A0A087Y494_POEFO Loading...

AarF domain containing kinase 5

AlphaFold DB , UniProt , Accession A0A087Y494, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 576 aa.

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(Predicted Aligned Error values between residue pairs)

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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	48	Very low	48	Very low	223 Å²	223	130.8 Å²	130.8	100%	1.099	68%	0.681	S	S	*	*				0	52.2	0	-65.9	179.3	76.1	0	0	111.8
2	T	49.2	Very low	48.1	Very low	134 Å²	134	126.6 Å²	126.6	82%	0.822	67%	0.669	S	S	*	*			trans	-122.6	10.8	-175.1	39.3	0	0	0	0	113.2
3	G	45.3	Very low	48.3	Very low	56 Å²	56	125.5 Å²	125.5	58%	0.577	66%	0.664	S	S	*	*	S	Bend	trans	-102.2	-28	-179.9	0	0	0	0	0	115.7
4	E	46.4	Very low	48.2	Very low	163 Å²	163	126 Å²	126	76%	0.762	66%	0.66	S	S	*	*	S	Bend	trans	-84.6	-30.9	-173.2	-75.4	-178.1	145.4	0	0	113.8	S6 R7	E4-S6 VanDerWaalsContact C-N 3.27Å; E4-S6 PolarHBondContact O-N 3.42Å; E4-R7 PolarHBondContact O-N 3.47Å
5	T	48.5	Very low	48.3	Very low	97 Å²	97	125.5 Å²	125.5	60%	0.595	65%	0.653	S	S	*	*	H	α-helix	trans	-65.6	-26.6	176.9	24.1	0	0	0	0	113.2
6	S	45.7	Very low	48.1	Very low	53 Å²	53	124.3 Å²	124.3	37%	0.371	65%	0.647	S	S	.	*	H	α-helix	trans	-75.4	-24	177.1	-174.9	0	0	0	0	113.8	E4 R10	E4-S6 VanDerWaalsContact C-N 3.27Å; E4-S6 PolarHBondContact O-N 3.42Å; S6-R10 PolarHBondContact O-NE 3.15Å; S6-R10 PolarHBondContact OG-NH2 3.48Å
7	R	47	Very low	47.8	Very low	201 Å²	201	120.5 Å²	120.5	76%	0.758	64%	0.638	S	S	*	*	H	α-helix	trans	-79.2	-38.1	177.6	-99.7	-178	178.5	-177.9	0.3	112.1	E4 R10 L11	E4-R7 PolarHBondContact O-N 3.47Å; R7-R10 PolarHBondContact O-N 3.33Å; R7-L11 PolarHBondContact O-N 3.45Å
8	V	50.7	Low	47.5	Very low	100 Å²	100	120.7 Å²	120.7	61%	0.606	64%	0.638	S	S	*	*	H	α-helix	trans	-68.7	-39.1	179.8	-179.5	0	0	0	0	111.7	R10 L11 C12	V8-R10 VanDerWaalsContact C-N 3.34Å; V8-R10 PolarHBondContact O-N 2.81Å; V8-L11 PolarHBondContact O-N 2.86Å; V8-C12 PolarHBondContact O-N 3.27Å
9	L	50.4	Low	47.2	Very low	120 Å²	120	122.5 Å²	122.5	63%	0.628	65%	0.648	S	S	*	*	H	α-helix	trans	-68.5	-28.3	177.5	-96.5	145.3	0	0	0	113.8
10	R	49.4	Very low	47	Very low	175 Å²	175	126.9 Å²	126.9	66%	0.66	66%	0.655	S	S	*	*	H	α-helix	trans	-76.2	-33	176.2	-86.1	-175	-95	-158.1	-5.3	113.2	S6 R7 V8 H14	S6-R10 PolarHBondContact O-NE 3.15Å; S6-R10 PolarHBondContact OG-NH2 3.48Å; R7-R10 PolarHBondContact O-N 3.33Å; V8-R10 VanDerWaalsContact C-N 3.34Å; V8-R10 PolarHBondContact O-N 2.81Å; R10-H14 PolarHBondContact O-N 3.06Å
11	L	47.4	Very low	46.5	Very low	117 Å²	117	131.2 Å²	131.2	61%	0.613	66%	0.663	S	S	*	*	H	α-helix	trans	-69	-39.4	175.4	-110.4	106.2	0	0	0	112.3	R7 V8 N13 H14 H15	R7-L11 PolarHBondContact O-N 3.45Å; V8-L11 PolarHBondContact O-N 2.86Å; L11-N13 PolarHBondContact O-N 3.44Å; L11-H14 PolarHBondContact O-N 2.95Å; L11-H15 PolarHBondContact O-CD2 2.89Å; L11-H15 PolarHBondContact O-N 2.9Å
12	C	49.8	Very low	45.9	Very low	80 Å²	80	129.8 Å²	129.8	54%	0.541	65%	0.653	S	S	.	*	H	α-helix	trans	-64.9	-36.1	179.8	-75.1	0	0	0	0	113.4	V8 L16	V8-C12 PolarHBondContact O-N 3.27Å; C12-L16 PolarHBondContact O-N 2.79Å
13	N	49.8	Very low	45.6	Very low	112 Å²	112	128.5 Å²	128.5	60%	0.599	65%	0.647	S	S	*	*	H	α-helix	trans	-74.5	-27.1	178.7	-77.6	-24.3	0	0	0	113.3	L11 A17	L11-N13 PolarHBondContact O-N 3.44Å; N13-A17 PolarHBondContact O-N 2.9Å
14	H	48.1	Very low	45.1	Very low	133 Å²	133	134 Å²	134	62%	0.616	66%	0.657	S	S	*	*	H	α-helix	trans	-71.7	-38.3	176.8	-159.8	70.6	0	0	0	111.9	R10 L11 A17 L18	R10-H14 PolarHBondContact O-N 3.06Å; L11-H14 PolarHBondContact O-N 2.95Å; H14-A17 PolarHBondContact O-N 3.14Å; H14-L18 PolarHBondContact O-N 2.88Å
15	H	48.7	Very low	44.4	Very low	119 Å²	119	133.7 Å²	133.7	55%	0.551	66%	0.661	S	S	*	*	H	α-helix	trans	-70.8	-32	174.8	-80.5	-76.3	0	0	0	113.3	L11 A17 L18	L11-H15 PolarHBondContact O-CD2 2.89Å; L11-H15 PolarHBondContact O-N 2.9Å; H15-A17 VanDerWaalsContact C-N 3.33Å; H15-A17 PolarHBondContact O-N 3.38Å; H15-L18 PolarHBondContact O-N 3.46Å
16	L	45	Very low	43.6	Very low	106 Å²	106	133.2 Å²	133.2	56%	0.555	67%	0.667	S	S	*	*	H	α-helix	trans	-70.9	-28.3	176.6	-130	98	0	0	0	113	C12	C12-L16 PolarHBondContact O-N 2.79Å
17	A	42.8	Very low	42.8	Very low	60 Å²	60	142.3 Å²	142.3	50%	0.496	69%	0.693	S	S	.	*	H	α-helix	trans	-75.3	-27.7	177.6	0	0	0	0	0	113	N13 H14 H15	N13-A17 PolarHBondContact O-N 2.9Å; H14-A17 PolarHBondContact O-N 3.14Å; H15-A17 VanDerWaalsContact C-N 3.33Å; H15-A17 PolarHBondContact O-N 3.38Å
18	L	42.4	Very low	42.3	Very low	123 Å²	123	138.8 Å²	138.8	64%	0.644	69%	0.694	S	S	*	*	H	α-helix	trans	-72.5	-26.5	176.3	-85.4	158.2	0	0	0	113.2	H14 H15	H14-L18 PolarHBondContact O-N 2.88Å; H15-L18 PolarHBondContact O-N 3.46Å
19	L	41.4	Very low	41.5	Very low	155 Å²	155	140.2 Å²	140.2	81%	0.812	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-5.7	179.1	-74.3	167.8	0	0	0	114.5
20	R	43.9	Very low	40.5	Very low	211 Å²	211	146 Å²	146	80%	0.796	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	9.5	-175.4	-82.2	-173.9	175.3	179	-0.1	115.4
21	R	36.3	Very low	39.5	Very low	218 Å²	218	143 Å²	143	82%	0.823	72%	0.723	S	S	*	*			trans	-115.4	90.6	177.1	-78.9	-173.2	174.1	-176.4	-0.9	112.4
22	H	34.8	Very low	38.7	Very low	193 Å²	193	146.1 Å²	146.1	89%	0.894	74%	0.739	S	S	*	*			trans	-153.9	120.8	142.6	-98.5	-61.1	0	0	0	109.8
23	P	44.2	Very low	37.9	Very low	107 Å²	107	147 Å²	147	70%	0.695	75%	0.745	S	S	*	*			trans	-101.6	140.3	174.1	34.5	-25.6	0	0	0	113.2
24	H	35.4	Very low	37.7	Very low	171 Å²	171	147.9 Å²	147.9	79%	0.792	76%	0.755	S	S	*	*			trans	46.1	128.4	145.2	-66.6	-54.5	0	0	0	122.6
25	N	30.3	Very low	37.2	Very low	157 Å²	157	148 Å²	148	84%	0.84	77%	0.765	S	S	*	*				-174.3	133.1	97.8	-97.2	-27.8	0	0	0	116.1
26	A	32.9	Very low	37	Very low	86 Å²	86	152.8 Å²	152.8	71%	0.711	78%	0.778	S	S	*	*			trans	19.9	128.1	147.5	0	0	0	0	0	122.4
27	R	28.3	Very low	36.8	Very low	244 Å²	244	154 Å²	154	92%	0.921	79%	0.792	S	S	*	*				178.6	148.6	97.9	-99	178.3	177.3	172.2	-0.5	112.3
28	T	37.4	Very low	36.9	Very low	127 Å²	127	154.2 Å²	154.2	78%	0.779	80%	0.8	S	S	*	*			trans	-76.1	164.3	-175.9	20.5	0	0	0	0	114.3
29	T	33.4	Very low	37.3	Very low	131 Å²	131	158.2 Å²	158.2	80%	0.804	81%	0.812	S	S	*	*			trans	84	104.9	163.3	61.8	0	0	0	0	119.7
30	R	28.9	Very low	37.7	Very low	242 Å²	242	161.7 Å²	161.7	91%	0.913	81%	0.814	S	S	*	*				175.5	125.6	104.9	-97.6	177.8	171.9	173.1	-2.1	112.9
31	S	28.6	Very low	37.9	Very low	112 Å²	112	162.2 Å²	162.2	78%	0.783	82%	0.816	S	S	*	*			trans	39.2	97.4	146	179.7	0	0	0	0	119.5	S33	S31-S33 PolarHBondContact O-N 3.36Å
32	L	29.4	Very low	38.7	Very low	181 Å²	181	153.8 Å²	153.8	95%	0.948	80%	0.797	S	S	*	*			trans	-80.1	105.2	157.6	-90	156.4	0	0	0	109.9
33	S	34.3	Very low	39.8	Very low	98 Å²	98	150.5 Å²	150.5	69%	0.685	79%	0.786	S	S	*	*			trans	-71.5	131.2	161.9	53.4	0	0	0	0	110.3	S31 V35	S31-S33 PolarHBondContact O-N 3.36Å; S33-V35 PolarHBondContact O-N 2.92Å
34	V	45.1	Very low	40.6	Very low	132 Å²	132	152.1 Å²	152.1	80%	0.8	78%	0.782	S	S	*	*			trans	-39.8	123.3	175	176.3	0	0	0	0	113.7
35	V	36.9	Very low	41.7	Very low	136 Å²	136	151.7 Å²	151.7	82%	0.824	77%	0.774	S	S	*	*			trans	-123.9	115.1	154.4	179.1	0	0	0	0	108.1	S33	S33-V35 PolarHBondContact O-N 2.92Å
36	R	44.4	Very low	43.1	Very low	219 Å²	219	151.8 Å²	151.8	83%	0.826	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-57.7	142.4	177.1	-70.9	175.3	171.6	172.1	-3.1	111.2	G38	R36-G38 PolarHBondContact O-N 2.93Å
37	P	42.3	Very low	44.6	Very low	132 Å²	132	151.1 Å²	151.1	86%	0.857	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-75.3	119.6	172.1	30.4	-29.9	0	0	0	109.8
38	G	43.8	Very low	46.2	Very low	63 Å²	63	143.6 Å²	143.6	65%	0.649	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-69.9	133.1	-180	0	0	0	0	0	113.3	R36 R40	R36-G38 PolarHBondContact O-N 2.93Å; G38-R40 PolarHBondContact O-N 3.45Å
39	K	51.9	Low	47.2	Very low	207 Å²	207	141.7 Å²	141.7	90%	0.9	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.1	1.9	173.6	-83.3	175.1	169.6	177.2	0	117.3
40	R	49.8	Very low	48.3	Very low	228 Å²	228	137.6 Å²	137.6	86%	0.86	70%	0.699	S	S	*	*	H	α-helix	trans	-80.6	-27.9	-172.2	-80.2	-174.6	175.6	-178.5	-0.9	115.3	G38 F44	G38-R40 PolarHBondContact O-N 3.45Å; R40-F44 PolarHBondContact O-N 3.25Å
41	R	48.1	Very low	49.7	Very low	222 Å²	222	131.7 Å²	131.7	84%	0.838	69%	0.685	S	S	*	*	H	α-helix	trans	-69.5	-34.1	179.2	-88.5	-177.7	172.8	173.7	-2	113.4	W45	R41-W45 PolarHBondContact O-N 3.34Å; R41-W45 VanDerWaalsContact O-N 3.15Å
42	G	53.6	Low	51.3	Low	41 Å²	41	129.8 Å²	129.8	42%	0.423	67%	0.672	S	S	.	*	H	α-helix	trans	-69.6	-33.5	179.7	0	0	0	0	0	113.3	K46	G42-K46 VanDerWaalsContact O-CB 3.3Å; G42-K46 WeakPolarHBondContact O-CB 3.36Å; G42-K46 WeakPolarHBondContact O-CG 3.41Å; G42-K46 PolarHBondContact O-N 2.99Å
43	L	55.9	Low	52.9	Low	124 Å²	124	125.4 Å²	125.4	65%	0.649	65%	0.653	S	S	*	*	H	α-helix	trans	-71.6	-43.8	177.5	-168.1	69.5	0	0	0	111.1	W45 K46 T47	L43-W45 PolarHBondContact O-N 3.22Å; L43-K46 PolarHBondContact O-N 3.24Å; L43-T47 PolarHBondContact O-N 2.92Å; L43-T47 PolarHBondContact O-OG1 2.93Å
44	F	62.7	Low	54.5	Low	141 Å²	141	122.6 Å²	122.6	62%	0.618	64%	0.639	S	S	*	*	H	α-helix	trans	-62.2	-43	178.2	-164.9	-95.5	0	0	0	112.2	R40 T47 L48	R40-F44 PolarHBondContact O-N 3.25Å; F44-T47 VanDerWaalsContact CA-OG1 3.29Å; F44-T47 WeakPolarHBondContact CA-OG1 3.14Å; F44-T47 PolarHBondContact O-N 2.81Å; F44-T47 PolarHBondContact O-OG1 2.83Å; F44-L48 HydrophobicContact CE1-CD1 4.21Å; F44-L48 WeakPolarHBondContact O-CB 3.3Å; F44-L48 PolarHBondContact O-N 3.37Å
45	W	56.9	Low	55.8	Low	163 Å²	163	122.8 Å²	122.8	62%	0.617	63%	0.629	S	S	*	*	H	α-helix	trans	-68.5	-36.9	175.7	-107.9	99.3	0	0	0	112.9	R41 L43 L48 L49	R41-W45 PolarHBondContact O-N 3.34Å; R41-W45 VanDerWaalsContact O-N 3.15Å; L43-W45 PolarHBondContact O-N 3.22Å; W45-L48 PolarHBondContact O-N 3.49Å; W45-L49 HydrophobicContact CE3-CD1 3.66Å; W45-L49 HydrophobicContact CE3-CG 4.16Å; W45-L49 HydrophobicContact CZ3-CD1 4.04Å; W45-L49 HydrophobicContact CZ3-CG 4.29Å; W45-L49 WeakPolarHBondContact O-CB 3.34Å; W45-L49 PolarHBondContact O-N 2.86Å
46	K	61.4	Low	57.7	Low	159 Å²	159	119.7 Å²	119.7	69%	0.691	61%	0.612	S	S	*	*	H	α-helix	trans	-67.8	-37.4	174.2	-75.5	175.9	-179	-169.1	0	112.2	G42 L43 G50	G42-K46 VanDerWaalsContact O-CB 3.3Å; G42-K46 WeakPolarHBondContact O-CB 3.36Å; G42-K46 WeakPolarHBondContact O-CG 3.41Å; G42-K46 PolarHBondContact O-N 2.99Å; L43-K46 PolarHBondContact O-N 3.24Å; K46-G50 PolarHBondContact O-N 2.93Å
47	T	63.5	Low	59.1	Low	71 Å²	71	115.1 Å²	115.1	44%	0.436	60%	0.604	S	S	.	*	H	α-helix	trans	-69.3	-37.3	172.4	45.9	0	0	0	0	112	L43 F44 G50 L51	L43-T47 PolarHBondContact O-N 2.92Å; L43-T47 PolarHBondContact O-OG1 2.93Å; F44-T47 VanDerWaalsContact CA-OG1 3.29Å; F44-T47 WeakPolarHBondContact CA-OG1 3.14Å; F44-T47 PolarHBondContact O-N 2.81Å; F44-T47 PolarHBondContact O-OG1 2.83Å; T47-G50 PolarHBondContact O-N 3.33Å; T47-L51 WeakPolarHBondContact O-CB 3.37Å; T47-L51 WeakPolarHBondContact O-CD1 3.41Å; T47-L51 WeakPolarHBondContact O-CG 3.29Å; T47-L51 PolarHBondContact O-N 3.48Å
48	L	61.9	Low	60.6	Low	86 Å²	86	111.7 Å²	111.7	45%	0.45	59%	0.586	S	S	.	*	H	α-helix	trans	-66.5	-42.3	176.4	-150.4	90.5	0	0	0	111.6	F44 W45 L51 S52	F44-L48 HydrophobicContact CE1-CD1 4.21Å; F44-L48 WeakPolarHBondContact O-CB 3.3Å; F44-L48 PolarHBondContact O-N 3.37Å; W45-L48 PolarHBondContact O-N 3.49Å; L48-L51 PolarHBondContact O-N 3.45Å; L48-S52 WeakPolarHBondContact O-CB 3.34Å; L48-S52 PolarHBondContact O-N 3.47Å; L48-S52 PolarHBondContact O-OG 3.1Å
49	L	57.4	Low	62.3	Low	88 Å²	88	111.4 Å²	111.4	46%	0.461	57%	0.572	S	S	.	*	H	α-helix	trans	-66.7	-40.5	173.6	-93.8	151.7	0	0	0	112.6	W45 L51 S52 V53	W45-L49 HydrophobicContact CE3-CD1 3.66Å; W45-L49 HydrophobicContact CE3-CG 4.16Å; W45-L49 HydrophobicContact CZ3-CD1 4.04Å; W45-L49 HydrophobicContact CZ3-CG 4.29Å; W45-L49 WeakPolarHBondContact O-CB 3.34Å; W45-L49 PolarHBondContact O-N 2.86Å; L49-L51 VanDerWaalsContact C-N 3.33Å; L49-S52 WeakPolarHBondContact CA-OG 3.33Å; L49-S52 PolarHBondContact O-N 3.18Å; L49-S52 PolarHBondContact O-OG 2.92Å; L49-V53 PolarHBondContact O-N 3.33Å
50	G	58	Low	63.5	Low	44 Å²	44	103.4 Å²	103.4	45%	0.454	55%	0.548	S	S	.	.	I	π-helix	trans	-63.8	-37.9	174.7	0	0	0	0	0	112.6	K46 T47 G54	K46-G50 PolarHBondContact O-N 2.93Å; T47-G50 PolarHBondContact O-N 3.33Å; G50-G54 VanDerWaalsContact O-CA 3.25Å; G50-G54 WeakPolarHBondContact O-CA 3.25Å; G50-G54 PolarHBondContact O-N 2.94Å
51	L	58.2	Low	65	Low	118 Å²	118	96.7 Å²	96.7	62%	0.618	53%	0.532	S	S	*	.	I	π-helix	trans	-74.4	-32.9	174.2	-79	162.4	0	0	0	112.9	T47 L48 L49 F55	T47-L51 WeakPolarHBondContact O-CB 3.37Å; T47-L51 WeakPolarHBondContact O-CD1 3.41Å; T47-L51 WeakPolarHBondContact O-CG 3.29Å; T47-L51 PolarHBondContact O-N 3.48Å; L48-L51 PolarHBondContact O-N 3.45Å; L49-L51 VanDerWaalsContact C-N 3.33Å; L51-F55 VanDerWaalsContact O-CB 3.27Å; L51-F55 WeakPolarHBondContact O-CB 3.28Å
52	S	61.8	Low	66.6	Low	72 Å²	72	92.3 Å²	92.3	50%	0.503	52%	0.519	S	S	.	.	I	π-helix	trans	-83	-24.5	-178.6	67	0	0	0	0	114.2	L48 L49 P56	L48-S52 WeakPolarHBondContact O-CB 3.34Å; L48-S52 PolarHBondContact O-N 3.47Å; L48-S52 PolarHBondContact O-OG 3.1Å; L49-S52 WeakPolarHBondContact CA-OG 3.33Å; L49-S52 PolarHBondContact O-N 3.18Å; L49-S52 PolarHBondContact O-OG 2.92Å; S52-P56 WeakPolarHBondContact O-CD 3.47Å; S52-P56 VanDerWaalsContact O-CG 3.27Å; S52-P56 WeakPolarHBondContact O-CG 3.27Å
53	V	63.2	Low	68	Low	90 Å²	90	94.4 Å²	94.4	55%	0.545	52%	0.515	S	S	.	.	I	π-helix	trans	-111.5	-43.8	-179.9	-176.4	0	0	0	0	112.2	L49 P56 L57	L49-V53 PolarHBondContact O-N 3.33Å; V53-P56 WeakPolarHBondContact O-CD 3.38Å; V53-L57 WeakPolarHBondContact O-CB 3.35Å; V53-L57 PolarHBondContact O-N 3.46Å
54	G	66.6	Low	69.2	Low	39 Å²	39	91.4 Å²	91.4	40%	0.402	51%	0.508	S	S	.	.	I	π-helix	trans	-70.7	-37.3	-176.8	0	0	0	0	0	113.3	G50 A58	G50-G54 VanDerWaalsContact O-CA 3.25Å; G50-G54 WeakPolarHBondContact O-CA 3.25Å; G50-G54 PolarHBondContact O-N 2.94Å; G54-A58 VanDerWaalsContact O-CB 3.28Å; G54-A58 WeakPolarHBondContact O-CB 3.49Å; G54-A58 PolarHBondContact O-N 2.96Å
55	F	72.6	Confident	70.1	Confident	135 Å²	135	90.1 Å²	90.1	59%	0.592	51%	0.512	S	S	*	.	H	α-helix	trans	-68.7	-48.4	179	-177.1	-94.6	0	0	0	112.6	L51 L57 A58 V59	L51-F55 VanDerWaalsContact O-CB 3.27Å; L51-F55 WeakPolarHBondContact O-CB 3.28Å; F55-L57 VanDerWaalsContact C-N 3.3Å; F55-L57 PolarHBondContact O-N 2.89Å; F55-A58 PolarHBondContact O-N 3.3Å; F55-V59 HydrophobicContact CD1-CG2 4.16Å; F55-V59 HydrophobicContact CE1-CG2 3.88Å; F55-V59 HydrophobicContact CE2-CG2 4.31Å; F55-V59 HydrophobicContact CZ-CG2 3.96Å; F55-V59 WeakPolarHBondContact O-CB 3.27Å; F55-V59 VanDerWaalsContact O-CG2 3.25Å; F55-V59 WeakPolarHBondContact O-CG2 3.26Å; F55-V59 PolarHBondContact O-N 3.48Å
56	P	77	Confident	71.3	Confident	72 Å²	72	82.6 Å²	82.6	47%	0.468	49%	0.485	S	S	.	.	H	α-helix	trans	-60.8	-37.6	174.2	-25.7	36.3	0	0	0	113.3	S52 V53 V59 G60	S52-P56 WeakPolarHBondContact O-CD 3.47Å; S52-P56 VanDerWaalsContact O-CG 3.27Å; S52-P56 WeakPolarHBondContact O-CG 3.27Å; V53-P56 WeakPolarHBondContact O-CD 3.38Å; P56-V59 PolarHBondContact O-N 2.91Å; P56-G60 PolarHBondContact O-N 3.13Å
57	L	74.6	Confident	72.4	Confident	123 Å²	123	81.1 Å²	81.1	64%	0.644	48%	0.48	S	S	*	.	H	α-helix	trans	-66.2	-45.6	178	-151.8	90.1	0	0	0	111.3	V53 F55 V59 G60 V61	V53-L57 WeakPolarHBondContact O-CB 3.35Å; V53-L57 PolarHBondContact O-N 3.46Å; F55-L57 VanDerWaalsContact C-N 3.3Å; F55-L57 PolarHBondContact O-N 2.89Å; L57-V59 PolarHBondContact O-N 2.67Å; L57-G60 PolarHBondContact O-N 3.5Å; L57-V61 WeakPolarHBondContact O-CG2 3.25Å; L57-V61 PolarHBondContact O-N 3.46Å
58	A	74.3	Confident	73.2	Confident	59 Å²	59	83.1 Å²	83.1	49%	0.488	49%	0.494	S	S	.	.	H	α-helix	trans	-64.2	-39.3	176.6	0	0	0	0	0	112.3	G54 F55 K62	G54-A58 VanDerWaalsContact O-CB 3.28Å; G54-A58 WeakPolarHBondContact O-CB 3.49Å; G54-A58 PolarHBondContact O-N 2.96Å; F55-A58 PolarHBondContact O-N 3.3Å; A58-K62 VanDerWaalsContact O-CB 3.26Å; A58-K62 WeakPolarHBondContact O-CB 3.43Å; A58-K62 PolarHBondContact O-N 3.46Å
59	V	77.9	Confident	74	Confident	57 Å²	57	84.1 Å²	84.1	35%	0.345	49%	0.492	S	S	.	.	H	α-helix	trans	-65.7	-40.3	173.2	171.6	0	0	0	0	111	F55 P56 L57 K62 Y63 M74	F55-V59 HydrophobicContact CD1-CG2 4.16Å; F55-V59 HydrophobicContact CE1-CG2 3.88Å; F55-V59 HydrophobicContact CE2-CG2 4.31Å; F55-V59 HydrophobicContact CZ-CG2 3.96Å; F55-V59 WeakPolarHBondContact O-CB 3.27Å; F55-V59 VanDerWaalsContact O-CG2 3.25Å; F55-V59 WeakPolarHBondContact O-CG2 3.26Å; F55-V59 PolarHBondContact O-N 3.48Å; P56-V59 PolarHBondContact O-N 2.91Å; L57-V59 PolarHBondContact O-N 2.67Å; V59-K62 PolarHBondContact O-N 3.45Å; V59-Y63 VanDerWaalsContact O-CB 3.32Å; V59-Y63 WeakPolarHBondContact O-CB 3.32Å; V59-Y63 PolarHBondContact O-N 2.96Å; V59-M74 HydrophobicContact CG1-CE 3.86Å
60	G	78.7	Confident	75.2	Confident	39 Å²	39	84.6 Å²	84.6	40%	0.402	49%	0.492	S	S	.	.	H	α-helix	trans	-64.5	-45	176.8	0	0	0	0	0	112.8	P56 L57 Y63 A64	P56-G60 PolarHBondContact O-N 3.13Å; L57-G60 PolarHBondContact O-N 3.5Å; G60-Y63 PolarHBondContact O-N 3.28Å; G60-A64 WeakPolarHBondContact O-CB 3.05Å; G60-A64 PolarHBondContact O-N 3.05Å
61	V	79.6	Confident	76.4	Confident	87 Å²	87	87 Å²	87	53%	0.527	49%	0.488	S	S	.	.	H	α-helix	trans	-62.7	-48.1	174	172.5	0	0	0	0	110.4	L57 Y63 A64 T65	L57-V61 WeakPolarHBondContact O-CG2 3.25Å; L57-V61 PolarHBondContact O-N 3.46Å; V61-Y63 VanDerWaalsContact C-N 3.28Å; V61-Y63 PolarHBondContact O-N 3.36Å; V61-A64 PolarHBondContact O-N 3.22Å; V61-A64 VanDerWaalsContact O-N 3.1Å; V61-T65 PolarHBondContact O-N 2.82Å; V61-T65 PolarHBondContact O-OG1 3.45Å
62	K	82.7	Confident	77.6	Confident	131 Å²	131	83.2 Å²	83.2	57%	0.57	47%	0.465	S	S	*	.	H	α-helix	trans	-59.2	-39	176.6	-173.6	176.2	-179.8	177.6	0	112	A58 V59 T65 A66	A58-K62 VanDerWaalsContact O-CB 3.26Å; A58-K62 WeakPolarHBondContact O-CB 3.43Å; A58-K62 PolarHBondContact O-N 3.46Å; V59-K62 PolarHBondContact O-N 3.45Å; K62-T65 PolarHBondContact O-OG1 3.22Å; K62-A66 WeakPolarHBondContact O-CB 3.46Å; K62-A66 PolarHBondContact O-N 3.5Å
63	Y	83.4	Confident	78.5	Confident	84 Å²	84	86 Å²	86	33%	0.329	46%	0.464	S	S	.	.	H	α-helix	trans	-65.9	-42.3	175.1	-175.8	-94.1	0	0	0	111.6	V59 G60 V61 T65 A66 R71 M74 R75	V59-Y63 VanDerWaalsContact O-CB 3.32Å; V59-Y63 WeakPolarHBondContact O-CB 3.32Å; V59-Y63 PolarHBondContact O-N 2.96Å; G60-Y63 PolarHBondContact O-N 3.28Å; V61-Y63 VanDerWaalsContact C-N 3.28Å; V61-Y63 PolarHBondContact O-N 3.36Å; Y63-T65 VanDerWaalsContact C-N 3.33Å; Y63-T65 PolarHBondContact O-N 3.37Å; Y63-A66 PolarHBondContact O-N 3.32Å; Y63-R71 HydrophobicContact CD2-CB 4.3Å; Y63-R71 HydrophobicContact CD2-CG 4.26Å; Y63-R71 HydrophobicContact CE2-CB 3.88Å; Y63-R71 HydrophobicContact CE2-CG 4.21Å; Y63-R71 WeakPolarHBondContact O-CD 3.28Å; Y63-R71 VanDerWaalsContact O-CG 3.28Å; Y63-R71 WeakPolarHBondContact O-CG 3.35Å; Y63-R71 PolarHBondContact O-NE 3.48Å; Y63-M74 HydrophobicContact CD2-CB 4.16Å; Y63-M74 HydrophobicContact CD2-CE 4.17Å; Y63-M74 HydrophobicContact CD2-SD 4.2Å; Y63-R75 PolarHBondContact OH-NH2 3.36Å
64	A	80	Confident	79.4	Confident	62 Å²	62	84 Å²	84	51%	0.512	45%	0.449	S	S	.	.	H	α-helix	trans	-67.2	-31.5	178.9	0	0	0	0	0	113	G60 V61 R71	G60-A64 WeakPolarHBondContact O-CB 3.05Å; G60-A64 PolarHBondContact O-N 3.05Å; V61-A64 PolarHBondContact O-N 3.22Å; V61-A64 VanDerWaalsContact O-N 3.1Å; A64-R71 PolarHBondContact O-NH2 3.07Å
