49Å; L122-L464 HydrophobicContact CB-CD2 4.15Å; L122-L464 HydrophobicContact CD2-CD1 4.15Å; V123-L464 HydrophobicContact CG2-CD2 3.99Å; L141-L464 HydrophobicContact CD2-CD2 4.05Å; F145-L464 HydrophobicContact CB-CB 4.22Å; F145-L464 HydrophobicContact CB-CD1 4.45Å; T460-L464 HydrophobicContact CG2-CD1 4.32Å; T460-L464 WeakPolarHBondContact O-CG 3.35Å; T460-L464 PolarHBondContact O-N 3.06Å; T460-L464 VanDerWaalsContact O-N 3.09Å; A461-L464 PolarHBondContact O-N 2.87Å; L464-V467 PolarHBondContact O-N 2.95Å; L464-L468 WeakPolarHBondContact O-CB 3.27Å; L464-L468 WeakPolarHBondContact O-CG 3.38Å; L464-L468 PolarHBondContact O-N 3.26Å
465	L	95.4	Very high	93.2	Very high	47 Å²	47	40.3 Å²	40.3	25%	0.246	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-48.3	174.1	-179.7	63	0	0	0	111.6	F145 F368 A461 L462 V463 V467 L468 L469	F145-L465 HydrophobicContact CD2-CB 4.27Å; F145-L465 HydrophobicContact CE2-CB 3.89Å; F145-L465 HydrophobicContact CE2-CD1 4.24Å; F145-L465 HydrophobicContact CE2-CG 4.46Å; F145-L465 HydrophobicContact CZ-CD1 4.35Å; F368-L465 HydrophobicContact CE2-CD1 3.57Å; F368-L465 HydrophobicContact CZ-CD1 3.74Å; A461-L465 WeakPolarHBondContact O-CB 3.16Å; A461-L465 PolarHBondContact O-N 3.46Å; L462-L465 PolarHBondContact O-N 3.35Å; V463-L465 VanDerWaalsContact C-N 3.34Å; V463-L465 PolarHBondContact O-N 3.48Å; L465-V467 PolarHBondContact O-N 2.97Å; L465-L468 PolarHBondContact O-N 2.81Å; L465-L469 HydrophobicContact CD1-CD1 3.86Å; L465-L469 HydrophobicContact CD1-CG 4.09Å; L465-L469 HydrophobicContact CG-CD1 4Å; L465-L469 WeakPolarHBondContact O-CB 3.49Å; L465-L469 WeakPolarHBondContact O-CG 3.49Å; L465-L469 PolarHBondContact O-N 2.94Å
466	L	94.8	Very high	93.1	Very high	97 Å²	97	44 Å²	44	51%	0.508	24%	0.237	S	C	.	.	H	α-helix	trans	-57.1	-38.5	174.2	177.5	62.5	0	0	0	111.4	L462 V463 V470 I471	L462-L466 PolarHBondContact O-N 3.33Å; V463-L466 PolarHBondContact O-N 3.49Å; L466-V470 HydrophobicContact CD1-CB 4.38Å; L466-V470 HydrophobicContact CD1-CG2 4.14Å; L466-V470 PolarHBondContact O-N 3.46Å; L466-I471 HydrophobicContact CD2-CD1 4.32Å; L466-I471 HydrophobicContact CG-CD1 4.11Å; L466-I471 HydrophobicContact CG-CG1 4.49Å; L466-I471 PolarHBondContact O-N 3.42Å
467	V	92.8	Very high	93	Very high	7 Å²	7	44.7 Å²	44.7	4%	0.042	24%	0.242	C	C	.	.	I	π-helix	trans	-66.5	-48.3	176.7	170.9	0	0	0	0	111.7	V123 L141 V463 L464 L465 L469 I471 A472 F475	V123-V467 HydrophobicContact CG1-CG1 4.07Å; V123-V467 HydrophobicContact CG2-CB 4.35Å; V123-V467 HydrophobicContact CG2-CG1 4.14Å; V123-V467 HydrophobicContact CG2-CG2 3.76Å; L141-V467 HydrophobicContact CD1-CG1 4.37Å; L141-V467 HydrophobicContact CD2-CG1 4.46Å; V463-V467 VanDerWaalsContact O-CG2 3.28Å; V463-V467 WeakPolarHBondContact O-CG2 3.5Å; V463-V467 PolarHBondContact O-N 3.29Å; L464-V467 PolarHBondContact O-N 2.95Å; L465-V467 PolarHBondContact O-N 2.97Å; V467-L469 VanDerWaalsContact C-N 3.29Å; V467-L469 PolarHBondContact O-N 2.98Å; V467-I471 HydrophobicContact CB-CB 4.39Å; V467-I471 HydrophobicContact CG1-CB 4.42Å; V467-I471 HydrophobicContact CG2-CB 4.2Å; V467-I471 HydrophobicContact CG2-CD1 3.96Å; V467-I471 HydrophobicContact CG2-CG1 4.4Å; V467-I471 PolarHBondContact O-N 2.91Å; V467-I471 VanDerWaalsContact O-N 3.08Å; V467-A472 WeakPolarHBondContact O-CB 3.34Å; V467-A472 PolarHBondContact O-N 3.05Å; V467-F475 HydrophobicContact CG1-CE2 4.19Å
468	L	91.6	Very high	93	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.237	C	C	.	.	I	π-helix	trans	-62.6	-31.9	178.6	-75.9	168.1	0	0	0	113.7	V138 L141 Y142 F145 T366 G367 F368 L464 L465	V138-L468 HydrophobicContact CG2-CD2 4.28Å; L141-L468 HydrophobicContact CB-CD2 3.59Å; L141-L468 HydrophobicContact CB-CG 4.14Å; L141-L468 HydrophobicContact CD1-CD2 4.11Å; L141-L468 HydrophobicContact CG-CD2 4.5Å; Y142-L468 HydrophobicContact CD1-CD1 3.73Å; Y142-L468 HydrophobicContact CD1-CD2 3.66Å; Y142-L468 HydrophobicContact CD1-CG 4.34Å; Y142-L468 HydrophobicContact CE1-CD1 4.15Å; Y142-L468 HydrophobicContact CE1-CD2 3.63Å; Y142-L468 HydrophobicContact CE1-CG 4.44Å; F145-L468 HydrophobicContact CB-CD1 4.28Å; F145-L468 HydrophobicContact CG-CD1 4.46Å; T366-L468 WeakPolarHBondContact CA-O 3.24Å; G367-L468 PolarHBondContact N-O 2.93Å; F368-L468 HydrophobicContact CE1-CD1 4.17Å; F368-L468 HydrophobicContact CZ-CD1 4.22Å; L464-L468 WeakPolarHBondContact O-CB 3.27Å; L464-L468 WeakPolarHBondContact O-CG 3.38Å; L464-L468 PolarHBondContact O-N 3.26Å; L465-L468 PolarHBondContact O-N 2.81Å
469	L	92.8	Very high	92.9	Very high	90 Å²	90	42.4 Å²	42.4	47%	0.471	23%	0.226	S	C	.	.	I	π-helix	trans	-87	-33.8	-179.1	-64.3	179.9	0	0	0	113.5	L465 V467	L465-L469 HydrophobicContact CD1-CD1 3.86Å; L465-L469 HydrophobicContact CD1-CG 4.09Å; L465-L469 HydrophobicContact CG-CD1 4Å; L465-L469 WeakPolarHBondContact O-CB 3.49Å; L465-L469 WeakPolarHBondContact O-CG 3.49Å; L465-L469 PolarHBondContact O-N 2.94Å; V467-L469 VanDerWaalsContact C-N 3.29Å; V467-L469 PolarHBondContact O-N 2.98Å
470	V	92.9	Very high	92.7	Very high	99 Å²	99	43.6 Å²	43.6	60%	0.6	23%	0.229	S	C	*	.	I	π-helix	trans	-130.6	-45.3	-167.5	-172.7	0	0	0	0	114	L466	L466-V470 HydrophobicContact CD1-CB 4.38Å; L466-V470 HydrophobicContact CD1-CG2 4.14Å; L466-V470 PolarHBondContact O-N 3.46Å
471	I	91.1	Very high	92.6	Very high	55 Å²	55	43.5 Å²	43.5	28%	0.282	23%	0.229	S	C	.	.	I	π-helix	trans	-87.5	-24.4	-166.8	-47.1	-177.3	0	0	0	112.1	L466 V467 P473 L474 F475	L466-I471 HydrophobicContact CD2-CD1 4.32Å; L466-I471 HydrophobicContact CG-CD1 4.11Å; L466-I471 HydrophobicContact CG-CG1 4.49Å; L466-I471 PolarHBondContact O-N 3.42Å; V467-I471 HydrophobicContact CB-CB 4.39Å; V467-I471 HydrophobicContact CG1-CB 4.42Å; V467-I471 HydrophobicContact CG2-CB 4.2Å; V467-I471 HydrophobicContact CG2-CD1 3.96Å; V467-I471 HydrophobicContact CG2-CG1 4.4Å; V467-I471 PolarHBondContact O-N 2.91Å; V467-I471 VanDerWaalsContact O-N 3.08Å; I471-P473 VanDerWaalsContact C-CD 3.42Å; I471-L474 HydrophobicContact CG2-CD1 4.09Å; I471-L474 WeakPolarHBondContact O-CB 3.28Å; I471-L474 PolarHBondContact O-N 3.29Å; I471-F475 HydrophobicContact CG2-CE2 3.92Å; I471-F475 HydrophobicContact CG2-CZ 4.18Å
472	A	87.9	Confident	92.6	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-49	-42.6	-173.7	0	0	0	0	0	115.7	I364 T366 V467 L474 F475	I364-A472 HydrophobicContact CB-CB 4.48Å; I364-A472 HydrophobicContact CG2-CB 4.04Å; T366-A472 HydrophobicContact CG2-CB 4.34Å; V467-A472 WeakPolarHBondContact O-CB 3.34Å; V467-A472 PolarHBondContact O-N 3.05Å; A472-L474 PolarHBondContact O-N 3.16Å; A472-F475 PolarHBondContact O-N 3.22Å
473	P	89.8	Confident	92.3	Very high	64 Å²	64	38.6 Å²	38.6	42%	0.416	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-63	-26.8	179.3	-24.1	36.3	0	0	0	114	T366 I471 F475 Y476	T366-P473 HydrophobicContact CG2-CG 3.55Å; I471-P473 VanDerWaalsContact C-CD 3.42Å; P473-F475 PolarHBondContact O-N 3.46Å; P473-Y476 VanDerWaalsContact O-CB 3.28Å; P473-Y476 WeakPolarHBondContact O-CB 3.42Å; P473-Y476 PolarHBondContact O-N 3.34Å; P473-Y476 VanDerWaalsContact O-N 3.08Å
474	L	91	Very high	92.2	Very high	124 Å²	124	37.2 Å²	37.2	65%	0.649	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-65.1	-22.1	179.8	-61	176.9	0	0	0	112.2	T344 I471 A472 Y476	T344-L474 WeakPolarHBondContact CG2-O 3.18Å; I471-L474 HydrophobicContact CG2-CD1 4.09Å; I471-L474 WeakPolarHBondContact O-CB 3.28Å; I471-L474 PolarHBondContact O-N 3.29Å; A472-L474 PolarHBondContact O-N 3.16Å; L474-Y476 VanDerWaalsContact C-N 3.28Å; L474-Y476 PolarHBondContact O-N 3.1Å
475	F	90.5	Very high	92.2	Very high	15 Å²	15	37.2 Å²	37.2	7%	0.066	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-82.6	3.6	176	-58	-66.1	0	0	0	113.9	V123 I127 V340 I364 V467 I471 A472 P473 S477 L478	V123-F475 HydrophobicContact CG1-CD2 4.42Å; V123-F475 HydrophobicContact CG1-CE1 4.47Å; V123-F475 HydrophobicContact CG1-CE2 3.63Å; V123-F475 HydrophobicContact CG1-CZ 3.65Å; I127-F475 HydrophobicContact CD1-CB 4.34Å; I127-F475 HydrophobicContact CD1-CD2 4.39Å; I127-F475 HydrophobicContact CD1-CG 4.29Å; V340-F475 HydrophobicContact CG1-CD1 4.16Å; V340-F475 HydrophobicContact CG1-CE1 3.81Å; I364-F475 HydrophobicContact CD1-CB 4.01Å; V467-F475 HydrophobicContact CG1-CE2 4.19Å; I471-F475 HydrophobicContact CG2-CE2 3.92Å; I471-F475 HydrophobicContact CG2-CZ 4.18Å; A472-F475 PolarHBondContact O-N 3.22Å; P473-F475 PolarHBondContact O-N 3.46Å; F475-S477 VanDerWaalsContact C-N 3.32Å; F475-S477 PolarHBondContact O-N 3.49Å; F475-L478 HydrophobicContact CB-CB 4.41Å; F475-L478 HydrophobicContact CB-CD2 4.48Å; F475-L478 HydrophobicContact CD1-CD2 4.11Å; F475-L478 WeakPolarHBondContact O-CB 3.43Å; F475-L478 PolarHBondContact O-N 3.38Å
476	Y	90.5	Very high	92	Very high	112 Å²	112	35 Å²	35	44%	0.439	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-49.7	178.6	178.9	-92.2	0	0	0	112.9	I360 G362 H363 P473 L474 L478	I360-Y476 HydrophobicContact CD1-CD1 4.45Å; I360-Y476 HydrophobicContact CD1-CE1 3.94Å; G362-Y476 PolarHBondContact N-O 3.23Å; G362-Y476 WeakPolarHBondContact O-CA 3.45Å; G362-Y476 WeakPolarHBondContact O-CD2 3.45Å; H363-Y476 HydrophobicContact CB-CD2 4.48Å; H363-Y476 HydrophobicContact CB-CE2 4.33Å; P473-Y476 VanDerWaalsContact O-CB 3.28Å; P473-Y476 WeakPolarHBondContact O-CB 3.42Å; P473-Y476 PolarHBondContact O-N 3.34Å; P473-Y476 VanDerWaalsContact O-N 3.08Å; L474-Y476 VanDerWaalsContact C-N 3.28Å; L474-Y476 PolarHBondContact O-N 3.1Å; Y476-L478 VanDerWaalsContact C-N 3.29Å; Y476-L478 PolarHBondContact O-N 3.39Å
477	S	92	Very high	91.7	Very high	15 Å²	15	30.4 Å²	30.4	11%	0.105	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	0.1	-178.9	-59	0	0	0	0	114.1	S347 H348 F475 Q479	S347-S477 WeakPolarHBondContact CB-O 3.21Å; S347-S477 PolarHBondContact OG-O 2.86Å; H348-S477 PolarHBondContact ND1-OG 3.19Å; H348-S477 VanDerWaalsContact ND1-OG 3.15Å; F475-S477 VanDerWaalsContact C-N 3.32Å; F475-S477 PolarHBondContact O-N 3.49Å; S477-Q479 PolarHBondContact O-N 3.08Å
478	L	92.2	Very high	91.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.163	C	C	.	.			trans	-66.3	122.9	-177.8	176.1	56.7	0	0	0	110.9	V340 I360 A361 F475 Y476 V482 L483	V340-L478 HydrophobicContact CG1-CD1 4.22Å; V340-L478 HydrophobicContact CG1-CD2 4.12Å; I360-L478 CarbonylContact C-O 3.49Å; I360-L478 WeakPolarHBondContact CA-O 3.1Å; A361-L478 HydrophobicContact CB-CB 4.4Å; A361-L478 PolarHBondContact N-O 3.26Å; F475-L478 HydrophobicContact CB-CB 4.41Å; F475-L478 HydrophobicContact CB-CD2 4.48Å; F475-L478 HydrophobicContact CD1-CD2 4.11Å; F475-L478 WeakPolarHBondContact O-CB 3.43Å; F475-L478 PolarHBondContact O-N 3.38Å; Y476-L478 VanDerWaalsContact C-N 3.29Å; Y476-L478 PolarHBondContact O-N 3.39Å; L478-V482 HydrophobicContact CD1-CB 4.16Å; L478-V482 HydrophobicContact CD1-CG1 4.25Å; L478-L483 HydrophobicContact CD2-CD1 4.06Å; L478-L483 HydrophobicContact CD2-CD2 3.89Å; L478-L483 HydrophobicContact CD2-CG 4Å; L478-L483 HydrophobicContact CG-CD1 4.2Å; L478-L483 HydrophobicContact CG-CG 4.24Å
479	Q	93.8	Very high	91.5	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.009	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-72.5	137.2	177.5	-65.7	172.2	-99.3	0	0	112.1	D304 T307 S359 S477 S481 V482	D304-Q479 PolarHBondContact OD1-NE2 3.1Å; T307-Q479 PolarHBondContact OG1-NE2 3.11Å; T307-Q479 PolarHBondContact OG1-OE1 3.09Å; S359-Q479 CarbonylContact O-C 3.57Å; S359-Q479 WeakPolarHBondContact O-CA 3.45Å; S477-Q479 PolarHBondContact O-N 3.08Å; Q479-S481 WeakPolarHBondContact CB-OG 3.39Å; Q479-S481 PolarHBondContact O-N 3.03Å; Q479-V482 HydrophobicContact CB-CG2 4.14Å; Q479-V482 WeakPolarHBondContact O-CB 3.39Å; Q479-V482 PolarHBondContact O-N 2.83Å; Q479-V482 VanDerWaalsContact O-N 3.16Å
480	K	91.4	Very high	91.1	Very high	51 Å²	51	28.6 Å²	28.6	22%	0.222	15%	0.149	C	C	.	.	H	α-helix	trans	-64.4	-27.8	175.9	-72.4	167.3	167	142	0	112.2	L131 Y271 S359 I360 V482 L483 A484	L131-K480 HydrophobicContact CD1-CD 4.45Å; L131-K480 HydrophobicContact CD1-CG 4.03Å; Y271-K480 HydrophobicContact CD1-CB 4.2Å; S359-K480 WeakPolarHBondContact O-CB 3.32Å; S359-K480 WeakPolarHBondContact O-CG 3.35Å; S359-K480 PolarHBondContact O-N 3.47Å; I360-K480 WeakPolarHBondContact O-CD 3.45Å; I360-K480 WeakPolarHBondContact O-CE 3.24Å; I360-K480 PolarHBondContact O-NZ 3.18Å; K480-V482 VanDerWaalsContact C-N 3.34Å; K480-V482 PolarHBondContact O-N 2.67Å; K480-L483 PolarHBondContact O-N 2.88Å; K480-A484 PolarHBondContact O-N 3.42Å
481	S	93.5	Very high	90.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-58.3	-40.5	170.7	54.4	0	0	0	0	113	Y271 D304 Q479 A484 V485	Y271-S481 WeakPolarHBondContact O-CA 3.35Å; Y271-S481 WeakPolarHBondContact O-CB 3.18Å; D304-S481 WeakPolarHBondContact OD1-CB 3.44Å; D304-S481 PolarHBondContact OD1-OG 3.08Å; Q479-S481 WeakPolarHBondContact CB-OG 3.39Å; Q479-S481 PolarHBondContact O-N 3.03Å; S481-A484 PolarHBondContact O-N 3.27Å; S481-V485 WeakPolarHBondContact O-CG2 3.1Å; S481-V485 PolarHBondContact O-N 3.07Å; S481-V485 VanDerWaalsContact O-N 3.12Å
482	V	94.3	Very high	90.5	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.8	-44.2	176.4	-178	0	0	0	0	111.3	T307 V339 A343 L478 Q479 K480 A484 V485 I486	T307-V482 HydrophobicContact CG2-CG2 3.57Å; V339-V482 HydrophobicContact CG1-CG1 4.45Å; A343-V482 HydrophobicContact CB-CG1 4.31Å; A343-V482 HydrophobicContact CB-CG2 3.75Å; L478-V482 HydrophobicContact CD1-CB 4.16Å; L478-V482 HydrophobicContact CD1-CG1 4.25Å; Q479-V482 HydrophobicContact CB-CG2 4.14Å; Q479-V482 WeakPolarHBondContact O-CB 3.39Å; Q479-V482 PolarHBondContact O-N 2.83Å; Q479-V482 VanDerWaalsContact O-N 3.16Å; K480-V482 VanDerWaalsContact C-N 3.34Å; K480-V482 PolarHBondContact O-N 2.67Å; V482-A484 VanDerWaalsContact C-N 3.28Å; V482-A484 PolarHBondContact O-N 3.17Å; V482-V485 PolarHBondContact O-N 3.27Å; V482-I486 HydrophobicContact CG1-CD1 4.01Å; V482-I486 WeakPolarHBondContact O-CG1 3.17Å; V482-I486 PolarHBondContact O-N 3.15Å
483	L	92	Very high	90.2	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.016	15%	0.146	C	C	.	.	H	α-helix	trans	-61.2	-36.2	176.7	-70.5	163.6	0	0	0	112.2	P124 I127 A128 L131 L478 K480 T487	P124-L483 HydrophobicContact CB-CD2 4.11Å; P124-L483 VanDerWaalsContact O-CD2 3.27Å; P124-L483 WeakPolarHBondContact O-CD2 3.37Å; I127-L483 HydrophobicContact CB-CD1 4.49Å; I127-L483 HydrophobicContact CB-CD2 4.15Å; I127-L483 HydrophobicContact CG2-CD1 3.63Å; I127-L483 HydrophobicContact CG2-CD2 4.17Å; A128-L483 HydrophobicContact CB-CB 3.93Å; A128-L483 HydrophobicContact CB-CD2 4.01Å; L131-L483 HydrophobicContact CD1-CD1 4.19Å; L478-L483 HydrophobicContact CD2-CD1 4.06Å; L478-L483 HydrophobicContact CD2-CD2 3.89Å; L478-L483 HydrophobicContact CD2-CG 4Å; L478-L483 HydrophobicContact CG-CD1 4.2Å; L478-L483 HydrophobicContact CG-CG 4.24Å; K480-L483 PolarHBondContact O-N 2.88Å; L483-T487 PolarHBondContact O-N 3.44Å; L483-T487 PolarHBondContact O-OG1 3.37Å
484	A	92.3	Very high	89.9	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-67.3	-44.1	174.5	0	0	0	0	0	112.6	Q268 L272 K480 S481 V482 I486 T487 I488	Q268-A484 HydrophobicContact CB-CB 4.3Å; Q268-A484 VanDerWaalsContact OE1-CB 3.32Å; L272-A484 HydrophobicContact CD2-CB 4.12Å; L272-A484 HydrophobicContact CG-CB 4.41Å; K480-A484 PolarHBondContact O-N 3.42Å; S481-A484 PolarHBondContact O-N 3.27Å; V482-A484 VanDerWaalsContact C-N 3.28Å; V482-A484 PolarHBondContact O-N 3.17Å; A484-I486 PolarHBondContact O-N 2.85Å; A484-T487 WeakPolarHBondContact O-CB 3.49Å; A484-T487 PolarHBondContact O-N 3Å; A484-I488 WeakPolarHBondContact O-CG1 3.43Å; A484-I488 PolarHBondContact O-N 3.19Å
485	V	94.3	Very high	89.8	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-58.5	-48.1	173.7	176.2	0	0	0	0	110.9	L272 S308 C311 L312 L315 S481 V482 T487 I488 V489	L272-V485 HydrophobicContact CD2-CB 4.44Å; L272-V485 HydrophobicContact CD2-CG2 3.44Å; L272-V485 VanDerWaalsContact CD2-CG2 3.44Å; S308-V485 WeakPolarHBondContact O-CG2 3.28Å; C311-V485 HydrophobicContact CB-CB 4.32Å; C311-V485 HydrophobicContact CB-CG1 4.06Å; C311-V485 HydrophobicContact CB-CG2 4.23Å; L312-V485 HydrophobicContact CB-CG1 4.16Å; L312-V485 HydrophobicContact CD1-CG1 4.02Å; L315-V485 HydrophobicContact CD1-CG1 3.84Å; S481-V485 WeakPolarHBondContact O-CG2 3.1Å; S481-V485 PolarHBondContact O-N 3.07Å; S481-V485 VanDerWaalsContact O-N 3.12Å; V482-V485 PolarHBondContact O-N 3.27Å; V485-T487 VanDerWaalsContact C-N 3.28Å; V485-T487 PolarHBondContact O-N 3.26Å; V485-I488 PolarHBondContact O-N 3.15Å; V485-V489 HydrophobicContact CG1-CG2 3.99Å; V485-V489 WeakPolarHBondContact O-CB 3.42Å; V485-V489 VanDerWaalsContact O-CG2 3.26Å; V485-V489 WeakPolarHBondContact O-CG2 3.46Å; V485-V489 PolarHBondContact O-N 3.47Å
486	I	90.2	Very high	89.7	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-58.1	-42.8	178.8	-69.2	163.7	0	0	0	110.8	P124 L315 E336 V340 V482 A484 N490	P124-I486 HydrophobicContact CB-CD1 4.22Å; L315-I486 HydrophobicContact CD1-CG1 4.09Å; E336-I486 HydrophobicContact CG-CG2 4.23Å; V340-I486 HydrophobicContact CG2-CD1 3.31Å; V482-I486 HydrophobicContact CG1-CD1 4.01Å; V482-I486 WeakPolarHBondContact O-CG1 3.17Å; V482-I486 PolarHBondContact O-N 3.15Å; A484-I486 PolarHBondContact O-N 2.85Å; I486-N490 WeakPolarHBondContact O-CB 3.38Å; I486-N490 PolarHBondContact O-N 2.97Å; I486-N490 VanDerWaalsContact O-N 3.1Å; I486-N490 PolarHBondContact O-ND2 3.03Å
487	T	88.9	Confident	89.6	Confident	2 Å²	2	23.1 Å²	23.1	1%	0.012	12%	0.121	C	C	.	.	H	α-helix	trans	-59.5	-51.5	175.6	-57.8	0	0	0	0	111.2	A128 Y129 I264 Q268 L483 A484 V485 V489 N490 L491	A128-T487 WeakPolarHBondContact CB-OG1 3.5Å; Y129-T487 HydrophobicContact CD1-CG2 4.42Å; Y129-T487 HydrophobicContact CE1-CG2 3.7Å; I264-T487 HydrophobicContact CG2-CG2 3.75Å; Q268-T487 HydrophobicContact CG-CG2 3.87Å; L483-T487 PolarHBondContact O-N 3.44Å; L483-T487 PolarHBondContact O-OG1 3.37Å; A484-T487 WeakPolarHBondContact O-CB 3.49Å; A484-T487 PolarHBondContact O-N 3Å; V485-T487 VanDerWaalsContact C-N 3.28Å; V485-T487 PolarHBondContact O-N 3.26Å; T487-V489 PolarHBondContact O-N 2.85Å; T487-N490 PolarHBondContact O-N 3.43Å; T487-N490 VanDerWaalsContact O-N 3.09Å; T487-L491 WeakPolarHBondContact O-CG 3.26Å; T487-L491 PolarHBondContact O-N 3.12Å; T487-L491 VanDerWaalsContact O-N 3.11Å
488	I	91.1	Very high	89.6	Confident	28 Å²	28	25.9 Å²	25.9	14%	0.144	13%	0.131	C	C	.	.	H	α-helix	trans	-63.3	-43.2	-178.2	-70	168.4	0	0	0	111.9	L265 Q268 L272 A484 V485 N490 L491 R492	L265-I488 HydrophobicContact CD1-CB 4.41Å; L265-I488 HydrophobicContact CD1-CD1 3.73Å; L265-I488 HydrophobicContact CD1-CG1 3.71Å; L265-I488 HydrophobicContact CD1-CG2 3.88Å; Q268-I488 HydrophobicContact CB-CD1 3.88Å; Q268-I488 HydrophobicContact CB-CG1 4.03Å; L272-I488 HydrophobicContact CD1-CD1 3.58Å; L272-I488 HydrophobicContact CD2-CD1 4.19Å; L272-I488 HydrophobicContact CG-CD1 4.01Å; A484-I488 WeakPolarHBondContact O-CG1 3.43Å; A484-I488 PolarHBondContact O-N 3.19Å; V485-I488 PolarHBondContact O-N 3.15Å; I488-N490 PolarHBondContact O-N 2.93Å; I488-L491 PolarHBondContact O-N 2.88Å; I488-L491 VanDerWaalsContact O-N 3.12Å; I488-R492 PolarHBondContact O-N 3.44Å
489	V	89.1	Confident	89.5	Confident	5 Å²	5	35.4 Å²	35.4	3%	0.03	17%	0.167	C	C	.	.	H	α-helix	trans	-61.2	-29.6	175.5	170.1	0	0	0	0	111.6	L312 L315 L316 K319 V485 T487 R492	L312-V489 HydrophobicContact CD1-CG2 4.08Å; L315-V489 HydrophobicContact CB-CG1 4.31Å; L315-V489 HydrophobicContact CB-CG2 4.02Å; L316-V489 HydrophobicContact CD2-CG2 3.95Å; L316-V489 HydrophobicContact CG-CG2 4.3Å; K319-V489 HydrophobicContact CD-CG1 3.59Å; K319-V489 HydrophobicContact CG-CG1 4.29Å; V485-V489 HydrophobicContact CG1-CG2 3.99Å; V485-V489 WeakPolarHBondContact O-CB 3.42Å; V485-V489 VanDerWaalsContact O-CG2 3.26Å; V485-V489 WeakPolarHBondContact O-CG2 3.46Å; V485-V489 PolarHBondContact O-N 3.47Å; T487-V489 PolarHBondContact O-N 2.85Å; V489-R492 WeakPolarHBondContact O-CB 3.4Å
490	N	84.4	Confident	89.3	Confident	25 Å²	25	38.7 Å²	38.7	13%	0.134	19%	0.185	C	C	.	.	H	α-helix	trans	-81.8	-23.1	176	-75.2	-35.4	0	0	0	114.2	Q125 K319 E336 I486 T487 I488 R492	Q125-N490 PolarHBondContact NE2-ND2 2.9Å; K319-N490 PolarHBondContact NZ-OD1 3.45Å; E336-N490 PolarHBondContact OE1-OD1 2.59Å; E336-N490 PolarHBondContact OE2-ND2 2.93Å; I486-N490 WeakPolarHBondContact O-CB 3.38Å; I486-N490 PolarHBondContact O-N 2.97Å; I486-N490 VanDerWaalsContact O-N 3.1Å; I486-N490 PolarHBondContact O-ND2 3.03Å; T487-N490 PolarHBondContact O-N 3.43Å; T487-N490 VanDerWaalsContact O-N 3.09Å; I488-N490 PolarHBondContact O-N 2.93Å; N490-R492 VanDerWaalsContact C-N 3.26Å; N490-R492 PolarHBondContact O-N 3.44Å
491	L	86.8	Confident	89.3	Confident	13 Å²	13	37.7 Å²	37.7	7%	0.068	18%	0.182	C	C	.	.	H	α-helix	trans	-73	-17	170.8	-61.4	172.4	0	0	0	113.2	I264 L265 T487 I488 G493 A494 L495	I264-L491 HydrophobicContact CB-CD1 3.85Å; I264-L491 HydrophobicContact CB-CD2 4.42Å; I264-L491 HydrophobicContact CD1-CD2 3.95Å; I264-L491 HydrophobicContact CG2-CD1 3.74Å; I264-L491 HydrophobicContact CG2-CD2 4.43Å; L265-L491 HydrophobicContact CB-CD1 4.32Å; T487-L491 WeakPolarHBondContact O-CG 3.26Å; T487-L491 PolarHBondContact O-N 3.12Å; T487-L491 VanDerWaalsContact O-N 3.11Å; I488-L491 PolarHBondContact O-N 2.88Å; I488-L491 VanDerWaalsContact O-N 3.12Å; L491-G493 PolarHBondContact O-N 3.35Å; L491-A494 PolarHBondContact O-N 2.84Å; L491-L495 HydrophobicContact CB-CD1 4.44Å; L491-L495 PolarHBondContact O-N 3.31Å; L491-L495 VanDerWaalsContact O-N 3.08Å
492	R	84.6	Confident	89.3	Confident	64 Å²	64	41.8 Å²	41.8	24%	0.242	21%	0.208	C	C	.	.	H	α-helix	trans	-47.1	-39	-179.2	-172.1	179.7	-172.5	-115.9	-0.2	113.8	E320 E323 I488 V489 N490 A494 L495 R496	E320-R492 IonicContact OE1-NH2 2.88Å; E320-R492 PolarHBondContact OE1-NH2 3.02Å; E320-R492 IonicContact OE2-CZ 3Å; E320-R492 IonicContact OE2-NH1 2.7Å; E320-R492 PolarHBondContact OE2-NH1 2.88Å; E320-R492 IonicContact OE2-NH2 3.66Å; E320-R492 PolarHBondContact OE2-NH2 2.87Å; E323-R492 IonicContact OE2-NH1 3.11Å; E323-R492 PolarHBondContact OE2-NH1 2.9Å; I488-R492 PolarHBondContact O-N 3.44Å; V489-R492 WeakPolarHBondContact O-CB 3.4Å; N490-R492 VanDerWaalsContact C-N 3.26Å; N490-R492 PolarHBondContact O-N 3.44Å; R492-A494 PolarHBondContact O-N 3.48Å; R492-L495 PolarHBondContact O-N 2.85Å; R492-R496 WeakPolarHBondContact O-CB 3.4Å; R492-R496 PolarHBondContact O-N 3.49Å
493	G	81.1	Confident	89.3	Confident	49 Å²	49	49.1 Å²	49.1	51%	0.505	24%	0.24	S	C	.	.	H	α-helix	trans	-65.9	-33.7	179.6	0	0	0	0	0	114.1	L491	L491-G493 PolarHBondContact O-N 3.35Å
494	A	85	Confident	89.4	Confident	17 Å²	17	51.1 Å²	51.1	14%	0.14	25%	0.25	C	C	.	.	H	α-helix	trans	-76.5	-47.8	173.2	0	0	0	0	0	110.8	V257 S261 L491 R492 R496 K497	V257-A494 HydrophobicContact CG1-CB 4.04Å; S261-A494 VanDerWaalsContact OG-CB 3.26Å; S261-A494 WeakPolarHBondContact OG-CB 3.37Å; L491-A494 PolarHBondContact O-N 2.84Å; R492-A494 PolarHBondContact O-N 3.48Å; A494-R496 PolarHBondContact O-N 3.17Å; A494-K497 WeakPolarHBondContact O-CB 3.12Å; A494-K497 VanDerWaalsContact O-CG 3.3Å; A494-K497 WeakPolarHBondContact O-CG 3.29Å; A494-K497 PolarHBondContact O-N 3.4Å
495	L	88.5	Confident	89.6	Confident	46 Å²	46	56.7 Å²	56.7	24%	0.241	27%	0.271	C	S	.	.	H	α-helix	trans	-62	-27.7	179.7	-62	176.1	0	0	0	113.1	F262 L265 L491 R492 K497 F498	F262-L495 HydrophobicContact CD1-CD2 4.46Å; F262-L495 HydrophobicContact CD2-CD2 4.38Å; F262-L495 HydrophobicContact CE1-CD2 4.25Å; F262-L495 HydrophobicContact CE2-CD2 4.17Å; F262-L495 HydrophobicContact CZ-CD2 4.1Å; L265-L495 HydrophobicContact CD2-CD1 4.33Å; L491-L495 HydrophobicContact CB-CD1 4.44Å; L491-L495 PolarHBondContact O-N 3.31Å; L491-L495 VanDerWaalsContact O-N 3.08Å; R492-L495 PolarHBondContact O-N 2.85Å; L495-K497 PolarHBondContact O-N 3.46Å; L495-F498 WeakPolarHBondContact O-CD2 3.44Å
496	R	87.8	Confident	89.6	Confident	84 Å²	84	63.3 Å²	63.3	32%	0.317	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-63.7	-16.1	173.2	-162.1	-177.5	-110.9	162.9	-9.7	113	E320 E323 R492 A494 F498 R499	E320-R496 VanDerWaalsContact CD-NH2 3.35Å; E320-R496 IonicContact OE1-NH2 3.28Å; E320-R496 PolarHBondContact OE1-NH2 3.49Å; E320-R496 VanDerWaalsContact OE1-NH2 3.11Å; E320-R496 IonicContact OE2-CZ 3.57Å; E320-R496 IonicContact OE2-NH2 2.83Å; E320-R496 PolarHBondContact OE2-NH2 3.09Å; E323-R496 IonicContact OE1-NH1 3.96Å; E323-R496 PolarHBondContact OE1-NH1 3.24Å; E323-R496 IonicContact OE2-CZ 2.67Å; E323-R496 IonicContact OE2-NH1 3.21Å; E323-R496 PolarHBondContact OE2-NH1 2.87Å; E323-R496 IonicContact OE2-NH2 3.4Å; E323-R496 PolarHBondContact OE2-NH2 3.3Å; R492-R496 WeakPolarHBondContact O-CB 3.4Å; R492-R496 PolarHBondContact O-N 3.49Å; A494-R496 PolarHBondContact O-N 3.17Å; R496-F498 VanDerWaalsContact C-N 3.25Å; R496-F498 PolarHBondContact O-N 3.24Å; R496-R499 WeakPolarHBondContact O-CB 3.32Å; R496-R499 PolarHBondContact O-N 3.37Å; R496-R499 VanDerWaalsContact O-N 3.09Å
497	K	88.6	Confident	89.8	Confident	81 Å²	81	69.5 Å²	69.5	35%	0.352	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-61.9	-24.1	179.9	-74.2	-76.9	146.6	-162.6	0	114.6	A494 L495 R499 D500 W515	A494-K497 WeakPolarHBondContact O-CB 3.12Å; A494-K497 VanDerWaalsContact O-CG 3.3Å; A494-K497 WeakPolarHBondContact O-CG 3.29Å; A494-K497 PolarHBondContact O-N 3.4Å; L495-K497 PolarHBondContact O-N 3.46Å; K497-R499 PolarHBondContact O-N 3.38Å; K497-R499 VanDerWaalsContact O-N 3.15Å; K497-D500 WeakPolarHBondContact CD-OD2 3.25Å; K497-D500 WeakPolarHBondContact CE-OD2 3.26Å; K497-D500 IonicContact NZ-OD2 2.76Å; K497-D500 PolarHBondContact NZ-OD2 3.12Å; K497-D500 WeakPolarHBondContact O-CB 3.29Å; K497-D500 PolarHBondContact O-N 3.22Å; K497-W515 HydrophobicContact CB-CZ2 4.24Å
498	F	91.9	Very high	90.1	Very high	74 Å²	74	70.5 Å²	70.5	33%	0.325	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-56.1	-30	172.1	-79.4	-89.3	0	0	0	113	T258 F262 L495 R496 D500 L501 W515 M519	T258-F498 HydrophobicContact CG2-CD2 4.03Å; T258-F498 HydrophobicContact CG2-CE2 3.41Å; T258-F498 VanDerWaalsContact CG2-CE2 3.41Å; T258-F498 HydrophobicContact CG2-CZ 4.15Å; F262-F498 AromaticContact CE2-CE2 3.52Å; F262-F498 HydrophobicContact CE2-CE2 3.52Å; F262-F498 AromaticContact CE2-CZ 3.66Å; F262-F498 HydrophobicContact CE2-CZ 3.66Å; F262-F498 AromaticContact CZ-CE2 3.71Å; F262-F498 HydrophobicContact CZ-CE2 3.71Å; F262-F498 AromaticContact CZ-CZ 3.94Å; F262-F498 HydrophobicContact CZ-CZ 3.94Å; L495-F498 WeakPolarHBondContact O-CD2 3.44Å; R496-F498 VanDerWaalsContact C-N 3.25Å; R496-F498 PolarHBondContact O-N 3.24Å; F498-D500 PolarHBondContact O-N 2.85Å; F498-L501 HydrophobicContact CB-CD1 4.26Å; F498-L501 HydrophobicContact CD1-CD1 3.56Å; F498-L501 HydrophobicContact CE1-CD1 4.28Å; F498-L501 HydrophobicContact CG-CD1 4.21Å; F498-L501 WeakPolarHBondContact O-CB 3.26Å; F498-L501 WeakPolarHBondContact O-CG 3.48Å; F498-L501 PolarHBondContact O-N 3.11Å; F498-W515 AromaticContact CD1-CH2 3.95Å; F498-W515 HydrophobicContact CD1-CH2 3.95Å; F498-W515 HydrophobicContact CD1-CZ3 4.37Å; F498-W515 HydrophobicContact CD2-CH2 4.2Å; F498-W515 AromaticContact CE1-CH2 3.72Å; F498-W515 HydrophobicContact CE1-CH2 3.72Å; F498-W515 AromaticContact CE1-CZ3 4Å; F498-W515 HydrophobicContact CE1-CZ3 4Å; F498-W515 AromaticContact CE2-CH2 3.99Å; F498-W515 HydrophobicContact CE2-CH2 3.99Å; F498-W515 HydrophobicContact CG-CH2 4.18Å; F498-W515 AromaticContact CZ-CH2 3.75Å; F498-W515 HydrophobicContact CZ-CH2 3.75Å; F498-W515 HydrophobicContact CZ-CZ3 4.31Å; F498-M519 HydrophobicContact CE1-CE 4.09Å; F498-M519 HydrophobicContact CZ-CE 3.91Å; F498-M519 HydrophobicContact CZ-CG 4.37Å; F498-M519 HydrophobicContact CZ-SD 3.91Å
499	R	91.1	Very high	90.2	Very high	200 Å²	200	77.2 Å²	77.2	76%	0.755	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-70.8	-18.5	177.7	-156.7	-179.8	71.8	158.6	2.6	113.4	R496 K497	R496-R499 WeakPolarHBondContact O-CB 3.32Å; R496-R499 PolarHBondContact O-N 3.37Å; R496-R499 VanDerWaalsContact O-N 3.09Å; K497-R499 PolarHBondContact O-N 3.38Å; K497-R499 VanDerWaalsContact O-N 3.15Å
500	D	88.9	Confident	90.3	Very high	70 Å²	70	80.5 Å²	80.5	37%	0.374	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-84	-16.2	177.9	-60.9	-19.2	0	0	0	112	K497 F498 K503 M504	K497-D500 WeakPolarHBondContact CD-OD2 3.25Å; K497-D500 WeakPolarHBondContact CE-OD2 3.26Å; K497-D500 IonicContact NZ-OD2 2.76Å; K497-D500 PolarHBondContact NZ-OD2 3.12Å; K497-D500 WeakPolarHBondContact O-CB 3.29Å; K497-D500 PolarHBondContact O-N 3.22Å; F498-D500 PolarHBondContact O-N 2.85Å; D500-K503 PolarHBondContact O-N 2.66Å; D500-M504 PolarHBondContact O-N 3.35Å
501	L	92	Very high	90.8	Very high	31 Å²	31	81.9 Å²	81.9	16%	0.162	39%	0.392	C	S	.	.	H	α-helix	trans	-58.2	-44.2	-174.8	-64.2	170.5	0	0	0	115	F498 K503 M504 W505 T512 W515	F498-L501 HydrophobicContact CB-CD1 4.26Å; F498-L501 HydrophobicContact CD1-CD1 3.56Å; F498-L501 HydrophobicContact CE1-CD1 4.28Å; F498-L501 HydrophobicContact CG-CD1 4.21Å; F498-L501 WeakPolarHBondContact O-CB 3.26Å; F498-L501 WeakPolarHBondContact O-CG 3.48Å; F498-L501 PolarHBondContact O-N 3.11Å; L501-K503 VanDerWaalsContact C-N 3.26Å; L501-K503 PolarHBondContact O-N 2.93Å; L501-M504 HydrophobicContact CD2-CE 3.69Å; L501-M504 PolarHBondContact O-N 3.22Å; L501-W505 WeakPolarHBondContact O-CB 3.39Å; L501-W505 PolarHBondContact O-N 3.43Å; L501-T512 HydrophobicContact CD2-CG2 4.2Å; L501-W515 HydrophobicContact CD1-CE3 4.31Å; L501-W515 HydrophobicContact CD1-CH2 3.98Å; L501-W515 HydrophobicContact CD1-CZ3 3.71Å; L501-W515 HydrophobicContact CD2-CD2 3.66Å; L501-W515 HydrophobicContact CD2-CE3 3.39Å; L501-W515 HydrophobicContact CD2-CG 4.32Å; L501-W515 HydrophobicContact CD2-CH2 4.08Å; L501-W515 HydrophobicContact CD2-CZ2 4.28Å; L501-W515 HydrophobicContact CD2-CZ3 3.63Å; L501-W515 HydrophobicContact CG-CE3 4.44Å; L501-W515 HydrophobicContact CG-CH2 4.4Å; L501-W515 HydrophobicContact CG-CZ3 4.22Å
502	P	93.7	Very high	91.2	Very high	85 Å²	85	81.9 Å²	81.9	55%	0.552	39%	0.392	S	S	*	.	H	α-helix	trans	-63.6	-35.1	-179.9	-21.9	34.7	0	0	0	112	N506	P502-N506 VanDerWaalsContact O-CG 3.31Å; P502-N506 PolarHBondContact O-N 3.08Å; P502-N506 PolarHBondContact O-ND2 3.41Å
503	K	94.1	Very high	91.7	Very high	154 Å²	154	81.4 Å²	81.4	67%	0.67	40%	0.396	S	S	*	.	H	α-helix	trans	-69.7	-43.5	174.5	-174.5	177	179.2	179.9	0	111.1	D500 L501 N506 I507	D500-K503 PolarHBondContact O-N 2.66Å; L501-K503 VanDerWaalsContact C-N 3.26Å; L501-K503 PolarHBondContact O-N 2.93Å; K503-N506 PolarHBondContact O-N 3.46Å; K503-I507 HydrophobicContact CG-CD1 4.02Å; K503-I507 WeakPolarHBondContact O-CG1 3.33Å; K503-I507 PolarHBondContact O-N 2.92Å
504	M	93.1	Very high	92.4	Very high	46 Å²	46	79.3 Å²	79.3	23%	0.227	37%	0.374	C	S	.	.	H	α-helix	trans	-64	-41.9	178.4	-167.7	168.3	48.7	0	0	111.8	D500 L501 N506 I507 S508 T512 W515	D500-M504 PolarHBondContact O-N 3.35Å; L501-M504 HydrophobicContact CD2-CE 3.69Å; L501-M504 PolarHBondContact O-N 3.22Å; M504-N506 VanDerWaalsContact C-N 3.32Å; M504-N506 PolarHBondContact O-N 3Å; M504-I507 PolarHBondContact O-N 3.37Å; M504-I507 VanDerWaalsContact O-N 3.11Å; M504-S508 CarbonylContact O-C 3.56Å; M504-S508 PolarHBondContact O-N 2.82Å; M504-T512 VanDerWaalsContact C-OG1 3.24Å; M504-T512 HydrophobicContact CE-CG2 4.36Å; M504-T512 WeakPolarHBondContact CG-OG1 3.35Å; M504-W515 HydrophobicContact CE-CB 3.82Å; M504-W515 HydrophobicContact CE-CD2 4.46Å; M504-W515 HydrophobicContact CE-CG 3.82Å
505	W	95.8	Very high	92.9	Very high	117 Å²	117	78.6 Å²	78.6	44%	0.443	37%	0.367	S	S	.	.	H	α-helix	trans	-59.5	-38.8	176.3	-178.2	-98.4	0	0	0	113.4	L501 I507 R509 T512 V513	L501-W505 WeakPolarHBondContact O-CB 3.39Å; L501-W505 PolarHBondContact O-N 3.43Å; W505-I507 VanDerWaalsContact C-N 3.32Å; W505-R509 HydrophobicContact CD2-CB 4.43Å; W505-R509 HydrophobicContact CD2-CG 3.99Å; W505-R509 HydrophobicContact CE3-CB 4.15Å; W505-R509 HydrophobicContact CE3-CG 4.22Å; W505-R509 HydrophobicContact CH2-CB 4.23Å; W505-R509 HydrophobicContact CH2-CG 4.28Å; W505-R509 HydrophobicContact CZ2-CB 4.5Å; W505-R509 HydrophobicContact CZ2-CG 4.05Å; W505-R509 HydrophobicContact CZ3-CB 4.04Å; W505-R509 HydrophobicContact CZ3-CG 4.36Å; W505-R509 WeakPolarHBondContact O-CG 3.43Å; W505-T512 WeakPolarHBondContact CA-OG1 3.43Å; W505-T512 HydrophobicContact CB-CG2 4.38Å; W505-T512 HydrophobicContact CE3-CG2 3.87Å; W505-T512 PolarHBondContact N-OG1 3.49Å; W505-T512 VanDerWaalsContact N-OG1 3.1Å; W505-V513 HydrophobicContact CZ3-CG2 4.12Å
506	N	95.4	Very high	93.2	Very high	138 Å²	138	81.3 Å²	81.3	74%	0.738	38%	0.378	S	S	*	.	H	α-helix	trans	-72	-24.9	177.5	-70.6	-10.7	0	0	0	113.1	P502 K503 M504	P502-N506 VanDerWaalsContact O-CG 3.31Å; P502-N506 PolarHBondContact O-N 3.08Å; P502-N506 PolarHBondContact O-ND2 3.41Å; K503-N506 PolarHBondContact O-N 3.46Å; M504-N506 VanDerWaalsContact C-N 3.32Å; M504-N506 PolarHBondContact O-N 3Å
507	I	93.9	Very high	93.7	Very high	130 Å²	130	79.1 Å²	79.1	67%	0.667	37%	0.373	S	S	*	.	H	α-helix	trans	-85.9	-50.3	176.1	-65.5	165.8	0	0	0	110.8	K503 M504 W505	K503-I507 HydrophobicContact CG-CD1 4.02Å; K503-I507 WeakPolarHBondContact O-CG1 3.33Å; K503-I507 PolarHBondContact O-N 2.92Å; M504-I507 PolarHBondContact O-N 3.37Å; M504-I507 VanDerWaalsContact O-N 3.11Å; W505-I507 VanDerWaalsContact C-N 3.32Å
508	S	94.4	Very high	94	Very high	23 Å²	23	75.3 Å²	75.3	16%	0.161	36%	0.357	C	S	.	.			trans	-153	106.6	-176.5	-177.7	0	0	0	0	111.2	M504 M510 D511 T512	M504-S508 CarbonylContact O-C 3.56Å; M504-S508 PolarHBondContact O-N 2.82Å; S508-M510 VanDerWaalsContact C-N 3.28Å; S508-M510 PolarHBondContact O-N 3.48Å; S508-D511 WeakPolarHBondContact CB-OD2 3.47Å; S508-D511 PolarHBondContact O-N 2.97Å; S508-D511 VanDerWaalsContact OG-CG 3.27Å; S508-D511 PolarHBondContact OG-N 3.44Å; S508-D511 PolarHBondContact OG-OD2 2.95Å; S508-T512 PolarHBondContact O-N 3.04Å; S508-T512 PolarHBondContact O-OG1 3.01Å
509	R	93.5	Very high	94.1	Very high	169 Å²	169	72.3 Å²	72.3	64%	0.638	34%	0.344	S	S	*	.	H	α-helix	trans	-61.2	-37.5	176	-59.8	-177.5	-172.9	171.1	1.9	111.9	W505 T512 V513	W505-R509 HydrophobicContact CD2-CB 4.43Å; W505-R509 HydrophobicContact CD2-CG 3.99Å; W505-R509 HydrophobicContact CE3-CB 4.15Å; W505-R509 HydrophobicContact CE3-CG 4.22Å; W505-R509 HydrophobicContact CH2-CB 4.23Å; W505-R509 HydrophobicContact CH2-CG 4.28Å; W505-R509 HydrophobicContact CZ2-CB 4.5Å; W505-R509 HydrophobicContact CZ2-CG 4.05Å; W505-R509 HydrophobicContact CZ3-CB 4.04Å; W505-R509 HydrophobicContact CZ3-CG 4.36Å; W505-R509 WeakPolarHBondContact O-CG 3.43Å; R509-T512 PolarHBondContact O-N 3.07Å; R509-V513 WeakPolarHBondContact O-CG2 3.26Å; R509-V513 PolarHBondContact O-N 3.03Å
510	M	92.1	Very high	94.3	Very high	74 Å²	74	66.4 Å²	66.4	37%	0.365	33%	0.327	S	S	.	.	H	α-helix	trans	-62.7	-45.9	-178.8	-64.3	-56.5	-62.1	0	0	111.7	S508 T512 V513 I514 C541	S508-M510 VanDerWaalsContact C-N 3.28Å; S508-M510 PolarHBondContact O-N 3.48Å; M510-T512 VanDerWaalsContact C-N 3.31Å; M510-T512 PolarHBondContact O-N 3.2Å; M510-V513 PolarHBondContact O-N 3.31Å; M510-V513 VanDerWaalsContact O-N 3.14Å; M510-I514 WeakPolarHBondContact O-CG1 3.45Å; M510-I514 PolarHBondContact O-N 3.19Å; M510-C541 HydrophobicContact CE-CB 3.72Å; M510-C541 VanDerWaalsContact CE-SG 3.58Å
511	D	93.8	Very high	94.6	Very high	54 Å²	54	63.6 Å²	63.6	29%	0.289	31%	0.313	S	S	.	.	H	α-helix	trans	-68.1	-34.1	-178.4	-58.2	-44.8	0	0	0	111.3	A251 S508 I514 W515	A251-D511 HydrophobicContact CB-CB 4.06Å; S508-D511 WeakPolarHBondContact CB-OD2 3.47Å; S508-D511 PolarHBondContact O-N 2.97Å; S508-D511 VanDerWaalsContact OG-CG 3.27Å; S508-D511 PolarHBondContact OG-N 3.44Å; S508-D511 PolarHBondContact OG-OD2 2.95Å; D511-I514 PolarHBondContact O-N 2.66Å; D511-W515 WeakPolarHBondContact O-CB 3.47Å; D511-W515 PolarHBondContact O-N 3.08Å
512	T	95.1	Very high	94.5	Very high	13 Å²	13	62.1 Å²	62.1	8%	0.08	31%	0.305	C	S	.	.	H	α-helix	trans	-66.5	-36.6	171.1	-54.6	0	0	0	0	113.1	L501 M504 W505 S508 R509 M510 W515 F516	L501-T512 HydrophobicContact CD2-CG2 4.2Å; M504-T512 VanDerWaalsContact C-OG1 3.24Å; M504-T512 HydrophobicContact CE-CG2 4.36Å; M504-T512 WeakPolarHBondContact CG-OG1 3.35Å; W505-T512 WeakPolarHBondContact CA-OG1 3.43Å; W505-T512 HydrophobicContact CB-CG2 4.38Å; W505-T512 HydrophobicContact CE3-CG2 3.87Å; W505-T512 PolarHBondContact N-OG1 3.49Å; W505-T512 VanDerWaalsContact N-OG1 3.1Å; S508-T512 PolarHBondContact O-N 3.04Å; S508-T512 PolarHBondContact O-OG1 3.01Å; R509-T512 PolarHBondContact O-N 3.07Å; M510-T512 VanDerWaalsContact C-N 3.31Å; M510-T512 PolarHBondContact O-N 3.2Å; T512-W515 PolarHBondContact O-N 3.29Å; T512-F516 WeakPolarHBondContact O-CB 3.02Å; T512-F516 PolarHBondContact O-N 3.09Å
513	V	95.4	Very high	94.5	Very high	54 Å²	54	58.5 Å²	58.5	33%	0.327	28%	0.282	S	S	.	.	H	α-helix	trans	-68.3	-42.1	174	177.9	0	0	0	0	110.7	W505 R509 M510 W515 F516 V517 F537	W505-V513 HydrophobicContact CZ3-CG2 4.12Å; R509-V513 WeakPolarHBondContact O-CG2 3.26Å; R509-V513 PolarHBondContact O-N 3.03Å; M510-V513 PolarHBondContact O-N 3.31Å; M510-V513 VanDerWaalsContact O-N 3.14Å; V513-W515 VanDerWaalsContact C-N 3.34Å; V513-W515 PolarHBondContact O-N 3.14Å; V513-F516 PolarHBondContact O-N 3.46Å; V513-V517 HydrophobicContact CG1-CG2 4.16Å; V513-V517 WeakPolarHBondContact O-CB 3.17Å; V513-V517 VanDerWaalsContact O-CG2 3.32Å; V513-V517 WeakPolarHBondContact O-CG2 3.3Å; V513-V517 PolarHBondContact O-N 3.12Å; V513-F537 HydrophobicContact CG1-CE1 3.83Å; V513-F537 HydrophobicContact CG1-CZ 3.72Å
514	I	95.4	Very high	94.4	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-58.7	-46.4	173.9	-66.2	164.4	0	0	0	110.6	L252 M510 D511 F516 T518 F537 C541	L252-I514 HydrophobicContact CB-CG2 4.07Å; M510-I514 WeakPolarHBondContact O-CG1 3.45Å; M510-I514 PolarHBondContact O-N 3.19Å; D511-I514 PolarHBondContact O-N 2.66Å; I514-F516 PolarHBondContact O-N 2.99Å; I514-T518 WeakPolarHBondContact O-CB 3.43Å; I514-T518 PolarHBondContact O-N 3.38Å; I514-T518 PolarHBondContact O-OG1 2.93Å; I514-F537 HydrophobicContact CB-CD1 4.48Å; I514-F537 HydrophobicContact CG1-CD1 3.97Å; I514-F537 HydrophobicContact CG1-CE1 3.97Å; I514-C541 HydrophobicContact CD1-CB 3.9Å; I514-C541 HydrophobicContact CG1-CB 4.2Å
515	W	96.2	Very high	94.2	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.008	27%	0.27	C	S	.	.	H	α-helix	trans	-58	-48.7	175.7	-174.5	99.6	0	0	0	111.6	A251 S254 G255 T258 K497 F498 L501 M504 D511 T512 V513 T518 M519	A251-W515 HydrophobicContact CB-CB 4.47Å; S254-W515 PolarHBondContact OG-NE1 3.33Å; G255-W515 VanDerWaalsContact N-CD1 3.31Å; T258-W515 HydrophobicContact CG2-CH2 4Å; T258-W515 HydrophobicContact CG2-CZ2 3.81Å; K497-W515 HydrophobicContact CB-CZ2 4.24Å; F498-W515 AromaticContact CD1-CH2 3.95Å; F498-W515 HydrophobicContact CD1-CH2 3.95Å; F498-W515 HydrophobicContact CD1-CZ3 4.37Å; F498-W515 HydrophobicContact CD2-CH2 4.2Å; F498-W515 AromaticContact CE1-CH2 3.72Å; F498-W515 HydrophobicContact CE1-CH2 3.72Å; F498-W515 AromaticContact CE1-CZ3 4Å; F498-W515 HydrophobicContact CE1-CZ3 4Å; F498-W515 AromaticContact CE2-CH2 3.99Å; F498-W515 HydrophobicContact CE2-CH2 3.99Å; F498-W515 HydrophobicContact CG-CH2 4.18Å; F498-W515 AromaticContact CZ-CH2 3.75Å; F498-W515 HydrophobicContact CZ-CH2 3.75Å; F498-W515 HydrophobicContact CZ-CZ3 4.31Å; L501-W515 HydrophobicContact CD1-CE3 4.31Å; L501-W515 HydrophobicContact CD1-CH2 3.98Å; L501-W515 HydrophobicContact CD1-CZ3 3.71Å; L501-W515 HydrophobicContact CD2-CD2 3.66Å; L501-W515 HydrophobicContact CD2-CE3 3.39Å; L501-W515 HydrophobicContact CD2-CG 4.32Å; L501-W515 HydrophobicContact CD2-CH2 4.08Å; L501-W515 HydrophobicContact CD2-CZ2 4.28Å; L501-W515 HydrophobicContact CD2-CZ3 3.63Å; L501-W515 HydrophobicContact CG-CE3 4.44Å; L501-W515 HydrophobicContact CG-CH2 4.4Å; L501-W515 HydrophobicContact CG-CZ3 4.22Å; M504-W515 HydrophobicContact CE-CB 3.82Å; M504-W515 HydrophobicContact CE-CD2 4.46Å; M504-W515 HydrophobicContact CE-CG 3.82Å; D511-W515 WeakPolarHBondContact O-CB 3.47Å; D511-W515 PolarHBondContact O-N 3.08Å; T512-W515 PolarHBondContact O-N 3.29Å; V513-W515 VanDerWaalsContact C-N 3.34Å; V513-W515 PolarHBondContact O-N 3.14Å; W515-T518 PolarHBondContact O-N 3.41Å; W515-M519 HydrophobicContact CE3-CB 4.18Å; W515-M519 HydrophobicContact CH2-CB 4.32Å; W515-M519 HydrophobicContact CH2-CG 3.87Å; W515-M519 HydrophobicContact CZ2-CG 4.39Å; W515-M519 HydrophobicContact CZ3-CB 4.05Å; W515-M519 HydrophobicContact CZ3-CE 4.03Å; W515-M519 HydrophobicContact CZ3-CG 3.97Å; W515-M519 WeakPolarHBondContact O-CB 3.47Å; W515-M519 PolarHBondContact O-N 3.42Å
516	F	95.9	Very high	93.6	Very high	104 Å²	104	49.8 Å²	49.8	46%	0.456	25%	0.253	S	S	.	.	H	α-helix	trans	-68.1	-43.5	-176.1	-172.2	-93.9	0	0	0	112.4	T512 V513 I514 M519 L520	T512-F516 WeakPolarHBondContact O-CB 3.02Å; T512-F516 PolarHBondContact O-N 3.09Å; V513-F516 PolarHBondContact O-N 3.46Å; I514-F516 PolarHBondContact O-N 2.99Å; F516-M519 HydrophobicContact CD2-CE 4.06Å; F516-M519 HydrophobicContact CE2-CE 4.08Å; F516-M519 PolarHBondContact O-N 3.29Å; F516-L520 HydrophobicContact CE1-CD2 4.03Å; F516-L520 VanDerWaalsContact O-CB 3.26Å; F516-L520 WeakPolarHBondContact O-CB 3.37Å; F516-L520 PolarHBondContact O-N 3.14Å
517	V	96.6	Very high	93	Very high	38 Å²	38	43.3 Å²	43.3	23%	0.23	22%	0.218	C	C	.	.	H	α-helix	trans	-60.5	-47	175.2	169.5	0	0	0	0	110.6	V513 L520 S521 V533 F537	V513-V517 HydrophobicContact CG1-CG2 4.16Å; V513-V517 WeakPolarHBondContact O-CB 3.17Å; V513-V517 VanDerWaalsContact O-CG2 3.32Å; V513-V517 WeakPolarHBondContact O-CG2 3.3Å; V513-V517 PolarHBondContact O-N 3.12Å; V517-L520 PolarHBondContact O-N 3.11Å; V517-S521 WeakPolarHBondContact O-CB 3.19Å; V517-S521 PolarHBondContact O-N 3.09Å; V517-S521 PolarHBondContact O-OG 3.46Å; V517-V533 HydrophobicContact CG1-CG1 4.12Å; V517-F537 HydrophobicContact CB-CD1 4.08Å; V517-F537 HydrophobicContact CB-CE1 4.16Å; V517-F537 HydrophobicContact CB-CG 4.5Å; V517-F537 HydrophobicContact CG1-CB 4.33Å; V517-F537 HydrophobicContact CG1-CD1 4.04Å; V517-F537 HydrophobicContact CG1-CD2 4.33Å; V517-F537 HydrophobicContact CG1-CE1 4.47Å; V517-F537 HydrophobicContact CG1-CG 3.96Å; V517-F537 HydrophobicContact CG2-CD1 4.27Å; V517-F537 HydrophobicContact CG2-CE1 3.89Å; V517-F537 HydrophobicContact CG2-CE2 4.4Å; V517-F537 HydrophobicContact CG2-CZ 3.96Å
518	T	94.8	Very high	92.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-67.3	-38.7	-179.6	-48.2	0	0	0	0	112.4	L252 F256 I514 W515 S521 S522 G534	L252-T518 HydrophobicContact CG-CG2 4.37Å; F256-T518 HydrophobicContact CB-CG2 3.85Å; I514-T518 WeakPolarHBondContact O-CB 3.43Å; I514-T518 PolarHBondContact O-N 3.38Å; I514-T518 PolarHBondContact O-OG1 2.93Å; W515-T518 PolarHBondContact O-N 3.41Å; T518-S521 PolarHBondContact O-OG 3.39Å; T518-S522 WeakPolarHBondContact O-CB 3.17Å; T518-S522 PolarHBondContact O-N 3.48Å; T518-G534 VanDerWaalsContact OG1-CA 3.28Å; T518-G534 WeakPolarHBondContact OG1-CA 3.26Å