65	T	82.3	Confident	80.1	Confident	113 Å²	113	88.2 Å²	88.2	69%	0.693	45%	0.453	S	S	*	.	H	α-helix	trans	-95.5	-11.1	179.1	62.1	0	0	0	0	113.8	V61 K62 Y63	V61-T65 PolarHBondContact O-N 2.82Å; V61-T65 PolarHBondContact O-OG1 3.45Å; K62-T65 PolarHBondContact O-OG1 3.22Å; Y63-T65 VanDerWaalsContact C-N 3.33Å; Y63-T65 PolarHBondContact O-N 3.37Å
66	A	82.8	Confident	80.5	Confident	6 Å²	6	82.4 Å²	82.4	5%	0.05	43%	0.428	C	S	.	.	S	Bend	trans	-68.4	146.8	-178.2	0	0	0	0	0	112.8	K62 Y63 Q70 R71	K62-A66 WeakPolarHBondContact O-CB 3.46Å; K62-A66 PolarHBondContact O-N 3.5Å; Y63-A66 PolarHBondContact O-N 3.32Å; A66-Q70 HydrophobicContact CB-CB 3.83Å; A66-R71 HydrophobicContact CB-CG 3.71Å; A66-R71 PolarHBondContact O-NE 3.05Å; A66-R71 PolarHBondContact O-NH2 3.23Å
67	E	84.1	Confident	80.7	Confident	128 Å²	128	84.1 Å²	84.1	60%	0.598	44%	0.437	S	S	*	.			trans	-60.1	156.1	169.3	-70.2	177.8	176.5	0	0	111.7	R69 Q70 R71	E67-R69 PolarHBondContact O-N 2.99Å; E67-R69 VanDerWaalsContact O-N 3.13Å; E67-Q70 PolarHBondContact O-N 3.38Å; E67-R71 PolarHBondContact O-N 3.46Å
68	P	80.1	Confident	81.1	Confident	112 Å²	112	83.5 Å²	83.5	73%	0.727	44%	0.438	S	S	*	.	H	α-helix	trans	-50.6	-42	-178.5	-28.3	35	0	0	0	114	R71 R72	P68-R71 PolarHBondContact O-N 3.26Å; P68-R72 PolarHBondContact O-N 3.45Å
69	R	79.6	Confident	81.5	Confident	108 Å²	108	85 Å²	85	41%	0.408	44%	0.435	S	S	.	.	H	α-helix	trans	-64.7	-41.8	177.6	-169.5	176.4	-176.3	179.7	4.6	112.5	E67 R72 R73 E185	E67-R69 PolarHBondContact O-N 2.99Å; E67-R69 VanDerWaalsContact O-N 3.13Å; R69-R72 PolarHBondContact O-N 3.37Å; R69-R73 PolarHBondContact O-N 3.25Å; R69-E185 IonicContact NE-OE2 3.24Å
70	Q	81	Confident	81.7	Confident	97 Å²	97	83 Å²	83	45%	0.453	43%	0.426	S	S	.	.	H	α-helix	trans	-69.4	-41.2	177.8	-69.1	-178.1	8.6	0	0	111.6	A66 E67 R72 R73 M74	A66-Q70 HydrophobicContact CB-CB 3.83Å; E67-Q70 PolarHBondContact O-N 3.38Å; Q70-R72 VanDerWaalsContact C-N 3.32Å; Q70-R72 PolarHBondContact O-N 3.3Å; Q70-R73 PolarHBondContact O-N 3.37Å; Q70-M74 WeakPolarHBondContact O-CG 3.37Å; Q70-M74 PolarHBondContact O-N 2.89Å
71	R	83.1	Confident	82	Confident	96 Å²	96	88 Å²	88	36%	0.362	44%	0.437	S	S	.	.	H	α-helix	trans	-59.5	-42.6	173.1	-68.6	-173.8	-168	169.2	3.9	111.7	Y63 A64 A66 E67 P68 M74 R75	Y63-R71 HydrophobicContact CD2-CB 4.3Å; Y63-R71 HydrophobicContact CD2-CG 4.26Å; Y63-R71 HydrophobicContact CE2-CB 3.88Å; Y63-R71 HydrophobicContact CE2-CG 4.21Å; Y63-R71 WeakPolarHBondContact O-CD 3.28Å; Y63-R71 VanDerWaalsContact O-CG 3.28Å; Y63-R71 WeakPolarHBondContact O-CG 3.35Å; Y63-R71 PolarHBondContact O-NE 3.48Å; A64-R71 PolarHBondContact O-NH2 3.07Å; A66-R71 HydrophobicContact CB-CG 3.71Å; A66-R71 PolarHBondContact O-NE 3.05Å; A66-R71 PolarHBondContact O-NH2 3.23Å; E67-R71 PolarHBondContact O-N 3.46Å; P68-R71 PolarHBondContact O-N 3.26Å; R71-M74 PolarHBondContact O-N 3.17Å; R71-R75 PolarHBondContact O-N 3.43Å
72	R	83.7	Confident	82.4	Confident	38 Å²	38	85.2 Å²	85.2	14%	0.143	43%	0.426	C	S	.	.	H	α-helix	trans	-58.6	-50.2	174.9	-175.2	179.4	70.1	-131.4	2.6	111	P68 R69 Q70 M74 R75 I76 E185 D233	P68-R72 PolarHBondContact O-N 3.45Å; R69-R72 PolarHBondContact O-N 3.37Å; Q70-R72 VanDerWaalsContact C-N 3.32Å; Q70-R72 PolarHBondContact O-N 3.3Å; R72-M74 VanDerWaalsContact C-N 3.34Å; R72-M74 PolarHBondContact O-N 3.01Å; R72-R75 WeakPolarHBondContact O-CB 3.48Å; R72-R75 PolarHBondContact O-N 3.33Å; R72-R75 VanDerWaalsContact O-N 3.17Å; R72-I76 HydrophobicContact CG-CD1 3.75Å; R72-I76 HydrophobicContact CG-CG1 4.31Å; R72-I76 VanDerWaalsContact O-CG1 3.32Å; R72-I76 WeakPolarHBondContact O-CG1 3.4Å; R72-I76 PolarHBondContact O-N 3.43Å; R72-E185 IonicContact CZ-OE1 2.74Å; R72-E185 VanDerWaalsContact CZ-OE1 3.24Å; R72-E185 IonicContact NH1-OE1 2.72Å; R72-E185 PolarHBondContact NH1-OE1 3.42Å; R72-E185 IonicContact NH1-OE2 3.02Å; R72-E185 IonicContact NH2-OE1 3.34Å; R72-E185 PolarHBondContact NH2-OE1 3.43Å; R72-E185 IonicContact NH2-OE2 2.95Å; R72-E185 PolarHBondContact NH2-OE2 3.39Å; R72-E185 VanDerWaalsContact NH2-OE2 3.14Å; R72-D233 IonicContact CZ-OD2 3.44Å; R72-D233 IonicContact NE-OD2 2.81Å; R72-D233 PolarHBondContact NE-OD2 2.86Å; R72-D233 IonicContact NH2-OD2 3.64Å; R72-D233 PolarHBondContact NH2-OD2 3.4Å
73	R	80.8	Confident	82.8	Confident	131 Å²	131	79.6 Å²	79.6	49%	0.494	40%	0.401	S	S	.	.	H	α-helix	trans	-57	-45	177.3	-76.8	-175.9	172.5	179.6	-1.6	112.8	R69 Q70 R75 I76 V77 D233	R69-R73 PolarHBondContact O-N 3.25Å; Q70-R73 PolarHBondContact O-N 3.37Å; R73-R75 VanDerWaalsContact C-N 3.35Å; R73-R75 PolarHBondContact O-N 2.88Å; R73-I76 PolarHBondContact O-N 3.17Å; R73-V77 WeakPolarHBondContact O-CG2 3.32Å; R73-V77 PolarHBondContact O-N 3.41Å; R73-D233 IonicContact NE-OD1 3.73Å
74	M	82.3	Confident	83.1	Confident	46 Å²	46	78 Å²	78	23%	0.227	40%	0.396	C	S	.	.	H	α-helix	trans	-61	-43.5	177.3	-69.2	174.7	68.7	0	0	111.9	V59 Y63 Q70 R71 R72 V77 V78	V59-M74 HydrophobicContact CG1-CE 3.86Å; Y63-M74 HydrophobicContact CD2-CB 4.16Å; Y63-M74 HydrophobicContact CD2-CE 4.17Å; Y63-M74 HydrophobicContact CD2-SD 4.2Å; Q70-M74 WeakPolarHBondContact O-CG 3.37Å; Q70-M74 PolarHBondContact O-N 2.89Å; R71-M74 PolarHBondContact O-N 3.17Å; R72-M74 VanDerWaalsContact C-N 3.34Å; R72-M74 PolarHBondContact O-N 3.01Å; M74-V77 PolarHBondContact O-N 3.37Å; M74-V78 PolarHBondContact O-N 2.97Å
75	R	81.9	Confident	83.6	Confident	129 Å²	129	77.2 Å²	77.2	49%	0.487	39%	0.386	S	S	.	.	H	α-helix	trans	-62	-45.6	175.7	-171.7	-172.6	-54.5	174.2	4.6	111.8	Y63 R71 R72 R73 V77 V78 E79	Y63-R75 PolarHBondContact OH-NH2 3.36Å; R71-R75 PolarHBondContact O-N 3.43Å; R72-R75 WeakPolarHBondContact O-CB 3.48Å; R72-R75 PolarHBondContact O-N 3.33Å; R72-R75 VanDerWaalsContact O-N 3.17Å; R73-R75 VanDerWaalsContact C-N 3.35Å; R73-R75 PolarHBondContact O-N 2.88Å; R75-V77 VanDerWaalsContact C-N 3.26Å; R75-V77 PolarHBondContact O-N 3.43Å; R75-V78 PolarHBondContact O-N 3.24Å; R75-V78 VanDerWaalsContact O-N 3.17Å; R75-E79 VanDerWaalsContact CD-OE1 3.28Å; R75-E79 WeakPolarHBondContact CD-OE1 3.28Å; R75-E79 HydrophobicContact CG-CG 4.28Å; R75-E79 VanDerWaalsContact CG-OE1 3.26Å; R75-E79 WeakPolarHBondContact CG-OE1 3.48Å; R75-E79 WeakPolarHBondContact O-CB 3.41Å; R75-E79 WeakPolarHBondContact O-CG 3.26Å; R75-E79 PolarHBondContact O-N 2.89Å
76	I	81.5	Confident	84	Confident	13 Å²	13	76.7 Å²	76.7	7%	0.067	37%	0.372	C	S	.	.	H	α-helix	trans	-59.5	-37.9	179.2	-72.1	172.9	0	0	0	111.5	R72 R73 G80 D230 D233 R234	R72-I76 HydrophobicContact CG-CD1 3.75Å; R72-I76 HydrophobicContact CG-CG1 4.31Å; R72-I76 VanDerWaalsContact O-CG1 3.32Å; R72-I76 WeakPolarHBondContact O-CG1 3.4Å; R72-I76 PolarHBondContact O-N 3.43Å; R73-I76 PolarHBondContact O-N 3.17Å; I76-G80 WeakPolarHBondContact O-CA 3.49Å; I76-G80 PolarHBondContact O-N 3.14Å; I76-D230 HydrophobicContact CD1-CB 4.1Å; I76-D233 HydrophobicContact CD1-CB 3.5Å; I76-R234 HydrophobicContact CG2-CB 3.74Å
77	V	80.1	Confident	84.5	Confident	107 Å²	107	76.9 Å²	76.9	65%	0.648	37%	0.373	S	S	*	.	H	α-helix	trans	-65.1	-46.2	176.3	171	0	0	0	0	111.3	R73 M74 R75 G80 F81	R73-V77 WeakPolarHBondContact O-CG2 3.32Å; R73-V77 PolarHBondContact O-N 3.41Å; M74-V77 PolarHBondContact O-N 3.37Å; R75-V77 VanDerWaalsContact C-N 3.26Å; R75-V77 PolarHBondContact O-N 3.43Å; V77-G80 PolarHBondContact O-N 3.42Å; V77-F81 PolarHBondContact O-N 3.34Å
78	V	82.4	Confident	84.8	Confident	110 Å²	110	72.7 Å²	72.7	67%	0.667	35%	0.354	S	S	*	.	H	α-helix	trans	-63.8	-48.1	178.4	174.8	0	0	0	0	111.1	M74 R75 G80 F81 G82	M74-V78 PolarHBondContact O-N 2.97Å; R75-V78 PolarHBondContact O-N 3.24Å; R75-V78 VanDerWaalsContact O-N 3.17Å; V78-G80 PolarHBondContact O-N 3.31Å; V78-F81 PolarHBondContact O-N 2.88Å; V78-G82 PolarHBondContact O-N 2.95Å
79	E	82.6	Confident	85.3	Confident	92 Å²	92	70.3 Å²	70.3	43%	0.43	34%	0.34	S	S	.	.	H	α-helix	trans	-63	-33.5	174.9	-69.6	174.5	-175.9	0	0	111.8	R75 F81 G82 R83	R75-E79 VanDerWaalsContact CD-OE1 3.28Å; R75-E79 WeakPolarHBondContact CD-OE1 3.28Å; R75-E79 HydrophobicContact CG-CG 4.28Å; R75-E79 VanDerWaalsContact CG-OE1 3.26Å; R75-E79 WeakPolarHBondContact CG-OE1 3.48Å; R75-E79 WeakPolarHBondContact O-CB 3.41Å; R75-E79 WeakPolarHBondContact O-CG 3.26Å; R75-E79 PolarHBondContact O-N 2.89Å; E79-F81 VanDerWaalsContact C-N 3.35Å; E79-G82 CarbonylContact O-C 3.55Å; E79-G82 PolarHBondContact O-N 2.79Å; E79-G82 VanDerWaalsContact O-N 3.16Å; E79-R83 PolarHBondContact O-N 3.13Å
80	G	83.5	Confident	85.9	Confident	15 Å²	15	66.6 Å²	66.6	16%	0.155	33%	0.329	C	S	.	.	H	α-helix	trans	-61.7	-39.4	175.7	0	0	0	0	0	112.6	I76 V77 V78 G82 R83 F84	I76-G80 WeakPolarHBondContact O-CA 3.49Å; I76-G80 PolarHBondContact O-N 3.14Å; V77-G80 PolarHBondContact O-N 3.42Å; V78-G80 PolarHBondContact O-N 3.31Å; G80-G82 VanDerWaalsContact C-N 3.33Å; G80-G82 PolarHBondContact O-N 2.69Å; G80-R83 VanDerWaalsContact CA-NH2 3.33Å; G80-R83 PolarHBondContact O-N 3.09Å; G80-F84 WeakPolarHBondContact O-CB 3.46Å; G80-F84 PolarHBondContact O-N 2.92Å
81	F	85.5	Confident	86.4	Confident	142 Å²	142	62.5 Å²	62.5	62%	0.623	31%	0.313	S	S	*	.	H	α-helix	trans	-62.6	-41	172.2	-175.3	-100.2	0	0	0	112	V77 V78 E79 F84 C85	V77-F81 PolarHBondContact O-N 3.34Å; V78-F81 PolarHBondContact O-N 2.88Å; E79-F81 VanDerWaalsContact C-N 3.35Å; F81-F84 WeakPolarHBondContact O-CB 3.28Å; F81-F84 PolarHBondContact O-N 3.04Å; F81-C85 VanDerWaalsContact CE1-SG 3.59Å; F81-C85 PolarHBondContact O-N 2.99Å; F81-C85 PolarHBondContact O-SG 3.26Å
82	G	88	Confident	86.7	Confident	30 Å²	30	60.5 Å²	60.5	31%	0.309	31%	0.309	S	S	.	.	H	α-helix	trans	-64.3	-39.1	173.9	0	0	0	0	0	113.1	V78 E79 G80 R86	V78-G82 PolarHBondContact O-N 2.95Å; E79-G82 CarbonylContact O-C 3.55Å; E79-G82 PolarHBondContact O-N 2.79Å; E79-G82 VanDerWaalsContact O-N 3.16Å; G80-G82 VanDerWaalsContact C-N 3.33Å; G80-G82 PolarHBondContact O-N 2.69Å; G82-R86 WeakPolarHBondContact O-CG 3.29Å; G82-R86 PolarHBondContact O-N 3.41Å; G82-R86 PolarHBondContact O-NE 3.19Å
83	R	89.7	Confident	87.1	Confident	12 Å²	12	64.8 Å²	64.8	5%	0.045	33%	0.329	C	S	.	.	H	α-helix	trans	-62.3	-47.7	171	-72.1	-168.7	-63	-81.3	-2.3	111	E79 G80 C85 R86 S87 N138 D238	E79-R83 PolarHBondContact O-N 3.13Å; G80-R83 VanDerWaalsContact CA-NH2 3.33Å; G80-R83 PolarHBondContact O-N 3.09Å; R83-C85 PolarHBondContact O-N 3.41Å; R83-R86 PolarHBondContact O-N 3.19Å; R83-S87 WeakPolarHBondContact O-CB 3.39Å; R83-S87 PolarHBondContact O-N 2.84Å; R83-S87 PolarHBondContact O-OG 3.45Å; R83-N138 HydrophobicContact CG-CB 4.48Å; R83-D238 IonicContact CZ-OD1 2.89Å; R83-D238 IonicContact NE-OD1 3.32Å; R83-D238 PolarHBondContact NE-OD1 3.44Å; R83-D238 IonicContact NE-OD2 4Å; R83-D238 IonicContact NH2-OD1 3.14Å; R83-D238 PolarHBondContact NH2-OD1 3.49Å
84	F	89.4	Confident	87.7	Confident	50 Å²	50	59.6 Å²	59.6	22%	0.219	31%	0.311	C	S	.	.	H	α-helix	trans	-54.3	-51	177.4	175.2	-90	0	0	0	112.1	G80 F81 R86 S87 L88 T241 I244	G80-F84 WeakPolarHBondContact O-CB 3.46Å; G80-F84 PolarHBondContact O-N 2.92Å; F81-F84 WeakPolarHBondContact O-CB 3.28Å; F81-F84 PolarHBondContact O-N 3.04Å; F84-R86 VanDerWaalsContact C-N 3.33Å; F84-R86 PolarHBondContact O-N 3.27Å; F84-S87 PolarHBondContact O-N 2.76Å; F84-L88 HydrophobicContact CE1-CD2 3.98Å; F84-L88 HydrophobicContact CZ-CD2 4.29Å; F84-L88 VanDerWaalsContact O-CB 3.31Å; F84-L88 WeakPolarHBondContact O-CB 3.35Å; F84-L88 PolarHBondContact O-N 3.4Å; F84-T241 HydrophobicContact CB-CG2 4.25Å; F84-T241 HydrophobicContact CD2-CG2 3.52Å; F84-T241 HydrophobicContact CE2-CG2 4.26Å; F84-T241 HydrophobicContact CG-CG2 4.27Å; F84-I244 HydrophobicContact CE2-CD1 4.36Å; F84-I244 HydrophobicContact CE2-CG2 4.4Å
85	C	90.5	Very high	88	Confident	46 Å²	46	57.5 Å²	57.5	31%	0.311	30%	0.301	S	S	.	.	H	α-helix	trans	-62.4	-39.8	-179.3	-64.9	0	0	0	0	112.4	F81 R83 S89	F81-C85 VanDerWaalsContact CE1-SG 3.59Å; F81-C85 PolarHBondContact O-N 2.99Å; F81-C85 PolarHBondContact O-SG 3.26Å; R83-C85 PolarHBondContact O-N 3.41Å; C85-S89 WeakPolarHBondContact O-CB 3.2Å; C85-S89 PolarHBondContact O-N 3.2Å; C85-S89 PolarHBondContact O-OG 3.32Å
86	R	92	Very high	88.5	Confident	103 Å²	103	56.7 Å²	56.7	39%	0.389	30%	0.304	S	S	.	.	H	α-helix	trans	-64.8	-49.1	175.5	-74	-177.4	-69.5	163.5	-0.5	111.6	G82 R83 F84 L88 S89 V90 R137 N138	G82-R86 WeakPolarHBondContact O-CG 3.29Å; G82-R86 PolarHBondContact O-N 3.41Å; G82-R86 PolarHBondContact O-NE 3.19Å; R83-R86 PolarHBondContact O-N 3.19Å; F84-R86 VanDerWaalsContact C-N 3.33Å; F84-R86 PolarHBondContact O-N 3.27Å; R86-L88 VanDerWaalsContact C-N 3.29Å; R86-L88 PolarHBondContact O-N 2.89Å; R86-S89 PolarHBondContact O-N 3.25Å; R86-V90 WeakPolarHBondContact O-CG2 3.36Å; R86-V90 PolarHBondContact O-N 3.49Å; R86-R137 PolarHBondContact NH1-O 3.48Å; R86-N138 PolarHBondContact NE-OD1 2.87Å; R86-N138 PolarHBondContact NH2-OD1 3.16Å
87	S	91.7	Very high	89	Confident	9 Å²	9	57.6 Å²	57.6	6%	0.063	31%	0.309	C	S	.	.	H	α-helix	trans	-61	-39.3	178.3	-56.6	0	0	0	0	111.8	R83 F84 G91 N138 Y142	R83-S87 WeakPolarHBondContact O-CB 3.39Å; R83-S87 PolarHBondContact O-N 2.84Å; R83-S87 PolarHBondContact O-OG 3.45Å; F84-S87 PolarHBondContact O-N 2.76Å; S87-G91 PolarHBondContact O-N 3.24Å; S87-N138 PolarHBondContact OG-ND2 3.24Å; S87-Y142 WeakPolarHBondContact OG-CE1 3.41Å; S87-Y142 PolarHBondContact OG-OH 3.03Å
88	L	90.6	Very high	89.5	Confident	41 Å²	41	54.6 Å²	54.6	22%	0.215	29%	0.286	C	S	.	.	H	α-helix	trans	-64	-45.8	174.5	-177.2	64.8	0	0	0	112.5	F84 R86 V90 G91 I92 L245 I248	F84-L88 HydrophobicContact CE1-CD2 3.98Å; F84-L88 HydrophobicContact CZ-CD2 4.29Å; F84-L88 VanDerWaalsContact O-CB 3.31Å; F84-L88 WeakPolarHBondContact O-CB 3.35Å; F84-L88 PolarHBondContact O-N 3.4Å; R86-L88 VanDerWaalsContact C-N 3.29Å; R86-L88 PolarHBondContact O-N 2.89Å; L88-V90 PolarHBondContact O-N 3.28Å; L88-G91 PolarHBondContact O-N 3.27Å; L88-I92 HydrophobicContact CD1-CD1 3.8Å; L88-I92 HydrophobicContact CD1-CG1 4.15Å; L88-I92 HydrophobicContact CG-CD1 3.8Å; L88-I92 HydrophobicContact CG-CG1 4.47Å; L88-I92 WeakPolarHBondContact O-CB 3.28Å; L88-I92 VanDerWaalsContact O-CG1 3.27Å; L88-I92 WeakPolarHBondContact O-CG1 3.4Å; L88-I92 PolarHBondContact O-N 3.34Å; L88-L245 VanDerWaalsContact CA-CD2 3.43Å; L88-L245 HydrophobicContact CB-CD2 3.84Å; L88-L245 HydrophobicContact CD1-CD2 3.33Å; L88-L245 HydrophobicContact CG-CD2 4.19Å; L88-I248 HydrophobicContact CD1-CD1 3.84Å
89	S	91.9	Very high	89.8	Confident	61 Å²	61	55.4 Å²	55.4	43%	0.427	28%	0.277	S	S	.	.	H	α-helix	trans	-59.3	-50.2	177.1	-56.2	0	0	0	0	110.7	C85 R86 G91 I92 F93	C85-S89 WeakPolarHBondContact O-CB 3.2Å; C85-S89 PolarHBondContact O-N 3.2Å; C85-S89 PolarHBondContact O-OG 3.32Å; R86-S89 PolarHBondContact O-N 3.25Å; S89-G91 PolarHBondContact O-N 3.04Å; S89-I92 PolarHBondContact O-N 2.72Å; S89-F93 WeakPolarHBondContact O-CD2 3.31Å; S89-F93 PolarHBondContact O-N 3.26Å
90	V	92.4	Very high	90.3	Very high	30 Å²	30	58.1 Å²	58.1	18%	0.182	28%	0.284	C	S	.	.	H	α-helix	trans	-57.8	-49.3	177.1	170.6	0	0	0	0	111.4	R86 L88 I92 F93 I94	R86-V90 WeakPolarHBondContact O-CG2 3.36Å; R86-V90 PolarHBondContact O-N 3.49Å; L88-V90 PolarHBondContact O-N 3.28Å; V90-I92 VanDerWaalsContact C-N 3.34Å; V90-I92 PolarHBondContact O-N 3.43Å; V90-F93 PolarHBondContact O-N 2.54Å; V90-I94 HydrophobicContact CG1-CD1 3.76Å; V90-I94 HydrophobicContact CG1-CG1 4.46Å; V90-I94 WeakPolarHBondContact O-CG1 3.29Å; V90-I94 PolarHBondContact O-N 2.88Å
91	G	90.6	Very high	90.6	Very high	11 Å²	11	57.6 Å²	57.6	11%	0.113	28%	0.277	C	S	.	.	H	α-helix	trans	-61.5	-39.8	-179.8	0	0	0	0	0	113.3	S87 L88 S89 S95	S87-G91 PolarHBondContact O-N 3.24Å; L88-G91 PolarHBondContact O-N 3.27Å; S89-G91 PolarHBondContact O-N 3.04Å; G91-S95 VanDerWaalsContact O-CB 3.31Å; G91-S95 WeakPolarHBondContact O-CB 3.23Å; G91-S95 PolarHBondContact O-N 3.47Å; G91-S95 PolarHBondContact O-OG 2.9Å
92	I	90.1	Very high	90.5	Very high	55 Å²	55	54 Å²	54	28%	0.282	27%	0.267	S	S	.	.	H	α-helix	trans	-67	-46.2	176	-70.2	171.1	0	0	0	110.8	L88 S89 V90 I94 S95 M96	L88-I92 HydrophobicContact CD1-CD1 3.8Å; L88-I92 HydrophobicContact CD1-CG1 4.15Å; L88-I92 HydrophobicContact CG-CD1 3.8Å; L88-I92 HydrophobicContact CG-CG1 4.47Å; L88-I92 WeakPolarHBondContact O-CB 3.28Å; L88-I92 VanDerWaalsContact O-CG1 3.27Å; L88-I92 WeakPolarHBondContact O-CG1 3.4Å; L88-I92 PolarHBondContact O-N 3.34Å; S89-I92 PolarHBondContact O-N 2.72Å; V90-I92 VanDerWaalsContact C-N 3.34Å; V90-I92 PolarHBondContact O-N 3.43Å; I92-I94 PolarHBondContact O-N 3.18Å; I92-S95 PolarHBondContact O-N 3.19Å; I92-M96 HydrophobicContact CG2-CE 3.61Å; I92-M96 HydrophobicContact CG2-CG 4.2Å; I92-M96 HydrophobicContact CG2-SD 3.8Å; I92-M96 WeakPolarHBondContact O-CB 3.31Å; I92-M96 WeakPolarHBondContact O-CG 3.4Å; I92-M96 PolarHBondContact O-N 3.36Å
93	F	92.3	Very high	90.4	Very high	128 Å²	128	56.2 Å²	56.2	56%	0.561	27%	0.272	S	S	*	.	H	α-helix	trans	-58.6	-49.2	178.1	-83.6	-64.3	0	0	0	111.9	S89 V90 S95 M96 D97	S89-F93 WeakPolarHBondContact O-CD2 3.31Å; S89-F93 PolarHBondContact O-N 3.26Å; V90-F93 PolarHBondContact O-N 2.54Å; F93-S95 VanDerWaalsContact C-N 3.28Å; F93-S95 PolarHBondContact O-N 2.99Å; F93-M96 PolarHBondContact O-N 2.93Å; F93-D97 WeakPolarHBondContact O-CB 3.23Å; F93-D97 PolarHBondContact O-N 2.91Å
94	I	92.2	Very high	90.4	Very high	21 Å²	21	58.8 Å²	58.8	11%	0.108	29%	0.289	C	S	.	.	H	α-helix	trans	-56.5	-47.4	175.7	-69.2	171.7	0	0	0	110	V90 I92 M96 D97 Y98 A127 M131	V90-I94 HydrophobicContact CG1-CD1 3.76Å; V90-I94 HydrophobicContact CG1-CG1 4.46Å; V90-I94 WeakPolarHBondContact O-CG1 3.29Å; V90-I94 PolarHBondContact O-N 2.88Å; I92-I94 PolarHBondContact O-N 3.18Å; I94-M96 PolarHBondContact O-N 3.35Å; I94-D97 PolarHBondContact O-N 3.28Å; I94-Y98 HydrophobicContact CG2-CD2 3.79Å; I94-Y98 HydrophobicContact CG2-CE2 3.79Å; I94-Y98 WeakPolarHBondContact O-CD2 3.45Å; I94-Y98 PolarHBondContact O-N 3.41Å; I94-A127 HydrophobicContact CG1-CB 4.23Å; I94-A127 HydrophobicContact CG2-CB 3.76Å; I94-M131 HydrophobicContact CD1-CB 4.47Å
95	S	89.8	Confident	90.3	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.021	29%	0.293	C	S	.	.	H	α-helix	trans	-65.5	-38.9	-177.5	-61	0	0	0	0	113.4	G91 I92 F93 W99 I249 M252 H253	G91-S95 VanDerWaalsContact O-CB 3.31Å; G91-S95 WeakPolarHBondContact O-CB 3.23Å; G91-S95 PolarHBondContact O-N 3.47Å; G91-S95 PolarHBondContact O-OG 2.9Å; I92-S95 PolarHBondContact O-N 3.19Å; F93-S95 VanDerWaalsContact C-N 3.28Å; F93-S95 PolarHBondContact O-N 2.99Å; S95-W99 WeakPolarHBondContact O-CB 3.49Å; S95-W99 PolarHBondContact O-N 3.39Å; S95-I249 WeakPolarHBondContact OG-CG1 3.43Å; S95-M252 VanDerWaalsContact OG-CE 3.24Å; S95-M252 WeakPolarHBondContact OG-CE 3.41Å; S95-H253 PolarHBondContact O-CE1 3.12Å; S95-H253 PolarHBondContact O-NE2 3.34Å
96	M	91.4	Very high	90.2	Very high	112 Å²	112	56.2 Å²	56.2	55%	0.552	28%	0.279	S	S	*	.	H	α-helix	trans	-67.1	-38.6	176	-74.4	179.8	172	0	0	111.2	I92 F93 I94 W99 W100	I92-M96 HydrophobicContact CG2-CE 3.61Å; I92-M96 HydrophobicContact CG2-CG 4.2Å; I92-M96 HydrophobicContact CG2-SD 3.8Å; I92-M96 WeakPolarHBondContact O-CB 3.31Å; I92-M96 WeakPolarHBondContact O-CG 3.4Å; I92-M96 PolarHBondContact O-N 3.36Å; F93-M96 PolarHBondContact O-N 2.93Å; I94-M96 PolarHBondContact O-N 3.35Å; M96-W99 PolarHBondContact O-N 3.11Å; M96-W100 WeakPolarHBondContact O-CB 3.42Å; M96-W100 PolarHBondContact O-N 2.9Å
97	D	92.8	Very high	89.9	Confident	32 Å²	32	61 Å²	61	17%	0.171	30%	0.298	C	S	.	.	H	α-helix	trans	-63.9	-45.4	176.9	-165.6	17.4	0	0	0	111.4	F93 I94 W100 T101 R126	F93-D97 WeakPolarHBondContact O-CB 3.23Å; F93-D97 PolarHBondContact O-N 2.91Å; I94-D97 PolarHBondContact O-N 3.28Å; D97-W100 PolarHBondContact O-N 2.58Å; D97-T101 VanDerWaalsContact O-CB 3.3Å; D97-T101 WeakPolarHBondContact O-CB 3.32Å; D97-T101 PolarHBondContact O-N 3.35Å; D97-T101 PolarHBondContact O-OG1 3.43Å; D97-R126 IonicContact OD1-CZ 2.86Å; D97-R126 IonicContact OD1-NE 2.75Å; D97-R126 IonicContact OD1-NH2 3.81Å; D97-R126 PolarHBondContact OD1-NH2 2.84Å; D97-R126 IonicContact OD2-CZ 4Å; D97-R126 IonicContact OD2-NE 3.84Å; D97-R126 PolarHBondContact OD2-NE 2.83Å; D97-R126 IonicContact OD2-NH2 3.21Å; D97-R126 PolarHBondContact OD2-NH2 3.2Å
98	Y	89.9	Confident	89.4	Confident	44 Å²	44	64.7 Å²	64.7	17%	0.173	34%	0.337	C	S	.	.	H	α-helix	trans	-60.5	-46.9	171.4	-87.6	-76	0	0	0	112	I94 W100 T101 T102 H124 A127 Y160	I94-Y98 HydrophobicContact CG2-CD2 3.79Å; I94-Y98 HydrophobicContact CG2-CE2 3.79Å; I94-Y98 WeakPolarHBondContact O-CD2 3.45Å; I94-Y98 PolarHBondContact O-N 3.41Å; Y98-W100 VanDerWaalsContact C-N 3.31Å; Y98-W100 PolarHBondContact O-N 2.83Å; Y98-T101 PolarHBondContact O-N 3.22Å; Y98-T102 WeakPolarHBondContact O-CB 3.49Å; Y98-T102 PolarHBondContact O-N 2.92Å; Y98-T102 PolarHBondContact O-OG1 3.36Å; Y98-T102 VanDerWaalsContact O-OG1 3.06Å; Y98-H124 AromaticContact CE1-CE1 3.77Å; Y98-H124 AromaticContact CE1-ND1 3.55Å; Y98-H124 AromaticContact CZ-ND1 3.56Å; Y98-H124 PolarHBondContact OH-ND1 2.99Å; Y98-A127 HydrophobicContact CE2-CB 3.69Å; Y98-Y160 WeakPolarHBondContact OH-CE2 3.4Å; Y98-Y160 PolarHBondContact OH-OH 3.32Å
99	W	89.8	Confident	89.1	Confident	126 Å²	126	66.9 Å²	66.9	48%	0.477	35%	0.347	S	S	.	.	H	α-helix	trans	-60.3	-44.1	-178.8	-178.9	88	0	0	0	111.1	S95 M96 N103 V104	S95-W99 WeakPolarHBondContact O-CB 3.49Å; S95-W99 PolarHBondContact O-N 3.39Å; M96-W99 PolarHBondContact O-N 3.11Å; W99-N103 VanDerWaalsContact CD1-ND2 3.31Å; W99-N103 PolarHBondContact NE1-ND2 3.22Å; W99-N103 VanDerWaalsContact O-CB 3.24Å; W99-N103 WeakPolarHBondContact O-CB 3.27Å; W99-N103 PolarHBondContact O-N 3.44Å; W99-N103 PolarHBondContact O-ND2 2.6Å; W99-V104 HydrophobicContact CZ3-CG2 4.46Å
100	W	91.8	Very high	88.5	Confident	150 Å²	150	68.8 Å²	68.8	57%	0.568	35%	0.352	S	S	*	.	H	α-helix	trans	-64	-48	176.3	-176.3	-89.1	0	0	0	111.7	M96 D97 Y98 T102 V104 A105	M96-W100 WeakPolarHBondContact O-CB 3.42Å; M96-W100 PolarHBondContact O-N 2.9Å; D97-W100 PolarHBondContact O-N 2.58Å; Y98-W100 VanDerWaalsContact C-N 3.31Å; Y98-W100 PolarHBondContact O-N 2.83Å; W100-T102 PolarHBondContact O-N 3.34Å; W100-V104 HydrophobicContact CD2-CB 4.13Å; W100-V104 HydrophobicContact CD2-CG1 4.43Å; W100-V104 HydrophobicContact CD2-CG2 4.08Å; W100-V104 HydrophobicContact CE3-CB 4.48Å; W100-V104 HydrophobicContact CE3-CG2 3.96Å; W100-V104 HydrophobicContact CG-CB 4.43Å; W100-V104 HydrophobicContact CH2-CG1 4.27Å; W100-V104 HydrophobicContact CZ2-CG1 3.93Å; W100-V104 HydrophobicContact CZ3-CG2 4.28Å; W100-V104 WeakPolarHBondContact O-CA 3.31Å; W100-V104 WeakPolarHBondContact O-CB 3.48Å; W100-V104 PolarHBondContact O-N 3.02Å; W100-A105 PolarHBondContact O-N 2.96Å; W100-A105 VanDerWaalsContact O-N 3.09Å
101	T	89.5	Confident	87.8	Confident	3 Å²	3	74 Å²	74	2%	0.018	38%	0.375	C	S	.	.	I	π-helix	trans	-59.7	-50.3	-179.2	-58.9	0	0	0	0	110.5	D97 Y98 A105 L106 I120 C123	D97-T101 VanDerWaalsContact O-CB 3.3Å; D97-T101 WeakPolarHBondContact O-CB 3.32Å; D97-T101 PolarHBondContact O-N 3.35Å; D97-T101 PolarHBondContact O-OG1 3.43Å; Y98-T101 PolarHBondContact O-N 3.22Å; T101-A105 PolarHBondContact O-N 3.5Å; T101-L106 HydrophobicContact CG2-CD1 3.76Å; T101-L106 HydrophobicContact CG2-CG 4.05Å; T101-L106 VanDerWaalsContact O-CB 3.3Å; T101-L106 WeakPolarHBondContact O-CB 3.44Å; T101-L106 VanDerWaalsContact O-CG 3.3Å; T101-L106 WeakPolarHBondContact O-CG 3.21Å; T101-L106 PolarHBondContact O-N 2.76Å; T101-I120 HydrophobicContact CG2-CD1 4.28Å; T101-C123 HydrophobicContact CG2-CB 3.92Å
102	T	84.9	Confident	87	Confident	67 Å²	67	77.5 Å²	77.5	41%	0.411	40%	0.398	S	S	.	.	I	π-helix	trans	-73.5	-40	-176.8	-50.4	0	0	0	0	113.5	Y98 W100	Y98-T102 WeakPolarHBondContact O-CB 3.49Å; Y98-T102 PolarHBondContact O-N 2.92Å; Y98-T102 PolarHBondContact O-OG1 3.36Å; Y98-T102 VanDerWaalsContact O-OG1 3.06Å; W100-T102 PolarHBondContact O-N 3.34Å
103	N	86	Confident	86.5	Confident	76 Å²	76	76.2 Å²	76.2	41%	0.406	39%	0.394	S	S	.	.	I	π-helix	trans	-94.6	-17.3	-173.3	-64.3	-86.1	0	0	0	114.3	W99 R107	W99-N103 VanDerWaalsContact CD1-ND2 3.31Å; W99-N103 PolarHBondContact NE1-ND2 3.22Å; W99-N103 VanDerWaalsContact O-CB 3.24Å; W99-N103 WeakPolarHBondContact O-CB 3.27Å; W99-N103 PolarHBondContact O-N 3.44Å; W99-N103 PolarHBondContact O-ND2 2.6Å; N103-R107 WeakPolarHBondContact O-CD 3.2Å
104	V	89.2	Confident	85.9	Confident	66 Å²	66	75.2 Å²	75.2	40%	0.4	40%	0.4	S	S	.	.	I	π-helix	trans	-118.7	-61	-177.3	-173.3	0	0	0	0	110.8	W99 W100	W99-V104 HydrophobicContact CZ3-CG2 4.46Å; W100-V104 HydrophobicContact CD2-CB 4.13Å; W100-V104 HydrophobicContact CD2-CG1 4.43Å; W100-V104 HydrophobicContact CD2-CG2 4.08Å; W100-V104 HydrophobicContact CE3-CB 4.48Å; W100-V104 HydrophobicContact CE3-CG2 3.96Å; W100-V104 HydrophobicContact CG-CB 4.43Å; W100-V104 HydrophobicContact CH2-CG1 4.27Å; W100-V104 HydrophobicContact CZ2-CG1 3.93Å; W100-V104 HydrophobicContact CZ3-CG2 4.28Å; W100-V104 WeakPolarHBondContact O-CA 3.31Å; W100-V104 WeakPolarHBondContact O-CB 3.48Å; W100-V104 PolarHBondContact O-N 3.02Å
105	A	87.3	Confident	85.4	Confident	36 Å²	36	78 Å²	78	30%	0.298	42%	0.421	S	S	.	.	I	π-helix	trans	-68.9	-43	-172.3	0	0	0	0	0	112.7	W100 T101 M109	W100-A105 PolarHBondContact O-N 2.96Å; W100-A105 VanDerWaalsContact O-N 3.09Å; T101-A105 PolarHBondContact O-N 3.5Å; A105-M109 WeakPolarHBondContact O-CE 3.43Å
106	L	87.3	Confident	85.2	Confident	6 Å²	6	79.7 Å²	79.7	3%	0.031	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	4.7	-176.8	-64.3	178	0	0	0	113.5	T101 G108 M109 Y116 E119 I120	T101-L106 HydrophobicContact CG2-CD1 3.76Å; T101-L106 HydrophobicContact CG2-CG 4.05Å; T101-L106 VanDerWaalsContact O-CB 3.3Å; T101-L106 WeakPolarHBondContact O-CB 3.44Å; T101-L106 VanDerWaalsContact O-CG 3.3Å; T101-L106 WeakPolarHBondContact O-CG 3.21Å; T101-L106 PolarHBondContact O-N 2.76Å; L106-G108 PolarHBondContact O-N 2.85Å; L106-G108 VanDerWaalsContact O-N 3.13Å; L106-M109 HydrophobicContact CD2-SD 3.95Å; L106-M109 WeakPolarHBondContact O-CB 3.05Å; L106-M109 PolarHBondContact O-N 3.4Å; L106-M109 VanDerWaalsContact O-N 3.09Å; L106-Y116 HydrophobicContact CB-CD2 3.93Å; L106-Y116 HydrophobicContact CB-CE2 3.77Å; L106-Y116 HydrophobicContact CD1-CD2 3.98Å; L106-Y116 HydrophobicContact CD1-CE1 4.5Å; L106-Y116 HydrophobicContact CD1-CE2 3.63Å; L106-Y116 HydrophobicContact CD2-CD2 3.59Å; L106-Y116 HydrophobicContact CD2-CE2 4.12Å; L106-Y116 HydrophobicContact CD2-CG 4Å; L106-Y116 HydrophobicContact CG-CD2 4.04Å; L106-Y116 HydrophobicContact CG-CE2 4.04Å; L106-E119 HydrophobicContact CD2-CB 3.64Å; L106-E119 HydrophobicContact CD2-CG 4.34Å; L106-E119 HydrophobicContact CG-CB 4.49Å; L106-I120 HydrophobicContact CD1-CB 4.11Å; L106-I120 HydrophobicContact CD1-CD1 4.01Å
107	R	86.8	Confident	84.6	Confident	205 Å²	205	77.9 Å²	77.9	77%	0.774	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	118.3	-171.5	-172.2	177.2	179.5	172.4	0	111.2	N103 M109	N103-R107 WeakPolarHBondContact O-CD 3.2Å; R107-M109 VanDerWaalsContact C-N 3.25Å; R107-M109 PolarHBondContact O-N 3Å
108	G	81.8	Confident	84.3	Confident	86 Å²	86	80 Å²	80	89%	0.887	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	9	178.7	0	0	0	0	0	114.3	L106	L106-G108 PolarHBondContact O-N 2.85Å; L106-G108 VanDerWaalsContact O-N 3.13Å
109	M	83.1	Confident	84.2	Confident	86 Å²	86	82 Å²	82	42%	0.424	45%	0.448	S	S	.	.			trans	-81.5	147.5	169.1	-65.9	-171.7	-174.7	0	0	110.4	A105 L106 R107 E111 Y116	A105-M109 WeakPolarHBondContact O-CE 3.43Å; L106-M109 HydrophobicContact CD2-SD 3.95Å; L106-M109 WeakPolarHBondContact O-CB 3.05Å; L106-M109 PolarHBondContact O-N 3.4Å; L106-M109 VanDerWaalsContact O-N 3.09Å; R107-M109 VanDerWaalsContact C-N 3.25Å; R107-M109 PolarHBondContact O-N 3Å; M109-E111 PolarHBondContact O-N 2.87Å; M109-Y116 HydrophobicContact CB-CD2 4.06Å
110	D	80.8	Confident	84	Confident	101 Å²	101	77.2 Å²	77.2	54%	0.54	43%	0.431	S	S	.	.			trans	-69.8	124.9	169.6	178.9	-5	0	0	0	109.3	S112 S113 Y116	D110-S112 PolarHBondContact O-N 2.87Å; D110-S112 VanDerWaalsContact O-N 3.16Å; D110-S112 PolarHBondContact OD1-N 3.39Å; D110-S112 PolarHBondContact OD1-OG 3.23Å; D110-S112 PolarHBondContact OD2-OG 3.02Å; D110-S113 VanDerWaalsContact O-CB 3.27Å; D110-S113 WeakPolarHBondContact O-CB 3.46Å; D110-S113 PolarHBondContact O-N 2.98Å; D110-S113 PolarHBondContact O-OG 3.31Å; D110-Y116 VanDerWaalsContact O-CB 3.23Å; D110-Y116 WeakPolarHBondContact O-CB 3.41Å
111	E	76.7	Confident	83.7	Confident	139 Å²	139	72 Å²	72	65%	0.65	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-25	-179.7	-62.2	-174.3	-177.3	0	0	112.7	M109 Y116	M109-E111 PolarHBondContact O-N 2.87Å; E111-Y116 HydrophobicContact CB-CD1 4.33Å; E111-Y116 HydrophobicContact CB-CE1 4.05Å; E111-Y116 HydrophobicContact CB-CE2 4.42Å; E111-Y116 HydrophobicContact CG-CE1 4.26Å; E111-Y116 HydrophobicContact CG-CE2 3.95Å; E111-Y116 WeakPolarHBondContact O-CD1 3.41Å
112	S	73.8	Confident	83.8	Confident	86 Å²	86	73.7 Å²	73.7	60%	0.601	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-7.1	177.2	71.6	0	0	0	0	113.8	D110	D110-S112 PolarHBondContact O-N 2.87Å; D110-S112 VanDerWaalsContact O-N 3.16Å; D110-S112 PolarHBondContact OD1-N 3.39Å; D110-S112 PolarHBondContact OD1-OG 3.23Å; D110-S112 PolarHBondContact OD2-OG 3.02Å
113	S	80	Confident	84.1	Confident	28 Å²	28	70.5 Å²	70.5	20%	0.196	41%	0.412	C	S	.	.	S	Bend	trans	-71.2	142.7	-177.9	70.6	0	0	0	0	112	D110 S115 Y116 L117	D110-S113 VanDerWaalsContact O-CB 3.27Å; D110-S113 WeakPolarHBondContact O-CB 3.46Å; D110-S113 PolarHBondContact O-N 2.98Å; D110-S113 PolarHBondContact O-OG 3.31Å; S113-S115 PolarHBondContact O-N 2.9Å; S113-Y116 WeakPolarHBondContact O-CB 3.08Å; S113-Y116 PolarHBondContact O-N 2.98Å; S113-Y116 VanDerWaalsContact O-N 3.12Å; S113-Y116 VanDerWaalsContact OG-CB 3.27Å; S113-Y116 WeakPolarHBondContact OG-CB 3.4Å; S113-Y116 PolarHBondContact OG-N 3.28Å; S113-L117 PolarHBondContact O-N 3.16Å; S113-L117 VanDerWaalsContact O-N 3.12Å
114	P	79.7	Confident	84.3	Confident	107 Å²	107	68.5 Å²	68.5	70%	0.695	40%	0.4	S	S	*	.	H	α-helix	trans	-56.2	-34.9	177.1	-27.2	34.7	0	0	0	113.7	S118	P114-S118 WeakPolarHBondContact O-CB 3.28Å; P114-S118 PolarHBondContact O-N 3.11Å
115	S	81.9	Confident	84.5	Confident	78 Å²	78	68.6 Å²	68.6	55%	0.545	40%	0.396	S	S	.	.	H	α-helix	trans	-67.1	-42.5	177.6	-55.3	0	0	0	0	112.1	S113 S118 E119	S113-S115 PolarHBondContact O-N 2.9Å; S115-S118 PolarHBondContact O-N 3.14Å; S115-E119 WeakPolarHBondContact O-CG 3.28Å; S115-E119 PolarHBondContact O-N 3.4Å; S115-E119 VanDerWaalsContact O-N 3.07Å
116	Y	85.1	Confident	84.9	Confident	39 Å²	39	71.1 Å²	71.1	15%	0.153	40%	0.398	C	S	.	.	H	α-helix	trans	-59.7	-49.4	175.1	179.3	-81.5	0	0	0	111	L106 M109 D110 E111 S113 S118 E119 I120	L106-Y116 HydrophobicContact CB-CD2 3.93Å; L106-Y116 HydrophobicContact CB-CE2 3.77Å; L106-Y116 HydrophobicContact CD1-CD2 3.98Å; L106-Y116 HydrophobicContact CD1-CE1 4.5Å; L106-Y116 HydrophobicContact CD1-CE2 3.63Å; L106-Y116 HydrophobicContact CD2-CD2 3.59Å; L106-Y116 HydrophobicContact CD2-CE2 4.12Å; L106-Y116 HydrophobicContact CD2-CG 4Å; L106-Y116 HydrophobicContact CG-CD2 4.04Å; L106-Y116 HydrophobicContact CG-CE2 4.04Å; M109-Y116 HydrophobicContact CB-CD2 4.06Å; D110-Y116 VanDerWaalsContact O-CB 3.23Å; D110-Y116 WeakPolarHBondContact O-CB 3.41Å; E111-Y116 HydrophobicContact CB-CD1 4.33Å; E111-Y116 HydrophobicContact CB-CE1 4.05Å; E111-Y116 HydrophobicContact CB-CE2 4.42Å; E111-Y116 HydrophobicContact CG-CE1 4.26Å; E111-Y116 HydrophobicContact CG-CE2 3.95Å; E111-Y116 WeakPolarHBondContact O-CD1 3.41Å; S113-Y116 WeakPolarHBondContact O-CB 3.08Å; S113-Y116 PolarHBondContact O-N 2.98Å; S113-Y116 VanDerWaalsContact O-N 3.12Å; S113-Y116 VanDerWaalsContact OG-CB 3.27Å; S113-Y116 WeakPolarHBondContact OG-CB 3.4Å; S113-Y116 PolarHBondContact OG-N 3.28Å; Y116-S118 VanDerWaalsContact C-N 3.29Å; Y116-S118 PolarHBondContact O-N 3.06Å; Y116-E119 PolarHBondContact O-N 3.32Å; Y116-I120 HydrophobicContact CD1-CG2 4.45Å; Y116-I120 HydrophobicContact CE1-CG2 4.35Å; Y116-I120 WeakPolarHBondContact O-CG2 3.41Å; Y116-I120 PolarHBondContact O-N 3.47Å
117	L	79.6	Confident	85.1	Confident	74 Å²	74	70.8 Å²	70.8	39%	0.387	40%	0.397	S	S	.	.	H	α-helix	trans	-61.6	-37	180	-66	175.3	0	0	0	112.3	S113 I120 S121	S113-L117 PolarHBondContact O-N 3.16Å; S113-L117 VanDerWaalsContact O-N 3.12Å; L117-I120 WeakPolarHBondContact O-CG2 3.49Å; L117-S121 WeakPolarHBondContact O-CB 3.34Å; L117-S121 PolarHBondContact O-N 3.34Å
118	S	84.9	Confident	85.4	Confident	76 Å²	76	61 Å²	61	53%	0.531	36%	0.36	S	S	.	.	H	α-helix	trans	-66.7	-46	176.7	-176.1	0	0	0	0	112.3	P114 S115 Y116 S121 A122	P114-S118 WeakPolarHBondContact O-CB 3.28Å; P114-S118 PolarHBondContact O-N 3.11Å; S115-S118 PolarHBondContact O-N 3.14Å; Y116-S118 VanDerWaalsContact C-N 3.29Å; Y116-S118 PolarHBondContact O-N 3.06Å; S118-S121 PolarHBondContact O-N 3.37Å; S118-A122 WeakPolarHBondContact O-CB 3.39Å; S118-A122 PolarHBondContact O-N 3.05Å
119	E	87.8	Confident	86	Confident	87 Å²	87	60.5 Å²	60.5	41%	0.407	34%	0.337	S	S	.	.	H	α-helix	trans	-68	-41.9	-178.4	-74.2	-61.8	149.1	0	0	112.1	L106 S115 Y116 A122 C123	L106-E119 HydrophobicContact CD2-CB 3.64Å; L106-E119 HydrophobicContact CD2-CG 4.34Å; L106-E119 HydrophobicContact CG-CB 4.49Å; S115-E119 WeakPolarHBondContact O-CG 3.28Å; S115-E119 PolarHBondContact O-N 3.4Å; S115-E119 VanDerWaalsContact O-N 3.07Å; Y116-E119 PolarHBondContact O-N 3.32Å; E119-A122 PolarHBondContact O-N 2.97Å; E119-C123 PolarHBondContact O-N 2.95Å
120	I	86.1	Confident	86.5	Confident	25 Å²	25	61.1 Å²	61.1	13%	0.128	34%	0.335	C	S	.	.	H	α-helix	trans	-68	-39.2	176.6	-162.9	66.5	0	0	0	111.7	T101 L106 Y116 L117 A122 C123 H124	T101-I120 HydrophobicContact CG2-CD1 4.28Å; L106-I120 HydrophobicContact CD1-CB 4.11Å; L106-I120 HydrophobicContact CD1-CD1 4.01Å; Y116-I120 HydrophobicContact CD1-CG2 4.45Å; Y116-I120 HydrophobicContact CE1-CG2 4.35Å; Y116-I120 WeakPolarHBondContact O-CG2 3.41Å; Y116-I120 PolarHBondContact O-N 3.47Å; L117-I120 WeakPolarHBondContact O-CG2 3.49Å; I120-A122 VanDerWaalsContact C-N 3.34Å; I120-A122 PolarHBondContact O-N 3.38Å; I120-C123 WeakPolarHBondContact O-CB 3.33Å; I120-C123 PolarHBondContact O-N 2.73Å; I120-C123 VanDerWaalsContact O-N 3.16Å; I120-H124 PolarHBondContact O-CD2 2.92Å; I120-H124 PolarHBondContact O-N 3.21Å
121	S	86.4	Confident	87	Confident	42 Å²	42	59.2 Å²	59.2	29%	0.294	32%	0.324	S	S	.	.	H	α-helix	trans	-60.1	-43.2	173.7	174	0	0	0	0	111.3	L117 S118 C123 H124 Q125 E159	L117-S121 WeakPolarHBondContact O-CB 3.34Å; L117-S121 PolarHBondContact O-N 3.34Å; S118-S121 PolarHBondContact O-N 3.37Å; S121-C123 VanDerWaalsContact C-N 3.32Å; S121-C123 PolarHBondContact O-N 2.86Å; S121-H124 WeakPolarHBondContact O-CB 3.41Å; S121-H124 PolarHBondContact O-N 2.77Å; S121-Q125 PolarHBondContact O-N 3.38Å; S121-E159 WeakPolarHBondContact CB-OE1 3.34Å; S121-E159 PolarHBondContact OG-OE1 2.9Å
122	A	90.2	Very high	87.6	Confident	37 Å²	37	53.4 Å²	53.4	31%	0.306	30%	0.298	S	S	.	.	H	α-helix	trans	-62.3	-38.3	175	0	0	0	0	0	112.4	S118 E119 I120 Q125 R126	S118-A122 WeakPolarHBondContact O-CB 3.39Å; S118-A122 PolarHBondContact O-N 3.05Å; E119-A122 PolarHBondContact O-N 2.97Å; I120-A122 VanDerWaalsContact C-N 3.34Å; I120-A122 PolarHBondContact O-N 3.38Å; A122-Q125 PolarHBondContact O-N 2.83Å; A122-R126 WeakPolarHBondContact O-CG 3.48Å; A122-R126 PolarHBondContact O-N 3.28Å; A122-R126 VanDerWaalsContact O-N 3.11Å; A122-R126 PolarHBondContact O-NH1 3.46Å
123	C	92.1	Very high	88.4	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-64.2	-44.5	172.9	-174.5	0	0	0	0	112	T101 E119 I120 S121 Q125 R126 A127	T101-C123 HydrophobicContact CG2-CB 3.92Å; E119-C123 PolarHBondContact O-N 2.95Å; I120-C123 WeakPolarHBondContact O-CB 3.33Å; I120-C123 PolarHBondContact O-N 2.73Å; I120-C123 VanDerWaalsContact O-N 3.16Å; S121-C123 VanDerWaalsContact C-N 3.32Å; S121-C123 PolarHBondContact O-N 2.86Å; C123-Q125 VanDerWaalsContact C-N 3.32Å; C123-Q125 PolarHBondContact O-N 3.27Å; C123-R126 PolarHBondContact O-N 2.82Å; C123-A127 WeakPolarHBondContact O-CB 3.3Å; C123-A127 PolarHBondContact O-N 2.64Å
124	H	90.2	Very high	88.9	Confident	35 Å²	35	51.9 Å²	51.9	16%	0.162	28%	0.281	C	S	.	.	H	α-helix	trans	-57.8	-44.1	175.1	-66.5	-33.3	0	0	0	111.7	Y98 I120 S121 A127 A128 P157 E159 Y160	Y98-H124 AromaticContact CE1-CE1 3.77Å; Y98-H124 AromaticContact CE1-ND1 3.55Å; Y98-H124 AromaticContact CZ-ND1 3.56Å; Y98-H124 PolarHBondContact OH-ND1 2.99Å; I120-H124 PolarHBondContact O-CD2 2.92Å; I120-H124 PolarHBondContact O-N 3.21Å; S121-H124 WeakPolarHBondContact O-CB 3.41Å; S121-H124 PolarHBondContact O-N 2.77Å; H124-A127 PolarHBondContact O-N 2.9Å; H124-A128 WeakPolarHBondContact O-CB 3.24Å; H124-A128 PolarHBondContact O-N 3.21Å; H124-P157 HydrophobicContact CB-CB 4.21Å; H124-E159 HydrophobicContact CB-CB 3.98Å; H124-E159 HydrophobicContact CB-CG 4.04Å; H124-E159 IonicContact CD2-OE2 3.96Å; H124-Y160 HydrophobicContact CB-CD2 4.39Å; H124-Y160 HydrophobicContact CB-CE2 4.12Å
125	Q	93.3	Very high	89.4	Confident	68 Å²	68	47.1 Å²	47.1	32%	0.318	25%	0.25	S	S	.	.	H	α-helix	trans	-61.5	-51.6	178.6	-172.8	61.8	56	0	0	112.2	S121 A122 C123 A127 A128 D129 E159 T163	S121-Q125 PolarHBondContact O-N 3.38Å; A122-Q125 PolarHBondContact O-N 2.83Å; C123-Q125 VanDerWaalsContact C-N 3.32Å; C123-Q125 PolarHBondContact O-N 3.27Å; Q125-A127 VanDerWaalsContact C-N 3.28Å; Q125-A127 PolarHBondContact O-N 2.98Å; Q125-A128 WeakPolarHBondContact O-CB 3.21Å; Q125-A128 PolarHBondContact O-N 3.28Å; Q125-A128 VanDerWaalsContact O-N 3.17Å; Q125-D129 PolarHBondContact NE2-OD1 3.47Å; Q125-D129 PolarHBondContact O-N 3.23Å; Q125-E159 HydrophobicContact CB-CB 4.2Å; Q125-E159 HydrophobicContact CB-CG 4.05Å; Q125-T163 PolarHBondContact NE2-OG1 3.2Å
126	R	95.4	Very high	89.6	Confident	88 Å²	88	46.1 Å²	46.1	33%	0.332	24%	0.241	S	C	.	.	H	α-helix	trans	-57.9	-43.5	178	-69.1	-171.9	-56.4	-92.3	9.2	111.6	D97 A122 C123 D129 Y130	D97-R126 IonicContact OD1-CZ 2.86Å; D97-R126 IonicContact OD1-NE 2.75Å; D97-R126 IonicContact OD1-NH2 3.81Å; D97-R126 PolarHBondContact OD1-NH2 2.84Å; D97-R126 IonicContact OD2-CZ 4Å; D97-R126 IonicContact OD2-NE 3.84Å; D97-R126 PolarHBondContact OD2-NE 2.83Å; D97-R126 IonicContact OD2-NH2 3.21Å; D97-R126 PolarHBondContact OD2-NH2 3.2Å; A122-R126 WeakPolarHBondContact O-CG 3.48Å; A122-R126 PolarHBondContact O-N 3.28Å; A122-R126 VanDerWaalsContact O-N 3.11Å; A122-R126 PolarHBondContact O-NH1 3.46Å; C123-R126 PolarHBondContact O-N 2.82Å; R126-D129 PolarHBondContact O-N 3.07Å; R126-Y130 WeakPolarHBondContact O-CD2 3.32Å; R126-Y130 PolarHBondContact O-N 3.1Å
127	A	92.7	Very high	89.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66.6	-37.2	179.7	0	0	0	0	0	112.8	I94 Y98 C123 H124 Q125 M131 Y160	I94-A127 HydrophobicContact CG1-CB 4.23Å; I94-A127 HydrophobicContact CG2-CB 3.76Å; Y98-A127 HydrophobicContact CE2-CB 3.69Å; C123-A127 WeakPolarHBondContact O-CB 3.3Å; C123-A127 PolarHBondContact O-N 2.64Å; H124-A127 PolarHBondContact O-N 2.9Å; Q125-A127 VanDerWaalsContact C-N 3.28Å; Q125-A127 PolarHBondContact O-N 2.98Å; A127-M131 WeakPolarHBondContact O-CB 3.49Å; A127-M131 PolarHBondContact O-N 3.03Å; A127-Y160 WeakPolarHBondContact CB-OH 3.4Å