519	M	95.1	Very high	92.1	Very high	12 Å²	12	41.8 Å²	41.8	6%	0.059	21%	0.207	C	C	.	.	H	α-helix	trans	-65.6	-46.9	176.8	-176.2	-76.5	-59.2	0	0	111.2	G255 T258 G259 F262 F498 W515 F516 A523	G255-M519 VanDerWaalsContact O-CA 3.32Å; G255-M519 WeakPolarHBondContact O-CA 3.16Å; G255-M519 WeakPolarHBondContact O-CB 3.46Å; T258-M519 HydrophobicContact CG2-CG 4Å; G259-M519 WeakPolarHBondContact CA-O 3.41Å; F262-M519 HydrophobicContact CD2-SD 4.39Å; F262-M519 HydrophobicContact CE2-SD 4.15Å; F498-M519 HydrophobicContact CE1-CE 4.09Å; F498-M519 HydrophobicContact CZ-CE 3.91Å; F498-M519 HydrophobicContact CZ-CG 4.37Å; F498-M519 HydrophobicContact CZ-SD 3.91Å; W515-M519 HydrophobicContact CE3-CB 4.18Å; W515-M519 HydrophobicContact CH2-CB 4.32Å; W515-M519 HydrophobicContact CH2-CG 3.87Å; W515-M519 HydrophobicContact CZ2-CG 4.39Å; W515-M519 HydrophobicContact CZ3-CB 4.05Å; W515-M519 HydrophobicContact CZ3-CE 4.03Å; W515-M519 HydrophobicContact CZ3-CG 3.97Å; W515-M519 WeakPolarHBondContact O-CB 3.47Å; W515-M519 PolarHBondContact O-N 3.42Å; F516-M519 HydrophobicContact CD2-CE 4.06Å; F516-M519 HydrophobicContact CE2-CE 4.08Å; F516-M519 PolarHBondContact O-N 3.29Å; M519-A523 WeakPolarHBondContact O-CB 3.4Å; M519-A523 PolarHBondContact O-N 2.93Å
520	L	95	Very high	91.9	Very high	75 Å²	75	33.7 Å²	33.7	39%	0.393	18%	0.177	S	C	.	.	H	α-helix	trans	-69.4	-43	-178.4	-170.6	66.7	0	0	0	112.1	F516 V517 A523 L524	F516-L520 HydrophobicContact CE1-CD2 4.03Å; F516-L520 VanDerWaalsContact O-CB 3.26Å; F516-L520 WeakPolarHBondContact O-CB 3.37Å; F516-L520 PolarHBondContact O-N 3.14Å; V517-L520 PolarHBondContact O-N 3.11Å; L520-A523 PolarHBondContact O-N 3.04Å; L520-L524 HydrophobicContact CD1-CD1 3.58Å; L520-L524 HydrophobicContact CD1-CG 4.07Å; L520-L524 HydrophobicContact CG-CD1 3.99Å; L520-L524 WeakPolarHBondContact O-CB 3.3Å; L520-L524 WeakPolarHBondContact O-CG 3.44Å; L520-L524 PolarHBondContact O-N 3.47Å
521	S	94.8	Very high	91.5	Very high	12 Å²	12	30.8 Å²	30.8	8%	0.084	16%	0.162	C	C	.	.	H	α-helix	trans	-63.8	-42.9	176.3	63.3	0	0	0	0	111.6	V517 T518 A523 L525 G530	V517-S521 WeakPolarHBondContact O-CB 3.19Å; V517-S521 PolarHBondContact O-N 3.09Å; V517-S521 PolarHBondContact O-OG 3.46Å; T518-S521 PolarHBondContact O-OG 3.39Å; S521-A523 VanDerWaalsContact C-N 3.28Å; S521-A523 PolarHBondContact O-N 3.19Å; S521-L525 WeakPolarHBondContact O-CB 3.24Å; S521-L525 PolarHBondContact O-N 3.12Å; S521-G530 VanDerWaalsContact OG-CA 3.29Å; S521-G530 WeakPolarHBondContact OG-CA 3.31Å; S521-G530 PolarHBondContact OG-O 2.95Å; S521-G530 VanDerWaalsContact OG-O 3.1Å
522	S	91.4	Very high	91.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-69.7	-19.9	177.4	-177.8	0	0	0	0	114.4	A260 T518	A260-S522 PolarHBondContact N-OG 2.83Å; T518-S522 WeakPolarHBondContact O-CB 3.17Å; T518-S522 PolarHBondContact O-N 3.48Å
523	A	92.2	Very high	91.1	Very high	8 Å²	8	35.6 Å²	35.6	7%	0.066	19%	0.189	C	C	.	.	H	α-helix	trans	-91.8	-33.1	176.8	0	0	0	0	0	113.1	F262 L286 M519 L520 S521	F262-A523 HydrophobicContact CB-CB 4.46Å; L286-A523 WeakPolarHBondContact CB-O 3.41Å; L286-A523 HydrophobicContact CD1-CB 4.44Å; L286-A523 WeakPolarHBondContact CD1-O 3.2Å; M519-A523 WeakPolarHBondContact O-CB 3.4Å; M519-A523 PolarHBondContact O-N 2.93Å; L520-A523 PolarHBondContact O-N 3.04Å; S521-A523 VanDerWaalsContact C-N 3.28Å; S521-A523 PolarHBondContact O-N 3.19Å
524	L	91.7	Very high	91	Very high	65 Å²	65	33 Å²	33	34%	0.34	17%	0.173	S	C	.	.	H	α-helix	trans	-104.3	-30.8	-172	-62.1	-173.8	0	0	0	115.2	G284 I287 L520	G284-L524 WeakPolarHBondContact CA-O 3.34Å; G284-L524 PolarHBondContact N-O 2.82Å; I287-L524 HydrophobicContact CD1-CD2 4.22Å; I287-L524 HydrophobicContact CG1-CD2 4.37Å; L520-L524 HydrophobicContact CD1-CD1 3.58Å; L520-L524 HydrophobicContact CD1-CG 4.07Å; L520-L524 HydrophobicContact CG-CD1 3.99Å; L520-L524 WeakPolarHBondContact O-CB 3.3Å; L520-L524 WeakPolarHBondContact O-CG 3.44Å; L520-L524 PolarHBondContact O-N 3.47Å
525	L	89.6	Confident	90.7	Very high	59 Å²	59	35 Å²	35	31%	0.309	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-84.7	-178.8	-55.3	179.4	0	0	0	109.9	V283 S521 I529	V283-L525 WeakPolarHBondContact CA-O 3.36Å; V283-L525 HydrophobicContact CG1-CD2 3.88Å; S521-L525 WeakPolarHBondContact O-CB 3.24Å; S521-L525 PolarHBondContact O-N 3.12Å; L525-I529 HydrophobicContact CB-CB 4.4Å; L525-I529 HydrophobicContact CB-CG2 4.17Å; L525-I529 HydrophobicContact CD1-CG2 3.87Å
526	S	84.2	Confident	90.5	Very high	11 Å²	11	38.5 Å²	38.5	8%	0.077	21%	0.209	C	C	.	.			trans	-154.6	168.5	163.8	73.2	0	0	0	0	107.7	E528 I529 G530	S526-E528 VanDerWaalsContact C-N 3.32Å; S526-E528 PolarHBondContact O-N 3.39Å; S526-I529 WeakPolarHBondContact OG-CG1 3.29Å; S526-I529 PolarHBondContact OG-N 2.93Å; S526-G530 PolarHBondContact O-N 3.19Å
527	T	82.3	Confident	90.5	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.006	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-42.4	176.9	58.9	0	0	0	0	111.3	V167 F256 A260 T263 G530 L531	V167-T527 HydrophobicContact CG1-CG2 4.23Å; F256-T527 WeakPolarHBondContact CE2-O 3.37Å; A260-T527 HydrophobicContact CB-CG2 3.83Å; T263-T527 HydrophobicContact CG2-CG2 4.37Å; T527-G530 PolarHBondContact O-N 3.4Å; T527-L531 PolarHBondContact O-N 3.44Å; T527-L531 VanDerWaalsContact O-N 3.16Å
528	E	82.3	Confident	90.3	Very high	47 Å²	47	34.9 Å²	34.9	22%	0.22	19%	0.192	C	C	.	.	H	α-helix	trans	-65.5	-52.1	-178.2	-33	-162.8	130.2	0	0	112.5	M171 A388 S526 G530 L531 L532	M171-E528 HydrophobicContact CE-CG 3.82Å; M171-E528 WeakPolarHBondContact CE-OE1 3.36Å; M171-E528 HydrophobicContact CG-CG 4.13Å; A388-E528 HydrophobicContact CB-CB 4.26Å; S526-E528 VanDerWaalsContact C-N 3.32Å; S526-E528 PolarHBondContact O-N 3.39Å; E528-G530 PolarHBondContact O-N 2.94Å; E528-L531 PolarHBondContact O-N 3.27Å; E528-L532 PolarHBondContact O-N 2.9Å
529	I	86.6	Confident	90.1	Very high	74 Å²	74	40.5 Å²	40.5	38%	0.379	22%	0.22	S	C	.	.	H	α-helix	trans	-64.1	-36.7	178.5	-63.4	170	0	0	0	109.6	L525 S526 L531 L532 V533	L525-I529 HydrophobicContact CB-CB 4.4Å; L525-I529 HydrophobicContact CB-CG2 4.17Å; L525-I529 HydrophobicContact CD1-CG2 3.87Å; S526-I529 WeakPolarHBondContact OG-CG1 3.29Å; S526-I529 PolarHBondContact OG-N 2.93Å; I529-L531 PolarHBondContact O-N 2.64Å; I529-L532 PolarHBondContact O-N 2.86Å; I529-V533 HydrophobicContact CG2-CG2 4.16Å; I529-V533 WeakPolarHBondContact O-CB 3.48Å; I529-V533 VanDerWaalsContact O-CG2 3.31Å; I529-V533 WeakPolarHBondContact O-CG2 3.36Å; I529-V533 PolarHBondContact O-N 3.05Å
530	G	88.7	Confident	90	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-57.9	-45.7	177.6	0	0	0	0	0	113.6	S521 S526 T527 E528 G534	S521-G530 VanDerWaalsContact OG-CA 3.29Å; S521-G530 WeakPolarHBondContact OG-CA 3.31Å; S521-G530 PolarHBondContact OG-O 2.95Å; S521-G530 VanDerWaalsContact OG-O 3.1Å; S526-G530 PolarHBondContact O-N 3.19Å; T527-G530 PolarHBondContact O-N 3.4Å; E528-G530 PolarHBondContact O-N 2.94Å; G530-G534 PolarHBondContact O-N 3.27Å
531	L	85.4	Confident	89.9	Confident	12 Å²	12	41.8 Å²	41.8	6%	0.063	22%	0.223	C	C	.	.	H	α-helix	trans	-65.6	-45.7	175.4	-178.6	63.2	0	0	0	111.9	L252 F256 I392 T527 E528 I529 V533 G534 V535	L252-L531 HydrophobicContact CD2-CD1 3.49Å; L252-L531 VanDerWaalsContact CD2-CD1 3.49Å; L252-L531 HydrophobicContact CG-CD1 4.43Å; F256-L531 HydrophobicContact CB-CD1 4.36Å; F256-L531 HydrophobicContact CD1-CD1 4.47Å; F256-L531 HydrophobicContact CD2-CB 3.94Å; F256-L531 HydrophobicContact CD2-CD1 4.47Å; F256-L531 HydrophobicContact CE2-CB 4Å; F256-L531 HydrophobicContact CG-CB 4.49Å; F256-L531 HydrophobicContact CG-CD1 4.19Å; I392-L531 HydrophobicContact CD1-CD2 3.96Å; I392-L531 HydrophobicContact CG1-CD2 3.36Å; T527-L531 PolarHBondContact O-N 3.44Å; T527-L531 VanDerWaalsContact O-N 3.16Å; E528-L531 PolarHBondContact O-N 3.27Å; I529-L531 PolarHBondContact O-N 2.64Å; L531-V533 VanDerWaalsContact C-N 3.33Å; L531-V533 PolarHBondContact O-N 3.34Å; L531-G534 CarbonylContact O-C 3.49Å; L531-G534 WeakPolarHBondContact O-CA 3.01Å; L531-G534 PolarHBondContact O-N 3.09Å; L531-V535 HydrophobicContact CD1-CG2 4.2Å; L531-V535 HydrophobicContact CG-CG2 4.3Å; L531-V535 WeakPolarHBondContact O-CG2 3.49Å; L531-V535 PolarHBondContact O-N 3.35Å
532	L	87.6	Confident	89.6	Confident	114 Å²	114	45.3 Å²	45.3	60%	0.597	24%	0.244	S	C	*	.	H	α-helix	trans	-58.9	-45.3	179.6	178.9	61	0	0	0	111.5	E528 I529 G534 V535 C536	E528-L532 PolarHBondContact O-N 2.9Å; I529-L532 PolarHBondContact O-N 2.86Å; L532-G534 VanDerWaalsContact C-N 3.32Å; L532-G534 PolarHBondContact O-N 2.95Å; L532-V535 PolarHBondContact O-N 3.01Å; L532-C536 PolarHBondContact O-N 3.31Å; L532-C536 PolarHBondContact O-SG 3.39Å
533	V	92.9	Very high	89.6	Confident	54 Å²	54	47.9 Å²	47.9	33%	0.327	26%	0.257	S	S	.	.	H	α-helix	trans	-58.4	-44.4	172.5	169.2	0	0	0	0	110.8	V517 I529 L531 F537	V517-V533 HydrophobicContact CG1-CG1 4.12Å; I529-V533 HydrophobicContact CG2-CG2 4.16Å; I529-V533 WeakPolarHBondContact O-CB 3.48Å; I529-V533 VanDerWaalsContact O-CG2 3.31Å; I529-V533 WeakPolarHBondContact O-CG2 3.36Å; I529-V533 PolarHBondContact O-N 3.05Å; L531-V533 VanDerWaalsContact C-N 3.33Å; L531-V533 PolarHBondContact O-N 3.34Å; V533-F537 WeakPolarHBondContact O-CB 3.45Å; V533-F537 PolarHBondContact O-N 2.99Å
534	G	91.8	Very high	89.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.1	-44.9	176.8	0	0	0	0	0	113.9	L252 T518 G530 L531 L532 S538	L252-G534 WeakPolarHBondContact CD1-O 3.46Å; T518-G534 VanDerWaalsContact OG1-CA 3.28Å; T518-G534 WeakPolarHBondContact OG1-CA 3.26Å; G530-G534 PolarHBondContact O-N 3.27Å; L531-G534 CarbonylContact O-C 3.49Å; L531-G534 WeakPolarHBondContact O-CA 3.01Å; L531-G534 PolarHBondContact O-N 3.09Å; L532-G534 VanDerWaalsContact C-N 3.32Å; L532-G534 PolarHBondContact O-N 2.95Å; G534-S538 WeakPolarHBondContact O-CB 3.37Å; G534-S538 PolarHBondContact O-N 3.48Å
535	V	89.8	Confident	89.2	Confident	46 Å²	46	56.3 Å²	56.3	28%	0.279	29%	0.288	S	S	.	.	H	α-helix	trans	-64.3	-51.4	178.3	175.3	0	0	0	0	110.8	L248 L252 L531 L532 F537 S538 M539	L248-V535 HydrophobicContact CD2-CG2 3.94Å; L252-V535 HydrophobicContact CD1-CB 4.32Å; L252-V535 HydrophobicContact CD1-CG2 3.84Å; L531-V535 HydrophobicContact CD1-CG2 4.2Å; L531-V535 HydrophobicContact CG-CG2 4.3Å; L531-V535 WeakPolarHBondContact O-CG2 3.49Å; L531-V535 PolarHBondContact O-N 3.35Å; L532-V535 PolarHBondContact O-N 3.01Å; V535-F537 VanDerWaalsContact C-N 3.33Å; V535-F537 PolarHBondContact O-N 2.92Å; V535-S538 PolarHBondContact O-N 3.06Å; V535-M539 PolarHBondContact O-N 3.12Å
536	C	92.7	Very high	89.2	Confident	76 Å²	76	55.9 Å²	55.9	51%	0.514	29%	0.287	S	S	.	.	H	α-helix	trans	-62.4	-40.6	179.2	-69	0	0	0	0	112	L532 F540	L532-C536 PolarHBondContact O-N 3.31Å; L532-C536 PolarHBondContact O-SG 3.39Å; C536-F540 WeakPolarHBondContact O-CB 3.25Å; C536-F540 PolarHBondContact O-N 3.18Å
537	F	94.9	Very high	89.4	Confident	54 Å²	54	58.6 Å²	58.6	24%	0.237	30%	0.299	C	S	.	.	H	α-helix	trans	-68.2	-41	177.4	-174	-97.1	0	0	0	112.4	V513 I514 V517 V533 V535 F540 C541	V513-F537 HydrophobicContact CG1-CE1 3.83Å; V513-F537 HydrophobicContact CG1-CZ 3.72Å; I514-F537 HydrophobicContact CB-CD1 4.48Å; I514-F537 HydrophobicContact CG1-CD1 3.97Å; I514-F537 HydrophobicContact CG1-CE1 3.97Å; V517-F537 HydrophobicContact CB-CD1 4.08Å; V517-F537 HydrophobicContact CB-CE1 4.16Å; V517-F537 HydrophobicContact CB-CG 4.5Å; V517-F537 HydrophobicContact CG1-CB 4.33Å; V517-F537 HydrophobicContact CG1-CD1 4.04Å; V517-F537 HydrophobicContact CG1-CD2 4.33Å; V517-F537 HydrophobicContact CG1-CE1 4.47Å; V517-F537 HydrophobicContact CG1-CG 3.96Å; V517-F537 HydrophobicContact CG2-CD1 4.27Å; V517-F537 HydrophobicContact CG2-CE1 3.89Å; V517-F537 HydrophobicContact CG2-CE2 4.4Å; V517-F537 HydrophobicContact CG2-CZ 3.96Å; V533-F537 WeakPolarHBondContact O-CB 3.45Å; V533-F537 PolarHBondContact O-N 2.99Å; V535-F537 VanDerWaalsContact C-N 3.33Å; V535-F537 PolarHBondContact O-N 2.92Å; F537-F540 PolarHBondContact O-N 3.12Å; F537-C541 WeakPolarHBondContact CE1-SG 3.34Å; F537-C541 PolarHBondContact O-N 2.97Å; F537-C541 PolarHBondContact O-SG 3.49Å; F537-C541 VanDerWaalsContact O-SG 3.38Å
538	S	92.9	Very high	89.6	Confident	12 Å²	12	66.7 Å²	66.7	8%	0.084	33%	0.334	C	S	.	.	H	α-helix	trans	-58.6	-49	173.9	-179.5	0	0	0	0	111.4	G534 V535 F540 C541 V542	G534-S538 WeakPolarHBondContact O-CB 3.37Å; G534-S538 PolarHBondContact O-N 3.48Å; V535-S538 PolarHBondContact O-N 3.06Å; S538-F540 VanDerWaalsContact C-N 3.35Å; S538-F540 PolarHBondContact O-N 2.95Å; S538-C541 PolarHBondContact O-N 3.02Å; S538-V542 PolarHBondContact O-N 3.25Å; S538-V542 VanDerWaalsContact O-N 3.08Å
539	M	90.8	Very high	89.9	Confident	118 Å²	118	65.5 Å²	65.5	58%	0.581	33%	0.33	S	S	*	.	H	α-helix	trans	-61.7	-41.2	176.2	-172.8	177.1	-178.9	0	0	112	V535 V542 I543	V535-M539 PolarHBondContact O-N 3.12Å; M539-V542 PolarHBondContact O-N 3.48Å; M539-I543 HydrophobicContact CG-CD1 4.47Å; M539-I543 WeakPolarHBondContact O-CG1 3.47Å; M539-I543 PolarHBondContact O-N 3.29Å; M539-I543 VanDerWaalsContact O-N 3.1Å
540	F	92.6	Very high	90	Very high	107 Å²	107	70.2 Å²	70.2	47%	0.469	35%	0.348	S	S	.	.	H	α-helix	trans	-63.5	-40.5	175.2	-177.6	-114.7	0	0	0	112.5	C536 F537 S538 V542 I543 L544	C536-F540 WeakPolarHBondContact O-CB 3.25Å; C536-F540 PolarHBondContact O-N 3.18Å; F537-F540 PolarHBondContact O-N 3.12Å; S538-F540 VanDerWaalsContact C-N 3.35Å; S538-F540 PolarHBondContact O-N 2.95Å; F540-V542 VanDerWaalsContact C-N 3.32Å; F540-V542 PolarHBondContact O-N 2.76Å; F540-I543 PolarHBondContact O-N 2.95Å; F540-L544 HydrophobicContact CD1-CD1 3.96Å; F540-L544 HydrophobicContact CD1-CG 4.37Å; F540-L544 HydrophobicContact CE1-CD1 3.58Å; F540-L544 HydrophobicContact CE1-CD2 4.43Å; F540-L544 HydrophobicContact CE1-CG 4.08Å; F540-L544 HydrophobicContact CE2-CD2 4.37Å; F540-L544 HydrophobicContact CE2-CG 4.4Å; F540-L544 HydrophobicContact CZ-CD1 4.02Å; F540-L544 HydrophobicContact CZ-CD2 4.02Å; F540-L544 HydrophobicContact CZ-CG 4.09Å; F540-L544 WeakPolarHBondContact O-CG 3.39Å; F540-L544 PolarHBondContact O-N 2.97Å
541	C	92.1	Very high	90.2	Very high	7 Å²	7	71.5 Å²	71.5	5%	0.047	36%	0.357	C	S	.	.	H	α-helix	trans	-62.5	-35.5	173.6	-74.9	0	0	0	0	113.1	M510 I514 F537 S538 R545	M510-C541 HydrophobicContact CE-CB 3.72Å; M510-C541 VanDerWaalsContact CE-SG 3.58Å; I514-C541 HydrophobicContact CD1-CB 3.9Å; I514-C541 HydrophobicContact CG1-CB 4.2Å; F537-C541 WeakPolarHBondContact CE1-SG 3.34Å; F537-C541 PolarHBondContact O-N 2.97Å; F537-C541 PolarHBondContact O-SG 3.49Å; F537-C541 VanDerWaalsContact O-SG 3.38Å; S538-C541 PolarHBondContact O-N 3.02Å; C541-R545 WeakPolarHBondContact O-CB 3.5Å; C541-R545 PolarHBondContact O-N 3.39Å
542	V	90.1	Very high	90.6	Very high	87 Å²	87	71.6 Å²	71.6	53%	0.527	36%	0.359	S	S	.	.	H	α-helix	trans	-63.8	-45.3	172	174.3	0	0	0	0	110.7	S538 M539 F540 R545 T546	S538-V542 PolarHBondContact O-N 3.25Å; S538-V542 VanDerWaalsContact O-N 3.08Å; M539-V542 PolarHBondContact O-N 3.48Å; F540-V542 VanDerWaalsContact C-N 3.32Å; F540-V542 PolarHBondContact O-N 2.76Å; V542-R545 WeakPolarHBondContact O-CB 3.42Å; V542-R545 PolarHBondContact O-N 2.94Å; V542-R545 VanDerWaalsContact O-N 3.16Å; V542-T546 PolarHBondContact O-N 3.01Å; V542-T546 VanDerWaalsContact O-N 3.1Å
543	I	90.1	Very high	90.9	Very high	54 Å²	54	68.2 Å²	68.2	28%	0.277	34%	0.341	S	S	.	.	H	α-helix	trans	-61.4	-45.4	177	-66	164.5	0	0	0	111.4	M539 F540 R545 T546 Q547 I590	M539-I543 HydrophobicContact CG-CD1 4.47Å; M539-I543 WeakPolarHBondContact O-CG1 3.47Å; M539-I543 PolarHBondContact O-N 3.29Å; M539-I543 VanDerWaalsContact O-N 3.1Å; F540-I543 PolarHBondContact O-N 2.95Å; I543-R545 VanDerWaalsContact C-N 3.26Å; I543-R545 PolarHBondContact O-N 2.9Å; I543-T546 PolarHBondContact O-N 3.33Å; I543-T546 VanDerWaalsContact O-N 3.16Å; I543-T546 PolarHBondContact O-OG1 3.4Å; I543-Q547 WeakPolarHBondContact O-CG 3.49Å; I543-Q547 PolarHBondContact O-N 2.93Å; I543-I590 HydrophobicContact CG2-CD1 4.23Å
544	L	89.5	Confident	90.9	Very high	71 Å²	71	65.9 Å²	65.9	37%	0.372	33%	0.327	S	S	.	.	H	α-helix	trans	-60.4	-35.6	175.6	-70.3	179.8	0	0	0	112.4	F540	F540-L544 HydrophobicContact CD1-CD1 3.96Å; F540-L544 HydrophobicContact CD1-CG 4.37Å; F540-L544 HydrophobicContact CE1-CD1 3.58Å; F540-L544 HydrophobicContact CE1-CD2 4.43Å; F540-L544 HydrophobicContact CE1-CG 4.08Å; F540-L544 HydrophobicContact CE2-CD2 4.37Å; F540-L544 HydrophobicContact CE2-CG 4.4Å; F540-L544 HydrophobicContact CZ-CD1 4.02Å; F540-L544 HydrophobicContact CZ-CD2 4.02Å; F540-L544 HydrophobicContact CZ-CG 4.09Å; F540-L544 WeakPolarHBondContact O-CG 3.39Å; F540-L544 PolarHBondContact O-N 2.97Å
545	R	87.1	Confident	90.9	Very high	179 Å²	179	66 Å²	66	68%	0.675	33%	0.328	S	S	*	.	H	α-helix	trans	-69	-31.3	176.9	-174.4	174.9	176.7	167	-1.9	112.5	C541 V542 I543	C541-R545 WeakPolarHBondContact O-CB 3.5Å; C541-R545 PolarHBondContact O-N 3.39Å; V542-R545 WeakPolarHBondContact O-CB 3.42Å; V542-R545 PolarHBondContact O-N 2.94Å; V542-R545 VanDerWaalsContact O-N 3.16Å; I543-R545 VanDerWaalsContact C-N 3.26Å; I543-R545 PolarHBondContact O-N 2.9Å
546	T	87.9	Confident	91.1	Very high	49 Å²	49	64.8 Å²	64.8	30%	0.301	32%	0.32	S	S	.	.	H	α-helix	trans	-85.4	-19.5	176.5	61.4	0	0	0	0	114.2	V542 I543 Y588	V542-T546 PolarHBondContact O-N 3.01Å; V542-T546 VanDerWaalsContact O-N 3.1Å; I543-T546 PolarHBondContact O-N 3.33Å; I543-T546 VanDerWaalsContact O-N 3.16Å; I543-T546 PolarHBondContact O-OG1 3.4Å; T546-Y588 WeakPolarHBondContact CB-OH 3.36Å; T546-Y588 PolarHBondContact OG1-OH 2.66Å
547	Q	90.1	Very high	91	Very high	68 Å²	68	63.7 Å²	63.7	32%	0.318	31%	0.31	S	S	.	.	H	α-helix	trans	-66.5	-35.3	177.5	-83	176.1	9	0	0	114.4	I543 P549 I590	I543-Q547 WeakPolarHBondContact O-CG 3.49Å; I543-Q547 PolarHBondContact O-N 2.93Å; Q547-P549 WeakPolarHBondContact O-CD 3.47Å; Q547-I590 HydrophobicContact CB-CG2 4.39Å; Q547-I590 HydrophobicContact CG-CG2 3.31Å
548	K	85.6	Confident	90.5	Very high	172 Å²	172	66.2 Å²	66.2	75%	0.748	32%	0.323	S	S	*	.	S	Bend	trans	-122.8	66.2	-174	-66.3	-176.4	-179.5	177.2	0	112
549	P	88.7	Confident	89.8	Confident	21 Å²	21	75.7 Å²	75.7	14%	0.136	37%	0.366	C	S	.	.			trans	-70.3	162.6	176.6	33.1	-36.3	0	0	0	111.6	Q547 F583 A585	Q547-P549 WeakPolarHBondContact O-CD 3.47Å; P549-F583 HydrophobicContact CG-CD2 4.4Å; P549-F583 HydrophobicContact CG-CE1 3.94Å; P549-F583 HydrophobicContact CG-CE2 3.57Å; P549-F583 HydrophobicContact CG-CZ 3.3Å; P549-A585 HydrophobicContact CB-CB 3.49Å; P549-A585 VanDerWaalsContact CB-CB 3.49Å; P549-A585 HydrophobicContact CG-CB 3.75Å
550	K	89.8	Confident	89.5	Confident	174 Å²	174	71.9 Å²	71.9	76%	0.757	35%	0.351	S	S	*	.			trans	-72.7	141.1	173.4	-67.1	-173.7	179.5	-177.3	0	110.1	V584	K550-V584 WeakPolarHBondContact O-CB 3.25Å; K550-V584 PolarHBondContact O-N 3.24Å
551	S	92.5	Very high	89.2	Confident	26 Å²	26	73 Å²	73	18%	0.182	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	138.7	172.6	44.7	0	0	0	0	109.1	R582 A598 Q602	S551-R582 VanDerWaalsContact CA-O 3.3Å; S551-R582 WeakPolarHBondContact CA-O 3.46Å; S551-A598 WeakPolarHBondContact OG-CB 3.42Å; S551-Q602 PolarHBondContact O-NE2 3.48Å; S551-Q602 PolarHBondContact OG-NE2 2.98Å
552	S	93.4	Very high	88.9	Confident	15 Å²	15	76.6 Å²	76.6	11%	0.105	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	151.1	-179.3	55.9	0	0	0	0	112.9	S565 R582 Q602	S552-S565 WeakPolarHBondContact CB-OG 3.1Å; S552-S565 PolarHBondContact OG-OG 3.19Å; S552-R582 PolarHBondContact N-O 3.2Å; S552-R582 PolarHBondContact O-N 3.39Å; S552-Q602 VanDerWaalsContact C-OE1 3.3Å; S552-Q602 VanDerWaalsContact CA-OE1 3.24Å
553	L	93.9	Very high	89	Confident	42 Å²	42	73.1 Å²	73.1	22%	0.22	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	141.1	161.5	-63.6	179.8	0	0	0	110.3	V566 K579 I580 Q602 T603	L553-V566 PolarHBondContact O-N 2.84Å; L553-V566 VanDerWaalsContact O-N 3.09Å; L553-K579 HydrophobicContact CD1-CD 4.39Å; L553-K579 HydrophobicContact CD2-CB 4.38Å; L553-I580 CarbonylContact C-O 3.56Å; L553-I580 VanDerWaalsContact CA-O 3.27Å; L553-I580 WeakPolarHBondContact CA-O 3.38Å; L553-Q602 HydrophobicContact CD2-CB 4.24Å; L553-Q602 HydrophobicContact CG-CB 4.25Å; L553-Q602 VanDerWaalsContact N-OE1 3.17Å; L553-T603 HydrophobicContact CD2-CG2 4.02Å
554	L	93.3	Very high	89	Confident	6 Å²	6	73.6 Å²	73.6	3%	0.031	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	150.8	172.8	-51.3	-176.8	0	0	0	111.7	F563 E564 I580 R582 D652	L554-F563 HydrophobicContact CB-CB 4.13Å; L554-F563 HydrophobicContact CD1-CB 3.79Å; L554-E564 CarbonylContact C-O 3.55Å; L554-E564 VanDerWaalsContact CA-O 3.24Å; L554-E564 WeakPolarHBondContact CA-O 3.3Å; L554-I580 HydrophobicContact CB-CB 4.15Å; L554-I580 HydrophobicContact CB-CG2 4Å; L554-I580 HydrophobicContact CD1-CG2 3.85Å; L554-I580 HydrophobicContact CG-CG2 4.16Å; L554-I580 PolarHBondContact N-O 2.88Å; L554-R582 HydrophobicContact CD1-CB 4.07Å; L554-R582 VanDerWaalsContact CD1-CZ 3.47Å; L554-R582 VanDerWaalsContact CD1-NH2 3.29Å; L554-R582 HydrophobicContact CD2-CB 3.83Å; L554-R582 HydrophobicContact CG-CB 4.01Å; L554-D652 HydrophobicContact CD1-CB 4.3Å
555	G	92.4	Very high	89.1	Confident	2 Å²	2	70.9 Å²	70.9	2%	0.021	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	160	166	0	0	0	0	0	110.1	F563 E564 Q573	G555-F563 WeakPolarHBondContact O-CA 3.41Å; G555-E564 PolarHBondContact N-O 3.15Å; G555-E564 PolarHBondContact O-N 2.87Å; G555-Q573 CarbonylContact C-O 3.37Å; G555-Q573 WeakPolarHBondContact CA-O 3.31Å
556	L	92.8	Very high	89.3	Confident	21 Å²	21	65.6 Å²	65.6	11%	0.11	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	132	-179.9	-170.8	68.3	0	0	0	109.9	S560 F563 L572 Q573 M716	L556-S560 WeakPolarHBondContact CD1-O 3.27Å; L556-F563 HydrophobicContact CB-CD1 4.45Å; L556-F563 HydrophobicContact CB-CE1 4.11Å; L556-F563 HydrophobicContact CD1-CD1 4.23Å; L556-F563 HydrophobicContact CD1-CD2 4.33Å; L556-F563 HydrophobicContact CD1-CE1 3.78Å; L556-F563 HydrophobicContact CD1-CE2 3.89Å; L556-F563 HydrophobicContact CD1-CZ 3.62Å; L556-L572 CarbonylContact O-C 3.4Å; L556-L572 WeakPolarHBondContact O-CA 3.44Å; L556-Q573 PolarHBondContact N-O 2.74Å; L556-Q573 PolarHBondContact O-N 3.22Å; L556-M716 HydrophobicContact CD2-CE 4.49Å
557	V	90.7	Very high	89.3	Confident	53 Å²	53	68.2 Å²	68.2	32%	0.321	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	131.2	167.6	173.8	0	0	0	0	108.6	S560 V562 E564 L572	V557-S560 WeakPolarHBondContact CB-OG 3.31Å; V557-S560 PolarHBondContact O-N 2.96Å; V557-S560 PolarHBondContact O-OG 3.27Å; V557-V562 HydrophobicContact CB-CB 4.34Å; V557-V562 HydrophobicContact CG2-CB 4.36Å; V557-V562 HydrophobicContact CG2-CG1 4.37Å; V557-V562 PolarHBondContact N-O 3.47Å; V557-E564 HydrophobicContact CG2-CB 4.27Å; V557-L572 HydrophobicContact CB-CD2 4.24Å; V557-L572 HydrophobicContact CG2-CD2 3.41Å; V557-L572 VanDerWaalsContact CG2-CD2 3.41Å
558	E	84.4	Confident	89.2	Confident	106 Å²	106	68.3 Å²	68.3	50%	0.495	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	142.5	-175.3	-50	-163.1	119.6	0	0	112.2	S560 Q573	E558-S560 PolarHBondContact O-N 3.2Å; E558-S560 VanDerWaalsContact O-N 3.1Å; E558-Q573 HydrophobicContact CG-CG 4.11Å; E558-Q573 PolarHBondContact OE1-NE2 3.43Å
559	E	78.3	Confident	89.4	Confident	211 Å²	211	66.7 Å²	66.7	99%	0.986	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	22.5	-178.7	-53.6	-168.7	149.2	0	0	115.8
560	S	84.9	Confident	89.2	Confident	39 Å²	39	74.8 Å²	74.8	27%	0.273	39%	0.388	S	S	.	.	S	Bend	trans	-140.8	172.7	179.7	81.3	0	0	0	0	113.5	L556 V557 E558 V562	L556-S560 WeakPolarHBondContact CD1-O 3.27Å; V557-S560 WeakPolarHBondContact CB-OG 3.31Å; V557-S560 PolarHBondContact O-N 2.96Å; V557-S560 PolarHBondContact O-OG 3.27Å; E558-S560 PolarHBondContact O-N 3.2Å; E558-S560 VanDerWaalsContact O-N 3.1Å; S560-V562 PolarHBondContact OG-N 3.12Å; S560-V562 VanDerWaalsContact OG-N 3.17Å
561	E	84.8	Confident	89.1	Confident	131 Å²	131	72.9 Å²	72.9	61%	0.612	39%	0.386	S	S	*	.	S	Bend	trans	-93.1	7.6	170	-58.6	-172.5	171.6	0	0	113.2	F563 Y713	E561-F563 VanDerWaalsContact O-CD2 3.3Å; E561-F563 WeakPolarHBondContact O-CD2 3.13Å; E561-Y713 HydrophobicContact CB-CD2 4.1Å; E561-Y713 HydrophobicContact CB-CG 4.46Å; E561-Y713 HydrophobicContact CG-CD2 3.97Å; E561-Y713 HydrophobicContact CG-CE2 4.18Å; E561-Y713 HydrophobicContact CG-CG 4.29Å
562	V	87.4	Confident	88.9	Confident	82 Å²	82	73.1 Å²	73.1	50%	0.497	39%	0.385	S	S	.	.			trans	-84.5	126.4	-170.2	-177.7	0	0	0	0	111.2	V557 S560 E564	V557-V562 HydrophobicContact CB-CB 4.34Å; V557-V562 HydrophobicContact CG2-CB 4.36Å; V557-V562 HydrophobicContact CG2-CG1 4.37Å; V557-V562 PolarHBondContact N-O 3.47Å; S560-V562 PolarHBondContact OG-N 3.12Å; S560-V562 VanDerWaalsContact OG-N 3.17Å; V562-E564 HydrophobicContact CG1-CG 4.42Å
563	F	90.6	Very high	88.6	Confident	14 Å²	14	76.7 Å²	76.7	6%	0.061	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	113.8	177.5	-70.6	-86.2	0	0	0	111.9	L554 G555 L556 E561 I580 R582 V712 Y713 M716	L554-F563 HydrophobicContact CB-CB 4.13Å; L554-F563 HydrophobicContact CD1-CB 3.79Å; G555-F563 WeakPolarHBondContact O-CA 3.41Å; L556-F563 HydrophobicContact CB-CD1 4.45Å; L556-F563 HydrophobicContact CB-CE1 4.11Å; L556-F563 HydrophobicContact CD1-CD1 4.23Å; L556-F563 HydrophobicContact CD1-CD2 4.33Å; L556-F563 HydrophobicContact CD1-CE1 3.78Å; L556-F563 HydrophobicContact CD1-CE2 3.89Å; L556-F563 HydrophobicContact CD1-CZ 3.62Å; E561-F563 VanDerWaalsContact O-CD2 3.3Å; E561-F563 WeakPolarHBondContact O-CD2 3.13Å; F563-I580 HydrophobicContact CD1-CD1 3.61Å; F563-I580 HydrophobicContact CE1-CD1 3.25Å; F563-I580 HydrophobicContact CZ-CD1 4.02Å; F563-R582 PolarHBondContact O-NH1 3.24Å; F563-R582 PolarHBondContact O-NH2 3.19Å; F563-R582 VanDerWaalsContact O-NH2 3.11Å; F563-V712 HydrophobicContact CB-CG1 4.37Å; F563-V712 HydrophobicContact CD1-CG1 4.14Å; F563-V712 HydrophobicContact CD2-CB 3.8Å; F563-V712 HydrophobicContact CD2-CG1 3.61Å; F563-V712 HydrophobicContact CE1-CG1 4.31Å; F563-V712 HydrophobicContact CE2-CB 4.04Å; F563-V712 HydrophobicContact CE2-CG1 3.8Å; F563-V712 HydrophobicContact CG-CB 4.37Å; F563-V712 HydrophobicContact CG-CG1 3.77Å; F563-V712 HydrophobicContact CZ-CG1 4.13Å; F563-Y713 HydrophobicContact CE2-CD2 4.26Å; F563-Y713 HydrophobicContact CZ-CD2 4.42Å; F563-M716 HydrophobicContact CE1-CE 4.46Å; F563-M716 HydrophobicContact CE1-SD 3.79Å; F563-M716 HydrophobicContact CZ-CB 4.4Å; F563-M716 HydrophobicContact CZ-CE 3.87Å; F563-M716 HydrophobicContact CZ-SD 3.71Å
564	E	91.7	Very high	88.3	Confident	63 Å²	63	78.3 Å²	78.3	29%	0.294	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	163	-176.5	-97.3	-54.9	152.9	0	0	113.9	L554 G555 V557 V562 V566 Y569 L572	L554-E564 CarbonylContact C-O 3.55Å; L554-E564 VanDerWaalsContact CA-O 3.24Å; L554-E564 WeakPolarHBondContact CA-O 3.3Å; G555-E564 PolarHBondContact N-O 3.15Å; G555-E564 PolarHBondContact O-N 2.87Å; V557-E564 HydrophobicContact CG2-CB 4.27Å; V562-E564 HydrophobicContact CG1-CG 4.42Å; E564-V566 PolarHBondContact O-N 3.29Å; E564-Y569 HydrophobicContact CB-CD2 4.07Å; E564-Y569 HydrophobicContact CG-CD2 4.15Å; E564-Y569 HydrophobicContact CG-CE2 4.19Å; E564-Y569 WeakPolarHBondContact OE2-CE2 3.31Å; E564-L572 HydrophobicContact CB-CD1 4.17Å; E564-L572 HydrophobicContact CB-CD2 4.2Å; E564-L572 WeakPolarHBondContact O-CD1 3.48Å
565	S	91.7	Very high	87.9	Confident	14 Å²	14	81.2 Å²	81.2	10%	0.098	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	117	-170.8	-171.8	0	0	0	0	112.4	S552 S567 A568 Y569	S552-S565 WeakPolarHBondContact CB-OG 3.1Å; S552-S565 PolarHBondContact OG-OG 3.19Å; S565-S567 PolarHBondContact O-N 3.28Å; S565-S567 VanDerWaalsContact O-N 3.08Å; S565-S567 PolarHBondContact OG-OG 2.94Å; S565-A568 PolarHBondContact O-N 3.1Å; S565-Y569 PolarHBondContact O-N 3.38Å
566	V	89.9	Confident	87.5	Confident	69 Å²	69	86.4 Å²	86.4	42%	0.418	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-20	178.1	-173.5	0	0	0	0	112.6	L553 E564 L572 T574	L553-V566 PolarHBondContact O-N 2.84Å; L553-V566 VanDerWaalsContact O-N 3.09Å; E564-V566 PolarHBondContact O-N 3.29Å; V566-L572 HydrophobicContact CG2-CD1 4.28Å; V566-T574 HydrophobicContact CG2-CG2 4.16Å
567	S	88.1	Confident	87.1	Confident	104 Å²	104	85.8 Å²	85.8	73%	0.727	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-4.8	173.7	71.5	0	0	0	0	114.8	S565	S565-S567 PolarHBondContact O-N 3.28Å; S565-S567 VanDerWaalsContact O-N 3.08Å; S565-S567 PolarHBondContact OG-OG 2.94Å
568	A	88.8	Confident	87.1	Confident	69 Å²	69	83.7 Å²	83.7	57%	0.57	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.7	-37.9	-176.4	0	0	0	0	0	112.5	S565	S565-A568 PolarHBondContact O-N 3.1Å
569	Y	89.8	Confident	87.5	Confident	139 Å²	139	82.1 Å²	82.1	55%	0.545	44%	0.435	S	S	.	.			trans	-119.2	151.5	-178.2	-60.1	-78.5	0	0	0	111.6	E564 S565	E564-Y569 HydrophobicContact CB-CD2 4.07Å; E564-Y569 HydrophobicContact CG-CD2 4.15Å; E564-Y569 HydrophobicContact CG-CE2 4.19Å; E564-Y569 WeakPolarHBondContact OE2-CE2 3.31Å; S565-Y569 PolarHBondContact O-N 3.38Å
570	K	84.6	Confident	88.3	Confident	190 Å²	190	72.5 Å²	72.5	83%	0.826	39%	0.391	S	S	*	.	S	Bend	trans	-98.1	171.1	171.3	-63.3	-177.2	179.6	-178.3	0	109.4
571	N	86.6	Confident	88.8	Confident	134 Å²	134	70.7 Å²	70.7	72%	0.717	38%	0.378	S	S	*	.	S	Bend	trans	60	48.5	178.7	-51.5	7.1	0	0	0	112.5
572	L	89.7	Confident	89.3	Confident	31 Å²	31	66.5 Å²	66.5	16%	0.162	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	128	174	-65.9	175.5	0	0	0	109.5	L556 V557 E564 V566	L556-L572 CarbonylContact O-C 3.4Å; L556-L572 WeakPolarHBondContact O-CA 3.44Å; V557-L572 HydrophobicContact CB-CD2 4.24Å; V557-L572 HydrophobicContact CG2-CD2 3.41Å; V557-L572 VanDerWaalsContact CG2-CD2 3.41Å; E564-L572 HydrophobicContact CB-CD1 4.17Å; E564-L572 HydrophobicContact CB-CD2 4.2Å; E564-L572 WeakPolarHBondContact O-CD1 3.48Å; V566-L572 HydrophobicContact CG2-CD1 4.28Å
573	Q	86.5	Confident	89.6	Confident	90 Å²	90	62.6 Å²	62.6	42%	0.421	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	135.2	178.1	-63.7	-174.3	8.7	0	0	110.5	G555 L556 E558	G555-Q573 CarbonylContact C-O 3.37Å; G555-Q573 WeakPolarHBondContact CA-O 3.31Å; L556-Q573 PolarHBondContact N-O 2.74Å; L556-Q573 PolarHBondContact O-N 3.22Å; E558-Q573 HydrophobicContact CG-CG 4.11Å; E558-Q573 PolarHBondContact OE1-NE2 3.43Å
574	T	86.7	Confident	89.7	Confident	76 Å²	76	65.7 Å²	65.7	47%	0.466	35%	0.352	S	S	.	.			trans	-120.9	122.5	172.9	63.9	0	0	0	0	109.9	V566	V566-T574 HydrophobicContact CG2-CG2 4.16Å
575	K	85.9	Confident	89.7	Confident	68 Å²	68	63.3 Å²	63.3	30%	0.296	34%	0.343	S	S	.	.			trans	-71.8	134.2	-177.8	-65.2	-63.7	-163.8	85.8	0	110.9	G577 I578 M716 E720	K575-G577 PolarHBondContact O-N 2.93Å; K575-I578 PolarHBondContact O-N 3.01Å; K575-M716 HydrophobicContact CG-SD 3.99Å; K575-E720 VanDerWaalsContact CD-OE1 3.29Å; K575-E720 WeakPolarHBondContact CD-OE1 3.44Å; K575-E720 WeakPolarHBondContact CE-OE1 3.42Å; K575-E720 WeakPolarHBondContact CG-OE1 3.39Å; K575-E720 IonicContact NZ-OE1 3.7Å; K575-E720 PolarHBondContact NZ-OE1 3.1Å; K575-E720 IonicContact NZ-OE2 2.76Å; K575-E720 PolarHBondContact NZ-OE2 3.37Å
576	P	82.7	Confident	89.8	Confident	110 Å²	110	63.7 Å²	63.7	71%	0.714	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	118.8	-176.2	27.1	-33.9	0	0	0	111.8	K723	P576-K723 PolarHBondContact O-NZ 3.03Å; P576-K723 VanDerWaalsContact O-NZ 3.1Å
577	G	85.5	Confident	90	Very high	9 Å²	9	60.4 Å²	60.4	9%	0.093	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.8	1.5	179.1	0	0	0	0	0	116.3	K575 E645 L646 H647 T648	K575-G577 PolarHBondContact O-N 2.93Å; G577-E645 WeakPolarHBondContact CA-O 3.19Å; G577-L646 WeakPolarHBondContact O-CA 3.2Å; G577-L646 WeakPolarHBondContact O-CD1 3.37Å; G577-H647 PolarHBondContact O-CD2 3.4Å; G577-H647 PolarHBondContact O-N 3.39Å; G577-H647 PolarHBondContact O-NE2 2.97Å; G577-T648 PolarHBondContact O-N 3.09Å
578	I	91.1	Very high	90.3	Very high	8 Å²	8	57 Å²	57	4%	0.041	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	137	168.6	-59.5	170.6	0	0	0	108.4	K575 I580 T648 V650 M716 A719 E720	K575-I578 PolarHBondContact O-N 3.01Å; I578-I580 HydrophobicContact CG2-CG1 4.16Å; I578-T648 WeakPolarHBondContact CA-O 3.26Å; I578-V650 HydrophobicContact CG2-CG2 4.34Å; I578-M716 HydrophobicContact CD1-CG 4.1Å; I578-A719 HydrophobicContact CD1-CB 3.81Å; I578-A719 HydrophobicContact CG1-CB 4.24Å; I578-E720 HydrophobicContact CD1-CG 3.53Å
579	K	92.8	Very high	90.6	Very high	73 Å²	73	61 Å²	61	32%	0.317	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	129.1	168.3	-65.2	-64.3	176.4	-166.7	0	110.3	L553 T603 L646 T648 I649 V650	L553-K579 HydrophobicContact CD1-CD 4.39Å; L553-K579 HydrophobicContact CD2-CB 4.38Å; K579-T603 HydrophobicContact CB-CG2 3.88Å; K579-T603 HydrophobicContact CG-CG2 4.44Å; K579-L646 HydrophobicContact CB-CD1 4.01Å; K579-L646 HydrophobicContact CG-CD1 3.69Å; K579-L646 HydrophobicContact CG-CD2 4.25Å; K579-T648 PolarHBondContact N-O 3.42Å; K579-T648 VanDerWaalsContact N-O 3.11Å; K579-I649 CarbonylContact O-C 3.52Å; K579-I649 WeakPolarHBondContact O-CA 3.26Å; K579-V650 PolarHBondContact O-N 3.07Å
580	I	94.8	Very high	90.7	Very high	10 Å²	10	56.5 Å²	56.5	5%	0.051	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.2	-178.9	-52	177.7	0	0	0	107.6	L553 L554 F563 I578 V650 V712 M716	L553-I580 CarbonylContact C-O 3.56Å; L553-I580 VanDerWaalsContact CA-O 3.27Å; L553-I580 WeakPolarHBondContact CA-O 3.38Å; L554-I580 HydrophobicContact CB-CB 4.15Å; L554-I580 HydrophobicContact CB-CG2 4Å; L554-I580 HydrophobicContact CD1-CG2 3.85Å; L554-I580 HydrophobicContact CG-CG2 4.16Å; L554-I580 PolarHBondContact N-O 2.88Å; F563-I580 HydrophobicContact CD1-CD1 3.61Å; F563-I580 HydrophobicContact CE1-CD1 3.25Å; F563-I580 HydrophobicContact CZ-CD1 4.02Å; I578-I580 HydrophobicContact CG2-CG1 4.16Å; I580-V650 CarbonylContact C-O 3.6Å; I580-V650 WeakPolarHBondContact CA-O 3.42Å; I580-V650 HydrophobicContact CG1-CB 4.18Å; I580-V650 HydrophobicContact CG1-CG2 4.49Å; I580-V650 HydrophobicContact CG2-CB 4.29Å; I580-V650 HydrophobicContact CG2-CG1 4.42Å; I580-V712 HydrophobicContact CD1-CG1 4.05Å; I580-V712 HydrophobicContact CG2-CG1 3.61Å; I580-M716 HydrophobicContact CD1-CB 4.41Å; I580-M716 HydrophobicContact CD1-CG 4.44Å; I580-M716 HydrophobicContact CD1-SD 4.23Å
581	F	95.8	Very high	91.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	122.5	-172.2	175.4	-97.6	0	0	0	111.2	F583 F595 A598 L599 Q602 V650 D652	F581-F583 HydrophobicContact CE1-CB 4.01Å; F581-F583 HydrophobicContact CE1-CD2 4.47Å; F581-F583 HydrophobicContact CZ-CD2 4.45Å; F581-F595 HydrophobicContact CE1-CD2 4.15Å; F581-F595 AromaticContact CE1-CE2 3.94Å; F581-F595 HydrophobicContact CE1-CE2 3.94Å; F581-A598 HydrophobicContact CE2-CB 4.44Å; F581-A598 HydrophobicContact CZ-CB 4.17Å; F581-L599 HydrophobicContact CB-CD1 3.98Å; F581-L599 HydrophobicContact CD1-CD1 3.75Å; F581-L599 HydrophobicContact CD2-CD1 4.05Å; F581-L599 HydrophobicContact CE1-CB 4.06Å; F581-L599 HydrophobicContact CE1-CD1 4.15Å; F581-L599 HydrophobicContact CE2-CB 4.35Å; F581-L599 HydrophobicContact CE2-CD1 4.44Å; F581-L599 HydrophobicContact CG-CD1 3.67Å; F581-L599 HydrophobicContact CZ-CB 3.96Å; F581-L599 HydrophobicContact CZ-CD1 4.48Å; F581-Q602 HydrophobicContact CD2-CB 4.47Å; F581-Q602 HydrophobicContact CE2-CB 4.44Å; F581-V650 PolarHBondContact N-O 3.37Å; F581-D652 PolarHBondContact O-N 3.26Å
582	R	94.9	Very high	91.5	Very high	44 Å²	44	43.8 Å²	43.8	17%	0.166	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.1	176.7	-176.9	178	-76.4	154.6	2.7	110.2	S551 S552 L554 F563 V584 D652	S551-R582 VanDerWaalsContact CA-O 3.3Å; S551-R582 WeakPolarHBondContact CA-O 3.46Å; S552-R582 PolarHBondContact N-O 3.2Å; S552-R582 PolarHBondContact O-N 3.39Å; L554-R582 HydrophobicContact CD1-CB 4.07Å; L554-R582 VanDerWaalsContact CD1-CZ 3.47Å; L554-R582 VanDerWaalsContact CD1-NH2 3.29Å; L554-R582 HydrophobicContact CD2-CB 3.83Å; L554-R582 HydrophobicContact CG-CB 4.01Å; F563-R582 PolarHBondContact O-NH1 3.24Å; F563-R582 PolarHBondContact O-NH2 3.19Å; F563-R582 VanDerWaalsContact O-NH2 3.11Å; R582-V584 HydrophobicContact CG-CG2 4.19Å; R582-D652 HydrophobicContact CB-CB 4.2Å; R582-D652 HydrophobicContact CG-CB 4.48Å; R582-D652 IonicContact CZ-OD2 2.94Å; R582-D652 IonicContact NE-OD2 2.74Å; R582-D652 PolarHBondContact NE-OD2 3.02Å; R582-D652 IonicContact NH2-OD2 3.73Å; R582-D652 PolarHBondContact NH2-OD2 3.09Å
583	F	93.4	Very high	91.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	113.3	175.5	-175.2	-102.7	0	0	0	110.1	P549 F581 A585 L587 N591 F595	P549-F583 HydrophobicContact CG-CD2 4.4Å; P549-F583 HydrophobicContact CG-CE1 3.94Å; P549-F583 HydrophobicContact CG-CE2 3.57Å; P549-F583 HydrophobicContact CG-CZ 3.3Å; F581-F583 HydrophobicContact CE1-CB 4.01Å; F581-F583 HydrophobicContact CE1-CD2 4.47Å; F581-F583 HydrophobicContact CZ-CD2 4.45Å; F583-A585 VanDerWaalsContact C-N 3.29Å; F583-A585 HydrophobicContact CD1-CB 4.27Å; F583-A585 WeakPolarHBondContact CD1-O 3.45Å; F583-A585 HydrophobicContact CE1-CB 3.87Å; F583-A585 PolarHBondContact O-N 3.44Å; F583-L587 HydrophobicContact CE1-CD1 4.5Å; F583-N591 HydrophobicContact CZ-CB 4.5Å; F583-F595 HydrophobicContact CB-CD2 3.96Å; F583-F595 HydrophobicContact CB-CE2 4.14Å; F583-F595 AromaticContact CD1-CD2 3.91Å; F583-F595 HydrophobicContact CD1-CD2 3.91Å; F583-F595 HydrophobicContact CD2-CB 4.21Å; F583-F595 AromaticContact CD2-CD2 3.68Å; F583-F595 HydrophobicContact CD2-CD2 3.68Å; F583-F595 HydrophobicContact CD2-CG 4.44Å; F583-F595 HydrophobicContact CE1-CB 4.33Å; F583-F595 HydrophobicContact CE1-CD2 4.24Å; F583-F595 HydrophobicContact CE2-CB 3.7Å; F583-F595 HydrophobicContact CE2-CD2 4.04Å; F583-F595 HydrophobicContact CE2-CG 4.39Å; F583-F595 AromaticContact CG-CD2 3.6Å; F583-F595 HydrophobicContact CG-CD2 3.6Å; F583-F595 HydrophobicContact CG-CE2 4.27Å; F583-F595 HydrophobicContact CZ-CB 3.75Å; F583-F595 HydrophobicContact CZ-CD2 4.29Å
584	V	92.5	Very high	92	Very high	78 Å²	78	44.9 Å²	44.9	47%	0.473	23%	0.23	S	C	.	.			trans	-90.4	59.3	-167.4	-165.6	0	0	0	0	111.6	K550 R582 A655	K550-V584 WeakPolarHBondContact O-CB 3.25Å; K550-V584 PolarHBondContact O-N 3.24Å; R582-V584 HydrophobicContact CG-CG2 4.19Å; V584-A655 HydrophobicContact CB-CB 4.48Å; V584-A655 HydrophobicContact CG1-CB 4.23Å
585	A	92.7	Very high	92.4	Very high	13 Å²	13	41.3 Å²	41.3	11%	0.107	21%	0.208	C	C	.	.	S	Bend	trans	-168.2	162.5	173.2	0	0	0	0	0	112.5	P549 F583 A655 I656	P549-A585 HydrophobicContact CB-CB 3.49Å; P549-A585 VanDerWaalsContact CB-CB 3.49Å; P549-A585 HydrophobicContact CG-CB 3.75Å; F583-A585 VanDerWaalsContact C-N 3.29Å; F583-A585 HydrophobicContact CD1-CB 4.27Å; F583-A585 WeakPolarHBondContact CD1-O 3.45Å; F583-A585 HydrophobicContact CE1-CB 3.87Å; F583-A585 PolarHBondContact O-N 3.44Å; A585-A655 CarbonylContact C-O 3.55Å; A585-I656 WeakPolarHBondContact O-CA 3.33Å
586	P	94	Very high	92.8	Very high	23 Å²	23	39.2 Å²	39.2	15%	0.149	20%	0.199	C	C	.	.			trans	-55.5	149.2	158.4	-15	27.8	0	0	0	111	N591 Q657 F658	P586-N591 PolarHBondContact O-ND2 3.24Å; P586-N591 PolarHBondContact O-OD1 3.08Å; P586-Q657 HydrophobicContact CG-CB 4.11Å; P586-Q657 HydrophobicContact CG-CG 4.35Å; P586-F658 HydrophobicContact CB-CD1 3.66Å; P586-F658 HydrophobicContact CB-CD2 4.43Å; P586-F658 HydrophobicContact CB-CE1 3.44Å; P586-F658 VanDerWaalsContact CB-CE1 3.44Å; P586-F658 HydrophobicContact CB-CE2 4.24Å; P586-F658 HydrophobicContact CB-CG 4.15Å; P586-F658 HydrophobicContact CB-CZ 3.75Å; P586-F658 HydrophobicContact CG-CD1 3.97Å; P586-F658 HydrophobicContact CG-CE1 3.63Å; P586-F658 HydrophobicContact CG-CZ 4.3Å
587	L	94.3	Very high	93.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-111.3	112.3	-177.9	173	62.2	0	0	0	110	F583 K592 F595 I656 F658 L659 L667	F583-L587 HydrophobicContact CE1-CD1 4.5Å; L587-K592 HydrophobicContact CD1-CB 4.34Å; L587-F595 HydrophobicContact CD1-CB 3.6Å; L587-F595 HydrophobicContact CD1-CD1 4Å; L587-F595 HydrophobicContact CD1-CD2 4.16Å; L587-F595 HydrophobicContact CD1-CG 3.67Å; L587-F595 HydrophobicContact CD2-CD1 4.01Å; L587-F595 HydrophobicContact CD2-CD2 4.2Å; L587-F595 HydrophobicContact CD2-CE1 3.94Å; L587-F595 HydrophobicContact CD2-CE2 4.14Å; L587-F595 HydrophobicContact CD2-CG 4.14Å; L587-F595 HydrophobicContact CD2-CZ 4.01Å; L587-I656 HydrophobicContact CB-CD1 4.47Å; L587-I656 HydrophobicContact CB-CG2 4.27Å; L587-F658 PolarHBondContact N-O 2.71Å; L587-L659 HydrophobicContact CB-CD2 3.74Å; L587-L659 HydrophobicContact CD2-CD2 4.2Å; L587-L659 HydrophobicContact CG-CD2 4.19Å; L587-L667 HydrophobicContact CD2-CD1 4.15Å; L587-L667 HydrophobicContact CD2-CD2 3.83Å; L587-L667 HydrophobicContact CD2-CG 3.75Å
588	Y	94.1	Very high	93.7	Very high	33 Å²	33	38 Å²	38	13%	0.129	19%	0.192	C	C	.	.			trans	-154.1	176.2	-168.4	75.5	-66.8	0	0	0	112	T546 I590 N591 K592 F658 D660	T546-Y588 WeakPolarHBondContact CB-OH 3.36Å; T546-Y588 PolarHBondContact OG1-OH 2.66Å; Y588-I590 HydrophobicContact CD2-CB 4.17Å; Y588-I590 HydrophobicContact CD2-CG1 4.15Å; Y588-I590 HydrophobicContact CE1-CB 4.26Å; Y588-I590 HydrophobicContact CE2-CB 3.62Å; Y588-I590 HydrophobicContact CE2-CD1 3.63Å; Y588-I590 HydrophobicContact CE2-CG1 3.55Å; Y588-I590 PolarHBondContact O-N 3Å; Y588-N591 WeakPolarHBondContact CD1-OD1 3.33Å; Y588-N591 PolarHBondContact N-OD1 3.48Å; Y588-N591 PolarHBondContact O-N 2.83Å; Y588-N591 PolarHBondContact O-OD1 3.21Å; Y588-K592 PolarHBondContact O-N 3.42Å; Y588-F658 HydrophobicContact CG-CE2 4.25Å; Y588-F658 HydrophobicContact CG-CZ 4.39Å; Y588-D660 WeakPolarHBondContact CA-OD1 3.44Å; Y588-D660 WeakPolarHBondContact CB-OD2 3.44Å
589	Y	93.6	Very high	93.8	Very high	152 Å²	152	37.6 Å²	37.6	60%	0.596	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52	-30.4	-169.1	78.7	-86.3	0	0	0	115.5	D660	Y589-D660 WeakPolarHBondContact CD1-OD2 3.48Å; Y589-D660 PolarHBondContact N-OD1 2.7Å; Y589-D660 PolarHBondContact N-OD2 3.08Å
590	I	92.9	Very high	93.9	Very high	44 Å²	44	34.9 Å²	34.9	23%	0.226	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-35.6	-179.2	-65.1	-167.8	0	0	0	113	I543 Q547 Y588	I543-I590 HydrophobicContact CG2-CD1 4.23Å; Q547-I590 HydrophobicContact CB-CG2 4.39Å; Q547-I590 HydrophobicContact CG-CG2 3.31Å; Y588-I590 HydrophobicContact CD2-CB 4.17Å; Y588-I590 HydrophobicContact CD2-CG1 4.15Å; Y588-I590 HydrophobicContact CE1-CB 4.26Å; Y588-I590 HydrophobicContact CE2-CB 3.62Å; Y588-I590 HydrophobicContact CE2-CD1 3.63Å; Y588-I590 HydrophobicContact CE2-CG1 3.55Å; Y588-I590 PolarHBondContact O-N 3Å
591	N	94.7	Very high	93.7	Very high	1 Å²	1	43 Å²	43	1%	0.005	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119	-0	-170.2	69.8	4.5	0	0	0	114.8	F583 P586 Y588 E593 C594 F595	F583-N591 HydrophobicContact CZ-CB 4.5Å; P586-N591 PolarHBondContact O-ND2 3.24Å; P586-N591 PolarHBondContact O-OD1 3.08Å; Y588-N591 WeakPolarHBondContact CD1-OD1 3.33Å; Y588-N591 PolarHBondContact N-OD1 3.48Å; Y588-N591 PolarHBondContact O-N 2.83Å; Y588-N591 PolarHBondContact O-OD1 3.21Å; N591-E593 VanDerWaalsContact C-N 3.29Å; N591-E593 PolarHBondContact O-N 3.35Å; N591-C594 WeakPolarHBondContact O-CA 3.45Å; N591-C594 WeakPolarHBondContact O-CB 3.41Å; N591-C594 PolarHBondContact O-N 2.96Å; N591-F595 PolarHBondContact O-N 3.45Å
592	K	93.6	Very high	93.4	Very high	56 Å²	56	46 Å²	46	24%	0.243	23%	0.227	C	C	.	.	H	α-helix	trans	-51.4	-39.8	177.5	71.9	-174.8	178.2	80.6	0	114.9	L587 Y588 F595 K596 A662 T666	L587-K592 HydrophobicContact CD1-CB 4.34Å; Y588-K592 PolarHBondContact O-N 3.42Å; K592-F595 WeakPolarHBondContact O-CB 3.34Å; K592-F595 PolarHBondContact O-N 3.2Å; K592-K596 WeakPolarHBondContact O-CB 3.21Å; K592-K596 PolarHBondContact O-N 2.82Å; K592-A662 HydrophobicContact CD-CB 3.91Å; K592-T666 HydrophobicContact CB-CG2 4.22Å
593	E	93	Very high	93	Very high	104 Å²	104	45.1 Å²	45.1	49%	0.486	23%	0.227	S	C	.	.	H	α-helix	trans	-72.1	-33	177.6	-57.4	-52.3	146	0	0	112	N591 S597	N591-E593 VanDerWaalsContact C-N 3.29Å; N591-E593 PolarHBondContact O-N 3.35Å; E593-S597 WeakPolarHBondContact O-CB 3.37Å; E593-S597 PolarHBondContact O-N 3.05Å