128	A	92	Very high	89.9	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.2	-42.2	173.6	0	0	0	0	0	111.9	H124 Q125 M131 V132 Y160 T163	H124-A128 WeakPolarHBondContact O-CB 3.24Å; H124-A128 PolarHBondContact O-N 3.21Å; Q125-A128 WeakPolarHBondContact O-CB 3.21Å; Q125-A128 PolarHBondContact O-N 3.28Å; Q125-A128 VanDerWaalsContact O-N 3.17Å; A128-M131 WeakPolarHBondContact O-CB 3.47Å; A128-M131 PolarHBondContact O-N 3.44Å; A128-V132 PolarHBondContact O-N 3.45Å; A128-Y160 HydrophobicContact CB-CD1 3.68Å; A128-Y160 HydrophobicContact CB-CD2 4.41Å; A128-Y160 HydrophobicContact CB-CE1 4.02Å; A128-Y160 HydrophobicContact CB-CG 3.91Å; A128-T163 HydrophobicContact CB-CG2 4.1Å
129	D	93.7	Very high	89.7	Confident	75 Å²	75	45.4 Å²	45.4	40%	0.401	22%	0.224	S	C	.	.	H	α-helix	trans	-63.1	-46.8	178.8	-62.7	-22.5	0	0	0	111.1	Q125 R126 M131 V132 E133 T163	Q125-D129 PolarHBondContact NE2-OD1 3.47Å; Q125-D129 PolarHBondContact O-N 3.23Å; R126-D129 PolarHBondContact O-N 3.07Å; D129-M131 VanDerWaalsContact C-N 3.29Å; D129-M131 PolarHBondContact O-N 3.4Å; D129-V132 PolarHBondContact O-N 3.26Å; D129-E133 WeakPolarHBondContact O-CB 3.48Å; D129-E133 PolarHBondContact O-N 3.49Å; D129-T163 WeakPolarHBondContact OD1-CG2 3.42Å; D129-T163 PolarHBondContact OD1-OG1 3.25Å
130	Y	93.3	Very high	89.3	Confident	98 Å²	98	41.3 Å²	41.3	38%	0.384	21%	0.205	S	C	.	.	H	α-helix	trans	-62.1	-35.8	174.8	-77.2	-57.3	0	0	0	112.8	R126 G134	R126-Y130 WeakPolarHBondContact O-CD2 3.32Å; R126-Y130 PolarHBondContact O-N 3.1Å; Y130-G134 PolarHBondContact O-N 2.94Å
131	M	91.5	Very high	89	Confident	62 Å²	62	40.1 Å²	40.1	31%	0.305	20%	0.199	S	C	.	.	H	α-helix	trans	-65.5	-44.6	176.9	-173.9	176.3	-70.1	0	0	111.3	I94 A127 A128 D129 G134 A135 L149 Y160 L164	I94-M131 HydrophobicContact CD1-CB 4.47Å; A127-M131 WeakPolarHBondContact O-CB 3.49Å; A127-M131 PolarHBondContact O-N 3.03Å; A128-M131 WeakPolarHBondContact O-CB 3.47Å; A128-M131 PolarHBondContact O-N 3.44Å; D129-M131 VanDerWaalsContact C-N 3.29Å; D129-M131 PolarHBondContact O-N 3.4Å; M131-G134 PolarHBondContact O-N 3.11Å; M131-A135 WeakPolarHBondContact O-CB 3.36Å; M131-A135 PolarHBondContact O-N 3.26Å; M131-L149 HydrophobicContact SD-CD1 4.16Å; M131-Y160 HydrophobicContact CE-CD1 4.45Å; M131-Y160 HydrophobicContact CE-CE1 3.82Å; M131-Y160 HydrophobicContact SD-CD1 4.27Å; M131-Y160 HydrophobicContact SD-CE1 4.18Å; M131-L164 HydrophobicContact CG-CD2 4.26Å; M131-L164 HydrophobicContact SD-CD1 4.46Å; M131-L164 HydrophobicContact SD-CD2 4.08Å
132	V	90.9	Very high	89	Confident	17 Å²	17	39 Å²	39	10%	0.103	19%	0.188	C	C	.	.	H	α-helix	trans	-64.8	-46.4	175.3	167.2	0	0	0	0	111.2	A128 D129 G134 A135 V136 T163 L164 L167	A128-V132 PolarHBondContact O-N 3.45Å; D129-V132 PolarHBondContact O-N 3.26Å; V132-G134 VanDerWaalsContact C-N 3.3Å; V132-G134 PolarHBondContact O-N 2.88Å; V132-A135 PolarHBondContact O-N 3Å; V132-A135 VanDerWaalsContact O-N 3.13Å; V132-V136 HydrophobicContact CG1-CG2 4.11Å; V132-V136 WeakPolarHBondContact O-CB 3.31Å; V132-V136 VanDerWaalsContact O-CG2 3.3Å; V132-V136 WeakPolarHBondContact O-CG2 3.42Å; V132-V136 PolarHBondContact O-N 3.47Å; V132-T163 HydrophobicContact CB-CG2 4.26Å; V132-T163 HydrophobicContact CG2-CG2 3.76Å; V132-L164 HydrophobicContact CG2-CD2 3.78Å; V132-L164 HydrophobicContact CG2-CG 4.34Å; V132-L167 HydrophobicContact CG1-CD2 4.12Å; V132-L167 HydrophobicContact CG2-CD1 4.26Å; V132-L167 HydrophobicContact CG2-CG 4.21Å
133	E	90.6	Very high	88.7	Confident	72 Å²	72	37.4 Å²	37.4	34%	0.336	18%	0.175	S	C	.	.	H	α-helix	trans	-56.7	-45.8	176.8	-175	-173.8	175.7	0	0	111.4	D129 R137	D129-E133 WeakPolarHBondContact O-CB 3.48Å; D129-E133 PolarHBondContact O-N 3.49Å; E133-R137 VanDerWaalsContact O-CB 3.28Å; E133-R137 WeakPolarHBondContact O-CB 3.15Å; E133-R137 VanDerWaalsContact O-CG 3.28Å; E133-R137 WeakPolarHBondContact O-CG 3.43Å; E133-R137 PolarHBondContact O-N 2.92Å; E133-R137 IonicContact OE1-CZ 3.24Å; E133-R137 IonicContact OE1-NE 3.64Å; E133-R137 IonicContact OE1-NH1 2.69Å; E133-R137 PolarHBondContact OE1-NH1 3.09Å; E133-R137 IonicContact OE1-NH2 3.45Å; E133-R137 PolarHBondContact OE1-NH2 3.18Å
134	G	90.6	Very high	88.1	Confident	10 Å²	10	38.4 Å²	38.4	10%	0.103	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-44.1	175.3	0	0	0	0	0	112.7	Y130 M131 V132 N138	Y130-G134 PolarHBondContact O-N 2.94Å; M131-G134 PolarHBondContact O-N 3.11Å; V132-G134 VanDerWaalsContact C-N 3.3Å; V132-G134 PolarHBondContact O-N 2.88Å; G134-N138 WeakPolarHBondContact O-CB 3.33Å; G134-N138 PolarHBondContact O-N 2.91Å; G134-N138 PolarHBondContact O-ND2 3.15Å
135	A	89.2	Confident	87.8	Confident	7 Å²	7	37.3 Å²	37.3	6%	0.058	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-46	-180	0	0	0	0	0	112.4	M131 V132 N138 G139 L167	M131-A135 WeakPolarHBondContact O-CB 3.36Å; M131-A135 PolarHBondContact O-N 3.26Å; V132-A135 PolarHBondContact O-N 3Å; V132-A135 VanDerWaalsContact O-N 3.13Å; A135-N138 PolarHBondContact O-N 2.85Å; A135-G139 WeakPolarHBondContact O-CA 3.46Å; A135-G139 PolarHBondContact O-N 3.12Å; A135-L167 HydrophobicContact CB-CD1 4.05Å; A135-L167 HydrophobicContact CB-CD2 4.2Å
136	V	86.3	Confident	87.4	Confident	57 Å²	57	34.3 Å²	34.3	35%	0.345	16%	0.162	S	C	.	.	H	α-helix	trans	-63	-44.9	177.1	173.8	0	0	0	0	110.7	V132 N138 G139 L167	V132-V136 HydrophobicContact CG1-CG2 4.11Å; V132-V136 WeakPolarHBondContact O-CB 3.31Å; V132-V136 VanDerWaalsContact O-CG2 3.3Å; V132-V136 WeakPolarHBondContact O-CG2 3.42Å; V132-V136 PolarHBondContact O-N 3.47Å; V136-N138 VanDerWaalsContact C-N 3.32Å; V136-N138 PolarHBondContact O-N 3.13Å; V136-G139 PolarHBondContact O-N 3.1Å; V136-L167 HydrophobicContact CG2-CD2 3.7Å
137	R	86.2	Confident	86.6	Confident	155 Å²	155	31.3 Å²	31.3	59%	0.585	15%	0.151	S	C	*	.	H	α-helix	trans	-64.6	-32.8	178.9	-79.8	-177.1	172.1	161	8.8	113.8	R86 E133	R86-R137 PolarHBondContact NH1-O 3.48Å; E133-R137 VanDerWaalsContact O-CB 3.28Å; E133-R137 WeakPolarHBondContact O-CB 3.15Å; E133-R137 VanDerWaalsContact O-CG 3.28Å; E133-R137 WeakPolarHBondContact O-CG 3.43Å; E133-R137 PolarHBondContact O-N 2.92Å; E133-R137 IonicContact OE1-CZ 3.24Å; E133-R137 IonicContact OE1-NE 3.64Å; E133-R137 IonicContact OE1-NH1 2.69Å; E133-R137 PolarHBondContact OE1-NH1 3.09Å; E133-R137 IonicContact OE1-NH2 3.45Å; E133-R137 PolarHBondContact OE1-NH2 3.18Å
138	N	85.1	Confident	85.8	Confident	11 Å²	11	31.7 Å²	31.7	6%	0.059	16%	0.155	C	C	.	.	H	α-helix	trans	-86.3	-25.2	177.1	-73.6	-23.1	0	0	0	112.4	R83 R86 S87 G134 A135 V136 Y142 R234	R83-N138 HydrophobicContact CG-CB 4.48Å; R86-N138 PolarHBondContact NE-OD1 2.87Å; R86-N138 PolarHBondContact NH2-OD1 3.16Å; S87-N138 PolarHBondContact OG-ND2 3.24Å; G134-N138 WeakPolarHBondContact O-CB 3.33Å; G134-N138 PolarHBondContact O-N 2.91Å; G134-N138 PolarHBondContact O-ND2 3.15Å; A135-N138 PolarHBondContact O-N 2.85Å; V136-N138 VanDerWaalsContact C-N 3.32Å; V136-N138 PolarHBondContact O-N 3.13Å; N138-Y142 HydrophobicContact CB-CD1 4.21Å; N138-Y142 HydrophobicContact CB-CD2 3.44Å; N138-Y142 VanDerWaalsContact CB-CD2 3.44Å; N138-Y142 HydrophobicContact CB-CE2 3.85Å; N138-Y142 HydrophobicContact CB-CG 3.64Å; N138-Y142 WeakPolarHBondContact ND2-CE1 3.4Å; N138-R234 PolarHBondContact O-NH2 3.17Å
139	G	80.1	Confident	85.1	Confident	7 Å²	7	33.3 Å²	33.3	7%	0.072	16%	0.164	C	C	.	.			trans	62	-173.5	178.7	0	0	0	0	0	113.9	A135 V136 L141 Y142 R234	A135-G139 WeakPolarHBondContact O-CA 3.46Å; A135-G139 PolarHBondContact O-N 3.12Å; V136-G139 PolarHBondContact O-N 3.1Å; G139-L141 PolarHBondContact O-N 2.79Å; G139-L141 VanDerWaalsContact O-N 3.14Å; G139-Y142 PolarHBondContact O-N 3.28Å; G139-Y142 VanDerWaalsContact O-N 3.15Å; G139-R234 VanDerWaalsContact C-NH2 3.32Å; G139-R234 PolarHBondContact O-NH2 3.16Å
140	G	78.8	Confident	84	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.01	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	-115.1	169.2	0	0	0	0	0	113.4	Y142 I143 K144	G140-Y142 PolarHBondContact O-N 3.33Å; G140-Y142 VanDerWaalsContact O-N 3.15Å; G140-I143 PolarHBondContact O-N 3.25Å; G140-I143 VanDerWaalsContact O-N 3.12Å; G140-K144 PolarHBondContact O-N 3.05Å; G140-K144 VanDerWaalsContact O-N 3.1Å
141	L	80.4	Confident	82.6	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-50	-40.7	-178.9	-159.6	80.8	0	0	0	114.2	G139 K144 L145 R234 F235 D238 I239 L269	G139-L141 PolarHBondContact O-N 2.79Å; G139-L141 VanDerWaalsContact O-N 3.14Å; L141-K144 PolarHBondContact O-N 3.17Å; L141-L145 HydrophobicContact CD2-CD1 4.13Å; L141-L145 HydrophobicContact CG-CD1 4.05Å; L141-L145 HydrophobicContact CG-CG 4.46Å; L141-L145 WeakPolarHBondContact O-CB 3.42Å; L141-L145 VanDerWaalsContact O-CG 3.29Å; L141-L145 WeakPolarHBondContact O-CG 3.47Å; L141-L145 PolarHBondContact O-N 3.19Å; L141-R234 VanDerWaalsContact N-NH2 3.2Å; L141-F235 HydrophobicContact CD1-CD2 3.48Å; L141-F235 VanDerWaalsContact CD1-CD2 3.48Å; L141-F235 HydrophobicContact CD1-CE2 3.97Å; L141-F235 HydrophobicContact CD2-CD2 4.41Å; L141-D238 HydrophobicContact CD2-CB 3.42Å; L141-D238 VanDerWaalsContact CD2-CB 3.42Å; L141-I239 HydrophobicContact CD2-CD1 3.97Å; L141-I239 HydrophobicContact CD2-CG1 4Å; L141-L269 HydrophobicContact CD1-CD1 4.47Å; L141-L269 HydrophobicContact CD1-CD2 3.24Å; L141-L269 HydrophobicContact CD1-CG 3.93Å; L141-L269 HydrophobicContact CG-CD2 3.81Å
142	Y	86.3	Confident	81.3	Confident	19 Å²	19	24 Å²	24	8%	0.075	12%	0.123	C	C	.	.	H	α-helix	trans	-71.4	-36.6	-176.3	-72.4	-103	0	0	0	112.1	S87 N138 G139 G140 K144 L145 G146 D238 L242	S87-Y142 WeakPolarHBondContact OG-CE1 3.41Å; S87-Y142 PolarHBondContact OG-OH 3.03Å; N138-Y142 HydrophobicContact CB-CD1 4.21Å; N138-Y142 HydrophobicContact CB-CD2 3.44Å; N138-Y142 VanDerWaalsContact CB-CD2 3.44Å; N138-Y142 HydrophobicContact CB-CE2 3.85Å; N138-Y142 HydrophobicContact CB-CG 3.64Å; N138-Y142 WeakPolarHBondContact ND2-CE1 3.4Å; G139-Y142 PolarHBondContact O-N 3.28Å; G139-Y142 VanDerWaalsContact O-N 3.15Å; G140-Y142 PolarHBondContact O-N 3.33Å; G140-Y142 VanDerWaalsContact O-N 3.15Å; Y142-K144 VanDerWaalsContact C-N 3.35Å; Y142-L145 PolarHBondContact O-N 3.48Å; Y142-G146 PolarHBondContact O-N 2.71Å; Y142-D238 HydrophobicContact CE2-CB 4Å; Y142-L242 HydrophobicContact CD1-CD2 4.45Å; Y142-L242 HydrophobicContact CE1-CD2 3.84Å; Y142-L242 HydrophobicContact CE1-CG 4.31Å
143	I	83.5	Confident	79.9	Confident	3 Å²	3	25.4 Å²	25.4	2%	0.015	13%	0.131	C	C	.	.	H	α-helix	trans	-62.1	-47.9	172.2	-64.5	178.6	0	0	0	108.8	G140 L145 G146 Q147 L167 L172	G140-I143 PolarHBondContact O-N 3.25Å; G140-I143 VanDerWaalsContact O-N 3.12Å; I143-L145 VanDerWaalsContact C-N 3.35Å; I143-L145 PolarHBondContact O-N 3.41Å; I143-G146 CarbonylContact O-C 3.52Å; I143-G146 WeakPolarHBondContact O-CA 3.34Å; I143-G146 PolarHBondContact O-N 3Å; I143-G146 VanDerWaalsContact O-N 3.13Å; I143-Q147 HydrophobicContact CG2-CG 4.45Å; I143-Q147 WeakPolarHBondContact O-CG 3.45Å; I143-Q147 PolarHBondContact O-N 2.84Å; I143-L167 HydrophobicContact CG1-CD2 4.43Å; I143-L167 HydrophobicContact CG2-CB 4.25Å; I143-L172 HydrophobicContact CD1-CD1 3.76Å; I143-L172 HydrophobicContact CD1-CG 4.4Å
144	K	80.9	Confident	78.3	Confident	22 Å²	22	24.1 Å²	24.1	10%	0.096	13%	0.125	C	C	.	.	H	α-helix	trans	-64.5	-37.3	-179.6	-171.4	71	-152.3	-157.5	0	112.9	G140 L141 Y142 Q147 G148 S207 L208 L269 E272	G140-K144 PolarHBondContact O-N 3.05Å; G140-K144 VanDerWaalsContact O-N 3.1Å; L141-K144 PolarHBondContact O-N 3.17Å; Y142-K144 VanDerWaalsContact C-N 3.35Å; K144-Q147 PolarHBondContact O-N 3.45Å; K144-G148 PolarHBondContact O-N 3.31Å; K144-S207 VanDerWaalsContact CD-OG 3.24Å; K144-S207 WeakPolarHBondContact CD-OG 3.4Å; K144-L208 HydrophobicContact CB-CD2 4.02Å; K144-L208 HydrophobicContact CB-CG 4.46Å; K144-L208 HydrophobicContact CD-CD1 4.04Å; K144-L208 HydrophobicContact CD-CG 4.03Å; K144-L208 HydrophobicContact CG-CD1 4.06Å; K144-L208 HydrophobicContact CG-CD2 4.05Å; K144-L208 HydrophobicContact CG-CG 4.08Å; K144-L269 HydrophobicContact CB-CD1 4.18Å; K144-L269 HydrophobicContact CD-CD1 4.5Å; K144-L269 HydrophobicContact CG-CD1 3.39Å; K144-E272 VanDerWaalsContact CE-CD 3.45Å; K144-E272 VanDerWaalsContact CE-OE1 3.22Å; K144-E272 WeakPolarHBondContact CE-OE1 3.4Å; K144-E272 WeakPolarHBondContact CE-OE2 3.39Å; K144-E272 IonicContact NZ-OE1 2.65Å; K144-E272 PolarHBondContact NZ-OE1 3.17Å; K144-E272 IonicContact NZ-OE2 2.68Å; K144-E272 PolarHBondContact NZ-OE2 2.9Å
145	L	83.1	Confident	76.9	Confident	12 Å²	12	23.8 Å²	23.8	6%	0.063	12%	0.12	C	C	.	.	H	α-helix	trans	-66.4	-38.1	173.1	-73.7	168.3	0	0	0	112	L141 Y142 I143 G148 L149 I239 L242 L265 L269	L141-L145 HydrophobicContact CD2-CD1 4.13Å; L141-L145 HydrophobicContact CG-CD1 4.05Å; L141-L145 HydrophobicContact CG-CG 4.46Å; L141-L145 WeakPolarHBondContact O-CB 3.42Å; L141-L145 VanDerWaalsContact O-CG 3.29Å; L141-L145 WeakPolarHBondContact O-CG 3.47Å; L141-L145 PolarHBondContact O-N 3.19Å; Y142-L145 PolarHBondContact O-N 3.48Å; I143-L145 VanDerWaalsContact C-N 3.35Å; I143-L145 PolarHBondContact O-N 3.41Å; L145-G148 CarbonylContact O-C 3.55Å; L145-G148 PolarHBondContact O-N 3.33Å; L145-L149 WeakPolarHBondContact O-CG 3.47Å; L145-L149 PolarHBondContact O-N 2.97Å; L145-I239 HydrophobicContact CD1-CD1 4.26Å; L145-L242 HydrophobicContact CD1-CD1 3.18Å; L145-L265 HydrophobicContact CD2-CB 3.89Å; L145-L265 HydrophobicContact CD2-CD1 4.27Å; L145-L269 HydrophobicContact CD2-CD2 3.78Å; L145-L269 HydrophobicContact CG-CD2 3.88Å
146	G	83.9	Confident	76.1	Confident	5 Å²	5	24.4 Å²	24.4	5%	0.052	12%	0.122	C	C	.	.	H	α-helix	trans	-62.6	-43.7	171.1	0	0	0	0	0	112.8	Y142 I143 G148 L149 C150	Y142-G146 PolarHBondContact O-N 2.71Å; I143-G146 CarbonylContact O-C 3.52Å; I143-G146 WeakPolarHBondContact O-CA 3.34Å; I143-G146 PolarHBondContact O-N 3Å; I143-G146 VanDerWaalsContact O-N 3.13Å; G146-G148 VanDerWaalsContact C-N 3.32Å; G146-G148 PolarHBondContact O-N 3.47Å; G146-L149 WeakPolarHBondContact O-CB 3.33Å; G146-L149 PolarHBondContact O-N 2.85Å; G146-L149 VanDerWaalsContact O-N 3.12Å; G146-C150 PolarHBondContact O-N 2.9Å; G146-C150 PolarHBondContact O-SG 3.29Å
147	Q	78.8	Confident	75.7	Confident	25 Å²	25	22.8 Å²	22.8	12%	0.117	11%	0.113	C	C	.	.	H	α-helix	trans	-60.1	-41.9	171.6	-67.8	174.3	-10.7	0	0	111.3	I143 K144 L149 C150 A151 L167 E168 S207	I143-Q147 HydrophobicContact CG2-CG 4.45Å; I143-Q147 WeakPolarHBondContact O-CG 3.45Å; I143-Q147 PolarHBondContact O-N 2.84Å; K144-Q147 PolarHBondContact O-N 3.45Å; Q147-L149 VanDerWaalsContact C-N 3.31Å; Q147-L149 PolarHBondContact O-N 2.71Å; Q147-C150 WeakPolarHBondContact O-CB 3.49Å; Q147-C150 PolarHBondContact O-N 3.15Å; Q147-A151 PolarHBondContact O-N 3.15Å; Q147-L167 HydrophobicContact CG-CB 4.26Å; Q147-L167 PolarHBondContact NE2-O 2.91Å; Q147-E168 HydrophobicContact CG-CG 4.25Å; Q147-S207 PolarHBondContact OE1-OG 2.87Å
148	G	75.8	Confident	75.4	Confident	8 Å²	8	18 Å²	18	8%	0.082	10%	0.103	C	C	.	.	H	α-helix	trans	-61.2	-38.3	173.5	0	0	0	0	0	112.5	K144 L145 G146 A151 F152	K144-G148 PolarHBondContact O-N 3.31Å; L145-G148 CarbonylContact O-C 3.55Å; L145-G148 PolarHBondContact O-N 3.33Å; G146-G148 VanDerWaalsContact C-N 3.32Å; G146-G148 PolarHBondContact O-N 3.47Å; G148-A151 VanDerWaalsContact O-CB 3.28Å; G148-A151 WeakPolarHBondContact O-CB 3.42Å; G148-A151 PolarHBondContact O-N 3.14Å; G148-F152 WeakPolarHBondContact O-CD2 3.11Å
149	L	78.1	Confident	75.5	Confident	33 Å²	33	18.7 Å²	18.7	17%	0.173	11%	0.105	C	C	.	.	H	α-helix	trans	-66.5	-36.8	173.4	-74.2	171.7	0	0	0	112.2	M131 L145 G146 Q147 A151 F152 L156 L164 V261 L265	M131-L149 HydrophobicContact SD-CD1 4.16Å; L145-L149 WeakPolarHBondContact O-CG 3.47Å; L145-L149 PolarHBondContact O-N 2.97Å; G146-L149 WeakPolarHBondContact O-CB 3.33Å; G146-L149 PolarHBondContact O-N 2.85Å; G146-L149 VanDerWaalsContact O-N 3.12Å; Q147-L149 VanDerWaalsContact C-N 3.31Å; Q147-L149 PolarHBondContact O-N 2.71Å; L149-A151 PolarHBondContact O-N 2.99Å; L149-F152 CarbonylContact O-C 3.59Å; L149-F152 WeakPolarHBondContact O-CA 3.49Å; L149-F152 WeakPolarHBondContact O-CB 3.48Å; L149-F152 PolarHBondContact O-N 2.89Å; L149-L156 HydrophobicContact CB-CD1 4.06Å; L149-L156 WeakPolarHBondContact O-CD1 3.44Å; L149-L164 HydrophobicContact CB-CD1 4.32Å; L149-V261 HydrophobicContact CD2-CG1 3.94Å; L149-L265 HydrophobicContact CD2-CD1 3.85Å; L149-L265 HydrophobicContact CG-CD1 3.97Å
150	C	70.9	Confident	75.8	Confident	8 Å²	8	19.2 Å²	19.2	5%	0.054	11%	0.105	C	C	.	.	H	α-helix	trans	-58.8	-35.4	171.5	-66.9	0	0	0	0	112.4	G146 Q147 F152 N153 L164 E168	G146-C150 PolarHBondContact O-N 2.9Å; G146-C150 PolarHBondContact O-SG 3.29Å; Q147-C150 WeakPolarHBondContact O-CB 3.49Å; Q147-C150 PolarHBondContact O-N 3.15Å; C150-F152 PolarHBondContact O-N 3.12Å; C150-N153 WeakPolarHBondContact O-CA 3.19Å; C150-N153 VanDerWaalsContact O-CB 3.27Å; C150-N153 WeakPolarHBondContact O-CB 3.24Å; C150-N153 PolarHBondContact O-N 2.97Å; C150-L164 WeakPolarHBondContact SG-CB 3.41Å; C150-L164 PolarHBondContact SG-O 3.13Å; C150-E168 WeakPolarHBondContact CB-OE1 3.42Å
151	A	62.5	Low	75.8	Confident	15 Å²	15	21 Å²	21	12%	0.124	11%	0.114	C	C	.	.	H	α-helix	trans	-64.2	-22.8	175.4	0	0	0	0	0	112.9	Q147 G148 L149 N153 R479	Q147-A151 PolarHBondContact O-N 3.15Å; G148-A151 VanDerWaalsContact O-CB 3.28Å; G148-A151 WeakPolarHBondContact O-CB 3.42Å; G148-A151 PolarHBondContact O-N 3.14Å; L149-A151 PolarHBondContact O-N 2.99Å; A151-N153 VanDerWaalsContact C-N 3.3Å; A151-R479 HydrophobicContact CB-CG 4.21Å
152	F	65.2	Low	75.9	Confident	16 Å²	16	28.9 Å²	28.9	7%	0.07	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	37.9	167.9	-63.4	-78	0	0	0	112.2	G148 L149 C150 H154 L155 V261 L265 L475	G148-F152 WeakPolarHBondContact O-CD2 3.11Å; L149-F152 CarbonylContact O-C 3.59Å; L149-F152 WeakPolarHBondContact O-CA 3.49Å; L149-F152 WeakPolarHBondContact O-CB 3.48Å; L149-F152 PolarHBondContact O-N 2.89Å; C150-F152 PolarHBondContact O-N 3.12Å; F152-H154 PolarHBondContact O-N 3.1Å; F152-L155 HydrophobicContact CB-CB 4.07Å; F152-L155 HydrophobicContact CB-CD1 3.69Å; F152-L155 HydrophobicContact CB-CG 3.98Å; F152-L155 HydrophobicContact CD1-CD1 3.43Å; F152-L155 VanDerWaalsContact CD1-CD1 3.43Å; F152-L155 HydrophobicContact CD1-CG 4.2Å; F152-L155 HydrophobicContact CE1-CD1 4.26Å; F152-L155 HydrophobicContact CG-CD1 3.75Å; F152-L155 HydrophobicContact CG-CG 4.48Å; F152-L155 WeakPolarHBondContact O-CA 3.45Å; F152-L155 WeakPolarHBondContact O-CB 3.49Å; F152-L155 PolarHBondContact O-N 3.04Å; F152-V261 HydrophobicContact CD2-CG1 4.28Å; F152-V261 HydrophobicContact CE2-CG1 4.35Å; F152-L265 HydrophobicContact CD2-CD2 4.29Å; F152-L265 HydrophobicContact CE2-CD2 3.7Å; F152-L265 HydrophobicContact CE2-CG 4.07Å; F152-L475 HydrophobicContact CE1-CB 4.21Å; F152-L475 HydrophobicContact CE1-CD1 4.12Å; F152-L475 HydrophobicContact CE1-CD2 4.17Å; F152-L475 HydrophobicContact CE1-CG 4.4Å
153	N	61.7	Low	76	Confident	47 Å²	47	28.9 Å²	28.9	25%	0.251	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-25.6	178	56.9	11.2	0	0	0	114.6	C150 A151 I161 N482	C150-N153 WeakPolarHBondContact O-CA 3.19Å; C150-N153 VanDerWaalsContact O-CB 3.27Å; C150-N153 WeakPolarHBondContact O-CB 3.24Å; C150-N153 PolarHBondContact O-N 2.97Å; A151-N153 VanDerWaalsContact C-N 3.3Å; N153-I161 HydrophobicContact CB-CD1 4.17Å; N153-I161 HydrophobicContact CB-CG1 4.22Å; N153-I161 HydrophobicContact CB-CG2 3.99Å; N153-I161 WeakPolarHBondContact O-CD1 3.3Å; N153-I161 WeakPolarHBondContact O-CG1 3.46Å; N153-N482 PolarHBondContact ND2-ND2 2.9Å
154	H	57.6	Low	76.2	Confident	46 Å²	46	28.8 Å²	28.8	21%	0.213	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-8.2	178.9	53.8	-77.5	0	0	0	113.5	F152 L467	F152-H154 PolarHBondContact O-N 3.1Å; H154-L467 WeakPolarHBondContact CD2-CD1 3.22Å