594	C	93.4	Very high	92.8	Very high	41 Å²	41	46.9 Å²	46.9	28%	0.277	24%	0.238	S	C	.	.	H	α-helix	trans	-68.4	-41.9	174.1	-173.2	0	0	0	0	110.9	N591 A598	N591-C594 WeakPolarHBondContact O-CA 3.45Å; N591-C594 WeakPolarHBondContact O-CB 3.41Å; N591-C594 PolarHBondContact O-N 2.96Å; C594-A598 WeakPolarHBondContact O-CB 3.37Å; C594-A598 PolarHBondContact O-N 2.99Å
595	F	95	Very high	92.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-56.7	-56.8	171.6	172.6	-96.7	0	0	0	111.8	F581 F583 L587 N591 K592 S597 A598 L599 I651 T666 L667 V670	F581-F595 HydrophobicContact CE1-CD2 4.15Å; F581-F595 AromaticContact CE1-CE2 3.94Å; F581-F595 HydrophobicContact CE1-CE2 3.94Å; F583-F595 HydrophobicContact CB-CD2 3.96Å; F583-F595 HydrophobicContact CB-CE2 4.14Å; F583-F595 AromaticContact CD1-CD2 3.91Å; F583-F595 HydrophobicContact CD1-CD2 3.91Å; F583-F595 HydrophobicContact CD2-CB 4.21Å; F583-F595 AromaticContact CD2-CD2 3.68Å; F583-F595 HydrophobicContact CD2-CD2 3.68Å; F583-F595 HydrophobicContact CD2-CG 4.44Å; F583-F595 HydrophobicContact CE1-CB 4.33Å; F583-F595 HydrophobicContact CE1-CD2 4.24Å; F583-F595 HydrophobicContact CE2-CB 3.7Å; F583-F595 HydrophobicContact CE2-CD2 4.04Å; F583-F595 HydrophobicContact CE2-CG 4.39Å; F583-F595 AromaticContact CG-CD2 3.6Å; F583-F595 HydrophobicContact CG-CD2 3.6Å; F583-F595 HydrophobicContact CG-CE2 4.27Å; F583-F595 HydrophobicContact CZ-CB 3.75Å; F583-F595 HydrophobicContact CZ-CD2 4.29Å; L587-F595 HydrophobicContact CD1-CB 3.6Å; L587-F595 HydrophobicContact CD1-CD1 4Å; L587-F595 HydrophobicContact CD1-CD2 4.16Å; L587-F595 HydrophobicContact CD1-CG 3.67Å; L587-F595 HydrophobicContact CD2-CD1 4.01Å; L587-F595 HydrophobicContact CD2-CD2 4.2Å; L587-F595 HydrophobicContact CD2-CE1 3.94Å; L587-F595 HydrophobicContact CD2-CE2 4.14Å; L587-F595 HydrophobicContact CD2-CG 4.14Å; L587-F595 HydrophobicContact CD2-CZ 4.01Å; N591-F595 PolarHBondContact O-N 3.45Å; K592-F595 WeakPolarHBondContact O-CB 3.34Å; K592-F595 PolarHBondContact O-N 3.2Å; F595-S597 PolarHBondContact O-N 2.87Å; F595-A598 PolarHBondContact O-N 3.19Å; F595-L599 HydrophobicContact CE1-CD2 4.45Å; F595-L599 HydrophobicContact CZ-CD2 4.47Å; F595-L599 WeakPolarHBondContact O-CB 3.45Å; F595-L599 PolarHBondContact O-N 3.3Å; F595-I651 HydrophobicContact CE2-CG2 4.46Å; F595-I651 HydrophobicContact CZ-CD1 4.27Å; F595-I651 HydrophobicContact CZ-CG2 4.45Å; F595-T666 HydrophobicContact CD1-CG2 3.86Å; F595-T666 HydrophobicContact CE1-CG2 4.28Å; F595-L667 HydrophobicContact CE1-CD2 3.93Å; F595-L667 HydrophobicContact CZ-CD2 3.7Å; F595-V670 HydrophobicContact CE1-CG2 4.19Å
596	K	94.1	Very high	92.3	Very high	24 Å²	24	45.7 Å²	45.7	10%	0.104	23%	0.227	C	C	.	.	H	α-helix	trans	-60.4	-47.2	-178.3	-170.8	179.2	-176.3	-178.1	0	111.9	K592 L599 Y600 T666 E669 V670	K592-K596 WeakPolarHBondContact O-CB 3.21Å; K592-K596 PolarHBondContact O-N 2.82Å; K596-L599 PolarHBondContact O-N 3.19Å; K596-Y600 HydrophobicContact CD-CE2 4.39Å; K596-Y600 WeakPolarHBondContact CE-OH 3.31Å; K596-Y600 HydrophobicContact CG-CD1 4.45Å; K596-Y600 HydrophobicContact CG-CD2 4.3Å; K596-Y600 HydrophobicContact CG-CE1 4.04Å; K596-Y600 HydrophobicContact CG-CE2 3.9Å; K596-Y600 WeakPolarHBondContact O-CB 3.2Å; K596-Y600 WeakPolarHBondContact O-CD1 3.37Å; K596-Y600 VanDerWaalsContact O-CG 3.3Å; K596-Y600 PolarHBondContact O-N 2.94Å; K596-T666 HydrophobicContact CB-CG2 4.45Å; K596-E669 IonicContact NZ-OE1 2.72Å; K596-E669 PolarHBondContact NZ-OE1 3.39Å; K596-E669 IonicContact NZ-OE2 3.16Å; K596-E669 PolarHBondContact NZ-OE2 2.95Å; K596-V670 HydrophobicContact CG-CG2 4.21Å
597	S	93.1	Very high	91.8	Very high	79 Å²	79	48.7 Å²	48.7	55%	0.552	24%	0.241	S	C	*	.	H	α-helix	trans	-64.3	-41.1	178.4	-174.5	0	0	0	0	112.6	E593 F595 K601	E593-S597 WeakPolarHBondContact O-CB 3.37Å; E593-S597 PolarHBondContact O-N 3.05Å; F595-S597 PolarHBondContact O-N 2.87Å; S597-K601 WeakPolarHBondContact O-CB 3.32Å; S597-K601 PolarHBondContact O-N 3.43Å
598	A	93.2	Very high	91.4	Very high	14 Å²	14	54.3 Å²	54.3	12%	0.116	27%	0.27	C	S	.	.	H	α-helix	trans	-66.6	-45.3	176.9	0	0	0	0	0	112.1	S551 F581 C594 F595 K601 Q602	S551-A598 WeakPolarHBondContact OG-CB 3.42Å; F581-A598 HydrophobicContact CE2-CB 4.44Å; F581-A598 HydrophobicContact CZ-CB 4.17Å; C594-A598 WeakPolarHBondContact O-CB 3.37Å; C594-A598 PolarHBondContact O-N 2.99Å; F595-A598 PolarHBondContact O-N 3.19Å; A598-K601 PolarHBondContact O-N 3.42Å; A598-Q602 WeakPolarHBondContact O-CB 3.35Å; A598-Q602 WeakPolarHBondContact O-CG 3.49Å; A598-Q602 PolarHBondContact O-N 2.84Å
599	L	94.2	Very high	90.9	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.1	-50	177.4	178.1	60.9	0	0	0	111.3	F581 F595 K596 K601 Q602 T603 I649 I651 V670 Y674	F581-L599 HydrophobicContact CB-CD1 3.98Å; F581-L599 HydrophobicContact CD1-CD1 3.75Å; F581-L599 HydrophobicContact CD2-CD1 4.05Å; F581-L599 HydrophobicContact CE1-CB 4.06Å; F581-L599 HydrophobicContact CE1-CD1 4.15Å; F581-L599 HydrophobicContact CE2-CB 4.35Å; F581-L599 HydrophobicContact CE2-CD1 4.44Å; F581-L599 HydrophobicContact CG-CD1 3.67Å; F581-L599 HydrophobicContact CZ-CB 3.96Å; F581-L599 HydrophobicContact CZ-CD1 4.48Å; F595-L599 HydrophobicContact CE1-CD2 4.45Å; F595-L599 HydrophobicContact CZ-CD2 4.47Å; F595-L599 WeakPolarHBondContact O-CB 3.45Å; F595-L599 PolarHBondContact O-N 3.3Å; K596-L599 PolarHBondContact O-N 3.19Å; L599-K601 PolarHBondContact O-N 3.43Å; L599-Q602 PolarHBondContact O-N 3.03Å; L599-T603 HydrophobicContact CD1-CG2 3.96Å; L599-T603 PolarHBondContact O-N 3.23Å; L599-T603 PolarHBondContact O-OG1 3.12Å; L599-I649 HydrophobicContact CD1-CG2 4.2Å; L599-I651 HydrophobicContact CD2-CD1 4.28Å; L599-V670 HydrophobicContact CD2-CG1 3.48Å; L599-V670 VanDerWaalsContact CD2-CG1 3.48Å; L599-V670 HydrophobicContact CD2-CG2 4.35Å; L599-Y674 HydrophobicContact CD2-CE2 3.97Å; L599-Y674 HydrophobicContact CG-CE2 4.18Å
600	Y	93.8	Very high	90.3	Very high	17 Å²	17	50.8 Å²	50.8	7%	0.067	26%	0.259	C	S	.	.	H	α-helix	trans	-68.1	-22	-179	-69.4	12.8	0	0	0	112.4	K596 V604 N605 P606 I607 V670 D673 Y674	K596-Y600 HydrophobicContact CD-CE2 4.39Å; K596-Y600 WeakPolarHBondContact CE-OH 3.31Å; K596-Y600 HydrophobicContact CG-CD1 4.45Å; K596-Y600 HydrophobicContact CG-CD2 4.3Å; K596-Y600 HydrophobicContact CG-CE1 4.04Å; K596-Y600 HydrophobicContact CG-CE2 3.9Å; K596-Y600 WeakPolarHBondContact O-CB 3.2Å; K596-Y600 WeakPolarHBondContact O-CD1 3.37Å; K596-Y600 VanDerWaalsContact O-CG 3.3Å; K596-Y600 PolarHBondContact O-N 2.94Å; Y600-V604 CarbonylContact O-C 3.58Å; Y600-N605 PolarHBondContact O-N 3.44Å; Y600-P606 HydrophobicContact CD1-CG 4.39Å; Y600-P606 HydrophobicContact CD2-CG 4.27Å; Y600-P606 HydrophobicContact CE1-CG 4.02Å; Y600-P606 HydrophobicContact CE2-CG 3.87Å; Y600-I607 HydrophobicContact CD2-CD1 4.48Å; Y600-I607 HydrophobicContact CE2-CD1 3.86Å; Y600-I607 HydrophobicContact CE2-CG1 4.11Å; Y600-V670 HydrophobicContact CE1-CG2 4.01Å; Y600-D673 VanDerWaalsContact OH-CB 3.29Å; Y600-D673 WeakPolarHBondContact OH-CB 3.38Å; Y600-D673 PolarHBondContact OH-OD2 3.17Å; Y600-Y674 AromaticContact CD1-CE2 3.94Å; Y600-Y674 HydrophobicContact CD1-CE2 3.94Å; Y600-Y674 AromaticContact CD1-CZ 3.85Å; Y600-Y674 WeakPolarHBondContact CD1-OH 3.43Å; Y600-Y674 HydrophobicContact CE1-CD2 4.48Å; Y600-Y674 AromaticContact CE1-CE2 3.66Å; Y600-Y674 HydrophobicContact CE1-CE2 3.66Å; Y600-Y674 AromaticContact CE1-CZ 3.97Å
601	K	91.8	Very high	89.8	Confident	181 Å²	181	52.8 Å²	52.8	79%	0.787	27%	0.274	S	S	*	.	H	α-helix	trans	-86.9	-33.6	174.9	-176.9	176.4	178.6	-179.1	0	113.4	S597 A598 L599	S597-K601 WeakPolarHBondContact O-CB 3.32Å; S597-K601 PolarHBondContact O-N 3.43Å; A598-K601 PolarHBondContact O-N 3.42Å; L599-K601 PolarHBondContact O-N 3.43Å
602	Q	88.4	Confident	89.2	Confident	62 Å²	62	55.2 Å²	55.2	29%	0.29	29%	0.294	S	S	.	.	H	α-helix	trans	-88	-24.4	-178.1	-69.7	-171	24.4	0	0	113.5	S551 S552 L553 F581 A598 L599	S551-Q602 PolarHBondContact O-NE2 3.48Å; S551-Q602 PolarHBondContact OG-NE2 2.98Å; S552-Q602 VanDerWaalsContact C-OE1 3.3Å; S552-Q602 VanDerWaalsContact CA-OE1 3.24Å; L553-Q602 HydrophobicContact CD2-CB 4.24Å; L553-Q602 HydrophobicContact CG-CB 4.25Å; L553-Q602 VanDerWaalsContact N-OE1 3.17Å; F581-Q602 HydrophobicContact CD2-CB 4.47Å; F581-Q602 HydrophobicContact CE2-CB 4.44Å; A598-Q602 WeakPolarHBondContact O-CB 3.35Å; A598-Q602 WeakPolarHBondContact O-CG 3.49Å; A598-Q602 PolarHBondContact O-N 2.84Å; L599-Q602 PolarHBondContact O-N 3.03Å
603	T	87.8	Confident	88.6	Confident	25 Å²	25	56.4 Å²	56.4	15%	0.153	30%	0.297	C	S	.	.	S	Bend	trans	-104.6	-97.1	177.1	61	0	0	0	0	110.5	L553 K579 L599 I649 Y674	L553-T603 HydrophobicContact CD2-CG2 4.02Å; K579-T603 HydrophobicContact CB-CG2 3.88Å; K579-T603 HydrophobicContact CG-CG2 4.44Å; L599-T603 HydrophobicContact CD1-CG2 3.96Å; L599-T603 PolarHBondContact O-N 3.23Å; L599-T603 PolarHBondContact O-OG1 3.12Å; T603-I649 HydrophobicContact CG2-CD1 4.29Å; T603-I649 HydrophobicContact CG2-CG1 4.49Å; T603-Y674 PolarHBondContact OG1-OH 3.42Å
604	V	88.1	Confident	88.1	Confident	38 Å²	38	58.2 Å²	58.2	23%	0.23	30%	0.303	C	S	.	.			trans	-144.8	144.7	178.4	169.7	0	0	0	0	107.3	Y600 P606 I609 L646 Y674 I677	Y600-V604 CarbonylContact O-C 3.58Å; V604-P606 VanDerWaalsContact O-CD 3.25Å; V604-P606 WeakPolarHBondContact O-CD 3.09Å; V604-I609 HydrophobicContact CG1-CD1 3.24Å; V604-I609 HydrophobicContact CG1-CG1 4.36Å; V604-L646 HydrophobicContact CB-CD2 4.13Å; V604-L646 HydrophobicContact CG2-CD2 3.65Å; V604-Y674 WeakPolarHBondContact O-CE1 3.28Å; V604-Y674 PolarHBondContact O-OH 3.42Å; V604-I677 HydrophobicContact CG1-CD1 4.43Å
605	N	88.9	Confident	87.6	Confident	65 Å²	65	62.5 Å²	62.5	35%	0.348	32%	0.317	S	S	.	.			trans	-91.8	105.4	177.9	-175.9	-29.7	0	0	0	110.9	Y600 I607 L608 I609	Y600-N605 PolarHBondContact O-N 3.44Å; N605-I607 VanDerWaalsContact C-N 3.34Å; N605-I607 PolarHBondContact O-N 3.29Å; N605-I607 PolarHBondContact OD1-N 2.93Å; N605-I607 VanDerWaalsContact OD1-N 3.13Å; N605-L608 HydrophobicContact CB-CB 4.14Å; N605-L608 PolarHBondContact O-N 2.93Å; N605-L608 PolarHBondContact OD1-N 3.04Å; N605-L608 VanDerWaalsContact OD1-N 3.15Å; N605-I609 PolarHBondContact O-N 3.4Å
606	P	86.4	Confident	86.9	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.006	34%	0.339	C	S	.	.	H	α-helix	trans	-68.4	-32.3	-174.8	26.9	-34	0	0	0	113	Y600 V604 L608 I609 K610 D673 Y674 I677	Y600-P606 HydrophobicContact CD1-CG 4.39Å; Y600-P606 HydrophobicContact CD2-CG 4.27Å; Y600-P606 HydrophobicContact CE1-CG 4.02Å; Y600-P606 HydrophobicContact CE2-CG 3.87Å; V604-P606 VanDerWaalsContact O-CD 3.25Å; V604-P606 WeakPolarHBondContact O-CD 3.09Å; P606-L608 VanDerWaalsContact C-N 3.35Å; P606-L608 PolarHBondContact O-N 3.39Å; P606-I609 PolarHBondContact O-N 3.3Å; P606-K610 VanDerWaalsContact O-CB 3.27Å; P606-K610 WeakPolarHBondContact O-CB 3.31Å; P606-K610 PolarHBondContact O-N 3.32Å; P606-D673 HydrophobicContact CB-CB 4.4Å; P606-D673 VanDerWaalsContact CB-O 3.3Å; P606-D673 WeakPolarHBondContact CB-O 3.49Å; P606-D673 HydrophobicContact CG-CB 3.93Å; P606-Y674 HydrophobicContact CB-CD1 4.14Å; P606-Y674 HydrophobicContact CB-CE1 4.24Å; P606-Y674 HydrophobicContact CG-CD1 4.14Å; P606-Y674 HydrophobicContact CG-CE1 3.94Å; P606-I677 HydrophobicContact CB-CD1 3.78Å; P606-I677 HydrophobicContact CB-CG1 4.02Å; P606-I677 HydrophobicContact CB-CG2 4.38Å
607	I	83.8	Confident	86.2	Confident	85 Å²	85	66.3 Å²	66.3	44%	0.436	35%	0.353	S	S	.	.	H	α-helix	trans	-64.6	-42.8	179.4	-58.1	175.8	0	0	0	109.9	Y600 N605 K610 V611	Y600-I607 HydrophobicContact CD2-CD1 4.48Å; Y600-I607 HydrophobicContact CE2-CD1 3.86Å; Y600-I607 HydrophobicContact CE2-CG1 4.11Å; N605-I607 VanDerWaalsContact C-N 3.34Å; N605-I607 PolarHBondContact O-N 3.29Å; N605-I607 PolarHBondContact OD1-N 2.93Å; N605-I607 VanDerWaalsContact OD1-N 3.13Å; I607-K610 PolarHBondContact O-N 3.34Å; I607-V611 WeakPolarHBondContact O-CG2 3.42Å; I607-V611 PolarHBondContact O-N 3.49Å
608	L	84.7	Confident	85.6	Confident	118 Å²	118	70.4 Å²	70.4	62%	0.618	36%	0.361	S	S	*	.	H	α-helix	trans	-65.6	-43	179.4	-173.8	62.1	0	0	0	111.9	N605 P606 V611 A612	N605-L608 HydrophobicContact CB-CB 4.14Å; N605-L608 PolarHBondContact O-N 2.93Å; N605-L608 PolarHBondContact OD1-N 3.04Å; N605-L608 VanDerWaalsContact OD1-N 3.15Å; P606-L608 VanDerWaalsContact C-N 3.35Å; P606-L608 PolarHBondContact O-N 3.39Å; L608-V611 PolarHBondContact O-N 3.49Å; L608-A612 WeakPolarHBondContact O-CB 3.42Å; L608-A612 PolarHBondContact O-N 2.92Å
609	I	83.6	Confident	84.8	Confident	28 Å²	28	77 Å²	77	14%	0.144	38%	0.383	C	S	.	.	H	α-helix	trans	-61.6	-47.4	174.8	-70.5	176.7	0	0	0	110.9	V604 N605 P606 V611 A612 W613 L644 I677	V604-I609 HydrophobicContact CG1-CD1 3.24Å; V604-I609 HydrophobicContact CG1-CG1 4.36Å; N605-I609 PolarHBondContact O-N 3.4Å; P606-I609 PolarHBondContact O-N 3.3Å; I609-V611 PolarHBondContact O-N 3.34Å; I609-A612 CarbonylContact O-C 3.59Å; I609-A612 WeakPolarHBondContact O-CA 3.34Å; I609-A612 WeakPolarHBondContact O-CB 3.32Å; I609-A612 PolarHBondContact O-N 3Å; I609-W613 HydrophobicContact CG2-CD2 3.76Å; I609-W613 HydrophobicContact CG2-CE3 4.26Å; I609-W613 HydrophobicContact CG2-CG 4.3Å; I609-W613 HydrophobicContact CG2-CH2 4.09Å; I609-W613 HydrophobicContact CG2-CZ2 3.56Å; I609-W613 HydrophobicContact CG2-CZ3 4.42Å; I609-W613 PolarHBondContact O-N 3.39Å; I609-L644 HydrophobicContact CD1-CD1 4.14Å; I609-L644 HydrophobicContact CD1-CD2 3.75Å; I609-I677 HydrophobicContact CB-CG2 4.31Å; I609-I677 HydrophobicContact CD1-CD1 3.98Å; I609-I677 HydrophobicContact CG2-CB 4.42Å; I609-I677 HydrophobicContact CG2-CG2 3.88Å
610	K	81.8	Confident	83.5	Confident	83 Å²	83	82.9 Å²	82.9	36%	0.361	41%	0.409	S	S	.	.	H	α-helix	trans	-62.5	-30.9	179.7	-161.1	169.7	-168.9	172.5	0	112.5	P606 I607 K614 A676	P606-K610 VanDerWaalsContact O-CB 3.27Å; P606-K610 WeakPolarHBondContact O-CB 3.31Å; P606-K610 PolarHBondContact O-N 3.32Å; I607-K610 PolarHBondContact O-N 3.34Å; K610-K614 WeakPolarHBondContact O-CB 3.36Å; K610-K614 VanDerWaalsContact O-CG 3.31Å; K610-K614 WeakPolarHBondContact O-CG 3.37Å; K610-K614 PolarHBondContact O-N 3.3Å; K610-A676 HydrophobicContact CD-CB 4.49Å
611	V	83.6	Confident	82.6	Confident	86 Å²	86	87 Å²	87	52%	0.521	43%	0.431	S	S	.	.	H	α-helix	trans	-73.7	-41.5	170.2	170	0	0	0	0	111.7	I607 L608 I609 K614 K615	I607-V611 WeakPolarHBondContact O-CG2 3.42Å; I607-V611 PolarHBondContact O-N 3.49Å; L608-V611 PolarHBondContact O-N 3.49Å; I609-V611 PolarHBondContact O-N 3.34Å; V611-K614 PolarHBondContact O-N 3.16Å; V611-K615 WeakPolarHBondContact O-CB 3.46Å; V611-K615 PolarHBondContact O-N 3.36Å
612	A	81.8	Confident	81.6	Confident	53 Å²	53	85.9 Å²	85.9	44%	0.438	43%	0.426	S	S	.	.	H	α-helix	trans	-61.6	-48.2	176.7	0	0	0	0	0	111.9	L608 I609 K614 K615 A616	L608-A612 WeakPolarHBondContact O-CB 3.42Å; L608-A612 PolarHBondContact O-N 2.92Å; I609-A612 CarbonylContact O-C 3.59Å; I609-A612 WeakPolarHBondContact O-CA 3.34Å; I609-A612 WeakPolarHBondContact O-CB 3.32Å; I609-A612 PolarHBondContact O-N 3Å; A612-K614 PolarHBondContact O-N 3.37Å; A612-K615 CarbonylContact O-C 3.51Å; A612-K615 WeakPolarHBondContact O-CB 3.17Å; A612-K615 PolarHBondContact O-N 2.93Å; A612-K615 VanDerWaalsContact O-N 3.1Å; A612-A616 WeakPolarHBondContact O-CB 3.46Å; A612-A616 PolarHBondContact O-N 3.31Å
613	W	80.9	Confident	80.3	Confident	81 Å²	81	88.6 Å²	88.6	31%	0.307	44%	0.438	S	S	.	.	H	α-helix	trans	-58.8	-45.9	174.4	-67.1	-12.3	0	0	0	112.1	I609 K615 A616 A617 H641 L644 I677	I609-W613 HydrophobicContact CG2-CD2 3.76Å; I609-W613 HydrophobicContact CG2-CE3 4.26Å; I609-W613 HydrophobicContact CG2-CG 4.3Å; I609-W613 HydrophobicContact CG2-CH2 4.09Å; I609-W613 HydrophobicContact CG2-CZ2 3.56Å; I609-W613 HydrophobicContact CG2-CZ3 4.42Å; I609-W613 PolarHBondContact O-N 3.39Å; W613-K615 VanDerWaalsContact C-N 3.27Å; W613-K615 PolarHBondContact O-N 3.04Å; W613-A616 PolarHBondContact O-N 3.39Å; W613-A617 WeakPolarHBondContact O-CB 3.44Å; W613-A617 PolarHBondContact O-N 3.47Å; W613-H641 AromaticContact CD2-CE1 3.76Å; W613-H641 AromaticContact CD2-ND1 3.61Å; W613-H641 AromaticContact CE2-CE1 3.92Å; W613-H641 AromaticContact CE2-ND1 3.29Å; W613-H641 VanDerWaalsContact CE2-ND1 3.29Å; W613-H641 AromaticContact CE3-CE1 3.76Å; W613-H641 AromaticContact CE3-ND1 3.97Å; W613-H641 AromaticContact CH2-ND1 3.79Å; W613-H641 AromaticContact CZ2-ND1 3.41Å; W613-H641 WeakPolarHBondContact CZ2-ND1 3.2Å; W613-H641 AromaticContact CZ3-CE1 3.94Å; W613-H641 AromaticContact NE1-ND1 3.69Å; W613-L644 HydrophobicContact CH2-CD1 4.45Å; W613-L644 HydrophobicContact CZ2-CD1 4.12Å; W613-I677 HydrophobicContact CE3-CG2 4.43Å; W613-I677 HydrophobicContact CH2-CB 3.77Å; W613-I677 HydrophobicContact CH2-CG2 4.03Å; W613-I677 HydrophobicContact CZ3-CB 4Å; W613-I677 HydrophobicContact CZ3-CG2 3.82Å
614	K	82.1	Confident	78.8	Confident	141 Å²	141	93.5 Å²	93.5	61%	0.613	46%	0.46	S	S	*	.	H	α-helix	trans	-60.9	-33.8	174.1	-78.6	-177.9	176	-169.6	0	113.1	K610 V611 A612 K618	K610-K614 WeakPolarHBondContact O-CB 3.36Å; K610-K614 VanDerWaalsContact O-CG 3.31Å; K610-K614 WeakPolarHBondContact O-CG 3.37Å; K610-K614 PolarHBondContact O-N 3.3Å; V611-K614 PolarHBondContact O-N 3.16Å; A612-K614 PolarHBondContact O-N 3.37Å; K614-K618 WeakPolarHBondContact O-CB 3.28Å; K614-K618 WeakPolarHBondContact O-CG 3.36Å; K614-K618 PolarHBondContact O-N 3.33Å; K614-K618 VanDerWaalsContact O-N 3.16Å
615	K	83.5	Confident	77.3	Confident	132 Å²	132	97.3 Å²	97.3	57%	0.574	48%	0.483	S	S	*	.	H	α-helix	trans	-75.6	-35.2	176.6	-170.6	175.8	-179.4	179.4	0	112.3	V611 A612 W613 R619	V611-K615 WeakPolarHBondContact O-CB 3.46Å; V611-K615 PolarHBondContact O-N 3.36Å; A612-K615 CarbonylContact O-C 3.51Å; A612-K615 WeakPolarHBondContact O-CB 3.17Å; A612-K615 PolarHBondContact O-N 2.93Å; A612-K615 VanDerWaalsContact O-N 3.1Å; W613-K615 VanDerWaalsContact C-N 3.27Å; W613-K615 PolarHBondContact O-N 3.04Å; K615-R619 WeakPolarHBondContact O-CG 3.17Å; K615-R619 PolarHBondContact O-N 3.18Å; K615-R619 VanDerWaalsContact O-N 3.12Å
616	A	79.6	Confident	75.7	Confident	54 Å²	54	99.2 Å²	99.2	45%	0.446	50%	0.496	S	S	.	.	H	α-helix	trans	-68.1	-47.7	174.4	0	0	0	0	0	111.5	A612 W613 K618 R619 K620	A612-A616 WeakPolarHBondContact O-CB 3.46Å; A612-A616 PolarHBondContact O-N 3.31Å; W613-A616 PolarHBondContact O-N 3.39Å; A616-K618 VanDerWaalsContact C-N 3.34Å; A616-K618 PolarHBondContact O-N 3.27Å; A616-R619 WeakPolarHBondContact O-CA 3.28Å; A616-R619 WeakPolarHBondContact O-CB 3.37Å; A616-R619 PolarHBondContact O-N 2.88Å; A616-K620 PolarHBondContact O-N 3.43Å
617	A	79.8	Confident	73.8	Confident	50 Å²	50	104.3 Å²	104.3	41%	0.413	53%	0.528	S	S	.	.	H	α-helix	trans	-57.4	-45.4	174.1	0	0	0	0	0	111.9	W613 R619 K620 I621	W613-A617 WeakPolarHBondContact O-CB 3.44Å; W613-A617 PolarHBondContact O-N 3.47Å; A617-R619 PolarHBondContact O-N 2.89Å; A617-K620 PolarHBondContact O-N 3.22Å; A617-I621 WeakPolarHBondContact O-CD1 3.4Å; A617-I621 VanDerWaalsContact O-CG1 3.29Å; A617-I621 WeakPolarHBondContact O-CG1 3.07Å; A617-I621 PolarHBondContact O-N 3.46Å
618	K	80.9	Confident	72.1	Confident	164 Å²	164	106.5 Å²	106.5	71%	0.713	55%	0.547	S	S	*	.	H	α-helix	trans	-66.1	-17.6	174.3	-78.3	-169.1	173.6	-163.8	0	114.8	K614 A616	K614-K618 WeakPolarHBondContact O-CB 3.28Å; K614-K618 WeakPolarHBondContact O-CG 3.36Å; K614-K618 PolarHBondContact O-N 3.33Å; K614-K618 VanDerWaalsContact O-N 3.16Å; A616-K618 VanDerWaalsContact C-N 3.34Å; A616-K618 PolarHBondContact O-N 3.27Å
619	R	75.6	Confident	70.1	Confident	152 Å²	152	104.8 Å²	104.8	57%	0.574	56%	0.558	S	S	*	*	H	α-helix	trans	-81	-51.5	171.4	-82.7	177.7	167.6	-178.6	-8.9	110.8	K615 A616 A617 I621 K622 E623	K615-R619 WeakPolarHBondContact O-CG 3.17Å; K615-R619 PolarHBondContact O-N 3.18Å; K615-R619 VanDerWaalsContact O-N 3.12Å; A616-R619 WeakPolarHBondContact O-CA 3.28Å; A616-R619 WeakPolarHBondContact O-CB 3.37Å; A616-R619 PolarHBondContact O-N 2.88Å; A617-R619 PolarHBondContact O-N 2.89Å; R619-I621 PolarHBondContact O-N 3.08Å; R619-K622 CarbonylContact O-C 3.53Å; R619-K622 WeakPolarHBondContact O-CA 3.32Å; R619-K622 WeakPolarHBondContact O-CB 3.47Å; R619-K622 PolarHBondContact O-N 2.67Å; R619-E623 PolarHBondContact O-N 3.17Å
620	K	67.6	Low	67.8	Low	125 Å²	125	107.1 Å²	107.1	54%	0.543	59%	0.59	S	S	.	*	H	α-helix	trans	-55.1	-47.6	177	-71.5	-162.1	171.7	-166.6	0	112.5	A616 A617 K622 E623 E624	A616-K620 PolarHBondContact O-N 3.43Å; A617-K620 PolarHBondContact O-N 3.22Å; K620-K622 PolarHBondContact O-N 3.31Å; K620-K622 VanDerWaalsContact O-N 3.15Å; K620-E623 PolarHBondContact O-N 3.21Å; K620-E624 WeakPolarHBondContact O-CB 3.44Å; K620-E624 WeakPolarHBondContact O-CG 3.49Å; K620-E624 PolarHBondContact O-N 3.32Å
621	I	74.1	Confident	65.6	Low	103 Å²	103	111.3 Å²	111.3	53%	0.528	61%	0.614	S	S	.	*	H	α-helix	trans	-58.1	-31.4	174.9	-65.8	164.9	0	0	0	112.2	A617 R619 V625	A617-I621 WeakPolarHBondContact O-CD1 3.4Å; A617-I621 VanDerWaalsContact O-CG1 3.29Å; A617-I621 WeakPolarHBondContact O-CG1 3.07Å; A617-I621 PolarHBondContact O-N 3.46Å; R619-I621 PolarHBondContact O-N 3.08Å; I621-V625 WeakPolarHBondContact O-CB 3.5Å; I621-V625 WeakPolarHBondContact O-CG2 3.4Å; I621-V625 PolarHBondContact O-N 3Å
622	K	70.9	Confident	63.6	Low	158 Å²	158	116.1 Å²	116.1	69%	0.687	63%	0.631	S	S	*	*	H	α-helix	trans	-81.7	-28.1	176.6	-168	178.8	179	-172.2	0	112.6	R619 K620 V626	R619-K622 CarbonylContact O-C 3.53Å; R619-K622 WeakPolarHBondContact O-CA 3.32Å; R619-K622 WeakPolarHBondContact O-CB 3.47Å; R619-K622 PolarHBondContact O-N 2.67Å; K620-K622 PolarHBondContact O-N 3.31Å; K620-K622 VanDerWaalsContact O-N 3.15Å; K622-V626 VanDerWaalsContact O-CG2 3.23Å; K622-V626 WeakPolarHBondContact O-CG2 3.33Å
623	E	60.8	Low	61.1	Low	118 Å²	118	121.1 Å²	121.1	55%	0.551	65%	0.65	S	S	*	*	H	α-helix	trans	-75.9	-45.2	176.4	-73.3	149.2	-171.8	0	0	110.4	R619 K620 V625 V626	R619-E623 PolarHBondContact O-N 3.17Å; K620-E623 PolarHBondContact O-N 3.21Å; E623-V625 VanDerWaalsContact C-N 3.31Å; E623-V625 PolarHBondContact O-N 3.44Å; E623-V626 PolarHBondContact O-N 2.96Å
624	E	56.5	Low	59.1	Low	128 Å²	128	126.4 Å²	126.4	60%	0.598	68%	0.678	S	S	*	*	H	α-helix	trans	-57.9	-38.5	174.4	-71.4	159.3	-175	0	0	112.6	K620 V626	K620-E624 WeakPolarHBondContact O-CB 3.44Å; K620-E624 WeakPolarHBondContact O-CG 3.49Å; K620-E624 PolarHBondContact O-N 3.32Å; E624-V626 PolarHBondContact O-N 3.09Å
625	V	56.5	Low	56.5	Low	119 Å²	119	127.8 Å²	127.8	72%	0.721	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-9.9	177.1	168	0	0	0	0	113.3	I621 E623	I621-V625 WeakPolarHBondContact O-CB 3.5Å; I621-V625 WeakPolarHBondContact O-CG2 3.4Å; I621-V625 PolarHBondContact O-N 3Å; E623-V625 VanDerWaalsContact C-N 3.31Å; E623-V625 PolarHBondContact O-N 3.44Å
626	V	55.7	Low	54	Low	104 Å²	104	126.9 Å²	126.9	63%	0.63	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-9.8	-177.6	169.5	0	0	0	0	113.3	K622 E623 E624 P628	K622-V626 VanDerWaalsContact O-CG2 3.23Å; K622-V626 WeakPolarHBondContact O-CG2 3.33Å; E623-V626 PolarHBondContact O-N 2.96Å; E624-V626 PolarHBondContact O-N 3.09Å; V626-P628 VanDerWaalsContact O-CD 3.26Å; V626-P628 WeakPolarHBondContact O-CD 3.4Å
627	T	46.5	Very low	51.7	Low	109 Å²	109	129.8 Å²	129.8	67%	0.669	71%	0.711	S	S	*	*			trans	-114.6	89.4	178.1	43.6	0	0	0	0	113.4	G629	T627-G629 PolarHBondContact O-N 2.95Å
628	P	47.8	Very low	49.3	Very low	130 Å²	130	135.4 Å²	135.4	84%	0.844	73%	0.729	S	S	*	*			trans	-87.6	104.4	175.3	33.1	-32.6	0	0	0	112.6	V626	V626-P628 VanDerWaalsContact O-CD 3.26Å; V626-P628 WeakPolarHBondContact O-CD 3.4Å
629	G	43.3	Very low	47.1	Very low	82 Å²	82	134.3 Å²	134.3	85%	0.845	73%	0.73	S	S	*	*			trans	122.5	110.1	161.2	0	0	0	0	0	115.8	T627	T627-G629 PolarHBondContact O-N 2.95Å
630	G	34.3	Very low	45	Very low	78 Å²	78	132.2 Å²	132.2	80%	0.804	74%	0.739	S	S	*	*			trans	179.6	134.2	173.8	0	0	0	0	0	110.1
631	I	36.8	Very low	44	Very low	171 Å²	171	130.4 Å²	130.4	88%	0.877	73%	0.732	S	S	*	*			trans	-66.5	155.2	-170.2	-67.7	170.8	0	0	0	112.3
632	Q	40.1	Very low	42.5	Very low	186 Å²	186	132.5 Å²	132.5	87%	0.869	74%	0.744	S	S	*	*			trans	-53.6	145.4	178.1	-62.6	170.1	-66.2	0	0	113.9
633	D	28.9	Very low	41.8	Very low	159 Å²	159	130.6 Å²	130.6	85%	0.85	75%	0.748	S	S	*	*			trans	-142.9	146.3	139.9	-158	-4.6	0	0	0	108.8	M635	D633-M635 PolarHBondContact O-N 3.47Å
634	E	39.5	Very low	42	Very low	191 Å²	191	128 Å²	128	89%	0.893	74%	0.738	S	S	*	*			trans	-85.3	90.1	-177.4	-78.8	-159.4	135.3	0	0	111.3
635	M	27.3	Very low	42.8	Very low	171 Å²	171	130.4 Å²	130.4	84%	0.842	75%	0.749	S	S	*	*			trans	-120	112.5	164.1	-127.8	178.1	-163.3	0	0	111.6	D633 V637	D633-M635 PolarHBondContact O-N 3.47Å; M635-V637 VanDerWaalsContact C-N 3.32Å; M635-V637 PolarHBondContact O-N 3.44Å
636	S	31.3	Very low	44.1	Very low	112 Å²	112	125.4 Å²	125.4	78%	0.783	72%	0.718	S	S	*	*			trans	-70.5	86	175	49.4	0	0	0	0	110.2	Q638	S636-Q638 PolarHBondContact O-N 2.93Å
637	V	31.1	Very low	45.7	Very low	115 Å²	115	122.3 Å²	122.3	70%	0.697	70%	0.697	S	S	*	*			trans	-67.9	82.5	175.1	-173.3	0	0	0	0	109.5	M635	M635-V637 VanDerWaalsContact C-N 3.32Å; M635-V637 PolarHBondContact O-N 3.44Å
638	Q	28.9	Very low	47.9	Very low	168 Å²	168	117.2 Å²	117.2	79%	0.785	67%	0.665	S	S	*	*			trans	-49.9	143.2	163	-69.2	178.3	-36	0	0	108.7	S636 S640	S636-Q638 PolarHBondContact O-N 2.93Å; Q638-S640 VanDerWaalsContact C-N 3.28Å; Q638-S640 PolarHBondContact O-N 2.94Å
639	L	35	Very low	50.1	Low	142 Å²	142	111 Å²	111	74%	0.743	63%	0.625	S	S	*	*			trans	-67.1	92.1	173.1	-86.6	73.6	0	0	0	109	H641	L639-H641 PolarHBondContact O-CD2 3.01Å; L639-H641 PolarHBondContact O-N 3.09Å
640	S	32.4	Very low	52.5	Low	107 Å²	107	107.1 Å²	107.1	75%	0.748	59%	0.585	S	S	*	*			trans	-66.8	75.1	159.5	48.7	0	0	0	0	109	Q638 D642	Q638-S640 VanDerWaalsContact C-N 3.28Å; Q638-S640 PolarHBondContact O-N 2.94Å; S640-D642 PolarHBondContact O-N 2.86Å
641	H	46.3	Very low	55.5	Low	88 Å²	88	103.4 Å²	103.4	41%	0.407	55%	0.547	S	S	.	.			trans	-55.2	128.1	154.5	-68.3	-96.9	0	0	0	107.1	W613 L639 P643	W613-H641 AromaticContact CD2-CE1 3.76Å; W613-H641 AromaticContact CD2-ND1 3.61Å; W613-H641 AromaticContact CE2-CE1 3.92Å; W613-H641 AromaticContact CE2-ND1 3.29Å; W613-H641 VanDerWaalsContact CE2-ND1 3.29Å; W613-H641 AromaticContact CE3-CE1 3.76Å; W613-H641 AromaticContact CE3-ND1 3.97Å; W613-H641 AromaticContact CH2-ND1 3.79Å; W613-H641 AromaticContact CZ2-ND1 3.41Å; W613-H641 WeakPolarHBondContact CZ2-ND1 3.2Å; W613-H641 AromaticContact CZ3-CE1 3.94Å; W613-H641 AromaticContact NE1-ND1 3.69Å; L639-H641 PolarHBondContact O-CD2 3.01Å; L639-H641 PolarHBondContact O-N 3.09Å; H641-P643 WeakPolarHBondContact O-CD 3.23Å; H641-P643 VanDerWaalsContact O-N 3.1Å
642	D	43.3	Very low	58.2	Low	146 Å²	146	95.2 Å²	95.2	78%	0.781	51%	0.505	S	S	*	.			trans	-51	121.5	168.1	-65.9	-58.2	0	0	0	108.1	S640 L644	S640-D642 PolarHBondContact O-N 2.86Å; D642-L644 PolarHBondContact O-N 3.3Å
643	P	56.6	Low	60.8	Low	119 Å²	119	86.4 Å²	86.4	77%	0.773	46%	0.464	S	S	*	.			trans	-66.1	111.9	-170.1	24.1	-32.9	0	0	0	109.3	H641 E645	H641-P643 WeakPolarHBondContact O-CD 3.23Å; H641-P643 VanDerWaalsContact O-N 3.1Å; P643-E645 PolarHBondContact O-N 3.2Å; P643-E645 VanDerWaalsContact O-N 3.09Å
644	L	63.1	Low	63.8	Low	64 Å²	64	81.4 Å²	81.4	34%	0.335	44%	0.441	S	S	.	.			trans	-59	116.4	173	-71.8	167.3	0	0	0	108.3	I609 W613 D642 L646 I677 I679	I609-L644 HydrophobicContact CD1-CD1 4.14Å; I609-L644 HydrophobicContact CD1-CD2 3.75Å; W613-L644 HydrophobicContact CH2-CD1 4.45Å; W613-L644 HydrophobicContact CZ2-CD1 4.12Å; D642-L644 PolarHBondContact O-N 3.3Å; L644-L646 PolarHBondContact O-N 2.69Å; L644-L646 VanDerWaalsContact O-N 3.09Å; L644-I677 HydrophobicContact CD1-CB 4.49Å; L644-I677 HydrophobicContact CD1-CD1 4.2Å; L644-I679 HydrophobicContact CD1-CD1 4.43Å
645	E	74.4	Confident	66.3	Low	177 Å²	177	73.6 Å²	73.6	83%	0.827	41%	0.409	S	S	*	.	S	Bend	trans	-53.4	-35.5	-180	-60.7	-176	147.3	0	0	111.6	G577 P643	G577-E645 WeakPolarHBondContact CA-O 3.19Å; P643-E645 PolarHBondContact O-N 3.2Å; P643-E645 VanDerWaalsContact O-N 3.09Å
646	L	84.4	Confident	69.5	Low	15 Å²	15	65.5 Å²	65.5	8%	0.079	37%	0.369	C	S	.	.			trans	-78.9	114.1	176	-178.6	57.2	0	0	0	111.3	G577 K579 V604 L644 T648 I649 I679	G577-L646 WeakPolarHBondContact O-CA 3.2Å; G577-L646 WeakPolarHBondContact O-CD1 3.37Å; K579-L646 HydrophobicContact CB-CD1 4.01Å; K579-L646 HydrophobicContact CG-CD1 3.69Å; K579-L646 HydrophobicContact CG-CD2 4.25Å; V604-L646 HydrophobicContact CB-CD2 4.13Å; V604-L646 HydrophobicContact CG2-CD2 3.65Å; L644-L646 PolarHBondContact O-N 2.69Å; L644-L646 VanDerWaalsContact O-N 3.09Å; L646-T648 WeakPolarHBondContact CD1-O 3.48Å; L646-I649 HydrophobicContact CD1-CG1 4.29Å; L646-I649 HydrophobicContact CD2-CD1 4.17Å; L646-I649 HydrophobicContact CD2-CG1 4.06Å; L646-I649 HydrophobicContact CG-CG1 4.42Å; L646-I679 HydrophobicContact CB-CD1 4.32Å; L646-I679 HydrophobicContact CD2-CD1 4.09Å; L646-I679 HydrophobicContact CG-CD1 4.01Å; L646-I679 HydrophobicContact CG-CG2 4.46Å; L646-I679 WeakPolarHBondContact O-CD1 3.34Å; L646-I679 WeakPolarHBondContact O-CG1 3.2Å
647	H	88.6	Confident	72.4	Confident	38 Å²	38	66.5 Å²	66.5	18%	0.176	36%	0.362	C	S	.	.			trans	-106.8	-27.9	175.3	59.2	86	0	0	0	113.6	G577 I679 Q680 K723	G577-H647 PolarHBondContact O-CD2 3.4Å; G577-H647 PolarHBondContact O-N 3.39Å; G577-H647 PolarHBondContact O-NE2 2.97Å; H647-I679 WeakPolarHBondContact O-CA 3.26Å; H647-Q680 PolarHBondContact O-N 2.96Å; H647-K723 VanDerWaalsContact CD2-CE 3.48Å; H647-K723 WeakPolarHBondContact CD2-CE 3.3Å; H647-K723 PolarHBondContact CD2-NZ 3.29Å; H647-K723 WeakPolarHBondContact NE2-CD 3.45Å; H647-K723 PolarHBondContact NE2-NZ 3.2Å
648	T	91.9	Very high	75.4	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.012	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	135.3	-176.9	-52.9	0	0	0	0	112.4	G577 I578 K579 L646 Q680 L682 A719	G577-T648 PolarHBondContact O-N 3.09Å; I578-T648 WeakPolarHBondContact CA-O 3.26Å; K579-T648 PolarHBondContact N-O 3.42Å; K579-T648 VanDerWaalsContact N-O 3.11Å; L646-T648 WeakPolarHBondContact CD1-O 3.48Å; T648-Q680 CarbonylContact C-O 3.58Å; T648-Q680 WeakPolarHBondContact CA-O 3.2Å; T648-Q680 HydrophobicContact CG2-CB 4.32Å; T648-L682 HydrophobicContact CG2-CD1 3.75Å; T648-L682 HydrophobicContact CG2-CG 3.79Å; T648-A719 HydrophobicContact CG2-CB 3.69Å
649	I	94.2	Very high	78.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.8	169.6	-64.9	172.4	0	0	0	108.6	K579 L599 T603 L646 I651 Y674 I679 Q680 V681 L682	K579-I649 CarbonylContact O-C 3.52Å; K579-I649 WeakPolarHBondContact O-CA 3.26Å; L599-I649 HydrophobicContact CD1-CG2 4.2Å; T603-I649 HydrophobicContact CG2-CD1 4.29Å; T603-I649 HydrophobicContact CG2-CG1 4.49Å; L646-I649 HydrophobicContact CD1-CG1 4.29Å; L646-I649 HydrophobicContact CD2-CD1 4.17Å; L646-I649 HydrophobicContact CD2-CG1 4.06Å; L646-I649 HydrophobicContact CG-CG1 4.42Å; I649-I651 HydrophobicContact CG2-CG1 4.18Å; I649-Y674 HydrophobicContact CD1-CD1 3.75Å; I649-Y674 HydrophobicContact CD1-CD2 4.03Å; I649-Y674 HydrophobicContact CD1-CE1 3.45Å; I649-Y674 VanDerWaalsContact CD1-CE1 3.45Å; I649-Y674 HydrophobicContact CD1-CE2 3.74Å; I649-Y674 HydrophobicContact CD1-CG 4.05Å; I649-Y674 VanDerWaalsContact CD1-CZ 3.47Å; I649-I679 HydrophobicContact CD1-CG2 3.99Å; I649-I679 HydrophobicContact CG1-CG2 3.93Å; I649-Q680 PolarHBondContact N-O 2.96Å; I649-V681 WeakPolarHBondContact O-CA 3.37Å; I649-L682 PolarHBondContact O-N 3.09Å
650	V	95	Very high	81.3	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	124	170.8	-177.6	0	0	0	0	108.3	I578 K579 I580 F581 L682 A684 V712 A715	I578-V650 HydrophobicContact CG2-CG2 4.34Å; K579-V650 PolarHBondContact O-N 3.07Å; I580-V650 CarbonylContact C-O 3.6Å; I580-V650 WeakPolarHBondContact CA-O 3.42Å; I580-V650 HydrophobicContact CG1-CB 4.18Å; I580-V650 HydrophobicContact CG1-CG2 4.49Å; I580-V650 HydrophobicContact CG2-CB 4.29Å; I580-V650 HydrophobicContact CG2-CG1 4.42Å; F581-V650 PolarHBondContact N-O 3.37Å; V650-L682 HydrophobicContact CG2-CB 4.45Å; V650-L682 HydrophobicContact CG2-CD1 4.39Å; V650-A684 HydrophobicContact CG1-CB 3.96Å; V650-V712 HydrophobicContact CG1-CG1 4.5Å; V650-A715 HydrophobicContact CG1-CB 3.7Å; V650-A715 HydrophobicContact CG2-CB 4.13Å
651	I	95.6	Very high	84.3	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	116.4	175	-56.5	177.2	0	0	0	108	F595 L599 I649 C653 V670 V681 L682 L683 A684	F595-I651 HydrophobicContact CE2-CG2 4.46Å; F595-I651 HydrophobicContact CZ-CD1 4.27Å; F595-I651 HydrophobicContact CZ-CG2 4.45Å; L599-I651 HydrophobicContact CD2-CD1 4.28Å; I649-I651 HydrophobicContact CG2-CG1 4.18Å; I651-C653 PolarHBondContact O-N 2.87Å; I651-V670 HydrophobicContact CD1-CG1 4.46Å; I651-V681 HydrophobicContact CD1-CG1 3.6Å; I651-V681 HydrophobicContact CG1-CG1 4.13Å; I651-L682 PolarHBondContact N-O 3.38Å; I651-L683 HydrophobicContact CB-CD2 3.85Å; I651-L683 HydrophobicContact CD1-CD2 4.05Å; I651-L683 HydrophobicContact CG1-CD2 4.35Å; I651-L683 HydrophobicContact CG2-CD2 4.38Å; I651-A684 PolarHBondContact O-N 2.95Å
652	D	95.3	Very high	86.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	110.3	172.9	177.2	-7.5	0	0	0	109.1	L554 F581 R582 S654 V712	L554-D652 HydrophobicContact CD1-CB 4.3Å; F581-D652 PolarHBondContact O-N 3.26Å; R582-D652 HydrophobicContact CB-CB 4.2Å; R582-D652 HydrophobicContact CG-CB 4.48Å; R582-D652 IonicContact CZ-OD2 2.94Å; R582-D652 IonicContact NE-OD2 2.74Å; R582-D652 PolarHBondContact NE-OD2 3.02Å; R582-D652 IonicContact NH2-OD2 3.73Å; R582-D652 PolarHBondContact NH2-OD2 3.09Å; D652-S654 WeakPolarHBondContact OD1-CB 3.36Å; D652-S654 PolarHBondContact OD1-N 2.97Å; D652-S654 PolarHBondContact OD1-OG 3.31Å; D652-S654 PolarHBondContact OD2-OG 2.92Å; D652-V712 HydrophobicContact CB-CG2 4.11Å
653	C	94.1	Very high	89	Confident	1 Å²	1	44 Å²	44	1%	0.007	24%	0.242	C	C	.	.			trans	-94.4	4.9	-179	-60.5	0	0	0	0	113.9	I651 A655 I656 A684 Q685 C686	I651-C653 PolarHBondContact O-N 2.87Å; C653-A655 PolarHBondContact O-N 3.23Å; C653-A655 VanDerWaalsContact O-N 3.15Å; C653-I656 HydrophobicContact CB-CB 4.46Å; C653-I656 HydrophobicContact CB-CD1 4.06Å; C653-I656 HydrophobicContact CB-CG1 4.4Å; C653-I656 WeakPolarHBondContact O-CB 3.33Å; C653-I656 PolarHBondContact O-N 3.02Å; C653-A684 WeakPolarHBondContact CB-O 3.47Å; C653-A684 PolarHBondContact N-O 3.44Å; C653-Q685 CarbonylContact C-O 3.59Å; C653-C686 HydrophobicContact CB-CB 4.42Å
654	S	92.3	Very high	90.8	Very high	54 Å²	54	39.2 Å²	39.2	38%	0.378	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-37.2	-176.5	55.9	0	0	0	0	113.9	D652 Q685	D652-S654 WeakPolarHBondContact OD1-CB 3.36Å; D652-S654 PolarHBondContact OD1-N 2.97Å; D652-S654 PolarHBondContact OD1-OG 3.31Å; D652-S654 PolarHBondContact OD2-OG 2.92Å; S654-Q685 PolarHBondContact N-O 2.98Å
655	A	92.1	Very high	92.3	Very high	26 Å²	26	41.7 Å²	41.7	22%	0.215	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-3.3	178.9	0	0	0	0	0	114.5	V584 A585 C653 Q657	V584-A655 HydrophobicContact CB-CB 4.48Å; V584-A655 HydrophobicContact CG1-CB 4.23Å; A585-A655 CarbonylContact C-O 3.55Å; C653-A655 PolarHBondContact O-N 3.23Å; C653-A655 VanDerWaalsContact O-N 3.15Å; A655-Q657 PolarHBondContact O-N 3.36Å
656	I	93.9	Very high	93.3	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	18%	0.181	C	C	.	.			trans	-81.7	103.3	173.7	-56.2	-178	0	0	0	107.5	A585 L587 C653 F658 L659 N687 V690	A585-I656 WeakPolarHBondContact O-CA 3.33Å; L587-I656 HydrophobicContact CB-CD1 4.47Å; L587-I656 HydrophobicContact CB-CG2 4.27Å; C653-I656 HydrophobicContact CB-CB 4.46Å; C653-I656 HydrophobicContact CB-CD1 4.06Å; C653-I656 HydrophobicContact CB-CG1 4.4Å; C653-I656 WeakPolarHBondContact O-CB 3.33Å; C653-I656 PolarHBondContact O-N 3.02Å; I656-F658 WeakPolarHBondContact CG2-O 3.41Å; I656-L659 HydrophobicContact CG2-CD2 3.77Å; I656-L659 HydrophobicContact CG2-CG 4.4Å; I656-N687 PolarHBondContact O-ND2 2.98Å; I656-V690 HydrophobicContact CG2-CG2 3.99Å; I656-V690 WeakPolarHBondContact O-CG2 3.45Å
657	Q	92.8	Very high	93.7	Very high	134 Å²	134	32.8 Å²	32.8	63%	0.626	18%	0.178	S	C	*	.			trans	-76.8	-38.1	-176.8	-58	179.3	-20.5	0	0	112.3	P586 A655 N687	P586-Q657 HydrophobicContact CG-CB 4.11Å; P586-Q657 HydrophobicContact CG-CG 4.35Å; A655-Q657 PolarHBondContact O-N 3.36Å; Q657-N687 PolarHBondContact O-ND2 3.41Å
658	F	93.9	Very high	94	Very high	87 Å²	87	34.6 Å²	34.6	38%	0.382	19%	0.185	S	C	.	.			trans	-148.3	165.9	177.1	68.2	-93.3	0	0	0	110.7	P586 L587 Y588 I656	P586-F658 HydrophobicContact CB-CD1 3.66Å; P586-F658 HydrophobicContact CB-CD2 4.43Å; P586-F658 HydrophobicContact CB-CE1 3.44Å; P586-F658 VanDerWaalsContact CB-CE1 3.44Å; P586-F658 HydrophobicContact CB-CE2 4.24Å; P586-F658 HydrophobicContact CB-CG 4.15Å; P586-F658 HydrophobicContact CB-CZ 3.75Å; P586-F658 HydrophobicContact CG-CD1 3.97Å; P586-F658 HydrophobicContact CG-CE1 3.63Å; P586-F658 HydrophobicContact CG-CZ 4.3Å; L587-F658 PolarHBondContact N-O 2.71Å; Y588-F658 HydrophobicContact CG-CE2 4.25Å; Y588-F658 HydrophobicContact CG-CZ 4.39Å; I656-F658 WeakPolarHBondContact CG2-O 3.41Å
659	L	93.9	Very high	94	Very high	12 Å²	12	36.6 Å²	36.6	6%	0.063	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-120.6	148.2	167.5	-63.6	177.9	0	0	0	109.7	L587 I656 I664 L667 V690 L694	L587-L659 HydrophobicContact CB-CD2 3.74Å; L587-L659 HydrophobicContact CD2-CD2 4.2Å; L587-L659 HydrophobicContact CG-CD2 4.19Å; I656-L659 HydrophobicContact CG2-CD2 3.77Å; I656-L659 HydrophobicContact CG2-CG 4.4Å; L659-I664 HydrophobicContact CB-CG1 4.01Å; L659-I664 HydrophobicContact CD1-CG1 3.98Å; L659-L667 HydrophobicContact CD1-CD1 3.81Å; L659-L667 HydrophobicContact CD2-CD1 4.07Å; L659-V690 HydrophobicContact CD1-CG1 3.96Å; L659-V690 HydrophobicContact CG-CG1 4.2Å; L659-V690 HydrophobicContact CG-CG2 4.41Å; L659-L694 HydrophobicContact CD1-CD1 4.5Å; L659-L694 HydrophobicContact CD1-CD2 3.58Å; L659-L694 HydrophobicContact CD1-CG 3.79Å
660	D	93.9	Very high	94	Very high	42 Å²	42	36.6 Å²	36.6	23%	0.225	19%	0.194	C	C	.	.			trans	-105.3	177.1	159.9	75.7	8.8	0	0	0	110.9	Y588 Y589 A662 G663 I664	Y588-D660 WeakPolarHBondContact CA-OD1 3.44Å; Y588-D660 WeakPolarHBondContact CB-OD2 3.44Å; Y589-D660 WeakPolarHBondContact CD1-OD2 3.48Å; Y589-D660 PolarHBondContact N-OD1 2.7Å; Y589-D660 PolarHBondContact N-OD2 3.08Å; D660-A662 PolarHBondContact O-N 3.36Å; D660-A662 WeakPolarHBondContact OD1-CA 3.32Å; D660-A662 WeakPolarHBondContact OD1-CB 3.27Å; D660-A662 PolarHBondContact OD1-N 2.85Å; D660-G663 PolarHBondContact O-N 3.45Å; D660-G663 VanDerWaalsContact O-N 3.1Å; D660-G663 PolarHBondContact OD1-N 3.15Å; D660-I664 WeakPolarHBondContact O-CG1 3.42Å; D660-I664 PolarHBondContact O-N 3.44Å
661	T	94.1	Very high	93.8	Very high	124 Å²	124	37.8 Å²	37.8	76%	0.761	20%	0.199	S	C	*	.	H	α-helix	trans	-55.3	-33.5	178.5	-41.8	0	0	0	0	113	H665	T661-H665 WeakPolarHBondContact O-CB 3.41Å; T661-H665 PolarHBondContact O-N 3.48Å
662	A	94.7	Very high	93.6	Very high	27 Å²	27	44.1 Å²	44.1	22%	0.223	22%	0.223	C	C	.	.	H	α-helix	trans	-77.6	-35.9	179	0	0	0	0	0	111.8	K592 D660 H665 T666	K592-A662 HydrophobicContact CD-CB 3.91Å; D660-A662 PolarHBondContact O-N 3.36Å; D660-A662 WeakPolarHBondContact OD1-CA 3.32Å; D660-A662 WeakPolarHBondContact OD1-CB 3.27Å; D660-A662 PolarHBondContact OD1-N 2.85Å; A662-H665 PolarHBondContact O-N 3.29Å; A662-T666 WeakPolarHBondContact O-CB 3.11Å; A662-T666 PolarHBondContact O-N 3.19Å; A662-T666 PolarHBondContact O-OG1 2.82Å
663	G	94.5	Very high	93.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.2	-45.4	171	0	0	0	0	0	112.3	D660 T666 L667	D660-G663 PolarHBondContact O-N 3.45Å; D660-G663 VanDerWaalsContact O-N 3.1Å; D660-G663 PolarHBondContact OD1-N 3.15Å; G663-T666 PolarHBondContact O-N 3.26Å; G663-L667 WeakPolarHBondContact O-CG 3.21Å; G663-L667 PolarHBondContact O-N 2.79Å
664	I	93.8	Very high	93.3	Very high	20 Å²	20	44.8 Å²	44.8	10%	0.103	23%	0.226	C	C	.	.	H	α-helix	trans	-59	-48.6	172.8	-63.7	161.4	0	0	0	110.3	L659 D660 T666 L667 K668 S693	L659-I664 HydrophobicContact CB-CG1 4.01Å; L659-I664 HydrophobicContact CD1-CG1 3.98Å; D660-I664 WeakPolarHBondContact O-CG1 3.42Å; D660-I664 PolarHBondContact O-N 3.44Å; I664-T666 VanDerWaalsContact C-N 3.34Å; I664-T666 PolarHBondContact O-N 2.85Å; I664-L667 PolarHBondContact O-N 3.26Å; I664-K668 PolarHBondContact O-N 3.09Å; I664-S693 VanDerWaalsContact CD1-O 3.31Å; I664-S693 WeakPolarHBondContact CD1-O 3.21Å
665	H	94.5	Very high	93.2	Very high	116 Å²	116	46.4 Å²	46.4	54%	0.537	23%	0.228	S	C	.	.	H	α-helix	trans	-60.1	-42.8	177.6	-176.8	-76.3	0	0	0	111.9	T661 A662 L667 K668 E669	T661-H665 WeakPolarHBondContact O-CB 3.41Å; T661-H665 PolarHBondContact O-N 3.48Å; A662-H665 PolarHBondContact O-N 3.29Å; H665-L667 PolarHBondContact O-N 3.16Å; H665-K668 PolarHBondContact O-N 2.67Å; H665-E669 WeakPolarHBondContact O-CB 3.4Å; H665-E669 PolarHBondContact O-N 2.71Å
666	T	95.3	Very high	92.9	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.012	23%	0.234	C	C	.	.	H	α-helix	trans	-65.3	-35	176.5	-73.5	0	0	0	0	112.4	K592 F595 K596 A662 G663 I664 E669 V670	K592-T666 HydrophobicContact CB-CG2 4.22Å; F595-T666 HydrophobicContact CD1-CG2 3.86Å; F595-T666 HydrophobicContact CE1-CG2 4.28Å; K596-T666 HydrophobicContact CB-CG2 4.45Å; A662-T666 WeakPolarHBondContact O-CB 3.11Å; A662-T666 PolarHBondContact O-N 3.19Å; A662-T666 PolarHBondContact O-OG1 2.82Å; G663-T666 PolarHBondContact O-N 3.26Å; I664-T666 VanDerWaalsContact C-N 3.34Å; I664-T666 PolarHBondContact O-N 2.85Å; T666-E669 PolarHBondContact O-N 3.02Å; T666-V670 HydrophobicContact CG2-CG2 4.37Å; T666-V670 WeakPolarHBondContact O-CB 3.31Å; T666-V670 VanDerWaalsContact O-CG2 3.25Å; T666-V670 WeakPolarHBondContact O-CG2 3.45Å; T666-V670 PolarHBondContact O-N 2.74Å
667	L	94.3	Very high	92.6	Very high	3 Å²	3	47.5 Å²	47.5	2%	0.016	24%	0.236	C	C	.	.	H	α-helix	trans	-65.6	-45	171.2	-70.5	173.2	0	0	0	111.8	L587 F595 L659 G663 I664 H665 E669 V670 R671 L694 Y699	L587-L667 HydrophobicContact CD2-CD1 4.15Å; L587-L667 HydrophobicContact CD2-CD2 3.83Å; L587-L667 HydrophobicContact CD2-CG 3.75Å; F595-L667 HydrophobicContact CE1-CD2 3.93Å; F595-L667 HydrophobicContact CZ-CD2 3.7Å; L659-L667 HydrophobicContact CD1-CD1 3.81Å; L659-L667 HydrophobicContact CD2-CD1 4.07Å; G663-L667 WeakPolarHBondContact O-CG 3.21Å; G663-L667 PolarHBondContact O-N 2.79Å; I664-L667 PolarHBondContact O-N 3.26Å; H665-L667 PolarHBondContact O-N 3.16Å; L667-E669 VanDerWaalsContact C-N 3.29Å; L667-E669 PolarHBondContact O-N 3.11Å; L667-V670 PolarHBondContact O-N 2.65Å; L667-R671 WeakPolarHBondContact O-CB 3.47Å; L667-R671 PolarHBondContact O-N 2.75Å; L667-L694 HydrophobicContact CD1-CD2 4Å; L667-Y699 HydrophobicContact CB-CD2 4.13Å; L667-Y699 HydrophobicContact CB-CE2 3.7Å
668	K	93.1	Very high	92.2	Very high	76 Å²	76	44.1 Å²	44.1	33%	0.33	24%	0.237	S	C	.	.	H	α-helix	trans	-59.6	-41.1	174.1	-67.2	-164.3	-167.6	-161.3	0	111.7	I664 H665 R672 G697 E698 Y699	I664-K668 PolarHBondContact O-N 3.09Å; H665-K668 PolarHBondContact O-N 2.67Å; K668-R672 WeakPolarHBondContact O-CB 3.47Å; K668-R672 PolarHBondContact O-N 2.79Å; K668-G697 WeakPolarHBondContact CE-O 3.11Å; K668-G697 PolarHBondContact NZ-O 3.38Å; K668-E698 VanDerWaalsContact CE-O 3.23Å; K668-E698 WeakPolarHBondContact CE-O 3.46Å; K668-E698 VanDerWaalsContact NZ-C 3.33Å; K668-E698 PolarHBondContact NZ-O 3.01Å; K668-Y699 HydrophobicContact CG-CD2 3.83Å; K668-Y699 HydrophobicContact CG-CE2 4.43Å