155	L	60.7	Low	76.1	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.01	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-14.8	173.5	-66	-177.6	0	0	0	113.7	F152 W260 V261 F460 M464 L467	F152-L155 HydrophobicContact CB-CB 4.07Å; F152-L155 HydrophobicContact CB-CD1 3.69Å; F152-L155 HydrophobicContact CB-CG 3.98Å; F152-L155 HydrophobicContact CD1-CD1 3.43Å; F152-L155 VanDerWaalsContact CD1-CD1 3.43Å; F152-L155 HydrophobicContact CD1-CG 4.2Å; F152-L155 HydrophobicContact CE1-CD1 4.26Å; F152-L155 HydrophobicContact CG-CD1 3.75Å; F152-L155 HydrophobicContact CG-CG 4.48Å; F152-L155 WeakPolarHBondContact O-CA 3.45Å; F152-L155 WeakPolarHBondContact O-CB 3.49Å; F152-L155 PolarHBondContact O-N 3.04Å; L155-W260 HydrophobicContact CD1-CH2 3.58Å; L155-W260 HydrophobicContact CD1-CZ2 4.07Å; L155-W260 HydrophobicContact CD1-CZ3 4.44Å; L155-W260 HydrophobicContact CD2-CH2 4.3Å; L155-W260 HydrophobicContact CD2-CZ2 4.4Å; L155-V261 HydrophobicContact CD1-CG2 4.15Å; L155-F460 WeakPolarHBondContact O-CE2 3.37Å; L155-F460 WeakPolarHBondContact O-CZ 3.49Å; L155-M464 HydrophobicContact CB-SD 4.44Å; L155-M464 HydrophobicContact CD2-CE 3.58Å; L155-M464 HydrophobicContact CD2-SD 3.35Å; L155-M464 WeakPolarHBondContact CD2-SD 3.31Å; L155-L467 HydrophobicContact CD2-CB 4.31Å; L155-L467 HydrophobicContact CD2-CD1 3.18Å; L155-L467 HydrophobicContact CD2-CG 4.35Å; L155-L467 HydrophobicContact CG-CD1 4.11Å
156	L	73	Confident	76.1	Confident	20 Å²	20	35.3 Å²	35.3	11%	0.105	18%	0.181	C	C	.	.	S	Bend	trans	-115.1	145.4	-167.4	-62.7	176.9	0	0	0	111.3	L149 I161 L164 F258	L149-L156 HydrophobicContact CB-CD1 4.06Å; L149-L156 WeakPolarHBondContact O-CD1 3.44Å; L156-I161 HydrophobicContact CB-CG1 4.24Å; L156-L164 HydrophobicContact CD1-CD1 4.02Å; L156-F258 HydrophobicContact CD2-CE1 3.91Å; L156-F258 HydrophobicContact CD2-CZ 4.3Å
157	P	77.9	Confident	75.9	Confident	24 Å²	24	35 Å²	35	16%	0.156	18%	0.178	C	C	.	.			trans	-54.5	148.2	169.5	-22.8	31.2	0	0	0	111.6	H124 E159 Y160 I161	H124-P157 HydrophobicContact CB-CB 4.21Å; P157-E159 VanDerWaalsContact CB-OE2 3.31Å; P157-E159 WeakPolarHBondContact CB-OE2 3.26Å; P157-E159 PolarHBondContact O-N 2.77Å; P157-E159 VanDerWaalsContact O-N 3.08Å; P157-Y160 HydrophobicContact CB-CD2 4.03Å; P157-Y160 HydrophobicContact CG-CD2 3.88Å; P157-Y160 HydrophobicContact CG-CE2 4.2Å; P157-Y160 WeakPolarHBondContact O-CB 3.29Å; P157-Y160 PolarHBondContact O-N 2.78Å; P157-I161 PolarHBondContact O-N 2.97Å
158	P	78.1	Confident	75.5	Confident	55 Å²	55	38 Å²	38	36%	0.357	19%	0.192	S	C	.	.	H	α-helix	trans	-57.7	-28.4	-174	22.8	-33	0	0	0	113.8	I161 R162	P158-I161 PolarHBondContact O-N 3.22Å; P158-R162 WeakPolarHBondContact O-CG 3.25Å; P158-R162 PolarHBondContact O-N 3.36Å
159	E	87.5	Confident	74.8	Confident	24 Å²	24	44.7 Å²	44.7	11%	0.112	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-48	174.8	-60.6	76.9	-166.6	0	0	111	S121 H124 Q125 P157 I161 R162 T163	S121-E159 WeakPolarHBondContact CB-OE1 3.34Å; S121-E159 PolarHBondContact OG-OE1 2.9Å; H124-E159 HydrophobicContact CB-CB 3.98Å; H124-E159 HydrophobicContact CB-CG 4.04Å; H124-E159 IonicContact CD2-OE2 3.96Å; Q125-E159 HydrophobicContact CB-CB 4.2Å; Q125-E159 HydrophobicContact CB-CG 4.05Å; P157-E159 VanDerWaalsContact CB-OE2 3.31Å; P157-E159 WeakPolarHBondContact CB-OE2 3.26Å; P157-E159 PolarHBondContact O-N 2.77Å; P157-E159 VanDerWaalsContact O-N 3.08Å; E159-I161 PolarHBondContact O-N 2.91Å; E159-R162 PolarHBondContact O-N 2.9Å; E159-T163 WeakPolarHBondContact O-CB 3.29Å; E159-T163 PolarHBondContact O-N 2.99Å; E159-T163 PolarHBondContact O-OG1 2.85Å; E159-T163 VanDerWaalsContact O-OG1 3.07Å
160	Y	86	Confident	73.8	Confident	18 Å²	18	46 Å²	46	7%	0.071	23%	0.231	C	C	.	.	H	α-helix	trans	-60.9	-44.8	175.6	-78.2	-87.9	0	0	0	111.8	Y98 H124 A127 A128 M131 P157 R162 T163 L164	Y98-Y160 WeakPolarHBondContact OH-CE2 3.4Å; Y98-Y160 PolarHBondContact OH-OH 3.32Å; H124-Y160 HydrophobicContact CB-CD2 4.39Å; H124-Y160 HydrophobicContact CB-CE2 4.12Å; A127-Y160 WeakPolarHBondContact CB-OH 3.4Å; A128-Y160 HydrophobicContact CB-CD1 3.68Å; A128-Y160 HydrophobicContact CB-CD2 4.41Å; A128-Y160 HydrophobicContact CB-CE1 4.02Å; A128-Y160 HydrophobicContact CB-CG 3.91Å; M131-Y160 HydrophobicContact CE-CD1 4.45Å; M131-Y160 HydrophobicContact CE-CE1 3.82Å; M131-Y160 HydrophobicContact SD-CD1 4.27Å; M131-Y160 HydrophobicContact SD-CE1 4.18Å; P157-Y160 HydrophobicContact CB-CD2 4.03Å; P157-Y160 HydrophobicContact CG-CD2 3.88Å; P157-Y160 HydrophobicContact CG-CE2 4.2Å; P157-Y160 WeakPolarHBondContact O-CB 3.29Å; P157-Y160 PolarHBondContact O-N 2.78Å; Y160-R162 PolarHBondContact O-N 3.38Å; Y160-T163 PolarHBondContact O-N 2.85Å; Y160-L164 HydrophobicContact CD1-CD1 4.32Å; Y160-L164 WeakPolarHBondContact O-CB 3.18Å; Y160-L164 WeakPolarHBondContact O-CD1 3.41Å; Y160-L164 WeakPolarHBondContact O-CG 3.32Å; Y160-L164 PolarHBondContact O-N 3.46Å
161	I	79.6	Confident	73.1	Confident	40 Å²	40	48.8 Å²	48.8	21%	0.205	25%	0.254	C	S	.	.	H	α-helix	trans	-58	-50.5	-179.9	-53.7	169.3	0	0	0	109.9	N153 L156 P157 P158 E159 Q165	N153-I161 HydrophobicContact CB-CD1 4.17Å; N153-I161 HydrophobicContact CB-CG1 4.22Å; N153-I161 HydrophobicContact CB-CG2 3.99Å; N153-I161 WeakPolarHBondContact O-CD1 3.3Å; N153-I161 WeakPolarHBondContact O-CG1 3.46Å; L156-I161 HydrophobicContact CB-CG1 4.24Å; P157-I161 PolarHBondContact O-N 2.97Å; P158-I161 PolarHBondContact O-N 3.22Å; E159-I161 PolarHBondContact O-N 2.91Å; I161-Q165 VanDerWaalsContact O-CG 3.29Å; I161-Q165 WeakPolarHBondContact O-CG 3.31Å; I161-Q165 PolarHBondContact O-N 3.4Å
162	R	82.6	Confident	72.7	Confident	165 Å²	165	50.9 Å²	50.9	62%	0.623	26%	0.263	S	S	*	.	H	α-helix	trans	-66	-42.3	-177.3	-70.8	177.5	-169.6	-175	7.1	112.2	P158 E159 Y160	P158-R162 WeakPolarHBondContact O-CG 3.25Å; P158-R162 PolarHBondContact O-N 3.36Å; E159-R162 PolarHBondContact O-N 2.9Å; Y160-R162 PolarHBondContact O-N 3.38Å
163	T	88.7	Confident	72.1	Confident	19 Å²	19	56.4 Å²	56.4	12%	0.117	29%	0.294	C	S	.	.	H	α-helix	trans	-73.3	-42.6	-177.1	-59.7	0	0	0	0	111.7	Q125 A128 D129 V132 E159 Y160 Q165 V166	Q125-T163 PolarHBondContact NE2-OG1 3.2Å; A128-T163 HydrophobicContact CB-CG2 4.1Å; D129-T163 WeakPolarHBondContact OD1-CG2 3.42Å; D129-T163 PolarHBondContact OD1-OG1 3.25Å; V132-T163 HydrophobicContact CB-CG2 4.26Å; V132-T163 HydrophobicContact CG2-CG2 3.76Å; E159-T163 WeakPolarHBondContact O-CB 3.29Å; E159-T163 PolarHBondContact O-N 2.99Å; E159-T163 PolarHBondContact O-OG1 2.85Å; E159-T163 VanDerWaalsContact O-OG1 3.07Å; Y160-T163 PolarHBondContact O-N 2.85Å; T163-Q165 PolarHBondContact O-N 2.95Å; T163-V166 PolarHBondContact O-N 2.92Å
164	L	86.5	Confident	72.1	Confident	1 Å²	1	57 Å²	57	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-68.6	-20.4	-178.8	-68.7	164.6	0	0	0	113	M131 V132 L149 C150 L156 Y160 V166 L167	M131-L164 HydrophobicContact CG-CD2 4.26Å; M131-L164 HydrophobicContact SD-CD1 4.46Å; M131-L164 HydrophobicContact SD-CD2 4.08Å; V132-L164 HydrophobicContact CG2-CD2 3.78Å; V132-L164 HydrophobicContact CG2-CG 4.34Å; L149-L164 HydrophobicContact CB-CD1 4.32Å; C150-L164 WeakPolarHBondContact SG-CB 3.41Å; C150-L164 PolarHBondContact SG-O 3.13Å; L156-L164 HydrophobicContact CD1-CD1 4.02Å; Y160-L164 HydrophobicContact CD1-CD1 4.32Å; Y160-L164 WeakPolarHBondContact O-CB 3.18Å; Y160-L164 WeakPolarHBondContact O-CD1 3.41Å; Y160-L164 WeakPolarHBondContact O-CG 3.32Å; Y160-L164 PolarHBondContact O-N 3.46Å; L164-V166 PolarHBondContact O-N 3.27Å; L164-V166 VanDerWaalsContact O-N 3.12Å; L164-L167 HydrophobicContact CD2-CD1 3.72Å; L164-L167 VanDerWaalsContact O-CB 3.24Å; L164-L167 WeakPolarHBondContact O-CB 3.26Å; L164-L167 PolarHBondContact O-N 2.79Å
165	Q	80.5	Confident	72.1	Confident	97 Å²	97	64.6 Å²	64.6	45%	0.453	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-31.5	173.7	-83.7	169.6	-17.3	0	0	113	I161 T163 L167 E168	I161-Q165 VanDerWaalsContact O-CG 3.29Å; I161-Q165 WeakPolarHBondContact O-CG 3.31Å; I161-Q165 PolarHBondContact O-N 3.4Å; T163-Q165 PolarHBondContact O-N 2.95Å; Q165-L167 PolarHBondContact O-N 2.88Å; Q165-L167 VanDerWaalsContact O-N 3.1Å; Q165-E168 WeakPolarHBondContact O-CB 3.37Å; Q165-E168 PolarHBondContact O-N 2.71Å
166	V	82.4	Confident	72	Confident	73 Å²	73	71 Å²	71	44%	0.442	34%	0.344	S	S	.	.	H	α-helix	trans	-57.8	-27	175.9	174	0	0	0	0	112.1	T163 L164 E168 Q170	T163-V166 PolarHBondContact O-N 2.92Å; L164-V166 PolarHBondContact O-N 3.27Å; L164-V166 VanDerWaalsContact O-N 3.12Å; V166-E168 VanDerWaalsContact C-N 3.3Å; V166-E168 PolarHBondContact O-N 3.46Å; V166-Q170 WeakPolarHBondContact O-CG 3.45Å
167	L	79.4	Confident	71.7	Confident	0 Å²	0	79 Å²	79	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-72.6	-21	177.5	-59.5	178.6	0	0	0	112.8	V132 A135 V136 I143 Q147 L164 Q165	V132-L167 HydrophobicContact CG1-CD2 4.12Å; V132-L167 HydrophobicContact CG2-CD1 4.26Å; V132-L167 HydrophobicContact CG2-CG 4.21Å; A135-L167 HydrophobicContact CB-CD1 4.05Å; A135-L167 HydrophobicContact CB-CD2 4.2Å; V136-L167 HydrophobicContact CG2-CD2 3.7Å; I143-L167 HydrophobicContact CG1-CD2 4.43Å; I143-L167 HydrophobicContact CG2-CB 4.25Å; Q147-L167 HydrophobicContact CG-CB 4.26Å; Q147-L167 PolarHBondContact NE2-O 2.91Å; L164-L167 HydrophobicContact CD2-CD1 3.72Å; L164-L167 VanDerWaalsContact O-CB 3.24Å; L164-L167 WeakPolarHBondContact O-CB 3.26Å; L164-L167 PolarHBondContact O-N 2.79Å; Q165-L167 PolarHBondContact O-N 2.88Å; Q165-L167 VanDerWaalsContact O-N 3.1Å
168	E	70.8	Confident	71.9	Confident	87 Å²	87	80.8 Å²	80.8	41%	0.407	38%	0.384	S	S	.	.	H	α-helix	trans	-74	-34.1	177.6	-64.7	-177.9	170.6	0	0	111.9	Q147 C150 Q165 V166	Q147-E168 HydrophobicContact CG-CG 4.25Å; C150-E168 WeakPolarHBondContact CB-OE1 3.42Å; Q165-E168 WeakPolarHBondContact O-CB 3.37Å; Q165-E168 PolarHBondContact O-N 2.71Å; V166-E168 VanDerWaalsContact C-N 3.3Å; V166-E168 PolarHBondContact O-N 3.46Å
169	D	61.1	Low	72.3	Confident	149 Å²	149	78.2 Å²	78.2	80%	0.797	37%	0.367	S	S	*	.	H	α-helix	trans	-87.4	-11	-175.8	-71.1	-31.2	0	0	0	114.2	A171	D169-A171 PolarHBondContact O-N 3.42Å
170	Q	57.4	Low	72.5	Confident	61 Å²	61	79.6 Å²	79.6	29%	0.285	38%	0.376	S	S	.	.			trans	-84.2	95.8	-177.1	-75.2	-173.7	23.1	0	0	112.4	V166	V166-Q170 WeakPolarHBondContact O-CG 3.45Å
171	A	55.4	Low	72.6	Confident	65 Å²	65	80.5 Å²	80.5	54%	0.537	39%	0.387	S	S	.	.			trans	-78.2	122.6	162.2	0	0	0	0	0	110.2	D169 A205	D169-A171 PolarHBondContact O-N 3.42Å; A171-A205 HydrophobicContact CB-CB 4.41Å
172	L	53.8	Low	73.1	Confident	60 Å²	60	78.7 Å²	78.7	31%	0.314	38%	0.378	S	S	.	.			trans	-88	110.5	171	-75.4	168.4	0	0	0	108.9	I143 R174 Y228	I143-L172 HydrophobicContact CD1-CD1 3.76Å; I143-L172 HydrophobicContact CD1-CG 4.4Å; L172-R174 PolarHBondContact O-N 3.09Å; L172-Y228 PolarHBondContact O-OH 3.28Å
173	N	53.6	Low	73.7	Confident	132 Å²	132	70.8 Å²	70.8	71%	0.706	35%	0.348	S	S	*	.			trans	-81.1	118.1	172.5	-138.3	-4.1	0	0	0	109.3
174	R	61	Low	73.9	Confident	59 Å²	59	73.7 Å²	73.7	22%	0.223	36%	0.362	C	S	.	.			trans	-113.8	164.8	-177.5	-68.5	-165.2	175.4	-167	6	111.5	L172 Y228 D230	L172-R174 PolarHBondContact O-N 3.09Å; R174-Y228 HydrophobicContact CB-CD1 4.19Å; R174-Y228 HydrophobicContact CB-CE1 3.89Å; R174-Y228 HydrophobicContact CG-CD1 4.29Å; R174-Y228 HydrophobicContact CG-CE1 4.02Å; R174-D230 IonicContact CZ-OD1 2.79Å; R174-D230 IonicContact CZ-OD2 3.21Å; R174-D230 VanDerWaalsContact NH1-CG 3.25Å; R174-D230 IonicContact NH1-OD1 3.36Å; R174-D230 PolarHBondContact NH1-OD1 2.75Å; R174-D230 IonicContact NH1-OD2 2.87Å; R174-D230 PolarHBondContact NH1-OD2 2.78Å; R174-D230 IonicContact NH2-OD2 3.85Å
175	R	58.4	Low	74.1	Confident	205 Å²	205	76 Å²	76	77%	0.774	37%	0.373	S	S	*	.			trans	-78.7	147	-166	-55.8	-178.6	-161.4	176	4.9	112.8	K177 E178	R175-K177 PolarHBondContact O-N 2.59Å; R175-E178 PolarHBondContact O-N 3.15Å
176	Y	58.8	Low	74.7	Confident	137 Å²	137	73.7 Å²	73.7	54%	0.537	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-35.1	-176.9	-50.1	-78.4	0	0	0	116.6	E178 V179 Y200	Y176-E178 PolarHBondContact O-N 3.26Å; Y176-V179 PolarHBondContact O-N 3.21Å; Y176-Y200 WeakPolarHBondContact CD1-O 3.49Å; Y176-Y200 WeakPolarHBondContact CE1-O 3.21Å
177	K	66.6	Low	75.4	Confident	188 Å²	188	72 Å²	72	82%	0.817	35%	0.351	S	S	*	.	H	α-helix	trans	-67.2	-9.4	-172.7	-66.8	-169	177.4	-172.9	0	115.1	R175	R175-K177 PolarHBondContact O-N 2.59Å
178	E	80.9	Confident	76.1	Confident	61 Å²	61	78.6 Å²	78.6	29%	0.285	39%	0.386	S	S	.	.	H	α-helix	trans	-77.7	-26.1	178.2	-66.1	-178.9	-178.2	0	0	112.4	R175 Y176 L182 I229	R175-E178 PolarHBondContact O-N 3.15Å; Y176-E178 PolarHBondContact O-N 3.26Å; E178-L182 PolarHBondContact O-N 3.43Å; E178-I229 HydrophobicContact CB-CG2 4Å; E178-I229 HydrophobicContact CG-CG2 3.96Å
179	V	88.1	Confident	77.3	Confident	1 Å²	1	79.2 Å²	79.2	1%	0.006	39%	0.387	C	S	.	.	H	α-helix	trans	-67.4	-53.4	-176.5	-179.2	0	0	0	0	111.1	Y176 A181 L182 F183 P191 F198 Y200	Y176-V179 PolarHBondContact O-N 3.21Å; V179-A181 VanDerWaalsContact C-N 3.29Å; V179-A181 PolarHBondContact O-N 3.18Å; V179-L182 WeakPolarHBondContact O-CB 3.36Å; V179-L182 PolarHBondContact O-N 2.77Å; V179-F183 HydrophobicContact CG1-CD2 3.71Å; V179-F183 HydrophobicContact CG1-CE2 3.77Å; V179-F183 WeakPolarHBondContact O-CD2 3.18Å; V179-F183 PolarHBondContact O-N 2.89Å; V179-P191 HydrophobicContact CG1-CG 3.99Å; V179-F198 HydrophobicContact CG1-CE1 4.09Å; V179-F198 HydrophobicContact CG1-CZ 4.08Å; V179-Y200 HydrophobicContact CB-CE1 4.37Å; V179-Y200 HydrophobicContact CG1-CE1 4.33Å
180	D	90.3	Very high	78.9	Confident	54 Å²	54	73.7 Å²	73.7	29%	0.289	36%	0.359	S	S	.	.	H	α-helix	trans	-57.8	-43.1	-178	-58.1	-18.6	0	0	0	112.3	L182 F183 L184 Y200	D180-L182 VanDerWaalsContact C-N 3.28Å; D180-L182 PolarHBondContact O-N 3.04Å; D180-F183 PolarHBondContact O-N 3.35Å; D180-L184 WeakPolarHBondContact O-CB 3.42Å; D180-L184 VanDerWaalsContact O-CG 3.29Å; D180-L184 WeakPolarHBondContact O-CG 3.3Å; D180-L184 PolarHBondContact O-N 3.46Å; D180-Y200 VanDerWaalsContact OD1-CE1 3.29Å; D180-Y200 WeakPolarHBondContact OD1-CE1 3.48Å; D180-Y200 PolarHBondContact OD1-OH 3.39Å
181	A	88.5	Confident	80.6	Confident	37 Å²	37	70.8 Å²	70.8	31%	0.306	35%	0.345	S	S	.	.	H	α-helix	trans	-62.7	-38	179	0	0	0	0	0	111.6	V179 E185 I229	V179-A181 VanDerWaalsContact C-N 3.29Å; V179-A181 PolarHBondContact O-N 3.18Å; A181-E185 VanDerWaalsContact O-CG 3.28Å; A181-E185 WeakPolarHBondContact O-CG 3.24Å; A181-E185 PolarHBondContact O-N 3.43Å; A181-E185 VanDerWaalsContact O-N 3.13Å; A181-I229 HydrophobicContact CB-CD1 3.66Å
182	L	91	Very high	82.4	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-69.1	-45.3	177.7	-172.6	154.9	0	0	0	110.9	E178 V179 D180 E185 D186 V226 Q227 I229 R308 V309	E178-L182 PolarHBondContact O-N 3.43Å; V179-L182 WeakPolarHBondContact O-CB 3.36Å; V179-L182 PolarHBondContact O-N 2.77Å; D180-L182 VanDerWaalsContact C-N 3.28Å; D180-L182 PolarHBondContact O-N 3.04Å; L182-E185 PolarHBondContact O-N 3.14Å; L182-D186 PolarHBondContact O-N 2.99Å; L182-V226 HydrophobicContact CD1-CG1 3.88Å; L182-V226 HydrophobicContact CD2-CG1 4.07Å; L182-V226 HydrophobicContact CG-CG1 4.43Å; L182-Q227 WeakPolarHBondContact CD1-O 3.47Å; L182-I229 HydrophobicContact CB-CD1 4.02Å; L182-I229 HydrophobicContact CB-CG1 4.29Å; L182-I229 HydrophobicContact CD1-CB 4.45Å; L182-R308 HydrophobicContact CD1-CB 4.1Å; L182-R308 HydrophobicContact CD2-CB 4.01Å; L182-R308 HydrophobicContact CG-CB 4.29Å; L182-V309 HydrophobicContact CD2-CG2 3.2Å
183	F	93.9	Very high	84.4	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-62.4	-42.8	177.7	-91.1	-92.6	0	0	0	112.7	V179 D180 E185 D186 F187 N188 K189 P191 L194 F195 F198 V224 V226 V309	V179-F183 HydrophobicContact CG1-CD2 3.71Å; V179-F183 HydrophobicContact CG1-CE2 3.77Å; V179-F183 WeakPolarHBondContact O-CD2 3.18Å; V179-F183 PolarHBondContact O-N 2.89Å; D180-F183 PolarHBondContact O-N 3.35Å; F183-E185 VanDerWaalsContact C-N 3.3Å; F183-E185 PolarHBondContact O-N 3.14Å; F183-D186 PolarHBondContact O-N 3.13Å; F183-F187 AromaticContact CD1-CD2 3.67Å; F183-F187 HydrophobicContact CD1-CD2 3.67Å; F183-F187 AromaticContact CD1-CE2 3.97Å; F183-F187 HydrophobicContact CD1-CE2 3.97Å; F183-F187 HydrophobicContact CE1-CD2 4.13Å; F183-F187 AromaticContact CE1-CE2 3.99Å; F183-F187 HydrophobicContact CE1-CE2 3.99Å; F183-F187 HydrophobicContact CG-CD2 4.39Å; F183-F187 WeakPolarHBondContact O-CB 3.29Å; F183-F187 PolarHBondContact O-N 2.75Å; F183-N188 PolarHBondContact O-N 3.17Å; F183-K189 CarbonylContact C-O 3.59Å; F183-K189 WeakPolarHBondContact CB-O 3.34Å; F183-P191 HydrophobicContact CB-CG 4.28Å; F183-P191 HydrophobicContact CD1-CG 4.31Å; F183-P191 HydrophobicContact CD2-CG 3.82Å; F183-P191 HydrophobicContact CE2-CG 4.18Å; F183-P191 HydrophobicContact CG-CG 3.86Å; F183-L194 HydrophobicContact CD1-CD1 3.51Å; F183-L194 HydrophobicContact CE1-CD1 3.9Å; F183-F195 AromaticContact CE1-CE2 3.74Å; F183-F195 HydrophobicContact CE1-CE2 3.74Å; F183-F195 HydrophobicContact CE1-CZ 4.49Å; F183-F195 AromaticContact CZ-CE2 3.98Å; F183-F195 HydrophobicContact CZ-CE2 3.98Å; F183-F198 HydrophobicContact CZ-CE2 4.38Å; F183-V224 HydrophobicContact CZ-CG1 3.9Å; F183-V226 HydrophobicContact CE2-CG1 4.41Å; F183-V226 HydrophobicContact CE2-CG2 3.81Å; F183-V226 HydrophobicContact CZ-CG2 4.36Å; F183-V309 HydrophobicContact CD2-CG2 4.43Å; F183-V309 HydrophobicContact CE1-CG1 4.14Å; F183-V309 HydrophobicContact CE1-CG2 4.45Å; F183-V309 HydrophobicContact CE2-CG1 4.33Å; F183-V309 HydrophobicContact CE2-CG2 4.01Å; F183-V309 HydrophobicContact CZ-CB 4.48Å; F183-V309 HydrophobicContact CZ-CG1 3.65Å; F183-V309 HydrophobicContact CZ-CG2 4.03Å
184	L	92.7	Very high	86.3	Confident	80 Å²	80	69 Å²	69	42%	0.419	32%	0.32	S	S	.	.	H	α-helix	trans	-61.9	-38.4	174.1	-74.3	169.8	0	0	0	111.9	D180 N188 K189 T190	D180-L184 WeakPolarHBondContact O-CB 3.42Å; D180-L184 VanDerWaalsContact O-CG 3.29Å; D180-L184 WeakPolarHBondContact O-CG 3.3Å; D180-L184 PolarHBondContact O-N 3.46Å; L184-N188 WeakPolarHBondContact O-CA 3.43Å; L184-N188 PolarHBondContact O-N 3.43Å; L184-N188 VanDerWaalsContact O-N 3.09Å; L184-K189 PolarHBondContact N-O 2.98Å; L184-T190 HydrophobicContact CD2-CG2 4Å; L184-T190 HydrophobicContact CG-CG2 4.28Å
185	E	91.6	Very high	88.1	Confident	48 Å²	48	66.3 Å²	66.3	22%	0.224	31%	0.31	C	S	.	.	H	α-helix	trans	-71.3	-34	178.2	-74.9	177.6	-166	0	0	113.8	R69 R72 A181 L182 F183 R308	R69-E185 IonicContact NE-OE2 3.24Å; R72-E185 IonicContact CZ-OE1 2.74Å; R72-E185 VanDerWaalsContact CZ-OE1 3.24Å; R72-E185 IonicContact NH1-OE1 2.72Å; R72-E185 PolarHBondContact NH1-OE1 3.42Å; R72-E185 IonicContact NH1-OE2 3.02Å; R72-E185 IonicContact NH2-OE1 3.34Å; R72-E185 PolarHBondContact NH2-OE1 3.43Å; R72-E185 IonicContact NH2-OE2 2.95Å; R72-E185 PolarHBondContact NH2-OE2 3.39Å; R72-E185 VanDerWaalsContact NH2-OE2 3.14Å; A181-E185 VanDerWaalsContact O-CG 3.28Å; A181-E185 WeakPolarHBondContact O-CG 3.24Å; A181-E185 PolarHBondContact O-N 3.43Å; A181-E185 VanDerWaalsContact O-N 3.13Å; L182-E185 PolarHBondContact O-N 3.14Å; F183-E185 VanDerWaalsContact C-N 3.3Å; F183-E185 PolarHBondContact O-N 3.14Å; E185-R308 IonicContact OE2-CZ 3.61Å; E185-R308 IonicContact OE2-NH1 2.6Å; E185-R308 PolarHBondContact OE2-NH1 3.32Å; E185-R308 IonicContact OE2-NH2 2.81Å; E185-R308 PolarHBondContact OE2-NH2 3.33Å