669	E	93.1	Very high	92	Very high	43 Å²	43	40.1 Å²	40.1	20%	0.201	22%	0.219	C	C	.	.	H	α-helix	trans	-65.7	-47.4	179.2	-162.9	-168.1	-172.5	0	0	111.8	K596 H665 T666 L667 R672 D673	K596-E669 IonicContact NZ-OE1 2.72Å; K596-E669 PolarHBondContact NZ-OE1 3.39Å; K596-E669 IonicContact NZ-OE2 3.16Å; K596-E669 PolarHBondContact NZ-OE2 2.95Å; H665-E669 WeakPolarHBondContact O-CB 3.4Å; H665-E669 PolarHBondContact O-N 2.71Å; T666-E669 PolarHBondContact O-N 3.02Å; L667-E669 VanDerWaalsContact C-N 3.29Å; L667-E669 PolarHBondContact O-N 3.11Å; E669-R672 PolarHBondContact O-N 2.79Å; E669-R672 IonicContact OE1-NH2 3.49Å; E669-D673 VanDerWaalsContact O-CB 3.3Å; E669-D673 WeakPolarHBondContact O-CB 3.4Å; E669-D673 VanDerWaalsContact O-CG 3.24Å; E669-D673 PolarHBondContact O-N 3.31Å
670	V	93.9	Very high	91.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.4	-45.7	175.7	161.8	0	0	0	0	111.1	F595 K596 L599 Y600 I651 T666 L667 D673 Y674	F595-V670 HydrophobicContact CE1-CG2 4.19Å; K596-V670 HydrophobicContact CG-CG2 4.21Å; L599-V670 HydrophobicContact CD2-CG1 3.48Å; L599-V670 VanDerWaalsContact CD2-CG1 3.48Å; L599-V670 HydrophobicContact CD2-CG2 4.35Å; Y600-V670 HydrophobicContact CE1-CG2 4.01Å; I651-V670 HydrophobicContact CD1-CG1 4.46Å; T666-V670 HydrophobicContact CG2-CG2 4.37Å; T666-V670 WeakPolarHBondContact O-CB 3.31Å; T666-V670 VanDerWaalsContact O-CG2 3.25Å; T666-V670 WeakPolarHBondContact O-CG2 3.45Å; T666-V670 PolarHBondContact O-N 2.74Å; L667-V670 PolarHBondContact O-N 2.65Å; V670-D673 PolarHBondContact O-N 2.89Å; V670-Y674 HydrophobicContact CG1-CD2 3.88Å; V670-Y674 HydrophobicContact CG1-CE2 3.97Å; V670-Y674 VanDerWaalsContact O-CD2 3.29Å; V670-Y674 WeakPolarHBondContact O-CD2 3.12Å; V670-Y674 PolarHBondContact O-N 3.41Å; V670-Y674 VanDerWaalsContact O-N 3.09Å
671	R	91.7	Very high	91.8	Very high	25 Å²	25	40 Å²	40	9%	0.094	22%	0.217	C	C	.	.	H	α-helix	trans	-56.2	-55.3	175.7	178.4	177.1	170.3	-156.8	-12.9	110.8	L667 D673 Y674 E675 Y699 E704	L667-R671 WeakPolarHBondContact O-CB 3.47Å; L667-R671 PolarHBondContact O-N 2.75Å; R671-D673 VanDerWaalsContact C-N 3.33Å; R671-D673 PolarHBondContact O-N 3.47Å; R671-Y674 PolarHBondContact O-N 3.44Å; R671-E675 HydrophobicContact CG-CG 4.32Å; R671-E675 IonicContact CZ-OE1 3.19Å; R671-E675 VanDerWaalsContact CZ-OE1 3.28Å; R671-E675 IonicContact NE-OE1 2.64Å; R671-E675 PolarHBondContact NE-OE1 3.39Å; R671-E675 IonicContact NE-OE2 2.72Å; R671-E675 IonicContact NH2-OE1 2.79Å; R671-E675 PolarHBondContact NH2-OE1 3.44Å; R671-E675 WeakPolarHBondContact O-CB 3.11Å; R671-E675 VanDerWaalsContact O-CG 3.32Å; R671-E675 WeakPolarHBondContact O-CG 2.99Å; R671-E675 PolarHBondContact O-N 2.87Å; R671-Y699 PolarHBondContact NH1-O 3.18Å; R671-E704 IonicContact CZ-OE1 2.74Å; R671-E704 IonicContact CZ-OE2 3.95Å; R671-E704 IonicContact NH1-OE1 2.69Å; R671-E704 PolarHBondContact NH1-OE1 3.05Å; R671-E704 IonicContact NH1-OE2 2.75Å; R671-E704 PolarHBondContact NH1-OE2 2.95Å; R671-E704 IonicContact NH2-OE1 3.19Å; R671-E704 PolarHBondContact NH2-OE1 3.16Å; R671-E704 IonicContact NH2-OE2 2.69Å
672	R	90.8	Very high	91.7	Very high	134 Å²	134	34 Å²	34	51%	0.506	18%	0.181	S	C	.	.	H	α-helix	trans	-60.9	-37.2	179.3	-175.2	-158.1	66.9	-168.2	-4.5	113.3	K668 E669 A676	K668-R672 WeakPolarHBondContact O-CB 3.47Å; K668-R672 PolarHBondContact O-N 2.79Å; E669-R672 PolarHBondContact O-N 2.79Å; E669-R672 IonicContact OE1-NH2 3.49Å; R672-A676 VanDerWaalsContact O-CB 3.28Å; R672-A676 WeakPolarHBondContact O-CB 3.48Å; R672-A676 PolarHBondContact O-N 2.69Å; R672-A676 VanDerWaalsContact O-N 3.15Å
673	D	92.1	Very high	91.7	Very high	15 Å²	15	32.8 Å²	32.8	8%	0.08	17%	0.17	C	C	.	.	H	α-helix	trans	-68.2	-39.2	179.7	-78.3	5.7	0	0	0	111.3	Y600 P606 E669 V670 R671	Y600-D673 VanDerWaalsContact OH-CB 3.29Å; Y600-D673 WeakPolarHBondContact OH-CB 3.38Å; Y600-D673 PolarHBondContact OH-OD2 3.17Å; P606-D673 HydrophobicContact CB-CB 4.4Å; P606-D673 VanDerWaalsContact CB-O 3.3Å; P606-D673 WeakPolarHBondContact CB-O 3.49Å; P606-D673 HydrophobicContact CG-CB 3.93Å; E669-D673 VanDerWaalsContact O-CB 3.3Å; E669-D673 WeakPolarHBondContact O-CB 3.4Å; E669-D673 VanDerWaalsContact O-CG 3.24Å; E669-D673 PolarHBondContact O-N 3.31Å; V670-D673 PolarHBondContact O-N 2.89Å; R671-D673 VanDerWaalsContact C-N 3.33Å; R671-D673 PolarHBondContact O-N 3.47Å
674	Y	91.5	Very high	91.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-76.9	-40.9	175.3	-80	-62.5	0	0	0	113.7	L599 Y600 T603 V604 P606 I649 V670 R671 A676 I677 G678 I679 V681	L599-Y674 HydrophobicContact CD2-CE2 3.97Å; L599-Y674 HydrophobicContact CG-CE2 4.18Å; Y600-Y674 AromaticContact CD1-CE2 3.94Å; Y600-Y674 HydrophobicContact CD1-CE2 3.94Å; Y600-Y674 AromaticContact CD1-CZ 3.85Å; Y600-Y674 WeakPolarHBondContact CD1-OH 3.43Å; Y600-Y674 HydrophobicContact CE1-CD2 4.48Å; Y600-Y674 AromaticContact CE1-CE2 3.66Å; Y600-Y674 HydrophobicContact CE1-CE2 3.66Å; Y600-Y674 AromaticContact CE1-CZ 3.97Å; T603-Y674 PolarHBondContact OG1-OH 3.42Å; V604-Y674 WeakPolarHBondContact O-CE1 3.28Å; V604-Y674 PolarHBondContact O-OH 3.42Å; P606-Y674 HydrophobicContact CB-CD1 4.14Å; P606-Y674 HydrophobicContact CB-CE1 4.24Å; P606-Y674 HydrophobicContact CG-CD1 4.14Å; P606-Y674 HydrophobicContact CG-CE1 3.94Å; I649-Y674 HydrophobicContact CD1-CD1 3.75Å; I649-Y674 HydrophobicContact CD1-CD2 4.03Å; I649-Y674 HydrophobicContact CD1-CE1 3.45Å; I649-Y674 VanDerWaalsContact CD1-CE1 3.45Å; I649-Y674 HydrophobicContact CD1-CE2 3.74Å; I649-Y674 HydrophobicContact CD1-CG 4.05Å; I649-Y674 VanDerWaalsContact CD1-CZ 3.47Å; V670-Y674 HydrophobicContact CG1-CD2 3.88Å; V670-Y674 HydrophobicContact CG1-CE2 3.97Å; V670-Y674 VanDerWaalsContact O-CD2 3.29Å; V670-Y674 WeakPolarHBondContact O-CD2 3.12Å; V670-Y674 PolarHBondContact O-N 3.41Å; V670-Y674 VanDerWaalsContact O-N 3.09Å; R671-Y674 PolarHBondContact O-N 3.44Å; Y674-A676 PolarHBondContact O-N 3.41Å; Y674-I677 HydrophobicContact CD1-CD1 4.22Å; Y674-I677 HydrophobicContact CD1-CG1 4.46Å; Y674-I677 CarbonylContact O-C 3.58Å; Y674-I677 VanDerWaalsContact O-CG1 3.22Å; Y674-I677 WeakPolarHBondContact O-CG1 3.37Å; Y674-I677 PolarHBondContact O-N 2.83Å; Y674-G678 PolarHBondContact O-N 2.93Å; Y674-I679 CarbonylContact C-O 3.58Å; Y674-I679 HydrophobicContact CD1-CB 4.13Å; Y674-I679 HydrophobicContact CD1-CD1 4.23Å; Y674-I679 HydrophobicContact CD1-CG2 4.12Å; Y674-I679 HydrophobicContact CG-CG2 4.46Å; Y674-I679 PolarHBondContact O-N 3.43Å; Y674-V681 HydrophobicContact CD2-CG2 3.83Å; Y674-V681 HydrophobicContact CG-CG2 4.05Å
675	E	88.6	Confident	91.5	Very high	87 Å²	87	35.4 Å²	35.4	41%	0.407	18%	0.182	S	C	.	.	H	α-helix	trans	-56.7	-37.2	173.9	-75.9	171.6	157.9	0	0	111	R671 I677 G678 I679	R671-E675 HydrophobicContact CG-CG 4.32Å; R671-E675 IonicContact CZ-OE1 3.19Å; R671-E675 VanDerWaalsContact CZ-OE1 3.28Å; R671-E675 IonicContact NE-OE1 2.64Å; R671-E675 PolarHBondContact NE-OE1 3.39Å; R671-E675 IonicContact NE-OE2 2.72Å; R671-E675 IonicContact NH2-OE1 2.79Å; R671-E675 PolarHBondContact NH2-OE1 3.44Å; R671-E675 WeakPolarHBondContact O-CB 3.11Å; R671-E675 VanDerWaalsContact O-CG 3.32Å; R671-E675 WeakPolarHBondContact O-CG 2.99Å; R671-E675 PolarHBondContact O-N 2.87Å; E675-I677 PolarHBondContact O-N 3.17Å; E675-I677 VanDerWaalsContact O-N 3.13Å; E675-G678 PolarHBondContact O-N 3.49Å; E675-I679 PolarHBondContact N-O 3.09Å
676	A	86.8	Confident	91.3	Very high	41 Å²	41	30.5 Å²	30.5	34%	0.339	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	1.9	176.4	0	0	0	0	0	115.5	K610 R672 Y674	K610-A676 HydrophobicContact CD-CB 4.49Å; R672-A676 VanDerWaalsContact O-CB 3.28Å; R672-A676 WeakPolarHBondContact O-CB 3.48Å; R672-A676 PolarHBondContact O-N 2.69Å; R672-A676 VanDerWaalsContact O-N 3.15Å; Y674-A676 PolarHBondContact O-N 3.41Å
677	I	87.1	Confident	91.1	Very high	9 Å²	9	32.6 Å²	32.6	5%	0.046	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.2	17.1	164.2	63.3	158.6	0	0	0	112.6	V604 P606 I609 W613 L644 Y674 E675 I679	V604-I677 HydrophobicContact CG1-CD1 4.43Å; P606-I677 HydrophobicContact CB-CD1 3.78Å; P606-I677 HydrophobicContact CB-CG1 4.02Å; P606-I677 HydrophobicContact CB-CG2 4.38Å; I609-I677 HydrophobicContact CB-CG2 4.31Å; I609-I677 HydrophobicContact CD1-CD1 3.98Å; I609-I677 HydrophobicContact CG2-CB 4.42Å; I609-I677 HydrophobicContact CG2-CG2 3.88Å; W613-I677 HydrophobicContact CE3-CG2 4.43Å; W613-I677 HydrophobicContact CH2-CB 3.77Å; W613-I677 HydrophobicContact CH2-CG2 4.03Å; W613-I677 HydrophobicContact CZ3-CB 4Å; W613-I677 HydrophobicContact CZ3-CG2 3.82Å; L644-I677 HydrophobicContact CD1-CB 4.49Å; L644-I677 HydrophobicContact CD1-CD1 4.2Å; Y674-I677 HydrophobicContact CD1-CD1 4.22Å; Y674-I677 HydrophobicContact CD1-CG1 4.46Å; Y674-I677 CarbonylContact O-C 3.58Å; Y674-I677 VanDerWaalsContact O-CG1 3.22Å; Y674-I677 WeakPolarHBondContact O-CG1 3.37Å; Y674-I677 PolarHBondContact O-N 2.83Å; E675-I677 PolarHBondContact O-N 3.17Å; E675-I677 VanDerWaalsContact O-N 3.13Å; I677-I679 VanDerWaalsContact C-N 3.34Å; I677-I679 HydrophobicContact CD1-CD1 3.57Å; I677-I679 HydrophobicContact CD1-CG1 4.07Å; I677-I679 HydrophobicContact CG1-CB 4.45Å; I677-I679 HydrophobicContact CG1-CD1 4.14Å; I677-I679 HydrophobicContact CG1-CG1 4.07Å; I677-I679 PolarHBondContact O-N 3.09Å
678	G	84.8	Confident	90.8	Very high	63 Å²	63	37.4 Å²	37.4	65%	0.649	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.1	5	176.8	0	0	0	0	0	115.6	Y674 E675	Y674-G678 PolarHBondContact O-N 2.93Å; E675-G678 PolarHBondContact O-N 3.49Å
679	I	90.3	Very high	90.6	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.015	21%	0.209	C	C	.	.			trans	-93.6	125.8	-178.1	-60.1	-175.6	0	0	0	109.8	L644 L646 H647 I649 Y674 E675 I677	L644-I679 HydrophobicContact CD1-CD1 4.43Å; L646-I679 HydrophobicContact CB-CD1 4.32Å; L646-I679 HydrophobicContact CD2-CD1 4.09Å; L646-I679 HydrophobicContact CG-CD1 4.01Å; L646-I679 HydrophobicContact CG-CG2 4.46Å; L646-I679 WeakPolarHBondContact O-CD1 3.34Å; L646-I679 WeakPolarHBondContact O-CG1 3.2Å; H647-I679 WeakPolarHBondContact O-CA 3.26Å; I649-I679 HydrophobicContact CD1-CG2 3.99Å; I649-I679 HydrophobicContact CG1-CG2 3.93Å; Y674-I679 CarbonylContact C-O 3.58Å; Y674-I679 HydrophobicContact CD1-CB 4.13Å; Y674-I679 HydrophobicContact CD1-CD1 4.23Å; Y674-I679 HydrophobicContact CD1-CG2 4.12Å; Y674-I679 HydrophobicContact CG-CG2 4.46Å; Y674-I679 PolarHBondContact O-N 3.43Å; E675-I679 PolarHBondContact N-O 3.09Å; I677-I679 VanDerWaalsContact C-N 3.34Å; I677-I679 HydrophobicContact CD1-CD1 3.57Å; I677-I679 HydrophobicContact CD1-CG1 4.07Å; I677-I679 HydrophobicContact CG1-CB 4.45Å; I677-I679 HydrophobicContact CG1-CD1 4.14Å; I677-I679 HydrophobicContact CG1-CG1 4.07Å; I677-I679 PolarHBondContact O-N 3.09Å
680	Q	90.2	Very high	90.5	Very high	49 Å²	49	34.8 Å²	34.8	23%	0.229	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	141	177	-168.5	178.5	22.5	0	0	110.9	H647 T648 I649 L682	H647-Q680 PolarHBondContact O-N 2.96Å; T648-Q680 CarbonylContact C-O 3.58Å; T648-Q680 WeakPolarHBondContact CA-O 3.2Å; T648-Q680 HydrophobicContact CG2-CB 4.32Å; I649-Q680 PolarHBondContact N-O 2.96Å; Q680-L682 HydrophobicContact CG-CD2 3.82Å
681	V	92.4	Very high	90.3	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	123.5	174	-177.2	0	0	0	0	109.6	I649 I651 Y674	I649-V681 WeakPolarHBondContact O-CA 3.37Å; I651-V681 HydrophobicContact CD1-CG1 3.6Å; I651-V681 HydrophobicContact CG1-CG1 4.13Å; Y674-V681 HydrophobicContact CD2-CG2 3.83Å; Y674-V681 HydrophobicContact CG-CG2 4.05Å
682	L	93.1	Very high	90	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	145.7	177.2	-50.8	-177.2	0	0	0	110.1	T648 I649 V650 I651 Q680 L707 F709 A715 F718 A719	T648-L682 HydrophobicContact CG2-CD1 3.75Å; T648-L682 HydrophobicContact CG2-CG 3.79Å; I649-L682 PolarHBondContact O-N 3.09Å; V650-L682 HydrophobicContact CG2-CB 4.45Å; V650-L682 HydrophobicContact CG2-CD1 4.39Å; I651-L682 PolarHBondContact N-O 3.38Å; Q680-L682 HydrophobicContact CG-CD2 3.82Å; L682-L707 HydrophobicContact CD2-CD2 3.71Å; L682-F709 HydrophobicContact CB-CD2 4.26Å; L682-F709 HydrophobicContact CB-CE2 4.04Å; L682-F709 HydrophobicContact CD1-CE2 3.92Å; L682-F709 HydrophobicContact CD1-CZ 4.44Å; L682-F709 HydrophobicContact CD2-CE2 4.08Å; L682-F709 HydrophobicContact CG-CE2 4.22Å; L682-A715 HydrophobicContact CD1-CB 4.37Å; L682-A715 WeakPolarHBondContact CD1-O 3.42Å; L682-F718 HydrophobicContact CD1-CD1 3.9Å; L682-F718 HydrophobicContact CD2-CE1 4.37Å; L682-A719 HydrophobicContact CD1-CB 4.22Å
683	L	93.9	Very high	90	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130.2	175	-57.7	-172.2	0	0	0	110.5	I651 L694 Y699 L707 L708 F709	I651-L683 HydrophobicContact CB-CD2 3.85Å; I651-L683 HydrophobicContact CD1-CD2 4.05Å; I651-L683 HydrophobicContact CG1-CD2 4.35Å; I651-L683 HydrophobicContact CG2-CD2 4.38Å; L683-L694 HydrophobicContact CD1-CD1 3.86Å; L683-Y699 HydrophobicContact CD1-CD1 4.07Å; L683-Y699 HydrophobicContact CD1-CE1 3.43Å; L683-Y699 VanDerWaalsContact CD1-CE1 3.43Å; L683-Y699 HydrophobicContact CG-CE1 4.07Å; L683-L707 PolarHBondContact N-O 2.82Å; L683-L708 HydrophobicContact CB-CD2 3.95Å; L683-L708 HydrophobicContact CD1-CD2 4.21Å; L683-F709 PolarHBondContact O-N 3.19Å
684	A	93.1	Very high	89.9	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	149.1	-178.9	0	0	0	0	0	112.1	V650 I651 C653 C686 F709 V712 A715	V650-A684 HydrophobicContact CG1-CB 3.96Å; I651-A684 PolarHBondContact O-N 2.95Å; C653-A684 WeakPolarHBondContact CB-O 3.47Å; C653-A684 PolarHBondContact N-O 3.44Å; A684-C686 VanDerWaalsContact C-N 3.27Å; A684-C686 PolarHBondContact O-N 3.32Å; A684-F709 WeakPolarHBondContact CA-O 3.06Å; A684-F709 HydrophobicContact CB-CB 4.45Å; A684-V712 HydrophobicContact CB-CB 4.5Å; A684-V712 HydrophobicContact CB-CG2 3.98Å; A684-A715 HydrophobicContact CB-CB 4.12Å
685	Q	92	Very high	89.6	Confident	76 Å²	76	40.2 Å²	40.2	36%	0.355	24%	0.24	S	C	.	.	S	Bend	trans	57.1	33.2	176.3	-68.7	-175.6	-26.4	0	0	114.5	C653 S654 N687 F709 Y710 V712	C653-Q685 CarbonylContact C-O 3.59Å; S654-Q685 PolarHBondContact N-O 2.98Å; Q685-N687 PolarHBondContact O-N 3.44Å; Q685-F709 PolarHBondContact N-O 3.4Å; Q685-Y710 VanDerWaalsContact CG-O 3.28Å; Q685-Y710 WeakPolarHBondContact CG-O 3.3Å; Q685-V712 HydrophobicContact CG-CG2 4.33Å
686	C	90.4	Very high	89.5	Confident	12 Å²	12	42.8 Å²	42.8	8%	0.081	25%	0.25	C	S	.	.			trans	-66.5	119.1	173.2	-57.3	0	0	0	0	111.1	C653 A684 V690 R691 L708	C653-C686 HydrophobicContact CB-CB 4.42Å; A684-C686 VanDerWaalsContact C-N 3.27Å; A684-C686 PolarHBondContact O-N 3.32Å; C686-V690 HydrophobicContact CB-CG1 4.07Å; C686-R691 HydrophobicContact CB-CG 3.64Å; C686-R691 WeakPolarHBondContact O-CD 3.39Å; C686-L708 HydrophobicContact CB-CD2 4.43Å
687	N	90.1	Very high	89.5	Confident	46 Å²	46	41.8 Å²	41.8	25%	0.246	24%	0.243	C	C	.	.			trans	-65.2	161	176.5	88.2	55.7	0	0	0	112.1	I656 Q657 Q685 S689 V690 R691	I656-N687 PolarHBondContact O-ND2 2.98Å; Q657-N687 PolarHBondContact O-ND2 3.41Å; Q685-N687 PolarHBondContact O-N 3.44Å; N687-S689 VanDerWaalsContact C-N 3.31Å; N687-S689 PolarHBondContact O-N 3.22Å; N687-S689 WeakPolarHBondContact OD1-CA 3.09Å; N687-S689 WeakPolarHBondContact OD1-CB 3.35Å; N687-S689 PolarHBondContact OD1-N 3.24Å; N687-V690 WeakPolarHBondContact ND2-CG2 3.5Å; N687-V690 WeakPolarHBondContact O-CB 3.41Å; N687-V690 PolarHBondContact O-N 2.64Å; N687-V690 PolarHBondContact OD1-N 2.91Å; N687-V690 VanDerWaalsContact OD1-N 3.16Å; N687-R691 PolarHBondContact O-N 3.45Å
688	P	88.4	Confident	89.4	Confident	105 Å²	105	48.6 Å²	48.6	68%	0.682	28%	0.275	S	S	*	.	H	α-helix	trans	-57.1	-35.6	-175.3	-27.4	36	0	0	0	115.2	R691 D692	P688-R691 PolarHBondContact O-N 2.85Å; P688-D692 WeakPolarHBondContact O-CB 3.35Å; P688-D692 PolarHBondContact O-N 3.47Å
689	S	88.9	Confident	89.4	Confident	63 Å²	63	46 Å²	46	44%	0.441	25%	0.246	S	C	.	.	H	α-helix	trans	-71.3	-35.2	176.4	-167.5	0	0	0	0	112.2	N687 S693	N687-S689 VanDerWaalsContact C-N 3.31Å; N687-S689 PolarHBondContact O-N 3.22Å; N687-S689 WeakPolarHBondContact OD1-CA 3.09Å; N687-S689 WeakPolarHBondContact OD1-CB 3.35Å; N687-S689 PolarHBondContact OD1-N 3.24Å; S689-S693 WeakPolarHBondContact O-CB 3.4Å; S689-S693 PolarHBondContact O-N 2.67Å; S689-S693 PolarHBondContact O-OG 2.98Å; S689-S693 VanDerWaalsContact O-OG 3.12Å
690	V	90.4	Very high	88.6	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-68.4	-41.7	173.9	168.4	0	0	0	0	110.4	I656 L659 C686 N687 S693 L694	I656-V690 HydrophobicContact CG2-CG2 3.99Å; I656-V690 WeakPolarHBondContact O-CG2 3.45Å; L659-V690 HydrophobicContact CD1-CG1 3.96Å; L659-V690 HydrophobicContact CG-CG1 4.2Å; L659-V690 HydrophobicContact CG-CG2 4.41Å; C686-V690 HydrophobicContact CB-CG1 4.07Å; N687-V690 WeakPolarHBondContact ND2-CG2 3.5Å; N687-V690 WeakPolarHBondContact O-CB 3.41Å; N687-V690 PolarHBondContact O-N 2.64Å; N687-V690 PolarHBondContact OD1-N 2.91Å; N687-V690 VanDerWaalsContact OD1-N 3.16Å; V690-S693 PolarHBondContact O-N 3.34Å; V690-L694 HydrophobicContact CG1-CD1 3.87Å; V690-L694 HydrophobicContact CG1-CG 4.33Å; V690-L694 WeakPolarHBondContact O-CB 3.19Å; V690-L694 VanDerWaalsContact O-CG 3.25Å; V690-L694 WeakPolarHBondContact O-CG 3.18Å; V690-L694 PolarHBondContact O-N 3.21Å
691	R	88.8	Confident	87.6	Confident	79 Å²	79	51.6 Å²	51.6	30%	0.298	27%	0.273	S	S	.	.	H	α-helix	trans	-61.8	-46.7	175.1	-68.1	-179.3	69.8	-157.6	7.1	111.8	C686 N687 P688 S693 L694 T695 Y710	C686-R691 HydrophobicContact CB-CG 3.64Å; C686-R691 WeakPolarHBondContact O-CD 3.39Å; N687-R691 PolarHBondContact O-N 3.45Å; P688-R691 PolarHBondContact O-N 2.85Å; R691-S693 VanDerWaalsContact C-N 3.34Å; R691-S693 PolarHBondContact O-N 2.92Å; R691-L694 PolarHBondContact O-N 2.04Å; R691-L694 VanDerWaalsContact O-N 3.09Å; R691-T695 PolarHBondContact O-N 3.23Å; R691-T695 PolarHBondContact O-OG1 2.96Å; R691-Y710 PolarHBondContact NH1-OH 2.95Å; R691-Y710 PolarHBondContact NH2-OH 3.44Å
692	D	87.2	Confident	85.9	Confident	72 Å²	72	60.8 Å²	60.8	39%	0.385	31%	0.312	S	S	.	.	H	α-helix	trans	-55.8	-46.4	174.2	-176.1	53.5	0	0	0	112.2	P688 L694 T695 K696	P688-D692 WeakPolarHBondContact O-CB 3.35Å; P688-D692 PolarHBondContact O-N 3.47Å; D692-L694 PolarHBondContact O-N 3.33Å; D692-T695 PolarHBondContact O-N 2.91Å; D692-K696 WeakPolarHBondContact O-CB 3.27Å; D692-K696 WeakPolarHBondContact O-CG 3.44Å; D692-K696 PolarHBondContact O-N 3.33Å; D692-K696 WeakPolarHBondContact OD1-CD 3.48Å; D692-K696 VanDerWaalsContact OD1-CE 3.27Å; D692-K696 WeakPolarHBondContact OD1-CE 3.09Å; D692-K696 IonicContact OD1-NZ 3.55Å; D692-K696 PolarHBondContact OD1-NZ 3.46Å; D692-K696 IonicContact OD2-NZ 2.8Å; D692-K696 PolarHBondContact OD2-NZ 3.43Å
693	S	89.8	Confident	84	Confident	26 Å²	26	69 Å²	69	18%	0.182	35%	0.35	C	S	.	.	H	α-helix	trans	-64.3	-34.2	174.4	-65.6	0	0	0	0	113.9	I664 S689 V690 R691 G697	I664-S693 VanDerWaalsContact CD1-O 3.31Å; I664-S693 WeakPolarHBondContact CD1-O 3.21Å; S689-S693 WeakPolarHBondContact O-CB 3.4Å; S689-S693 PolarHBondContact O-N 2.67Å; S689-S693 PolarHBondContact O-OG 2.98Å; S689-S693 VanDerWaalsContact O-OG 3.12Å; V690-S693 PolarHBondContact O-N 3.34Å; R691-S693 VanDerWaalsContact C-N 3.34Å; R691-S693 PolarHBondContact O-N 2.92Å; S693-G697 WeakPolarHBondContact O-CA 3.37Å; S693-G697 PolarHBondContact O-N 2.87Å
694	L	89.5	Confident	82.4	Confident	4 Å²	4	71.4 Å²	71.4	2%	0.021	36%	0.362	C	S	.	.	H	α-helix	trans	-72.8	-37.9	176.6	-72	169.9	0	0	0	112.1	L659 L667 L683 V690 R691 D692 G697 E698 Y699 L708	L659-L694 HydrophobicContact CD1-CD1 4.5Å; L659-L694 HydrophobicContact CD1-CD2 3.58Å; L659-L694 HydrophobicContact CD1-CG 3.79Å; L667-L694 HydrophobicContact CD1-CD2 4Å; L683-L694 HydrophobicContact CD1-CD1 3.86Å; V690-L694 HydrophobicContact CG1-CD1 3.87Å; V690-L694 HydrophobicContact CG1-CG 4.33Å; V690-L694 WeakPolarHBondContact O-CB 3.19Å; V690-L694 VanDerWaalsContact O-CG 3.25Å; V690-L694 WeakPolarHBondContact O-CG 3.18Å; V690-L694 PolarHBondContact O-N 3.21Å; R691-L694 PolarHBondContact O-N 2.04Å; R691-L694 VanDerWaalsContact O-N 3.09Å; D692-L694 PolarHBondContact O-N 3.33Å; L694-G697 CarbonylContact O-C 3.34Å; L694-G697 PolarHBondContact O-N 2.68Å; L694-E698 PolarHBondContact O-N 2.65Å; L694-E698 VanDerWaalsContact O-N 3.16Å; L694-Y699 HydrophobicContact CD2-CD1 4.07Å; L694-Y699 HydrophobicContact CD2-CD2 4.04Å; L694-Y699 HydrophobicContact CD2-CG 3.63Å; L694-Y699 WeakPolarHBondContact O-CB 3.02Å; L694-Y699 PolarHBondContact O-N 2.85Å; L694-L708 HydrophobicContact CD1-CD2 4.19Å
695	T	86.6	Confident	80.9	Confident	106 Å²	106	77 Å²	77	65%	0.65	39%	0.388	S	S	*	.	H	α-helix	trans	-68.2	-52.3	175.1	-59	0	0	0	0	110.9	R691 D692 G697 E698	R691-T695 PolarHBondContact O-N 3.23Å; R691-T695 PolarHBondContact O-OG1 2.96Å; D692-T695 PolarHBondContact O-N 2.91Å; T695-G697 PolarHBondContact O-N 3.39Å; T695-E698 PolarHBondContact O-N 2.69Å
696	K	86.8	Confident	79.5	Confident	142 Å²	142	77.6 Å²	77.6	62%	0.617	39%	0.393	S	S	*	.	H	α-helix	trans	-62.9	-24.7	174.7	-74.4	166.3	171.4	148.7	0	113	D692	D692-K696 WeakPolarHBondContact O-CB 3.27Å; D692-K696 WeakPolarHBondContact O-CG 3.44Å; D692-K696 PolarHBondContact O-N 3.33Å; D692-K696 WeakPolarHBondContact OD1-CD 3.48Å; D692-K696 VanDerWaalsContact OD1-CE 3.27Å; D692-K696 WeakPolarHBondContact OD1-CE 3.09Å; D692-K696 IonicContact OD1-NZ 3.55Å; D692-K696 PolarHBondContact OD1-NZ 3.46Å; D692-K696 IonicContact OD2-NZ 2.8Å; D692-K696 PolarHBondContact OD2-NZ 3.43Å
697	G	85.3	Confident	78.7	Confident	19 Å²	19	77.9 Å²	77.9	20%	0.196	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	1.6	174.2	0	0	0	0	0	114.9	K668 S693 L694 T695 Y699	K668-G697 WeakPolarHBondContact CE-O 3.11Å; K668-G697 PolarHBondContact NZ-O 3.38Å; S693-G697 WeakPolarHBondContact O-CA 3.37Å; S693-G697 PolarHBondContact O-N 2.87Å; L694-G697 CarbonylContact O-C 3.34Å; L694-G697 PolarHBondContact O-N 2.68Å; T695-G697 PolarHBondContact O-N 3.39Å; G697-Y699 VanDerWaalsContact C-N 3.35Å; G697-Y699 PolarHBondContact O-N 3.12Å