186	D	93.7	Very high	89.9	Confident	49 Å²	49	62.1 Å²	62.1	26%	0.262	30%	0.297	S	S	.	.	H	α-helix	trans	-93.3	-34.9	-175.3	-87.2	6	0	0	0	113.9	L182 F183 S306 R308	L182-D186 PolarHBondContact O-N 2.99Å; F183-D186 PolarHBondContact O-N 3.13Å; D186-S306 WeakPolarHBondContact OD2-CB 3.34Å; D186-S306 PolarHBondContact OD2-OG 3.03Å; D186-R308 IonicContact OD1-CZ 2.92Å; D186-R308 IonicContact OD1-NE 3.04Å; D186-R308 PolarHBondContact OD1-NE 2.91Å; D186-R308 IonicContact OD1-NH2 3.85Å; D186-R308 PolarHBondContact OD1-NH2 3.34Å; D186-R308 WeakPolarHBondContact OD2-CB 3.44Å; D186-R308 IonicContact OD2-NE 3.41Å; D186-R308 PolarHBondContact OD2-NE 2.74Å
187	F	95.6	Very high	91.8	Very high	39 Å²	39	59.1 Å²	59.1	17%	0.171	29%	0.293	C	S	.	.	H	α-helix	trans	-120.3	-6.4	-173.6	-57.5	-78.9	0	0	0	113.7	F183 K189 L194 V309	F183-F187 AromaticContact CD1-CD2 3.67Å; F183-F187 HydrophobicContact CD1-CD2 3.67Å; F183-F187 AromaticContact CD1-CE2 3.97Å; F183-F187 HydrophobicContact CD1-CE2 3.97Å; F183-F187 HydrophobicContact CE1-CD2 4.13Å; F183-F187 AromaticContact CE1-CE2 3.99Å; F183-F187 HydrophobicContact CE1-CE2 3.99Å; F183-F187 HydrophobicContact CG-CD2 4.39Å; F183-F187 WeakPolarHBondContact O-CB 3.29Å; F183-F187 PolarHBondContact O-N 2.75Å; F187-K189 HydrophobicContact CB-CB 4.36Å; F187-K189 PolarHBondContact O-N 3.37Å; F187-L194 HydrophobicContact CB-CD1 3.77Å; F187-L194 HydrophobicContact CD2-CD1 3.99Å; F187-L194 HydrophobicContact CG-CD1 3.87Å; F187-V309 HydrophobicContact CE2-CB 3.78Å; F187-V309 HydrophobicContact CE2-CG1 4.2Å; F187-V309 HydrophobicContact CE2-CG2 3.76Å; F187-V309 HydrophobicContact CZ-CB 3.99Å; F187-V309 HydrophobicContact CZ-CG1 4.38Å; F187-V309 HydrophobicContact CZ-CG2 4.45Å
188	N	95.5	Very high	93.2	Very high	138 Å²	138	51.3 Å²	51.3	74%	0.738	26%	0.26	S	S	*	.	S	Bend	trans	54.2	30.3	-171.1	-162.7	51.6	0	0	0	113	F183 L184	F183-N188 PolarHBondContact O-N 3.17Å; L184-N188 WeakPolarHBondContact O-CA 3.43Å; L184-N188 PolarHBondContact O-N 3.43Å; L184-N188 VanDerWaalsContact O-N 3.09Å
189	K	95.1	Very high	93.8	Very high	99 Å²	99	52 Å²	52	43%	0.43	27%	0.265	S	S	.	.	S	Bend	trans	-144.1	154.7	-178.3	-70.4	-179.4	-177.2	-179.7	0	109.6	F183 L184 F187 Q193 L194	F183-K189 CarbonylContact C-O 3.59Å; F183-K189 WeakPolarHBondContact CB-O 3.34Å; L184-K189 PolarHBondContact N-O 2.98Å; F187-K189 HydrophobicContact CB-CB 4.36Å; F187-K189 PolarHBondContact O-N 3.37Å; K189-Q193 VanDerWaalsContact CA-OE1 3.23Å; K189-Q193 HydrophobicContact CB-CB 4.15Å; K189-L194 HydrophobicContact CB-CD1 3.84Å; K189-L194 HydrophobicContact CB-CG 4Å; K189-L194 HydrophobicContact CD-CD2 4.12Å; K189-L194 HydrophobicContact CD-CG 4Å
190	T	94.2	Very high	94	Very high	33 Å²	33	54.6 Å²	54.6	20%	0.202	28%	0.275	C	S	.	.			trans	-85.9	164.5	169.8	71.8	0	0	0	0	111	L184 E192 Q193 L194	L184-T190 HydrophobicContact CD2-CG2 4Å; L184-T190 HydrophobicContact CG-CG2 4.28Å; T190-E192 VanDerWaalsContact C-N 3.25Å; T190-E192 VanDerWaalsContact CB-OE2 3.23Å; T190-E192 WeakPolarHBondContact CB-OE2 3.45Å; T190-E192 PolarHBondContact O-N 3.49Å; T190-E192 PolarHBondContact OG1-OE2 3.31Å; T190-Q193 PolarHBondContact O-N 2.91Å; T190-L194 PolarHBondContact O-N 2.93Å
191	P	94.6	Very high	93.9	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-53.4	-40.1	174.8	-26.7	35.7	0	0	0	113.3	V179 F183 Q193 L194 F195 F198 Y200	V179-P191 HydrophobicContact CG1-CG 3.99Å; F183-P191 HydrophobicContact CB-CG 4.28Å; F183-P191 HydrophobicContact CD1-CG 4.31Å; F183-P191 HydrophobicContact CD2-CG 3.82Å; F183-P191 HydrophobicContact CE2-CG 4.18Å; F183-P191 HydrophobicContact CG-CG 3.86Å; P191-Q193 PolarHBondContact O-N 3.38Å; P191-L194 PolarHBondContact O-N 3.42Å; P191-L194 VanDerWaalsContact O-N 3.11Å; P191-F195 HydrophobicContact CB-CD2 4.46Å; P191-F195 WeakPolarHBondContact O-CD2 3.49Å; P191-F195 PolarHBondContact O-N 3.42Å; P191-F198 HydrophobicContact CB-CB 4.06Å; P191-F198 HydrophobicContact CB-CD1 3.79Å; P191-F198 HydrophobicContact CB-CD2 3.85Å; P191-F198 HydrophobicContact CB-CE1 4.18Å; P191-F198 HydrophobicContact CB-CE2 4.23Å; P191-F198 HydrophobicContact CB-CG 3.61Å; P191-F198 HydrophobicContact CB-CZ 4.39Å; P191-F198 HydrophobicContact CG-CD1 4.42Å; P191-F198 HydrophobicContact CG-CE1 4.4Å; P191-Y200 HydrophobicContact CG-CE1 4.36Å
192	E	93.1	Very high	94	Very high	101 Å²	101	57.7 Å²	57.7	47%	0.472	28%	0.284	S	S	.	.	H	α-helix	trans	-67.4	-17.1	179.9	-53.4	86.3	176.3	0	0	114	T190 Y200 Y217	T190-E192 VanDerWaalsContact C-N 3.25Å; T190-E192 VanDerWaalsContact CB-OE2 3.23Å; T190-E192 WeakPolarHBondContact CB-OE2 3.45Å; T190-E192 PolarHBondContact O-N 3.49Å; T190-E192 PolarHBondContact OG1-OE2 3.31Å; E192-Y200 VanDerWaalsContact OE1-CE2 3.28Å; E192-Y200 WeakPolarHBondContact OE1-CE2 3.34Å; E192-Y200 VanDerWaalsContact OE1-CZ 3.3Å; E192-Y200 PolarHBondContact OE1-OH 2.98Å; E192-Y200 PolarHBondContact OE2-OH 2.89Å; E192-Y217 PolarHBondContact O-OH 2.93Å
193	Q	94.3	Very high	93.9	Very high	107 Å²	107	61.8 Å²	61.8	50%	0.5	31%	0.305	S	S	.	.	H	α-helix	trans	-92.2	-18.6	176	-65.2	176.4	-37.9	0	0	112.9	K189 T190 P191 Y217	K189-Q193 VanDerWaalsContact CA-OE1 3.23Å; K189-Q193 HydrophobicContact CB-CB 4.15Å; T190-Q193 PolarHBondContact O-N 2.91Å; P191-Q193 PolarHBondContact O-N 3.38Å; Q193-Y217 PolarHBondContact O-OH 2.85Å
194	L	95.3	Very high	93.4	Very high	13 Å²	13	64.2 Å²	64.2	7%	0.068	33%	0.325	C	S	.	.	H	α-helix	trans	-98	-29.1	179.4	-82.4	153.1	0	0	0	112.2	F183 F187 K189 T190 P191 Q304	F183-L194 HydrophobicContact CD1-CD1 3.51Å; F183-L194 HydrophobicContact CE1-CD1 3.9Å; F187-L194 HydrophobicContact CB-CD1 3.77Å; F187-L194 HydrophobicContact CD2-CD1 3.99Å; F187-L194 HydrophobicContact CG-CD1 3.87Å; K189-L194 HydrophobicContact CB-CD1 3.84Å; K189-L194 HydrophobicContact CB-CG 4Å; K189-L194 HydrophobicContact CD-CD2 4.12Å; K189-L194 HydrophobicContact CD-CG 4Å; T190-L194 PolarHBondContact O-N 2.93Å; P191-L194 PolarHBondContact O-N 3.42Å; P191-L194 VanDerWaalsContact O-N 3.11Å; L194-Q304 HydrophobicContact CD2-CG 4.21Å
195	F	97.6	Very high	92.7	Very high	1 Å²	1	61.8 Å²	61.8	0%	0.004	32%	0.317	C	S	.	.			trans	-122.3	150.4	-177.1	-57.1	-79.2	0	0	0	110.4	F183 P191 T197 F198 A214 E215 L216 Y217 V222 V224 Q304 T311	F183-F195 AromaticContact CE1-CE2 3.74Å; F183-F195 HydrophobicContact CE1-CE2 3.74Å; F183-F195 HydrophobicContact CE1-CZ 4.49Å; F183-F195 AromaticContact CZ-CE2 3.98Å; F183-F195 HydrophobicContact CZ-CE2 3.98Å; P191-F195 HydrophobicContact CB-CD2 4.46Å; P191-F195 WeakPolarHBondContact O-CD2 3.49Å; P191-F195 PolarHBondContact O-N 3.42Å; F195-T197 WeakPolarHBondContact CB-O 3.37Å; F195-F198 HydrophobicContact CB-CB 4.44Å; F195-F198 AromaticContact CD2-CD2 3.63Å; F195-F198 HydrophobicContact CD2-CD2 3.63Å; F195-F198 HydrophobicContact CD2-CE2 4.28Å; F195-F198 AromaticContact CE2-CD2 3.97Å; F195-F198 HydrophobicContact CE2-CD2 3.97Å; F195-F198 HydrophobicContact CE2-CE2 4.16Å; F195-F198 HydrophobicContact CG-CD2 4.23Å; F195-A214 HydrophobicContact CB-CB 4.31Å; F195-A214 HydrophobicContact CD1-CB 3.84Å; F195-A214 HydrophobicContact CE1-CB 4.32Å; F195-A214 HydrophobicContact CG-CB 3.98Å; F195-E215 CarbonylContact C-O 3.6Å; F195-E215 WeakPolarHBondContact CB-O 3.16Å; F195-L216 HydrophobicContact CD1-CD2 3.74Å; F195-L216 HydrophobicContact CE1-CD2 3.81Å; F195-Y217 PolarHBondContact O-OH 3.48Å; F195-V222 HydrophobicContact CD1-CG2 4.13Å; F195-V222 HydrophobicContact CE1-CG2 3.9Å; F195-V224 HydrophobicContact CE1-CG2 3.83Å; F195-V224 HydrophobicContact CE2-CG1 4.43Å; F195-V224 HydrophobicContact CE2-CG2 4.25Å; F195-V224 HydrophobicContact CZ-CG1 4.12Å; F195-V224 HydrophobicContact CZ-CG2 3.62Å; F195-Q304 HydrophobicContact CE1-CB 4.12Å; F195-Q304 HydrophobicContact CE1-CG 3.93Å; F195-Q304 HydrophobicContact CZ-CB 3.88Å; F195-Q304 HydrophobicContact CZ-CG 4.02Å; F195-T311 HydrophobicContact CE1-CG2 3.97Å; F195-T311 HydrophobicContact CZ-CG2 4.3Å
196	K	97.6	Very high	91.9	Very high	117 Å²	117	62.1 Å²	62.1	51%	0.509	33%	0.327	S	S	.	.	S	Bend	trans	-69.3	-41.6	172.1	179.3	178.6	163.5	-156.7	0	111.3	E215 Y217	K196-E215 WeakPolarHBondContact CB-O 3.24Å; K196-E215 VanDerWaalsContact CD-OE1 3.29Å; K196-E215 WeakPolarHBondContact CD-OE1 3.27Å; K196-E215 WeakPolarHBondContact CE-OE1 3.23Å; K196-E215 PolarHBondContact N-O 2.96Å; K196-E215 IonicContact NZ-OE1 2.81Å; K196-E215 PolarHBondContact NZ-OE1 2.85Å; K196-Y217 HydrophobicContact CB-CD1 3.87Å; K196-Y217 HydrophobicContact CB-CE1 4.17Å; K196-Y217 HydrophobicContact CB-CG 4.42Å; K196-Y217 HydrophobicContact CG-CD1 4.44Å
197	T	97.4	Very high	90.8	Very high	74 Å²	74	60.4 Å²	60.4	45%	0.454	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	144.4	170.5	65.7	0	0	0	0	109	F195 A214 E215	F195-T197 WeakPolarHBondContact CB-O 3.37Å; T197-A214 CarbonylContact O-C 3.35Å; T197-A214 VanDerWaalsContact O-CA 3.25Å; T197-A214 WeakPolarHBondContact O-CA 3.27Å; T197-A214 VanDerWaalsContact O-CB 3.26Å; T197-A214 WeakPolarHBondContact O-CB 3.44Å; T197-E215 PolarHBondContact N-O 3.13Å; T197-E215 PolarHBondContact O-N 3.45Å; T197-E215 WeakPolarHBondContact OG1-CB 3.36Å
198	F	96.6	Very high	90.1	Very high	25 Å²	25	59 Å²	59	11%	0.11	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	121	177	-172.5	-88.2	0	0	0	109	V179 F183 P191 F195 Y200 H212 A214 V224	V179-F198 HydrophobicContact CG1-CE1 4.09Å; V179-F198 HydrophobicContact CG1-CZ 4.08Å; F183-F198 HydrophobicContact CZ-CE2 4.38Å; P191-F198 HydrophobicContact CB-CB 4.06Å; P191-F198 HydrophobicContact CB-CD1 3.79Å; P191-F198 HydrophobicContact CB-CD2 3.85Å; P191-F198 HydrophobicContact CB-CE1 4.18Å; P191-F198 HydrophobicContact CB-CE2 4.23Å; P191-F198 HydrophobicContact CB-CG 3.61Å; P191-F198 HydrophobicContact CB-CZ 4.39Å; P191-F198 HydrophobicContact CG-CD1 4.42Å; P191-F198 HydrophobicContact CG-CE1 4.4Å; F195-F198 HydrophobicContact CB-CB 4.44Å; F195-F198 AromaticContact CD2-CD2 3.63Å; F195-F198 HydrophobicContact CD2-CD2 3.63Å; F195-F198 HydrophobicContact CD2-CE2 4.28Å; F195-F198 AromaticContact CE2-CD2 3.97Å; F195-F198 HydrophobicContact CE2-CD2 3.97Å; F195-F198 HydrophobicContact CE2-CE2 4.16Å; F195-F198 HydrophobicContact CG-CD2 4.23Å; F198-Y200 HydrophobicContact CD1-CD1 4.25Å; F198-Y200 HydrophobicContact CD1-CD2 4.14Å; F198-Y200 HydrophobicContact CD1-CE1 4.19Å; F198-Y200 HydrophobicContact CD1-CE2 4.1Å; F198-Y200 HydrophobicContact CD1-CG 4.22Å; F198-Y200 HydrophobicContact CE1-CD1 4.1Å; F198-Y200 HydrophobicContact CE1-CE1 4.16Å; F198-Y200 HydrophobicContact CE1-CG 4.39Å; F198-H212 HydrophobicContact CE1-CB 4.08Å; F198-H212 AromaticContact CE1-CG 3.93Å; F198-H212 AromaticContact CE1-ND1 3.94Å; F198-H212 HydrophobicContact CE2-CB 3.98Å; F198-H212 HydrophobicContact CZ-CB 3.54Å; F198-H212 AromaticContact CZ-CG 3.6Å; F198-A214 HydrophobicContact CB-CB 4.48Å; F198-A214 HydrophobicContact CD2-CB 3.71Å; F198-A214 HydrophobicContact CE2-CB 4.4Å; F198-A214 HydrophobicContact CG-CB 4.45Å; F198-V224 HydrophobicContact CE2-CB 3.99Å; F198-V224 HydrophobicContact CE2-CG1 4.02Å; F198-V224 HydrophobicContact CE2-CG2 4.11Å
199	D	94.1	Very high	89.7	Confident	75 Å²	75	52.6 Å²	52.6	40%	0.401	28%	0.28	S	S	.	.			trans	-86.1	111.5	176.6	-166.2	-13.4	0	0	0	110.1	E201 H212 K213	D199-E201 PolarHBondContact O-N 3.32Å; D199-E201 WeakPolarHBondContact OD1-CB 3.3Å; D199-E201 PolarHBondContact OD1-N 2.89Å; D199-H212 WeakPolarHBondContact O-CB 3.24Å; D199-H212 PolarHBondContact O-ND1 2.86Å; D199-K213 HydrophobicContact CB-CB 4.46Å; D199-K213 VanDerWaalsContact CB-O 3.29Å; D199-K213 WeakPolarHBondContact CB-O 3.34Å; D199-K213 PolarHBondContact N-O 3.27Å
200	Y	91	Very high	89.4	Confident	55 Å²	55	48.2 Å²	48.2	22%	0.216	26%	0.261	C	S	.	.	S	Bend	trans	-71.4	-17.3	177	-79.2	-82	0	0	0	113.1	Y176 V179 D180 P191 E192 F198 P202 H212	Y176-Y200 WeakPolarHBondContact CD1-O 3.49Å; Y176-Y200 WeakPolarHBondContact CE1-O 3.21Å; V179-Y200 HydrophobicContact CB-CE1 4.37Å; V179-Y200 HydrophobicContact CG1-CE1 4.33Å; D180-Y200 VanDerWaalsContact OD1-CE1 3.29Å; D180-Y200 WeakPolarHBondContact OD1-CE1 3.48Å; D180-Y200 PolarHBondContact OD1-OH 3.39Å; P191-Y200 HydrophobicContact CG-CE1 4.36Å; E192-Y200 VanDerWaalsContact OE1-CE2 3.28Å; E192-Y200 WeakPolarHBondContact OE1-CE2 3.34Å; E192-Y200 VanDerWaalsContact OE1-CZ 3.3Å; E192-Y200 PolarHBondContact OE1-OH 2.98Å; E192-Y200 PolarHBondContact OE2-OH 2.89Å; F198-Y200 HydrophobicContact CD1-CD1 4.25Å; F198-Y200 HydrophobicContact CD1-CD2 4.14Å; F198-Y200 HydrophobicContact CD1-CE1 4.19Å; F198-Y200 HydrophobicContact CD1-CE2 4.1Å; F198-Y200 HydrophobicContact CD1-CG 4.22Å; F198-Y200 HydrophobicContact CE1-CD1 4.1Å; F198-Y200 HydrophobicContact CE1-CE1 4.16Å; F198-Y200 HydrophobicContact CE1-CG 4.39Å; Y200-P202 WeakPolarHBondContact O-CD 3.35Å; Y200-H212 PolarHBondContact O-CE1 2.8Å
201	E	89.4	Confident	89.3	Confident	130 Å²	130	48.4 Å²	48.4	61%	0.607	26%	0.262	S	S	*	.	S	Bend	trans	-78.5	118.2	169.9	-166.5	167.9	178.6	0	0	109.2	D199 I203	D199-E201 PolarHBondContact O-N 3.32Å; D199-E201 WeakPolarHBondContact OD1-CB 3.3Å; D199-E201 PolarHBondContact OD1-N 2.89Å; E201-I203 PolarHBondContact O-N 3.22Å
202	P	89.6	Confident	89.2	Confident	26 Å²	26	48.4 Å²	48.4	17%	0.169	26%	0.262	C	S	.	.			trans	-70.5	131.4	-179	28.6	-33.5	0	0	0	110.4	Y200 A204 Q210 V211	Y200-P202 WeakPolarHBondContact O-CD 3.35Å; P202-A204 PolarHBondContact O-N 3.09Å; P202-Q210 HydrophobicContact CB-CB 4.04Å; P202-V211 CarbonylContact C-O 3.55Å; P202-V211 VanDerWaalsContact CA-O 3.23Å; P202-V211 WeakPolarHBondContact CA-O 3.49Å; P202-V211 WeakPolarHBondContact CB-O 3.33Å
203	I	88.6	Confident	89.4	Confident	87 Å²	87	47.9 Å²	47.9	45%	0.446	26%	0.258	S	S	.	.	S	Bend	trans	-72	-22.6	173.1	59.4	168.5	0	0	0	112.1	E201 V211 K213 F314	E201-I203 PolarHBondContact O-N 3.22Å; I203-V211 HydrophobicContact CD1-CG1 4Å; I203-V211 HydrophobicContact CG1-CB 4.19Å; I203-V211 HydrophobicContact CG1-CG1 4.01Å; I203-V211 VanDerWaalsContact CG1-O 3.27Å; I203-V211 WeakPolarHBondContact CG1-O 3.38Å; I203-V211 PolarHBondContact N-O 3.01Å; I203-K213 HydrophobicContact CG2-CB 4.02Å; I203-F314 HydrophobicContact CD1-CD2 4.37Å; I203-F314 HydrophobicContact CD1-CE2 3.68Å
204	A	83	Confident	89.6	Confident	51 Å²	51	43 Å²	43	42%	0.421	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	147	174.8	0	0	0	0	0	110.1	P202 V211	P202-A204 PolarHBondContact O-N 3.09Å; A204-V211 HydrophobicContact CB-CB 4.26Å; A204-V211 HydrophobicContact CB-CG2 4.46Å; A204-V211 PolarHBondContact N-O 2.8Å; A204-V211 PolarHBondContact O-N 3.38Å
205	A	78.9	Confident	89.7	Confident	30 Å²	30	44.9 Å²	44.9	25%	0.248	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	138.1	172.1	0	0	0	0	0	109.3	A171	A171-A205 HydrophobicContact CB-CB 4.41Å
206	A	73.9	Confident	89.7	Confident	54 Å²	54	45.4 Å²	45.4	45%	0.446	25%	0.247	S	C	.	.			trans	-125.7	-172	179.2	0	0	0	0	0	110.1	L208 A209 Y228	A206-L208 PolarHBondContact O-N 3.47Å; A206-A209 PolarHBondContact N-O 3.43Å; A206-Y228 WeakPolarHBondContact O-CE2 3.49Å; A206-Y228 PolarHBondContact O-OH 2.99Å
207	S	71.8	Confident	89.6	Confident	13 Å²	13	46.8 Å²	46.8	9%	0.091	25%	0.25	C	C	.	.	S	Bend	trans	-70.8	-30	-175.9	50.1	0	0	0	0	114.3	K144 Q147	K144-S207 VanDerWaalsContact CD-OG 3.24Å; K144-S207 WeakPolarHBondContact CD-OG 3.4Å; Q147-S207 PolarHBondContact OE1-OG 2.87Å
208	L	79.8	Confident	89.5	Confident	10 Å²	10	48.8 Å²	48.8	5%	0.052	26%	0.258	C	S	.	.	S	Bend	trans	-110.7	-20.3	-177.9	-61	178.3	0	0	0	114.8	K144 A206 Q227 Y228 L231 L269 E272 L273	K144-L208 HydrophobicContact CB-CD2 4.02Å; K144-L208 HydrophobicContact CB-CG 4.46Å; K144-L208 HydrophobicContact CD-CD1 4.04Å; K144-L208 HydrophobicContact CD-CG 4.03Å; K144-L208 HydrophobicContact CG-CD1 4.06Å; K144-L208 HydrophobicContact CG-CD2 4.05Å; K144-L208 HydrophobicContact CG-CG 4.08Å; A206-L208 PolarHBondContact O-N 3.47Å; L208-Q227 WeakPolarHBondContact O-CA 3.41Å; L208-Y228 WeakPolarHBondContact O-CD2 3.46Å; L208-Y228 PolarHBondContact O-N 3.02Å; L208-L231 HydrophobicContact CB-CD1 4.04Å; L208-L231 HydrophobicContact CD2-CD1 3.76Å; L208-L231 HydrophobicContact CD2-CD2 4.34Å; L208-L231 WeakPolarHBondContact O-CD1 3.36Å; L208-L269 HydrophobicContact CD1-CD1 3.86Å; L208-L269 HydrophobicContact CD2-CD1 4.28Å; L208-E272 HydrophobicContact CD1-CB 3.93Å; L208-E272 WeakPolarHBondContact CD1-OE2 3.08Å; L208-L273 HydrophobicContact CD1-CD2 4.2Å; L208-L273 HydrophobicContact CD2-CD2 4.28Å
209	A	87.2	Confident	89.5	Confident	3 Å²	3	49.5 Å²	49.5	3%	0.025	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	162.9	-168.9	0	0	0	0	0	112	A206 K225 V226 F275	A206-A209 PolarHBondContact N-O 3.43Å; A209-K225 HydrophobicContact CB-CG 3.92Å; A209-V226 CarbonylContact C-O 3.6Å; A209-V226 WeakPolarHBondContact CA-O 3.34Å; A209-V226 VanDerWaalsContact CB-O 3.24Å; A209-V226 WeakPolarHBondContact CB-O 3.38Å; A209-F275 HydrophobicContact CB-CE2 4.25Å; A209-F275 HydrophobicContact CB-CZ 3.72Å
210	Q	88.5	Confident	89.6	Confident	8 Å²	8	48.1 Å²	48.1	4%	0.037	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	146.6	172.6	55.8	-172.7	40.2	0	0	109.5	P202 H212 K225 V226 Y228	P202-Q210 HydrophobicContact CB-CB 4.04Å; Q210-H212 WeakPolarHBondContact CG-NE2 3.46Å; Q210-H212 PolarHBondContact NE2-NE2 2.86Å; Q210-K225 CarbonylContact O-C 3.45Å; Q210-K225 WeakPolarHBondContact O-CA 3.46Å; Q210-V226 HydrophobicContact CG-CB 4.34Å; Q210-V226 PolarHBondContact N-O 3.4Å; Q210-V226 PolarHBondContact O-N 3.33Å; Q210-Y228 HydrophobicContact CB-CE1 4.44Å; Q210-Y228 HydrophobicContact CG-CE1 4.4Å
211	V	92.1	Very high	90	Very high	36 Å²	36	47.5 Å²	47.5	22%	0.218	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	126.4	-179	-174	0	0	0	0	108.3	P202 I203 A204 A223 V224 K225	P202-V211 CarbonylContact C-O 3.55Å; P202-V211 VanDerWaalsContact CA-O 3.23Å; P202-V211 WeakPolarHBondContact CA-O 3.49Å; P202-V211 WeakPolarHBondContact CB-O 3.33Å; I203-V211 HydrophobicContact CD1-CG1 4Å; I203-V211 HydrophobicContact CG1-CB 4.19Å; I203-V211 HydrophobicContact CG1-CG1 4.01Å; I203-V211 VanDerWaalsContact CG1-O 3.27Å; I203-V211 WeakPolarHBondContact CG1-O 3.38Å; I203-V211 PolarHBondContact N-O 3.01Å; A204-V211 HydrophobicContact CB-CB 4.26Å; A204-V211 HydrophobicContact CB-CG2 4.46Å; A204-V211 PolarHBondContact N-O 2.8Å; A204-V211 PolarHBondContact O-N 3.38Å; V211-A223 HydrophobicContact CG1-CB 4.01Å; V211-V224 WeakPolarHBondContact CA-O 3.36Å; V211-K225 HydrophobicContact CG2-CB 4.28Å; V211-K225 HydrophobicContact CG2-CG 4.15Å
212	H	94.3	Very high	90.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	151.4	177.8	-65.9	-90.5	0	0	0	110.2	F198 D199 Y200 Q210 A223 V224	F198-H212 HydrophobicContact CE1-CB 4.08Å; F198-H212 AromaticContact CE1-CG 3.93Å; F198-H212 AromaticContact CE1-ND1 3.94Å; F198-H212 HydrophobicContact CE2-CB 3.98Å; F198-H212 HydrophobicContact CZ-CB 3.54Å; F198-H212 AromaticContact CZ-CG 3.6Å; D199-H212 WeakPolarHBondContact O-CB 3.24Å; D199-H212 PolarHBondContact O-ND1 2.86Å; Y200-H212 PolarHBondContact O-CE1 2.8Å; Q210-H212 WeakPolarHBondContact CG-NE2 3.46Å; Q210-H212 PolarHBondContact NE2-NE2 2.86Å; H212-A223 WeakPolarHBondContact O-CA 3.19Å; H212-V224 HydrophobicContact CB-CB 4.43Å; H212-V224 PolarHBondContact N-O 3.33Å; H212-V224 PolarHBondContact O-N 3.06Å
213	K	96.4	Very high	90.8	Very high	90 Å²	90	41.1 Å²	41.1	39%	0.391	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	136.1	169.1	-169.8	177.5	179.7	-173.9	0	109	D199 I203 F314	D199-K213 HydrophobicContact CB-CB 4.46Å; D199-K213 VanDerWaalsContact CB-O 3.29Å; D199-K213 WeakPolarHBondContact CB-O 3.34Å; D199-K213 PolarHBondContact N-O 3.27Å; I203-K213 HydrophobicContact CG2-CB 4.02Å; K213-F314 HydrophobicContact CD-CE2 4.38Å; K213-F314 HydrophobicContact CD-CZ 4.45Å; K213-F314 HydrophobicContact CG-CD2 4.34Å; K213-F314 HydrophobicContact CG-CE2 4.42Å
214	A	97.6	Very high	91.2	Very high	4 Å²	4	37 Å²	37	3%	0.033	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	170	176.7	0	0	0	0	0	111.2	F195 T197 F198 V222 V224	F195-A214 HydrophobicContact CB-CB 4.31Å; F195-A214 HydrophobicContact CD1-CB 3.84Å; F195-A214 HydrophobicContact CE1-CB 4.32Å; F195-A214 HydrophobicContact CG-CB 3.98Å; T197-A214 CarbonylContact O-C 3.35Å; T197-A214 VanDerWaalsContact O-CA 3.25Å; T197-A214 WeakPolarHBondContact O-CA 3.27Å; T197-A214 VanDerWaalsContact O-CB 3.26Å; T197-A214 WeakPolarHBondContact O-CB 3.44Å; F198-A214 HydrophobicContact CB-CB 4.48Å; F198-A214 HydrophobicContact CD2-CB 3.71Å; F198-A214 HydrophobicContact CE2-CB 4.4Å; F198-A214 HydrophobicContact CG-CB 4.45Å; A214-V222 HydrophobicContact CB-CG2 3.89Å; A214-V222 PolarHBondContact N-O 3.05Å; A214-V222 PolarHBondContact O-N 3.24Å; A214-V224 HydrophobicContact CB-CG2 3.76Å
215	E	98.3	Very high	91.8	Very high	54 Å²	54	36.5 Å²	36.5	25%	0.252	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	131.3	174.6	-165.6	-178.5	114.2	0	0	109.5	F195 K196 T197 T220	F195-E215 CarbonylContact C-O 3.6Å; F195-E215 WeakPolarHBondContact CB-O 3.16Å; K196-E215 WeakPolarHBondContact CB-O 3.24Å; K196-E215 VanDerWaalsContact CD-OE1 3.29Å; K196-E215 WeakPolarHBondContact CD-OE1 3.27Å; K196-E215 WeakPolarHBondContact CE-OE1 3.23Å; K196-E215 PolarHBondContact N-O 2.96Å; K196-E215 IonicContact NZ-OE1 2.81Å; K196-E215 PolarHBondContact NZ-OE1 2.85Å; T197-E215 PolarHBondContact N-O 3.13Å; T197-E215 PolarHBondContact O-N 3.45Å; T197-E215 WeakPolarHBondContact OG1-CB 3.36Å; E215-T220 WeakPolarHBondContact CA-O 3.43Å
216	L	97.6	Very high	92.4	Very high	11 Å²	11	35.1 Å²	35.1	6%	0.058	20%	0.198	C	C	.	.			trans	-73.9	165.4	171.7	-64.1	177.4	0	0	0	111	F195 D218 G219 T220 V222 F301 Q304	F195-L216 HydrophobicContact CD1-CD2 3.74Å; F195-L216 HydrophobicContact CE1-CD2 3.81Å; L216-D218 WeakPolarHBondContact CB-OD1 3.47Å; L216-D218 PolarHBondContact O-N 2.85Å; L216-G219 PolarHBondContact O-N 3.5Å; L216-T220 PolarHBondContact N-O 2.89Å; L216-V222 HydrophobicContact CD1-CG1 3.87Å; L216-V222 HydrophobicContact CD2-CG2 4.49Å; L216-V222 HydrophobicContact CG-CG1 3.89Å; L216-V222 HydrophobicContact CG-CG2 4.32Å; L216-F301 HydrophobicContact CD1-CD1 3.4Å; L216-F301 VanDerWaalsContact CD1-CD1 3.4Å; L216-F301 HydrophobicContact CD1-CE1 3.5Å; L216-F301 HydrophobicContact CD1-CG 3.96Å; L216-F301 HydrophobicContact CD1-CZ 4.15Å; L216-Q304 HydrophobicContact CD2-CG 4.09Å
217	Y	95.9	Very high	93.3	Very high	146 Å²	146	32.8 Å²	32.8	57%	0.573	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-22.4	179.7	-69.7	-72.6	0	0	0	114.1	E192 Q193 F195 K196 G219	E192-Y217 PolarHBondContact O-OH 2.93Å; Q193-Y217 PolarHBondContact O-OH 2.85Å; F195-Y217 PolarHBondContact O-OH 3.48Å; K196-Y217 HydrophobicContact CB-CD1 3.87Å; K196-Y217 HydrophobicContact CB-CE1 4.17Å; K196-Y217 HydrophobicContact CB-CG 4.42Å; K196-Y217 HydrophobicContact CG-CD1 4.44Å; Y217-G219 PolarHBondContact O-N 2.81Å
218	D	95.5	Very high	94	Very high	117 Å²	117	32.4 Å²	32.4	63%	0.626	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-1.4	173.2	68.4	1.5	0	0	0	113.6	L216 T220	L216-D218 WeakPolarHBondContact CB-OD1 3.47Å; L216-D218 PolarHBondContact O-N 2.85Å; D218-T220 VanDerWaalsContact CG-OG1 3.23Å; D218-T220 WeakPolarHBondContact OD1-CB 3.44Å; D218-T220 PolarHBondContact OD1-N 2.76Å; D218-T220 PolarHBondContact OD1-OG1 2.78Å; D218-T220 PolarHBondContact OD2-OG1 2.89Å
219	G	96	Very high	94.1	Very high	39 Å²	39	32.5 Å²	32.5	40%	0.402	17%	0.174	S	C	.	.	S	Bend	trans	89.8	0	-178.2	0	0	0	0	0	114.6	L216 Y217 S221	L216-G219 PolarHBondContact O-N 3.5Å; Y217-G219 PolarHBondContact O-N 2.81Å; G219-S221 PolarHBondContact O-N 2.81Å
220	T	97.3	Very high	93.6	Very high	47 Å²	47	33.3 Å²	33.3	29%	0.288	18%	0.178	S	C	.	.			trans	-69.3	125.6	178.8	-54.7	0	0	0	0	111.1	E215 L216 D218 V222 F301	E215-T220 WeakPolarHBondContact CA-O 3.43Å; L216-T220 PolarHBondContact N-O 2.89Å; D218-T220 VanDerWaalsContact CG-OG1 3.23Å; D218-T220 WeakPolarHBondContact OD1-CB 3.44Å; D218-T220 PolarHBondContact OD1-N 2.76Å; D218-T220 PolarHBondContact OD1-OG1 2.78Å; D218-T220 PolarHBondContact OD2-OG1 2.89Å; T220-V222 HydrophobicContact CG2-CG1 4.33Å; T220-F301 HydrophobicContact CG2-CE1 4.32Å; T220-F301 HydrophobicContact CG2-CZ 3.74Å
221	S	98.1	Very high	93.1	Very high	42 Å²	42	32.9 Å²	32.9	29%	0.294	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	130.7	173.9	-170.5	0	0	0	0	110.5	G219 F314	G219-S221 PolarHBondContact O-N 2.81Å; S221-F314 WeakPolarHBondContact O-CB 3.46Å; S221-F314 PolarHBondContact O-N 3.47Å; S221-F314 WeakPolarHBondContact OG-CB 3.27Å
222	V	98.3	Very high	92.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	150.6	-177.7	-63.4	0	0	0	0	112.2	F195 A214 L216 T220 V224 F301 T311 A312	F195-V222 HydrophobicContact CD1-CG2 4.13Å; F195-V222 HydrophobicContact CE1-CG2 3.9Å; A214-V222 HydrophobicContact CB-CG2 3.89Å; A214-V222 PolarHBondContact N-O 3.05Å; A214-V222 PolarHBondContact O-N 3.24Å; L216-V222 HydrophobicContact CD1-CG1 3.87Å; L216-V222 HydrophobicContact CD2-CG2 4.49Å; L216-V222 HydrophobicContact CG-CG1 3.89Å; L216-V222 HydrophobicContact CG-CG2 4.32Å; T220-V222 HydrophobicContact CG2-CG1 4.33Å; V222-V224 HydrophobicContact CG2-CG2 4Å; V222-F301 HydrophobicContact CG1-CD2 3.8Å; V222-F301 HydrophobicContact CG1-CE2 3.62Å; V222-F301 HydrophobicContact CG1-CG 4.47Å; V222-F301 HydrophobicContact CG1-CZ 4.14Å; V222-T311 HydrophobicContact CB-CG2 3.85Å; V222-T311 HydrophobicContact CG1-CG2 4.13Å; V222-T311 HydrophobicContact CG2-CG2 3.87Å; V222-A312 CarbonylContact C-O 3.49Å; V222-A312 VanDerWaalsContact CA-O 3.27Å; V222-A312 WeakPolarHBondContact CA-O 3.49Å; V222-A312 WeakPolarHBondContact CB-O 3.39Å
223	A	97.6	Very high	91.5	Very high	22 Å²	22	38.3 Å²	38.3	18%	0.182	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	126.2	165.9	0	0	0	0	0	108.6	V211 H212 A312 F314	V211-A223 HydrophobicContact CG1-CB 4.01Å; H212-A223 WeakPolarHBondContact O-CA 3.19Å; A223-A312 PolarHBondContact N-O 2.81Å; A223-A312 PolarHBondContact O-N 3.1Å; A223-F314 HydrophobicContact CB-CD2 4.19Å
224	V	97.2	Very high	90.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	102.5	-176.9	-170.5	0	0	0	0	109	F183 F195 F198 V211 H212 A214 V222 V226 V309 L310 T311	F183-V224 HydrophobicContact CZ-CG1 3.9Å; F195-V224 HydrophobicContact CE1-CG2 3.83Å; F195-V224 HydrophobicContact CE2-CG1 4.43Å; F195-V224 HydrophobicContact CE2-CG2 4.25Å; F195-V224 HydrophobicContact CZ-CG1 4.12Å; F195-V224 HydrophobicContact CZ-CG2 3.62Å; F198-V224 HydrophobicContact CE2-CB 3.99Å; F198-V224 HydrophobicContact CE2-CG1 4.02Å; F198-V224 HydrophobicContact CE2-CG2 4.11Å; V211-V224 WeakPolarHBondContact CA-O 3.36Å; H212-V224 HydrophobicContact CB-CB 4.43Å; H212-V224 PolarHBondContact N-O 3.33Å; H212-V224 PolarHBondContact O-N 3.06Å; A214-V224 HydrophobicContact CB-CG2 3.76Å; V222-V224 HydrophobicContact CG2-CG2 4Å; V224-V226 HydrophobicContact CG1-CG2 3.97Å; V224-V309 HydrophobicContact CG1-CG1 3.65Å; V224-L310 CarbonylContact C-O 3.58Å; V224-L310 WeakPolarHBondContact CA-O 3.35Å; V224-T311 HydrophobicContact CG2-CG2 4.25Å
225	K	94.8	Very high	90.1	Very high	40 Å²	40	35.2 Å²	35.2	17%	0.174	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	118.1	177.6	-171.7	-173.2	-171.2	-175.2	0	108.7	A209 Q210 V211 F275 E278 V309 L310	A209-K225 HydrophobicContact CB-CG 3.92Å; Q210-K225 CarbonylContact O-C 3.45Å; Q210-K225 WeakPolarHBondContact O-CA 3.46Å; V211-K225 HydrophobicContact CG2-CB 4.28Å; V211-K225 HydrophobicContact CG2-CG 4.15Å; K225-F275 HydrophobicContact CB-CE2 4.21Å; K225-F275 HydrophobicContact CD-CE1 4.02Å; K225-F275 HydrophobicContact CD-CE2 3.94Å; K225-F275 HydrophobicContact CD-CZ 3.57Å; K225-F275 HydrophobicContact CG-CE2 3.7Å; K225-F275 HydrophobicContact CG-CZ 3.67Å; K225-F275 WeakPolarHBondContact O-CE2 3.32Å; K225-E278 IonicContact NZ-OE1 3.76Å; K225-E278 PolarHBondContact NZ-OE1 3.06Å; K225-E278 IonicContact NZ-OE2 3.92Å; K225-E278 PolarHBondContact NZ-OE2 3.39Å; K225-V309 CarbonylContact O-C 3.42Å; K225-V309 WeakPolarHBondContact O-CA 3.48Å; K225-L310 HydrophobicContact CB-CB 4.19Å; K225-L310 HydrophobicContact CD-CD2 4.29Å; K225-L310 PolarHBondContact N-O 3.4Å; K225-L310 PolarHBondContact O-N 2.97Å
226	V	93.4	Very high	89.5	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	122.9	-174.6	-174.6	0	0	0	0	109.1	L182 F183 A209 Q210 V224 V309	L182-V226 HydrophobicContact CD1-CG1 3.88Å; L182-V226 HydrophobicContact CD2-CG1 4.07Å; L182-V226 HydrophobicContact CG-CG1 4.43Å; F183-V226 HydrophobicContact CE2-CG1 4.41Å; F183-V226 HydrophobicContact CE2-CG2 3.81Å; F183-V226 HydrophobicContact CZ-CG2 4.36Å; A209-V226 CarbonylContact C-O 3.6Å; A209-V226 WeakPolarHBondContact CA-O 3.34Å; A209-V226 VanDerWaalsContact CB-O 3.24Å; A209-V226 WeakPolarHBondContact CB-O 3.38Å; Q210-V226 HydrophobicContact CG-CB 4.34Å; Q210-V226 PolarHBondContact N-O 3.4Å; Q210-V226 PolarHBondContact O-N 3.33Å; V224-V226 HydrophobicContact CG1-CG2 3.97Å; V226-V309 HydrophobicContact CG1-CG2 4.48Å
227	Q	91	Very high	88.8	Confident	6 Å²	6	39.7 Å²	39.7	3%	0.028	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	152.6	176.1	-66.1	-177.9	10.1	0	0	111.8	L182 L208 I229 L273 F275 K307 R308	L182-Q227 WeakPolarHBondContact CD1-O 3.47Å; L208-Q227 WeakPolarHBondContact O-CA 3.41Å; Q227-I229 PolarHBondContact O-N 3.38Å; Q227-L273 VanDerWaalsContact NE2-C 3.27Å; Q227-L273 PolarHBondContact NE2-O 2.98Å; Q227-F275 HydrophobicContact CB-CE2 4.47Å; Q227-F275 HydrophobicContact CG-CD2 3.96Å; Q227-F275 HydrophobicContact CG-CE1 4.06Å; Q227-F275 HydrophobicContact CG-CE2 3.37Å; Q227-F275 HydrophobicContact CG-CZ 3.43Å; Q227-F275 VanDerWaalsContact CG-CZ 3.43Å; Q227-K307 PolarHBondContact NE2-O 3.07Å; Q227-K307 VanDerWaalsContact NE2-O 3.1Å; Q227-R308 HydrophobicContact CB-CB 4.32Å; Q227-R308 HydrophobicContact CG-CB 4.42Å; Q227-R308 PolarHBondContact N-O 2.97Å
228	Y	86.4	Confident	88.5	Confident	5 Å²	5	32.9 Å²	32.9	2%	0.02	19%	0.191	C	C	.	.			trans	-67.6	131	166.9	-57.9	-61.2	0	0	0	110.5	L172 R174 A206 L208 Q210 D230 L231	L172-Y228 PolarHBondContact O-OH 3.28Å; R174-Y228 HydrophobicContact CB-CD1 4.19Å; R174-Y228 HydrophobicContact CB-CE1 3.89Å; R174-Y228 HydrophobicContact CG-CD1 4.29Å; R174-Y228 HydrophobicContact CG-CE1 4.02Å; A206-Y228 WeakPolarHBondContact O-CE2 3.49Å; A206-Y228 PolarHBondContact O-OH 2.99Å; L208-Y228 WeakPolarHBondContact O-CD2 3.46Å; L208-Y228 PolarHBondContact O-N 3.02Å; Q210-Y228 HydrophobicContact CB-CE1 4.44Å; Q210-Y228 HydrophobicContact CG-CE1 4.4Å; Y228-D230 PolarHBondContact O-N 3.22Å; Y228-D230 VanDerWaalsContact O-N 3.14Å; Y228-L231 HydrophobicContact CD2-CD1 3.83Å; Y228-L231 HydrophobicContact CG-CD1 4.3Å; Y228-L231 PolarHBondContact O-N 2.84Å; Y228-L231 VanDerWaalsContact O-N 3.16Å
229	I	82.1	Confident	88.1	Confident	11 Å²	11	27.3 Å²	27.3	6%	0.056	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-24.3	-167.2	-160	168.7	0	0	0	113.9	E178 A181 L182 Q227	E178-I229 HydrophobicContact CB-CG2 4Å; E178-I229 HydrophobicContact CG-CG2 3.96Å; A181-I229 HydrophobicContact CB-CD1 3.66Å; L182-I229 HydrophobicContact CB-CD1 4.02Å; L182-I229 HydrophobicContact CB-CG1 4.29Å; L182-I229 HydrophobicContact CD1-CB 4.45Å; Q227-I229 PolarHBondContact O-N 3.38Å
230	D	77.1	Confident	87.7	Confident	20 Å²	20	32.2 Å²	32.2	11%	0.107	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-19.6	-179.4	69.4	-45.4	0	0	0	113.9	I76 R174 Y228 D233 R234	I76-D230 HydrophobicContact CD1-CB 4.1Å; R174-D230 IonicContact CZ-OD1 2.79Å; R174-D230 IonicContact CZ-OD2 3.21Å; R174-D230 VanDerWaalsContact NH1-CG 3.25Å; R174-D230 IonicContact NH1-OD1 3.36Å; R174-D230 PolarHBondContact NH1-OD1 2.75Å; R174-D230 IonicContact NH1-OD2 2.87Å; R174-D230 PolarHBondContact NH1-OD2 2.78Å; R174-D230 IonicContact NH2-OD2 3.85Å; Y228-D230 PolarHBondContact O-N 3.22Å; Y228-D230 VanDerWaalsContact O-N 3.14Å; D230-D233 PolarHBondContact O-N 3.43Å; D230-R234 WeakPolarHBondContact O-CD 3.22Å; D230-R234 WeakPolarHBondContact O-CG 2.89Å; D230-R234 PolarHBondContact O-N 3.48Å; D230-R234 VanDerWaalsContact O-N 3.11Å; D230-R234 IonicContact OD2-CZ 2.79Å; D230-R234 IonicContact OD2-NH1 3.96Å; D230-R234 PolarHBondContact OD2-NH1 3.46Å
231	L	77.4	Confident	87.2	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.7	-47.9	-169.1	-76.7	173.1	0	0	0	113.4	L208 Y228 R234 F235 L273	L208-L231 HydrophobicContact CB-CD1 4.04Å; L208-L231 HydrophobicContact CD2-CD1 3.76Å; L208-L231 HydrophobicContact CD2-CD2 4.34Å; L208-L231 WeakPolarHBondContact O-CD1 3.36Å; Y228-L231 HydrophobicContact CD2-CD1 3.83Å; Y228-L231 HydrophobicContact CG-CD1 4.3Å; Y228-L231 PolarHBondContact O-N 2.84Å; Y228-L231 VanDerWaalsContact O-N 3.16Å; L231-R234 WeakPolarHBondContact O-CG 3.44Å; L231-R234 PolarHBondContact O-N 2.92Å; L231-F235 PolarHBondContact O-N 3.47Å; L231-L273 HydrophobicContact CB-CD2 4.4Å
232	R	75.6	Confident	86.7	Confident	104 Å²	104	30 Å²	30	39%	0.392	15%	0.151	S	C	.	.	H	α-helix	trans	-68.9	-39.1	-179.7	-168.2	174.1	-174.8	150.4	7.2	111.7	R234 F235 K307	R232-R234 PolarHBondContact O-N 3.19Å; R232-F235 PolarHBondContact O-N 2.95Å; R232-K307 VanDerWaalsContact NH1-CB 3.28Å
233	D	77.3	Confident	86.3	Confident	45 Å²	45	31.7 Å²	31.7	24%	0.241	16%	0.159	C	C	.	.	H	α-helix	trans	-64.8	-27.6	179.3	-80	-30.5	0	0	0	112	R72 R73 I76 D230	R72-D233 IonicContact CZ-OD2 3.44Å; R72-D233 IonicContact NE-OD2 2.81Å; R72-D233 PolarHBondContact NE-OD2 2.86Å; R72-D233 IonicContact NH2-OD2 3.64Å; R72-D233 PolarHBondContact NH2-OD2 3.4Å; R73-D233 IonicContact NE-OD1 3.73Å; I76-D233 HydrophobicContact CD1-CB 3.5Å; D230-D233 PolarHBondContact O-N 3.43Å
234	R	82	Confident	85.8	Confident	10 Å²	10	33.4 Å²	33.4	4%	0.038	17%	0.165	C	C	.	.	H	α-helix	trans	-101.1	-10.9	179.5	76.3	-167.8	-136.3	-175.2	8	115	I76 N138 G139 L141 D230 L231 R232 D236 G237 D238	I76-R234 HydrophobicContact CG2-CB 3.74Å; N138-R234 PolarHBondContact O-NH2 3.17Å; G139-R234 VanDerWaalsContact C-NH2 3.32Å; G139-R234 PolarHBondContact O-NH2 3.16Å; L141-R234 VanDerWaalsContact N-NH2 3.2Å; D230-R234 WeakPolarHBondContact O-CD 3.22Å; D230-R234 WeakPolarHBondContact O-CG 2.89Å; D230-R234 PolarHBondContact O-N 3.48Å; D230-R234 VanDerWaalsContact O-N 3.11Å; D230-R234 IonicContact OD2-CZ 2.79Å; D230-R234 IonicContact OD2-NH1 3.96Å; D230-R234 PolarHBondContact OD2-NH1 3.46Å; L231-R234 WeakPolarHBondContact O-CG 3.44Å; L231-R234 PolarHBondContact O-N 2.92Å; R232-R234 PolarHBondContact O-N 3.19Å; R234-D236 PolarHBondContact O-N 3.28Å; R234-G237 PolarHBondContact O-N 3.4Å; R234-D238 WeakPolarHBondContact CG-OD2 3.29Å; R234-D238 IonicContact CZ-OD2 3.71Å; R234-D238 IonicContact NE-OD2 2.75Å; R234-D238 PolarHBondContact NE-OD2 3.07Å; R234-D238 IonicContact NH2-OD2 3.76Å; R234-D238 WeakPolarHBondContact O-CB 3.22Å; R234-D238 PolarHBondContact O-N 3.48Å
235	F	84.3	Confident	85.3	Confident	20 Å²	20	34 Å²	34	9%	0.088	17%	0.168	C	C	.	.	H	α-helix	trans	-51	-57.6	-173.6	177.2	-95	0	0	0	112.6	L141 L231 R232 G237 D238 I239 K266 L269 A270 L273	L141-F235 HydrophobicContact CD1-CD2 3.48Å; L141-F235 VanDerWaalsContact CD1-CD2 3.48Å; L141-F235 HydrophobicContact CD1-CE2 3.97Å; L141-F235 HydrophobicContact CD2-CD2 4.41Å; L231-F235 PolarHBondContact O-N 3.47Å; R232-F235 PolarHBondContact O-N 2.95Å; F235-G237 VanDerWaalsContact C-N 3.32Å; F235-G237 PolarHBondContact O-N 3.23Å; F235-D238 PolarHBondContact O-N 3.16Å; F235-I239 HydrophobicContact CD1-CG1 4.41Å; F235-I239 HydrophobicContact CD2-CG1 4.35Å; F235-I239 HydrophobicContact CE1-CG1 4.12Å; F235-I239 HydrophobicContact CE2-CD1 4.37Å; F235-I239 HydrophobicContact CE2-CG1 4.03Å; F235-I239 HydrophobicContact CZ-CD1 4.43Å; F235-I239 HydrophobicContact CZ-CG1 3.92Å; F235-I239 WeakPolarHBondContact O-CB 3.46Å; F235-I239 WeakPolarHBondContact O-CG1 3.3Å; F235-I239 PolarHBondContact O-N 3.11Å; F235-K266 HydrophobicContact CZ-CG 4.14Å; F235-L269 HydrophobicContact CD2-CG 4.46Å; F235-L269 HydrophobicContact CE2-CB 4.13Å; F235-L269 HydrophobicContact CE2-CD2 3.99Å; F235-L269 HydrophobicContact CE2-CG 3.76Å; F235-A270 HydrophobicContact CZ-CB 4.26Å; F235-L273 HydrophobicContact CB-CD1 4.38Å; F235-L273 HydrophobicContact CD2-CD1 3.36Å; F235-L273 HydrophobicContact CE2-CD1 3.86Å; F235-L273 HydrophobicContact CG-CD1 4.02Å
236	D	83.8	Confident	84.8	Confident	115 Å²	115	33.7 Å²	33.7	62%	0.615	17%	0.168	S	C	*	.	H	α-helix	trans	-63.5	-38.4	-175.5	-68.6	-44	0	0	0	112.4	R234 R240	R234-D236 PolarHBondContact O-N 3.28Å; D236-R240 VanDerWaalsContact O-CB 3.23Å; D236-R240 WeakPolarHBondContact O-CB 3.3Å; D236-R240 PolarHBondContact O-N 3.19Å
237	G	84.8	Confident	84.4	Confident	44 Å²	44	36.5 Å²	36.5	45%	0.454	18%	0.183	S	C	.	.	H	α-helix	trans	-69.2	-43.1	178.8	0	0	0	0	0	113	R234 F235 R240 T241	R234-G237 PolarHBondContact O-N 3.4Å; F235-G237 VanDerWaalsContact C-N 3.32Å; F235-G237 PolarHBondContact O-N 3.23Å; G237-R240 PolarHBondContact O-N 3.41Å; G237-T241 PolarHBondContact O-N 2.93Å; G237-T241 PolarHBondContact O-OG1 3.26Å
238	D	87.8	Confident	84.2	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.011	20%	0.198	C	C	.	.	H	α-helix	trans	-68.8	-40.2	177.5	-73.8	-10.2	0	0	0	110.6	R83 L141 Y142 R234 F235 T241 L242	R83-D238 IonicContact CZ-OD1 2.89Å; R83-D238 IonicContact NE-OD1 3.32Å; R83-D238 PolarHBondContact NE-OD1 3.44Å; R83-D238 IonicContact NE-OD2 4Å; R83-D238 IonicContact NH2-OD1 3.14Å; R83-D238 PolarHBondContact NH2-OD1 3.49Å; L141-D238 HydrophobicContact CD2-CB 3.42Å; L141-D238 VanDerWaalsContact CD2-CB 3.42Å; Y142-D238 HydrophobicContact CE2-CB 4Å; R234-D238 WeakPolarHBondContact CG-OD2 3.29Å; R234-D238 IonicContact CZ-OD2 3.71Å; R234-D238 IonicContact NE-OD2 2.75Å; R234-D238 PolarHBondContact NE-OD2 3.07Å; R234-D238 IonicContact NH2-OD2 3.76Å; R234-D238 WeakPolarHBondContact O-CB 3.22Å; R234-D238 PolarHBondContact O-N 3.48Å; F235-D238 PolarHBondContact O-N 3.16Å; D238-T241 VanDerWaalsContact O-CB 3.31Å; D238-T241 WeakPolarHBondContact O-CB 3.39Å; D238-T241 PolarHBondContact O-N 3.18Å; D238-L242 WeakPolarHBondContact O-CG 3.31Å; D238-L242 PolarHBondContact O-N 2.96Å
239	I	88.2	Confident	84	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-63.4	-44.7	173.2	-68.9	-64.3	0	0	0	111.2	L141 L145 F235 T241 L242 E243 K266	L141-I239 HydrophobicContact CD2-CD1 3.97Å; L141-I239 HydrophobicContact CD2-CG1 4Å; L145-I239 HydrophobicContact CD1-CD1 4.26Å; F235-I239 HydrophobicContact CD1-CG1 4.41Å; F235-I239 HydrophobicContact CD2-CG1 4.35Å; F235-I239 HydrophobicContact CE1-CG1 4.12Å; F235-I239 HydrophobicContact CE2-CD1 4.37Å; F235-I239 HydrophobicContact CE2-CG1 4.03Å; F235-I239 HydrophobicContact CZ-CD1 4.43Å; F235-I239 HydrophobicContact CZ-CG1 3.92Å; F235-I239 WeakPolarHBondContact O-CB 3.46Å; F235-I239 WeakPolarHBondContact O-CG1 3.3Å; F235-I239 PolarHBondContact O-N 3.11Å; I239-T241 VanDerWaalsContact C-N 3.25Å; I239-T241 PolarHBondContact O-N 3.33Å; I239-L242 PolarHBondContact O-N 2.85Å; I239-L242 VanDerWaalsContact O-N 3.09Å; I239-E243 HydrophobicContact CG2-CG 4.34Å; I239-E243 WeakPolarHBondContact O-CG 3.38Å; I239-E243 PolarHBondContact O-N 3.49Å; I239-K266 HydrophobicContact CD1-CB 4.43Å; I239-K266 HydrophobicContact CD1-CG 4.39Å; I239-K266 HydrophobicContact CG1-CG 4.47Å; I239-K266 HydrophobicContact CG2-CD 3.74Å; I239-K266 HydrophobicContact CG2-CG 4.13Å