698	E	86.2	Confident	78.5	Confident	153 Å²	153	77 Å²	77	72%	0.715	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	44.1	-177.6	-56.2	-179.4	156.5	0	0	113.7	K668 L694 T695	K668-E698 VanDerWaalsContact CE-O 3.23Å; K668-E698 WeakPolarHBondContact CE-O 3.46Å; K668-E698 VanDerWaalsContact NZ-C 3.33Å; K668-E698 PolarHBondContact NZ-O 3.01Å; L694-E698 PolarHBondContact O-N 2.65Å; L694-E698 VanDerWaalsContact O-N 3.16Å; T695-E698 PolarHBondContact O-N 2.69Å
699	Y	84	Confident	78.5	Confident	7 Å²	7	72.7 Å²	72.7	3%	0.027	36%	0.36	C	S	.	.			trans	-72.9	-39.4	-178.5	177.5	-96.3	0	0	0	113.6	L667 K668 R671 L683 L694 G697	L667-Y699 HydrophobicContact CB-CD2 4.13Å; L667-Y699 HydrophobicContact CB-CE2 3.7Å; K668-Y699 HydrophobicContact CG-CD2 3.83Å; K668-Y699 HydrophobicContact CG-CE2 4.43Å; R671-Y699 PolarHBondContact NH1-O 3.18Å; L683-Y699 HydrophobicContact CD1-CD1 4.07Å; L683-Y699 HydrophobicContact CD1-CE1 3.43Å; L683-Y699 VanDerWaalsContact CD1-CE1 3.43Å; L683-Y699 HydrophobicContact CG-CE1 4.07Å; L694-Y699 HydrophobicContact CD2-CD1 4.07Å; L694-Y699 HydrophobicContact CD2-CD2 4.04Å; L694-Y699 HydrophobicContact CD2-CG 3.63Å; L694-Y699 WeakPolarHBondContact O-CB 3.02Å; L694-Y699 PolarHBondContact O-N 2.85Å; G697-Y699 VanDerWaalsContact C-N 3.35Å; G697-Y699 PolarHBondContact O-N 3.12Å
700	C	74.4	Confident	78.4	Confident	27 Å²	27	72.5 Å²	72.5	18%	0.182	35%	0.35	C	S	.	.	S	Bend	trans	-109	142.8	167.7	-72.8	0	0	0	0	108.5	E704	C700-E704 HydrophobicContact CB-CB 4.03Å; C700-E704 PolarHBondContact SG-O 2.95Å; C700-E704 VanDerWaalsContact SG-O 3.36Å
701	K	68.8	Low	78.4	Confident	144 Å²	144	73.7 Å²	73.7	63%	0.626	36%	0.358	S	S	*	.			trans	-69.9	163.2	157.2	-61.4	175.8	-179.6	176.8	0	109.4	E703 E704	K701-E703 PolarHBondContact O-N 2.83Å; K701-E703 VanDerWaalsContact O-N 3.12Å; K701-E704 HydrophobicContact CB-CG 4.11Å; K701-E704 PolarHBondContact N-OE2 3.29Å; K701-E704 WeakPolarHBondContact O-CA 3.33Å; K701-E704 WeakPolarHBondContact O-CB 3.43Å; K701-E704 PolarHBondContact O-N 3.12Å
702	K	57	Low	78.5	Confident	195 Å²	195	70.1 Å²	70.1	85%	0.848	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-57.6	-26.9	177.7	-69.2	-170.9	173.9	-172.1	0	113.7	E704	K702-E704 VanDerWaalsContact C-N 3.33Å
703	E	52.8	Low	78.7	Confident	171 Å²	171	71.2 Å²	71.2	80%	0.799	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-80.8	-11	176.1	-65.5	154	-179.1	0	0	113.1	K701	K701-E703 PolarHBondContact O-N 2.83Å; K701-E703 VanDerWaalsContact O-N 3.12Å
704	E	60.5	Low	78.6	Confident	51 Å²	51	71.1 Å²	71.1	24%	0.238	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-109.6	14.1	-172.8	-60.8	-178	139.8	0	0	113.6	R671 C700 K701 K702 N706 L707	R671-E704 IonicContact CZ-OE1 2.74Å; R671-E704 IonicContact CZ-OE2 3.95Å; R671-E704 IonicContact NH1-OE1 2.69Å; R671-E704 PolarHBondContact NH1-OE1 3.05Å; R671-E704 IonicContact NH1-OE2 2.75Å; R671-E704 PolarHBondContact NH1-OE2 2.95Å; R671-E704 IonicContact NH2-OE1 3.19Å; R671-E704 PolarHBondContact NH2-OE1 3.16Å; R671-E704 IonicContact NH2-OE2 2.69Å; C700-E704 HydrophobicContact CB-CB 4.03Å; C700-E704 PolarHBondContact SG-O 2.95Å; C700-E704 VanDerWaalsContact SG-O 3.36Å; K701-E704 HydrophobicContact CB-CG 4.11Å; K701-E704 PolarHBondContact N-OE2 3.29Å; K701-E704 WeakPolarHBondContact O-CA 3.33Å; K701-E704 WeakPolarHBondContact O-CB 3.43Å; K701-E704 PolarHBondContact O-N 3.12Å; K702-E704 VanDerWaalsContact C-N 3.33Å; E704-N706 PolarHBondContact O-N 3.19Å; E704-L707 HydrophobicContact CB-CD1 4.31Å; E704-L707 PolarHBondContact O-N 3.46Å
705	E	60.2	Low	78.6	Confident	119 Å²	119	70.9 Å²	70.9	56%	0.556	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-60.6	-13.5	176.3	-65.7	-167.2	172.9	0	0	113	R53 L707 L708	R53-E705 PolarHBondContact NH2-O 2.94Å; E705-L707 PolarHBondContact O-N 3Å; E705-L708 PolarHBondContact O-N 3.47Å
706	N	62.6	Low	78.8	Confident	87 Å²	87	66.2 Å²	66.2	47%	0.465	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-70.6	0.9	174.9	-61.6	-23	0	0	0	114.7	R53 E704 F709	R53-N706 PolarHBondContact NH1-OD1 3.09Å; E704-N706 PolarHBondContact O-N 3.19Å; N706-F709 WeakPolarHBondContact O-CE2 3.23Å; N706-F709 WeakPolarHBondContact O-CZ 3.39Å
707	L	74.7	Confident	78.9	Confident	19 Å²	19	60 Å²	60	10%	0.099	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-98.4	-1	176.2	-56.8	177.3	0	0	0	113.8	L682 L683 E704 E705	L682-L707 HydrophobicContact CD2-CD2 3.71Å; L683-L707 PolarHBondContact N-O 2.82Å; E704-L707 HydrophobicContact CB-CD1 4.31Å; E704-L707 PolarHBondContact O-N 3.46Å; E705-L707 PolarHBondContact O-N 3Å
708	L	85.5	Confident	79	Confident	27 Å²	27	62.4 Å²	62.4	14%	0.141	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124.7	-178.8	-77.6	156.1	0	0	0	110.9	R53 L683 C686 L694 E705	R53-L708 PolarHBondContact NH2-O 3.48Å; R53-L708 VanDerWaalsContact NH2-O 3.12Å; L683-L708 HydrophobicContact CB-CD2 3.95Å; L683-L708 HydrophobicContact CD1-CD2 4.21Å; C686-L708 HydrophobicContact CB-CD2 4.43Å; L694-L708 HydrophobicContact CD1-CD2 4.19Å; E705-L708 PolarHBondContact O-N 3.47Å
709	F	89.1	Confident	79.1	Confident	14 Å²	14	55.1 Å²	55.1	6%	0.061	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147.4	-173.3	-62.3	-84.3	0	0	0	112.5	L682 L683 A684 Q685 N706 E714 A715 F718	L682-F709 HydrophobicContact CB-CD2 4.26Å; L682-F709 HydrophobicContact CB-CE2 4.04Å; L682-F709 HydrophobicContact CD1-CE2 3.92Å; L682-F709 HydrophobicContact CD1-CZ 4.44Å; L682-F709 HydrophobicContact CD2-CE2 4.08Å; L682-F709 HydrophobicContact CG-CE2 4.22Å; L683-F709 PolarHBondContact O-N 3.19Å; A684-F709 WeakPolarHBondContact CA-O 3.06Å; A684-F709 HydrophobicContact CB-CB 4.45Å; Q685-F709 PolarHBondContact N-O 3.4Å; N706-F709 WeakPolarHBondContact O-CE2 3.23Å; N706-F709 WeakPolarHBondContact O-CZ 3.39Å; F709-E714 HydrophobicContact CB-CB 4.48Å; F709-E714 HydrophobicContact CD1-CB 4.22Å; F709-E714 HydrophobicContact CD1-CG 3.76Å; F709-A715 HydrophobicContact CB-CB 3.9Å; F709-A715 HydrophobicContact CD1-CB 4.38Å; F709-A715 HydrophobicContact CD2-CB 3.61Å; F709-A715 HydrophobicContact CE2-CB 4.27Å; F709-A715 HydrophobicContact CG-CB 3.68Å; F709-F718 HydrophobicContact CE1-CB 3.85Å; F709-F718 HydrophobicContact CE1-CD1 4.32Å; F709-F718 HydrophobicContact CE1-CD2 4.37Å; F709-F718 AromaticContact CE1-CG 3.93Å; F709-F718 HydrophobicContact CE1-CG 3.93Å; F709-F718 HydrophobicContact CE2-CD1 4.32Å; F709-F718 HydrophobicContact CZ-CB 3.91Å; F709-F718 AromaticContact CZ-CD1 3.55Å; F709-F718 HydrophobicContact CZ-CD1 3.55Å; F709-F718 HydrophobicContact CZ-CD2 4.23Å; F709-F718 HydrophobicContact CZ-CE1 4.1Å; F709-F718 AromaticContact CZ-CG 3.62Å; F709-F718 HydrophobicContact CZ-CG 3.62Å
710	Y	86.8	Confident	79.2	Confident	59 Å²	59	57.6 Å²	57.6	23%	0.231	27%	0.269	C	S	.	.	S	Bend	trans	-85	-24.1	179.4	-72.5	-77.5	0	0	0	112.6	I54 I56 Q685 R691 E714	I54-Y710 HydrophobicContact CB-CD2 3.9Å; I54-Y710 HydrophobicContact CB-CG 4.33Å; I54-Y710 HydrophobicContact CG2-CD2 3.85Å; I54-Y710 HydrophobicContact CG2-CE2 4.46Å; I54-Y710 HydrophobicContact CG2-CG 4.05Å; I54-Y710 WeakPolarHBondContact O-CD2 3.33Å; I54-Y710 WeakPolarHBondContact O-CE2 3.03Å; I56-Y710 HydrophobicContact CB-CE1 4.16Å; I56-Y710 HydrophobicContact CB-CE2 4.39Å; I56-Y710 HydrophobicContact CD1-CD1 4.06Å; I56-Y710 HydrophobicContact CD1-CE1 4.03Å; I56-Y710 HydrophobicContact CD1-CG 4.44Å; I56-Y710 PolarHBondContact O-OH 2.99Å; Q685-Y710 VanDerWaalsContact CG-O 3.28Å; Q685-Y710 WeakPolarHBondContact CG-O 3.3Å; R691-Y710 PolarHBondContact NH1-OH 2.95Å; R691-Y710 PolarHBondContact NH2-OH 3.44Å; Y710-E714 PolarHBondContact N-OE2 3Å
711	S	89.7	Confident	79.6	Confident	26 Å²	26	57.7 Å²	57.7	18%	0.182	27%	0.269	C	S	.	.	S	Bend	trans	-128	156.1	171.3	94.5	0	0	0	0	112.9	Y713 E714 A715	S711-Y713 VanDerWaalsContact C-N 3.26Å; S711-Y713 PolarHBondContact OG-N 2.93Å; S711-E714 PolarHBondContact N-OE2 2.86Å; S711-E714 PolarHBondContact O-N 2.66Å; S711-E714 WeakPolarHBondContact OG-CB 3.26Å; S711-E714 PolarHBondContact OG-N 3.3Å; S711-A715 PolarHBondContact O-N 3.03Å
712	V	91.4	Very high	80.1	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.024	25%	0.245	C	C	.	.	H	α-helix	trans	-67.7	-31.6	174.1	178.2	0	0	0	0	110.8	F563 I580 V650 D652 A684 Q685 M716	F563-V712 HydrophobicContact CB-CG1 4.37Å; F563-V712 HydrophobicContact CD1-CG1 4.14Å; F563-V712 HydrophobicContact CD2-CB 3.8Å; F563-V712 HydrophobicContact CD2-CG1 3.61Å; F563-V712 HydrophobicContact CE1-CG1 4.31Å; F563-V712 HydrophobicContact CE2-CB 4.04Å; F563-V712 HydrophobicContact CE2-CG1 3.8Å; F563-V712 HydrophobicContact CG-CB 4.37Å; F563-V712 HydrophobicContact CG-CG1 3.77Å; F563-V712 HydrophobicContact CZ-CG1 4.13Å; I580-V712 HydrophobicContact CD1-CG1 4.05Å; I580-V712 HydrophobicContact CG2-CG1 3.61Å; V650-V712 HydrophobicContact CG1-CG1 4.5Å; D652-V712 HydrophobicContact CB-CG2 4.11Å; A684-V712 HydrophobicContact CB-CB 4.5Å; A684-V712 HydrophobicContact CB-CG2 3.98Å; Q685-V712 HydrophobicContact CG-CG2 4.33Å; V712-M716 WeakPolarHBondContact O-CB 3.45Å; V712-M716 PolarHBondContact O-N 3.33Å
713	Y	90.4	Very high	80.8	Confident	95 Å²	95	46.7 Å²	46.7	37%	0.373	22%	0.223	S	C	.	.	H	α-helix	trans	-65.3	-45.8	175.2	-169.5	-88.1	0	0	0	111.5	E561 F563 S711 A715 M716 A717	E561-Y713 HydrophobicContact CB-CD2 4.1Å; E561-Y713 HydrophobicContact CB-CG 4.46Å; E561-Y713 HydrophobicContact CG-CD2 3.97Å; E561-Y713 HydrophobicContact CG-CE2 4.18Å; E561-Y713 HydrophobicContact CG-CG 4.29Å; F563-Y713 HydrophobicContact CE2-CD2 4.26Å; F563-Y713 HydrophobicContact CZ-CD2 4.42Å; S711-Y713 VanDerWaalsContact C-N 3.26Å; S711-Y713 PolarHBondContact OG-N 2.93Å; Y713-A715 VanDerWaalsContact C-N 3.35Å; Y713-A715 PolarHBondContact O-N 3.12Å; Y713-M716 HydrophobicContact CD2-CE 4.18Å; Y713-M716 HydrophobicContact CE2-CE 4.23Å; Y713-M716 PolarHBondContact O-N 3.5Å; Y713-A717 VanDerWaalsContact O-CB 3.26Å; Y713-A717 WeakPolarHBondContact O-CB 3.48Å; Y713-A717 PolarHBondContact O-N 2.97Å
714	E	88.2	Confident	81.3	Confident	24 Å²	24	43.4 Å²	43.4	11%	0.112	21%	0.211	C	C	.	.	H	α-helix	trans	-57.2	-46.3	177.5	-165.6	-170.7	-158.1	0	0	111.1	R53 I54 F709 Y710 S711 A717 F718	R53-E714 WeakPolarHBondContact CA-OE1 3.49Å; R53-E714 WeakPolarHBondContact CG-OE1 3.41Å; I54-E714 PolarHBondContact N-OE1 3.4Å; F709-E714 HydrophobicContact CB-CB 4.48Å; F709-E714 HydrophobicContact CD1-CB 4.22Å; F709-E714 HydrophobicContact CD1-CG 3.76Å; Y710-E714 PolarHBondContact N-OE2 3Å; S711-E714 PolarHBondContact N-OE2 2.86Å; S711-E714 PolarHBondContact O-N 2.66Å; S711-E714 WeakPolarHBondContact OG-CB 3.26Å; S711-E714 PolarHBondContact OG-N 3.3Å; E714-A717 PolarHBondContact O-N 3.35Å; E714-F718 WeakPolarHBondContact O-CB 3.46Å; E714-F718 PolarHBondContact O-N 2.87Å
715	A	90.1	Very high	81.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.5	-41.2	176.3	0	0	0	0	0	113.3	V650 L682 A684 F709 S711 Y713 A719	V650-A715 HydrophobicContact CG1-CB 3.7Å; V650-A715 HydrophobicContact CG2-CB 4.13Å; L682-A715 HydrophobicContact CD1-CB 4.37Å; L682-A715 WeakPolarHBondContact CD1-O 3.42Å; A684-A715 HydrophobicContact CB-CB 4.12Å; F709-A715 HydrophobicContact CB-CB 3.9Å; F709-A715 HydrophobicContact CD1-CB 4.38Å; F709-A715 HydrophobicContact CD2-CB 3.61Å; F709-A715 HydrophobicContact CE2-CB 4.27Å; F709-A715 HydrophobicContact CG-CB 3.68Å; S711-A715 PolarHBondContact O-N 3.03Å; Y713-A715 VanDerWaalsContact C-N 3.35Å; Y713-A715 PolarHBondContact O-N 3.12Å; A715-A719 WeakPolarHBondContact O-CB 3.47Å; A715-A719 PolarHBondContact O-N 3.25Å; A715-A719 VanDerWaalsContact O-N 3.11Å
716	M	90.4	Very high	80.8	Confident	7 Å²	7	47.7 Å²	47.7	3%	0.034	23%	0.229	C	C	.	.	H	α-helix	trans	-65	-45.7	175.8	-177.4	-172	71.5	0	0	111.1	L556 F563 K575 I578 I580 V712 Y713 A719 E720	L556-M716 HydrophobicContact CD2-CE 4.49Å; F563-M716 HydrophobicContact CE1-CE 4.46Å; F563-M716 HydrophobicContact CE1-SD 3.79Å; F563-M716 HydrophobicContact CZ-CB 4.4Å; F563-M716 HydrophobicContact CZ-CE 3.87Å; F563-M716 HydrophobicContact CZ-SD 3.71Å; K575-M716 HydrophobicContact CG-SD 3.99Å; I578-M716 HydrophobicContact CD1-CG 4.1Å; I580-M716 HydrophobicContact CD1-CB 4.41Å; I580-M716 HydrophobicContact CD1-CG 4.44Å; I580-M716 HydrophobicContact CD1-SD 4.23Å; V712-M716 WeakPolarHBondContact O-CB 3.45Å; V712-M716 PolarHBondContact O-N 3.33Å; Y713-M716 HydrophobicContact CD2-CE 4.18Å; Y713-M716 HydrophobicContact CE2-CE 4.23Å; Y713-M716 PolarHBondContact O-N 3.5Å; M716-A719 WeakPolarHBondContact O-CB 3.39Å; M716-A719 PolarHBondContact O-N 2.89Å; M716-A719 VanDerWaalsContact O-N 3.14Å; M716-E720 PolarHBondContact O-N 3Å
717	A	88.3	Confident	79.8	Confident	11 Å²	11	46.3 Å²	46.3	9%	0.091	24%	0.236	C	C	.	.	H	α-helix	trans	-61.6	-45.3	179.8	0	0	0	0	0	111.6	Y51 Y713 E714 A719 E720 V721	Y51-A717 HydrophobicContact CD1-CB 4.14Å; Y51-A717 HydrophobicContact CE1-CB 3.92Å; Y713-A717 VanDerWaalsContact O-CB 3.26Å; Y713-A717 WeakPolarHBondContact O-CB 3.48Å; Y713-A717 PolarHBondContact O-N 2.97Å; E714-A717 PolarHBondContact O-N 3.35Å; A717-A719 VanDerWaalsContact C-N 3.29Å; A717-A719 PolarHBondContact O-N 3.33Å; A717-E720 PolarHBondContact O-N 3.36Å; A717-V721 WeakPolarHBondContact O-CG2 3.27Å; A717-V721 PolarHBondContact O-N 2.97Å; A717-V721 VanDerWaalsContact O-N 3.17Å
718	F	87.9	Confident	78	Confident	70 Å²	70	51.6 Å²	51.6	31%	0.307	26%	0.262	S	S	.	.	H	α-helix	trans	-59.2	-37.7	172.9	176.2	-94	0	0	0	112.8	L682 F709 E714 V721 S722	L682-F718 HydrophobicContact CD1-CD1 3.9Å; L682-F718 HydrophobicContact CD2-CE1 4.37Å; F709-F718 HydrophobicContact CE1-CB 3.85Å; F709-F718 HydrophobicContact CE1-CD1 4.32Å; F709-F718 HydrophobicContact CE1-CD2 4.37Å; F709-F718 AromaticContact CE1-CG 3.93Å; F709-F718 HydrophobicContact CE1-CG 3.93Å; F709-F718 HydrophobicContact CE2-CD1 4.32Å; F709-F718 HydrophobicContact CZ-CB 3.91Å; F709-F718 AromaticContact CZ-CD1 3.55Å; F709-F718 HydrophobicContact CZ-CD1 3.55Å; F709-F718 HydrophobicContact CZ-CD2 4.23Å; F709-F718 HydrophobicContact CZ-CE1 4.1Å; F709-F718 AromaticContact CZ-CG 3.62Å; F709-F718 HydrophobicContact CZ-CG 3.62Å; E714-F718 WeakPolarHBondContact O-CB 3.46Å; E714-F718 PolarHBondContact O-N 2.87Å; F718-V721 PolarHBondContact O-N 3.15Å; F718-S722 WeakPolarHBondContact CE1-OG 3.43Å; F718-S722 WeakPolarHBondContact O-CB 3.31Å; F718-S722 PolarHBondContact O-N 3.12Å; F718-S722 PolarHBondContact O-OG 3Å
719	A	87.8	Confident	75.2	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-67.9	-34.9	177	0	0	0	0	0	113.2	I578 T648 L682 A715 M716 A717 K723	I578-A719 HydrophobicContact CD1-CB 3.81Å; I578-A719 HydrophobicContact CG1-CB 4.24Å; T648-A719 HydrophobicContact CG2-CB 3.69Å; L682-A719 HydrophobicContact CD1-CB 4.22Å; A715-A719 WeakPolarHBondContact O-CB 3.47Å; A715-A719 PolarHBondContact O-N 3.25Å; A715-A719 VanDerWaalsContact O-N 3.11Å; M716-A719 WeakPolarHBondContact O-CB 3.39Å; M716-A719 PolarHBondContact O-N 2.89Å; M716-A719 VanDerWaalsContact O-N 3.14Å; A717-A719 VanDerWaalsContact C-N 3.29Å; A717-A719 PolarHBondContact O-N 3.33Å; A719-K723 PolarHBondContact O-N 3.49Å
720	E	86.2	Confident	72.5	Confident	59 Å²	59	60.5 Å²	60.5	28%	0.276	32%	0.322	S	S	.	.	H	α-helix	trans	-67.2	-42.4	173.7	-65.8	-167.6	149.7	0	0	111.5	K575 I578 M716 A717 K723 N724	K575-E720 VanDerWaalsContact CD-OE1 3.29Å; K575-E720 WeakPolarHBondContact CD-OE1 3.44Å; K575-E720 WeakPolarHBondContact CE-OE1 3.42Å; K575-E720 WeakPolarHBondContact CG-OE1 3.39Å; K575-E720 IonicContact NZ-OE1 3.7Å; K575-E720 PolarHBondContact NZ-OE1 3.1Å; K575-E720 IonicContact NZ-OE2 2.76Å; K575-E720 PolarHBondContact NZ-OE2 3.37Å; I578-E720 HydrophobicContact CD1-CG 3.53Å; M716-E720 PolarHBondContact O-N 3Å; A717-E720 PolarHBondContact O-N 3.36Å; E720-K723 WeakPolarHBondContact O-CB 3.33Å; E720-K723 PolarHBondContact O-N 3.4Å; E720-N724 PolarHBondContact O-N 3.32Å; E720-N724 VanDerWaalsContact O-N 3.15Å
721	V	83.8	Confident	69.7	Low	29 Å²	29	62.6 Å²	62.6	18%	0.176	34%	0.343	C	S	.	.	H	α-helix	trans	-61.6	-47.2	174.6	179.1	0	0	0	0	111.6	Y51 A717 F718 K723 N724 Q725	Y51-V721 HydrophobicContact CD2-CG2 3.88Å; Y51-V721 HydrophobicContact CE1-CG2 3.92Å; Y51-V721 HydrophobicContact CE2-CG2 3.2Å; Y51-V721 HydrophobicContact CG-CG2 4.49Å; Y51-V721 WeakPolarHBondContact OH-CG2 3.5Å; A717-V721 WeakPolarHBondContact O-CG2 3.27Å; A717-V721 PolarHBondContact O-N 2.97Å; A717-V721 VanDerWaalsContact O-N 3.17Å; F718-V721 PolarHBondContact O-N 3.15Å; V721-K723 PolarHBondContact O-N 3.34Å; V721-N724 PolarHBondContact O-N 3.28Å; V721-Q725 HydrophobicContact CG1-CG 4.29Å; V721-Q725 PolarHBondContact O-N 3.45Å
722	S	78.1	Confident	66.8	Low	19 Å²	19	69 Å²	69	13%	0.133	38%	0.375	C	S	.	.	H	α-helix	trans	-61.1	-28.4	-178.4	-62.2	0	0	0	0	112.6	F718 K726	F718-S722 WeakPolarHBondContact CE1-OG 3.43Å; F718-S722 WeakPolarHBondContact O-CB 3.31Å; F718-S722 PolarHBondContact O-N 3.12Å; F718-S722 PolarHBondContact O-OG 3Å; S722-K726 WeakPolarHBondContact O-CG 3.28Å
723	K	72.4	Confident	64.2	Low	89 Å²	89	72.9 Å²	72.9	39%	0.387	42%	0.415	S	S	.	.	H	α-helix	trans	-72.4	-48.7	171	-166.2	-167.8	-157.2	158.8	0	111.4	P576 H647 A719 E720 V721 Q725 K726 G727	P576-K723 PolarHBondContact O-NZ 3.03Å; P576-K723 VanDerWaalsContact O-NZ 3.1Å; H647-K723 VanDerWaalsContact CD2-CE 3.48Å; H647-K723 WeakPolarHBondContact CD2-CE 3.3Å; H647-K723 PolarHBondContact CD2-NZ 3.29Å; H647-K723 WeakPolarHBondContact NE2-CD 3.45Å; H647-K723 PolarHBondContact NE2-NZ 3.2Å; A719-K723 PolarHBondContact O-N 3.49Å; E720-K723 WeakPolarHBondContact O-CB 3.33Å; E720-K723 PolarHBondContact O-N 3.4Å; V721-K723 PolarHBondContact O-N 3.34Å; K723-Q725 PolarHBondContact O-N 2.96Å; K723-K726 PolarHBondContact O-N 2.83Å; K723-G727 PolarHBondContact O-N 3.2Å
724	N	63.3	Low	61.1	Low	102 Å²	102	76.7 Å²	76.7	55%	0.545	44%	0.441	S	S	.	.	H	α-helix	trans	-63.6	-42.1	-176.9	-68.3	-12.3	0	0	0	112.1	E720 V721 K726 G727 I728	E720-N724 PolarHBondContact O-N 3.32Å; E720-N724 VanDerWaalsContact O-N 3.15Å; V721-N724 PolarHBondContact O-N 3.28Å; N724-K726 PolarHBondContact O-N 3.25Å; N724-G727 PolarHBondContact O-N 2.85Å; N724-G727 VanDerWaalsContact O-N 3.13Å; N724-I728 WeakPolarHBondContact O-CG1 3.18Å; N724-I728 PolarHBondContact O-N 2.92Å
725	Q	57.6	Low	58.2	Low	104 Å²	104	80.6 Å²	80.6	49%	0.486	47%	0.472	S	S	.	.	H	α-helix	trans	-61	-44.3	175	-72.7	179.4	-27.2	0	0	111.9	V721 K723 G727 I728 C729	V721-Q725 HydrophobicContact CG1-CG 4.29Å; V721-Q725 PolarHBondContact O-N 3.45Å; K723-Q725 PolarHBondContact O-N 2.96Å; Q725-G727 PolarHBondContact O-N 3.09Å; Q725-I728 PolarHBondContact O-N 2.81Å; Q725-I728 VanDerWaalsContact O-N 3.14Å; Q725-C729 PolarHBondContact O-N 3.27Å; Q725-C729 VanDerWaalsContact O-N 3.15Å; Q725-C729 PolarHBondContact O-SG 3.19Å; Q725-C729 VanDerWaalsContact O-SG 3.38Å
726	K	53.3	Low	55.1	Low	156 Å²	156	88.8 Å²	88.8	68%	0.678	51%	0.514	S	S	*	.	H	α-helix	trans	-63.2	-27.8	174.4	-74.8	-179.1	177.9	-178.1	0	113.6	S722 K723 N724	S722-K726 WeakPolarHBondContact O-CG 3.28Å; K723-K726 PolarHBondContact O-N 2.83Å; N724-K726 PolarHBondContact O-N 3.25Å
727	G	41.5	Very low	52	Low	59 Å²	59	93.4 Å²	93.4	61%	0.608	55%	0.547	S	S	*	.	H	α-helix	trans	-77.5	-27.2	173.5	0	0	0	0	0	114.3	K723 N724 Q725	K723-G727 PolarHBondContact O-N 3.2Å; N724-G727 PolarHBondContact O-N 2.85Å; N724-G727 VanDerWaalsContact O-N 3.13Å; Q725-G727 PolarHBondContact O-N 3.09Å
728	I	35.5	Very low	49.1	Very low	129 Å²	129	99.3 Å²	99.3	66%	0.662	58%	0.582	S	S	*	*	H	α-helix	trans	-83.3	-29.3	-179.5	-68.7	163.6	0	0	0	111.6	N724 Q725 V730	N724-I728 WeakPolarHBondContact O-CG1 3.18Å; N724-I728 PolarHBondContact O-N 2.92Å; Q725-I728 PolarHBondContact O-N 2.81Å; Q725-I728 VanDerWaalsContact O-N 3.14Å; I728-V730 PolarHBondContact O-N 2.87Å
729	C	27.9	Very low	46.4	Very low	103 Å²	103	106.2 Å²	106.2	70%	0.696	63%	0.629	S	S	*	*	S	Bend	trans	-74.3	26.4	178.4	-63.8	0	0	0	0	115.3	Q725	Q725-C729 PolarHBondContact O-N 3.27Å; Q725-C729 VanDerWaalsContact O-N 3.15Å; Q725-C729 PolarHBondContact O-SG 3.19Å; Q725-C729 VanDerWaalsContact O-SG 3.38Å
730	V	32.6	Very low	44.4	Very low	126 Å²	126	111.5 Å²	111.5	76%	0.764	66%	0.661	S	S	*	*			trans	-126.7	73.1	167.7	-168.1	0	0	0	0	112.3	I728	I728-V730 PolarHBondContact O-N 2.87Å
731	P	28	Very low	42.2	Very low	102 Å²	102	114.3 Å²	114.3	66%	0.662	68%	0.681	S	S	*	*	S	Bend	trans	-111.8	119.9	156.5	33.5	-20.4	0	0	0	110.8
732	N	28.8	Very low	39.8	Very low	162 Å²	162	119 Å²	119	87%	0.866	71%	0.709	S	S	*	*			trans	32.9	107.9	161.9	-61.4	-11.1	0	0	0	118.2
733	G	37.1	Very low	37.6	Very low	84 Å²	84	124.9 Å²	124.9	87%	0.866	74%	0.743	S	S	*	*			trans	-63.1	140.9	-176	0	0	0	0	0	115.3
734	L	24.8	Very low	35.4	Very low	175 Å²	175	127.1 Å²	127.1	92%	0.916	77%	0.765	S	S	*	*			trans	-138.4	136.6	157.8	-114.1	152.6	0	0	0	107.3
735	S	27.9	Very low	33.6	Very low	107 Å²	107	128.8 Å²	128.8	75%	0.748	78%	0.78	S	S	*	*			trans	-81.8	143.9	-173.3	47.5	0	0	0	0	112
736	L	24.3	Very low	31.8	Very low	172 Å²	172	130.6 Å²	130.6	90%	0.901	80%	0.801	S	S	*	*			trans	-149.5	90.3	159.5	-115.5	151.5	0	0	0	110
737	S	25.3	Very low	30.2	Very low	104 Å²	104	128.6 Å²	128.6	73%	0.727	81%	0.81	S	S	*	*			trans	-71.7	140.8	161.4	52	0	0	0	0	110.4
738	V	26.4	Very low	29.3	Very low	134 Å²	134	134.4 Å²	134.4	81%	0.812	83%	0.827	S	S	*	*			trans	-166	129.5	140.5	133	0	0	0	0	109.3
739	V	32.6	Very low	28.7	Very low	215 Å²	215	134.9 Å²	134.9	100%	1.303	84%	0.842	S	S	*	*			trans	39.1	0	162.2	-172.1	0	0	0	0	117.3

Retrieved 739 of 739 residues in 1628.4 ms (Link to these results)

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