240	R	87.2	Confident	84.1	Confident	141 Å²	141	45.3 Å²	45.3	53%	0.532	23%	0.225	S	C	.	.	H	α-helix	trans	-61.4	-37.5	178.7	-176.2	57.1	176.7	-176.8	1.1	112	D236 G237 E243 I244	D236-R240 VanDerWaalsContact O-CB 3.23Å; D236-R240 WeakPolarHBondContact O-CB 3.3Å; D236-R240 PolarHBondContact O-N 3.19Å; G237-R240 PolarHBondContact O-N 3.41Å; R240-E243 WeakPolarHBondContact CD-OE2 3.35Å; R240-E243 IonicContact CZ-OE2 3.11Å; R240-E243 IonicContact NH1-OE2 2.6Å; R240-E243 PolarHBondContact NH1-OE2 3.42Å; R240-E243 PolarHBondContact O-N 3.27Å; R240-I244 HydrophobicContact CG-CD1 4.18Å; R240-I244 VanDerWaalsContact O-CG1 3.31Å; R240-I244 WeakPolarHBondContact O-CG1 3.4Å; R240-I244 PolarHBondContact O-N 3.34Å
241	T	87.6	Confident	84.3	Confident	11 Å²	11	53 Å²	53	7%	0.067	26%	0.257	C	S	.	.	H	α-helix	trans	-55.8	-51.4	172.2	-63.9	0	0	0	0	110.5	F84 G237 D238 I239 E243 I244 L245	F84-T241 HydrophobicContact CB-CG2 4.25Å; F84-T241 HydrophobicContact CD2-CG2 3.52Å; F84-T241 HydrophobicContact CE2-CG2 4.26Å; F84-T241 HydrophobicContact CG-CG2 4.27Å; G237-T241 PolarHBondContact O-N 2.93Å; G237-T241 PolarHBondContact O-OG1 3.26Å; D238-T241 VanDerWaalsContact O-CB 3.31Å; D238-T241 WeakPolarHBondContact O-CB 3.39Å; D238-T241 PolarHBondContact O-N 3.18Å; I239-T241 VanDerWaalsContact C-N 3.25Å; I239-T241 PolarHBondContact O-N 3.33Å; T241-E243 PolarHBondContact O-N 2.85Å; T241-I244 PolarHBondContact O-N 3.06Å; T241-L245 HydrophobicContact CG2-CD1 4.06Å; T241-L245 VanDerWaalsContact O-CG 3.3Å; T241-L245 WeakPolarHBondContact O-CG 3.38Å; T241-L245 PolarHBondContact O-N 3.28Å
242	L	87.6	Confident	84.4	Confident	31 Å²	31	55.9 Å²	55.9	16%	0.162	27%	0.272	C	S	.	.	H	α-helix	trans	-65.2	-38	-179.5	-66.6	170.3	0	0	0	112.9	Y142 L145 D238 I239 I244 L245 L246 L262	Y142-L242 HydrophobicContact CD1-CD2 4.45Å; Y142-L242 HydrophobicContact CE1-CD2 3.84Å; Y142-L242 HydrophobicContact CE1-CG 4.31Å; L145-L242 HydrophobicContact CD1-CD1 3.18Å; D238-L242 WeakPolarHBondContact O-CG 3.31Å; D238-L242 PolarHBondContact O-N 2.96Å; I239-L242 PolarHBondContact O-N 2.85Å; I239-L242 VanDerWaalsContact O-N 3.09Å; L242-I244 VanDerWaalsContact C-N 3.34Å; L242-I244 PolarHBondContact O-N 3.17Å; L242-L245 HydrophobicContact CD2-CD1 4.35Å; L242-L245 PolarHBondContact O-N 2.95Å; L242-L246 WeakPolarHBondContact O-CG 3.46Å; L242-L246 PolarHBondContact O-N 2.92Å; L242-L262 HydrophobicContact CB-CD1 4.22Å; L242-L262 HydrophobicContact CB-CD2 3.81Å; L242-L262 HydrophobicContact CD1-CD1 4.18Å
243	E	88.5	Confident	84.5	Confident	36 Å²	36	52.4 Å²	52.4	17%	0.168	26%	0.26	C	S	.	.	H	α-helix	trans	-58.1	-46	173.5	-72	174.7	178.1	0	0	111.3	I239 R240 T241 L246 D247 L262 K266	I239-E243 HydrophobicContact CG2-CG 4.34Å; I239-E243 WeakPolarHBondContact O-CG 3.38Å; I239-E243 PolarHBondContact O-N 3.49Å; R240-E243 WeakPolarHBondContact CD-OE2 3.35Å; R240-E243 IonicContact CZ-OE2 3.11Å; R240-E243 IonicContact NH1-OE2 2.6Å; R240-E243 PolarHBondContact NH1-OE2 3.42Å; R240-E243 PolarHBondContact O-N 3.27Å; T241-E243 PolarHBondContact O-N 2.85Å; E243-L246 PolarHBondContact O-N 3.35Å; E243-D247 PolarHBondContact O-N 2.86Å; E243-D247 VanDerWaalsContact O-N 3.1Å; E243-L262 HydrophobicContact CG-CD2 3.94Å; E243-K266 IonicContact OE1-NZ 3.01Å; E243-K266 PolarHBondContact OE1-NZ 3.45Å; E243-K266 VanDerWaalsContact OE1-NZ 3.11Å
244	I	88	Confident	84.4	Confident	59 Å²	59	55.3 Å²	55.3	30%	0.303	28%	0.281	S	S	.	.	H	α-helix	trans	-63	-42.8	177.2	-67.6	164.4	0	0	0	110.7	F84 R240 T241 L242 D247 I248	F84-I244 HydrophobicContact CE2-CD1 4.36Å; F84-I244 HydrophobicContact CE2-CG2 4.4Å; R240-I244 HydrophobicContact CG-CD1 4.18Å; R240-I244 VanDerWaalsContact O-CG1 3.31Å; R240-I244 WeakPolarHBondContact O-CG1 3.4Å; R240-I244 PolarHBondContact O-N 3.34Å; T241-I244 PolarHBondContact O-N 3.06Å; L242-I244 VanDerWaalsContact C-N 3.34Å; L242-I244 PolarHBondContact O-N 3.17Å; I244-D247 PolarHBondContact O-N 3.08Å; I244-I248 HydrophobicContact CG2-CD1 3.96Å; I244-I248 WeakPolarHBondContact O-CG1 3.32Å; I244-I248 PolarHBondContact O-N 3.02Å
245	L	85.8	Confident	83.8	Confident	13 Å²	13	60.6 Å²	60.6	7%	0.068	32%	0.319	C	S	.	.	H	α-helix	trans	-62	-46	178.7	-67.4	175.3	0	0	0	112	L88 T241 L242 D247 I248 I249	L88-L245 VanDerWaalsContact CA-CD2 3.43Å; L88-L245 HydrophobicContact CB-CD2 3.84Å; L88-L245 HydrophobicContact CD1-CD2 3.33Å; L88-L245 HydrophobicContact CG-CD2 4.19Å; T241-L245 HydrophobicContact CG2-CD1 4.06Å; T241-L245 VanDerWaalsContact O-CG 3.3Å; T241-L245 WeakPolarHBondContact O-CG 3.38Å; T241-L245 PolarHBondContact O-N 3.28Å; L242-L245 HydrophobicContact CD2-CD1 4.35Å; L242-L245 PolarHBondContact O-N 2.95Å; L245-D247 PolarHBondContact O-N 3.26Å; L245-I248 PolarHBondContact O-N 3.13Å; L245-I249 WeakPolarHBondContact O-CG1 3.19Å; L245-I249 PolarHBondContact O-N 3.37Å
246	L	85.5	Confident	83	Confident	32 Å²	32	63.2 Å²	63.2	17%	0.168	33%	0.331	C	S	.	.	H	α-helix	trans	-62.9	-33.3	177	-69.4	-179.6	0	0	0	112.3	L242 E243 I249 K250 F256 L262	L242-L246 WeakPolarHBondContact O-CG 3.46Å; L242-L246 PolarHBondContact O-N 2.92Å; E243-L246 PolarHBondContact O-N 3.35Å; L246-I249 HydrophobicContact CD2-CD1 4.46Å; L246-I249 PolarHBondContact O-N 3.46Å; L246-K250 VanDerWaalsContact O-CB 3.31Å; L246-K250 WeakPolarHBondContact O-CB 3.48Å; L246-K250 PolarHBondContact O-N 3.47Å; L246-F256 HydrophobicContact CD2-CE1 3.97Å; L246-L262 HydrophobicContact CD1-CB 3.59Å; L246-L262 HydrophobicContact CD1-CD2 3.47Å; L246-L262 VanDerWaalsContact CD1-CD2 3.47Å; L246-L262 HydrophobicContact CD1-CG 4.12Å; L246-L262 HydrophobicContact CG-CD2 4.42Å
247	D	85.4	Confident	82.2	Confident	60 Å²	60	59.9 Å²	59.9	32%	0.321	32%	0.323	S	S	.	.	H	α-helix	trans	-69	-38.1	176.1	-74	-15.1	0	0	0	112.1	E243 I244 L245 F251 R259	E243-D247 PolarHBondContact O-N 2.86Å; E243-D247 VanDerWaalsContact O-N 3.1Å; I244-D247 PolarHBondContact O-N 3.08Å; L245-D247 PolarHBondContact O-N 3.26Å; D247-F251 PolarHBondContact O-N 3.44Å; D247-R259 VanDerWaalsContact CG-NH1 3.25Å; D247-R259 IonicContact OD1-CZ 2.9Å; D247-R259 IonicContact OD1-NE 3.14Å; D247-R259 IonicContact OD1-NH1 3.71Å; D247-R259 PolarHBondContact OD1-NH1 2.72Å; D247-R259 IonicContact OD1-NH2 3.02Å; D247-R259 IonicContact OD2-CZ 3.77Å; D247-R259 IonicContact OD2-NH1 2.9Å; D247-R259 PolarHBondContact OD2-NH1 3.45Å; D247-R259 VanDerWaalsContact OD2-NH1 3.15Å; D247-R259 IonicContact OD2-NH2 3.58Å; D247-R259 PolarHBondContact OD2-NH2 3.5Å; D247-R259 VanDerWaalsContact OD2-NH2 3.09Å
248	I	84.9	Confident	81.6	Confident	65 Å²	65	60.1 Å²	60.1	33%	0.333	31%	0.312	S	S	.	.	H	α-helix	trans	-66.9	-44.2	172.5	-65.1	166.2	0	0	0	110.8	L88 I244 L245 K250 F251 M252	L88-I248 HydrophobicContact CD1-CD1 3.84Å; I244-I248 HydrophobicContact CG2-CD1 3.96Å; I244-I248 WeakPolarHBondContact O-CG1 3.32Å; I244-I248 PolarHBondContact O-N 3.02Å; L245-I248 PolarHBondContact O-N 3.13Å; I248-K250 PolarHBondContact O-N 3.33Å; I248-F251 WeakPolarHBondContact O-CB 3.21Å; I248-F251 PolarHBondContact O-N 2.81Å; I248-M252 HydrophobicContact CG2-CE 4.13Å; I248-M252 PolarHBondContact O-N 2.84Å
249	I	82.9	Confident	81.1	Confident	27 Å²	27	65.9 Å²	65.9	14%	0.138	33%	0.334	C	S	.	.	H	α-helix	trans	-62.1	-45.1	178.9	-67.5	168.3	0	0	0	110.4	S95 L245 L246 F251 M252 H253 F256	S95-I249 WeakPolarHBondContact OG-CG1 3.43Å; L245-I249 WeakPolarHBondContact O-CG1 3.19Å; L245-I249 PolarHBondContact O-N 3.37Å; L246-I249 HydrophobicContact CD2-CD1 4.46Å; L246-I249 PolarHBondContact O-N 3.46Å; I249-F251 PolarHBondContact O-N 3.43Å; I249-M252 HydrophobicContact CG1-CE 4.46Å; I249-M252 CarbonylContact O-C 3.57Å; I249-M252 PolarHBondContact O-N 3.06Å; I249-H253 PolarHBondContact O-N 2.86Å; I249-F256 HydrophobicContact CG2-CD1 3.62Å; I249-F256 HydrophobicContact CG2-CE1 3.89Å; I249-F256 HydrophobicContact CG2-CG 4.16Å
250	K	83.5	Confident	80.5	Confident	116 Å²	116	68.8 Å²	68.8	50%	0.504	35%	0.345	S	S	.	.	H	α-helix	trans	-58.4	-34.9	177.3	-176.5	-178	178.3	-174.7	0	112.4	L246 I248 H253 P254	L246-K250 VanDerWaalsContact O-CB 3.31Å; L246-K250 WeakPolarHBondContact O-CB 3.48Å; L246-K250 PolarHBondContact O-N 3.47Å; I248-K250 PolarHBondContact O-N 3.33Å; K250-H253 CarbonylContact O-C 3.6Å; K250-P254 WeakPolarHBondContact O-CA 3.35Å
251	F	81.8	Confident	80.1	Confident	180 Å²	180	62.2 Å²	62.2	79%	0.789	32%	0.32	S	S	*	.	H	α-helix	trans	-66	-40.3	175.3	177.6	-96.2	0	0	0	112.1	D247 I248 I249	D247-F251 PolarHBondContact O-N 3.44Å; I248-F251 WeakPolarHBondContact O-CB 3.21Å; I248-F251 PolarHBondContact O-N 2.81Å; I249-F251 PolarHBondContact O-N 3.43Å
252	M	79.1	Confident	79.8	Confident	62 Å²	62	62.6 Å²	62.6	31%	0.305	32%	0.322	S	S	.	.	H	α-helix	trans	-78	-31.1	177.5	-64.7	-176	-63.5	0	0	113.3	S95 I248 I249	S95-M252 VanDerWaalsContact OG-CE 3.24Å; S95-M252 WeakPolarHBondContact OG-CE 3.41Å; I248-M252 HydrophobicContact CG2-CE 4.13Å; I248-M252 PolarHBondContact O-N 2.84Å; I249-M252 HydrophobicContact CG1-CE 4.46Å; I249-M252 CarbonylContact O-C 3.57Å; I249-M252 PolarHBondContact O-N 3.06Å
253	H	79.4	Confident	79.6	Confident	31 Å²	31	68.5 Å²	68.5	14%	0.144	35%	0.346	C	S	.	.			trans	-129.7	80.7	-174.9	-62.7	-73.4	0	0	0	110.1	S95 I249 K250 S255 F256	S95-H253 PolarHBondContact O-CE1 3.12Å; S95-H253 PolarHBondContact O-NE2 3.34Å; I249-H253 PolarHBondContact O-N 2.86Å; K250-H253 CarbonylContact O-C 3.6Å; H253-S255 PolarHBondContact O-N 3.28Å; H253-F256 HydrophobicContact CB-CB 3.88Å; H253-F256 WeakPolarHBondContact O-CB 3.2Å; H253-F256 PolarHBondContact O-N 2.82Å
254	P	75.1	Confident	79.1	Confident	106 Å²	106	68.5 Å²	68.5	69%	0.688	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.4	-173.6	-26.3	36.1	0	0	0	115.1	K250 F256	K250-P254 WeakPolarHBondContact O-CA 3.35Å; P254-F256 PolarHBondContact O-N 3.44Å
255	S	68.3	Low	78.7	Confident	120 Å²	120	66.3 Å²	66.3	84%	0.839	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-13.5	174	50.8	0	0	0	0	113.2	H253 G257	H253-S255 PolarHBondContact O-N 3.28Å; S255-G257 PolarHBondContact O-N 3.37Å
256	F	68.9	Low	78.7	Confident	75 Å²	75	69 Å²	69	33%	0.329	35%	0.347	S	S	.	.			trans	-78.7	113.1	-176.3	-169.6	-103.6	0	0	0	112.1	L246 I249 H253 P254 F258	L246-F256 HydrophobicContact CD2-CE1 3.97Å; I249-F256 HydrophobicContact CG2-CD1 3.62Å; I249-F256 HydrophobicContact CG2-CE1 3.89Å; I249-F256 HydrophobicContact CG2-CG 4.16Å; H253-F256 HydrophobicContact CB-CB 3.88Å; H253-F256 WeakPolarHBondContact O-CB 3.2Å; H253-F256 PolarHBondContact O-N 2.82Å; P254-F256 PolarHBondContact O-N 3.44Å; F256-F258 HydrophobicContact CD1-CB 4.34Å; F256-F258 HydrophobicContact CD1-CD2 4.13Å; F256-F258 AromaticContact CD2-CD2 3.6Å; F256-F258 HydrophobicContact CD2-CD2 3.6Å; F256-F258 AromaticContact CD2-CE2 3.89Å; F256-F258 HydrophobicContact CD2-CE2 3.89Å; F256-F258 HydrophobicContact CE1-CB 3.62Å; F256-F258 AromaticContact CE1-CD2 3.71Å; F256-F258 HydrophobicContact CE1-CD2 3.71Å; F256-F258 AromaticContact CE1-CG 3.96Å; F256-F258 HydrophobicContact CE1-CG 3.96Å; F256-F258 AromaticContact CE2-CD2 3.09Å; F256-F258 HydrophobicContact CE2-CD2 3.09Å; F256-F258 AromaticContact CE2-CE2 3.36Å; F256-F258 HydrophobicContact CE2-CE2 3.36Å; F256-F258 AromaticContact CE2-CG 3.96Å; F256-F258 HydrophobicContact CE2-CG 3.96Å; F256-F258 HydrophobicContact CE2-CZ 4.4Å; F256-F258 HydrophobicContact CG-CD2 4.09Å; F256-F258 HydrophobicContact CZ-CB 3.72Å; F256-F258 AromaticContact CZ-CD2 3.16Å; F256-F258 HydrophobicContact CZ-CD2 3.16Å; F256-F258 AromaticContact CZ-CE2 3.86Å; F256-F258 HydrophobicContact CZ-CE2 3.86Å; F256-F258 AromaticContact CZ-CG 3.54Å; F256-F258 HydrophobicContact CZ-CG 3.54Å
257	G	65.8	Low	78.6	Confident	45 Å²	45	70 Å²	70	46%	0.464	36%	0.36	S	S	.	.			trans	-109.7	30.1	-169.6	0	0	0	0	0	116.8	S255 R259 W260	S255-G257 PolarHBondContact O-N 3.37Å; G257-R259 PolarHBondContact O-N 2.89Å; G257-W260 PolarHBondContact O-NE1 2.85Å
258	F	72.4	Confident	78.3	Confident	50 Å²	50	68.2 Å²	68.2	22%	0.219	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-0.1	-169.8	-79	-101.5	0	0	0	116.7	L156 F256 W260 V261 L262	L156-F258 HydrophobicContact CD2-CE1 3.91Å; L156-F258 HydrophobicContact CD2-CZ 4.3Å; F256-F258 HydrophobicContact CD1-CB 4.34Å; F256-F258 HydrophobicContact CD1-CD2 4.13Å; F256-F258 AromaticContact CD2-CD2 3.6Å; F256-F258 HydrophobicContact CD2-CD2 3.6Å; F256-F258 AromaticContact CD2-CE2 3.89Å; F256-F258 HydrophobicContact CD2-CE2 3.89Å; F256-F258 HydrophobicContact CE1-CB 3.62Å; F256-F258 AromaticContact CE1-CD2 3.71Å; F256-F258 HydrophobicContact CE1-CD2 3.71Å; F256-F258 AromaticContact CE1-CG 3.96Å; F256-F258 HydrophobicContact CE1-CG 3.96Å; F256-F258 AromaticContact CE2-CD2 3.09Å; F256-F258 HydrophobicContact CE2-CD2 3.09Å; F256-F258 AromaticContact CE2-CE2 3.36Å; F256-F258 HydrophobicContact CE2-CE2 3.36Å; F256-F258 AromaticContact CE2-CG 3.96Å; F256-F258 HydrophobicContact CE2-CG 3.96Å; F256-F258 HydrophobicContact CE2-CZ 4.4Å; F256-F258 HydrophobicContact CG-CD2 4.09Å; F256-F258 HydrophobicContact CZ-CB 3.72Å; F256-F258 AromaticContact CZ-CD2 3.16Å; F256-F258 HydrophobicContact CZ-CD2 3.16Å; F256-F258 AromaticContact CZ-CE2 3.86Å; F256-F258 HydrophobicContact CZ-CE2 3.86Å; F256-F258 AromaticContact CZ-CG 3.54Å; F256-F258 HydrophobicContact CZ-CG 3.54Å; F258-W260 PolarHBondContact O-N 2.83Å; F258-V261 HydrophobicContact CD1-CB 4.28Å; F258-V261 HydrophobicContact CD1-CG2 3.83Å; F258-V261 HydrophobicContact CE1-CG2 4.48Å; F258-V261 WeakPolarHBondContact O-CB 3.19Å; F258-V261 PolarHBondContact O-N 2.6Å; F258-L262 PolarHBondContact O-N 3.02Å
259	R	77.1	Confident	78.2	Confident	122 Å²	122	65.3 Å²	65.3	46%	0.46	34%	0.336	S	S	.	.	H	α-helix	trans	-59	-33.5	-177.7	-170.2	171.3	-172.2	158.7	10.6	113.2	D247 G257 V261 K263	D247-R259 VanDerWaalsContact CG-NH1 3.25Å; D247-R259 IonicContact OD1-CZ 2.9Å; D247-R259 IonicContact OD1-NE 3.14Å; D247-R259 IonicContact OD1-NH1 3.71Å; D247-R259 PolarHBondContact OD1-NH1 2.72Å; D247-R259 IonicContact OD1-NH2 3.02Å; D247-R259 IonicContact OD2-CZ 3.77Å; D247-R259 IonicContact OD2-NH1 2.9Å; D247-R259 PolarHBondContact OD2-NH1 3.45Å; D247-R259 VanDerWaalsContact OD2-NH1 3.15Å; D247-R259 IonicContact OD2-NH2 3.58Å; D247-R259 PolarHBondContact OD2-NH2 3.5Å; D247-R259 VanDerWaalsContact OD2-NH2 3.09Å; G257-R259 PolarHBondContact O-N 2.89Å; R259-V261 VanDerWaalsContact C-N 3.34Å; R259-K263 PolarHBondContact O-N 2.74Å; R259-K263 VanDerWaalsContact O-N 3.16Å
260	W	76.8	Confident	78.4	Confident	63 Å²	63	66.2 Å²	66.2	24%	0.239	35%	0.348	C	S	.	.	H	α-helix	trans	-67.9	-35	175.9	68.4	-96.2	0	0	0	111.9	L155 G257 F258 K263 D264 L475	L155-W260 HydrophobicContact CD1-CH2 3.58Å; L155-W260 HydrophobicContact CD1-CZ2 4.07Å; L155-W260 HydrophobicContact CD1-CZ3 4.44Å; L155-W260 HydrophobicContact CD2-CH2 4.3Å; L155-W260 HydrophobicContact CD2-CZ2 4.4Å; G257-W260 PolarHBondContact O-NE1 2.85Å; F258-W260 PolarHBondContact O-N 2.83Å; W260-K263 WeakPolarHBondContact O-CB 3.49Å; W260-K263 PolarHBondContact O-N 2.79Å; W260-D264 PolarHBondContact O-N 3.48Å; W260-L475 HydrophobicContact CZ3-CD1 4.11Å
261	V	77.5	Confident	78.5	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.018	33%	0.334	C	S	.	.	H	α-helix	trans	-63.3	-45.2	177.1	-177.5	0	0	0	0	110	L149 F152 L155 F258 R259 K263 D264 L265	L149-V261 HydrophobicContact CD2-CG1 3.94Å; F152-V261 HydrophobicContact CD2-CG1 4.28Å; F152-V261 HydrophobicContact CE2-CG1 4.35Å; L155-V261 HydrophobicContact CD1-CG2 4.15Å; F258-V261 HydrophobicContact CD1-CB 4.28Å; F258-V261 HydrophobicContact CD1-CG2 3.83Å; F258-V261 HydrophobicContact CE1-CG2 4.48Å; F258-V261 WeakPolarHBondContact O-CB 3.19Å; F258-V261 PolarHBondContact O-N 2.6Å; R259-V261 VanDerWaalsContact C-N 3.34Å; V261-K263 VanDerWaalsContact C-N 3.29Å; V261-K263 PolarHBondContact O-N 2.9Å; V261-D264 PolarHBondContact O-N 2.95Å; V261-L265 HydrophobicContact CG1-CD1 3.99Å; V261-L265 HydrophobicContact CG1-CG 4.31Å; V261-L265 WeakPolarHBondContact O-CB 3.41Å; V261-L265 WeakPolarHBondContact O-CG 3.3Å; V261-L265 PolarHBondContact O-N 3.31Å
262	L	82.2	Confident	78.7	Confident	18 Å²	18	55.2 Å²	55.2	9%	0.094	30%	0.301	C	S	.	.	H	α-helix	trans	-62.3	-38.5	175.7	-179	64.8	0	0	0	111.9	L242 E243 L246 F258 L265 K266	L242-L262 HydrophobicContact CB-CD1 4.22Å; L242-L262 HydrophobicContact CB-CD2 3.81Å; L242-L262 HydrophobicContact CD1-CD1 4.18Å; E243-L262 HydrophobicContact CG-CD2 3.94Å; L246-L262 HydrophobicContact CD1-CB 3.59Å; L246-L262 HydrophobicContact CD1-CD2 3.47Å; L246-L262 VanDerWaalsContact CD1-CD2 3.47Å; L246-L262 HydrophobicContact CD1-CG 4.12Å; L246-L262 HydrophobicContact CG-CD2 4.42Å; F258-L262 PolarHBondContact O-N 3.02Å; L262-L265 PolarHBondContact O-N 2.88Å; L262-K266 VanDerWaalsContact O-CB 3.26Å; L262-K266 WeakPolarHBondContact O-CB 3.49Å; L262-K266 PolarHBondContact O-N 3.28Å
263	K	82.6	Confident	79.1	Confident	155 Å²	155	52.8 Å²	52.8	67%	0.674	29%	0.289	S	S	*	.	H	α-helix	trans	-62.6	-44.5	177	-174.1	-176.2	175.6	-173.5	0	111.4	R259 W260 V261 K266 A267	R259-K263 PolarHBondContact O-N 2.74Å; R259-K263 VanDerWaalsContact O-N 3.16Å; W260-K263 WeakPolarHBondContact O-CB 3.49Å; W260-K263 PolarHBondContact O-N 2.79Å; V261-K263 VanDerWaalsContact C-N 3.29Å; V261-K263 PolarHBondContact O-N 2.9Å; K263-K266 PolarHBondContact O-N 3.43Å; K263-A267 PolarHBondContact O-N 3.25Å
264	D	78.3	Confident	79.8	Confident	37 Å²	37	52.9 Å²	52.9	20%	0.198	29%	0.291	C	S	.	.	H	α-helix	trans	-67	-46	178.5	-68.2	-6.2	0	0	0	110.3	W260 V261 K266 A267 T268 R472	W260-D264 PolarHBondContact O-N 3.48Å; V261-D264 PolarHBondContact O-N 2.95Å; D264-K266 VanDerWaalsContact C-N 3.32Å; D264-K266 PolarHBondContact O-N 3.39Å; D264-A267 PolarHBondContact O-N 3.36Å; D264-A267 VanDerWaalsContact O-N 3.16Å; D264-T268 PolarHBondContact O-N 3.45Å; D264-T268 PolarHBondContact O-OG1 3.18Å; D264-R472 IonicContact OD2-CZ 2.77Å; D264-R472 IonicContact OD2-NE 3.59Å; D264-R472 IonicContact OD2-NH1 2.82Å; D264-R472 PolarHBondContact OD2-NH1 3.07Å
265	L	79.9	Confident	80.7	Confident	12 Å²	12	48 Å²	48	6%	0.063	26%	0.258	C	S	.	.	H	α-helix	trans	-59.3	-39.4	174.7	-75.1	175.8	0	0	0	113	L145 L149 F152 V261 L262 A267 T268 L269	L145-L265 HydrophobicContact CD2-CB 3.89Å; L145-L265 HydrophobicContact CD2-CD1 4.27Å; L149-L265 HydrophobicContact CD2-CD1 3.85Å; L149-L265 HydrophobicContact CG-CD1 3.97Å; F152-L265 HydrophobicContact CD2-CD2 4.29Å; F152-L265 HydrophobicContact CE2-CD2 3.7Å; F152-L265 HydrophobicContact CE2-CG 4.07Å; V261-L265 HydrophobicContact CG1-CD1 3.99Å; V261-L265 HydrophobicContact CG1-CG 4.31Å; V261-L265 WeakPolarHBondContact O-CB 3.41Å; V261-L265 WeakPolarHBondContact O-CG 3.3Å; V261-L265 PolarHBondContact O-N 3.31Å; L262-L265 PolarHBondContact O-N 2.88Å; L265-A267 VanDerWaalsContact C-N 3.33Å; L265-A267 PolarHBondContact O-N 3.36Å; L265-T268 PolarHBondContact O-N 3.19Å; L265-L269 WeakPolarHBondContact O-CB 3.44Å; L265-L269 PolarHBondContact O-N 2.96Å
266	K	85.4	Confident	82.1	Confident	71 Å²	71	44.5 Å²	44.5	31%	0.309	23%	0.229	S	C	.	.	H	α-helix	trans	-60.6	-43.3	176.4	179.3	-173.5	-172.8	167	0	111.3	F235 I239 E243 L262 K263 D264 A270	F235-K266 HydrophobicContact CZ-CG 4.14Å; I239-K266 HydrophobicContact CD1-CB 4.43Å; I239-K266 HydrophobicContact CD1-CG 4.39Å; I239-K266 HydrophobicContact CG1-CG 4.47Å; I239-K266 HydrophobicContact CG2-CD 3.74Å; I239-K266 HydrophobicContact CG2-CG 4.13Å; E243-K266 IonicContact OE1-NZ 3.01Å; E243-K266 PolarHBondContact OE1-NZ 3.45Å; E243-K266 VanDerWaalsContact OE1-NZ 3.11Å; L262-K266 VanDerWaalsContact O-CB 3.26Å; L262-K266 WeakPolarHBondContact O-CB 3.49Å; L262-K266 PolarHBondContact O-N 3.28Å; K263-K266 PolarHBondContact O-N 3.43Å; D264-K266 VanDerWaalsContact C-N 3.32Å; D264-K266 PolarHBondContact O-N 3.39Å; K266-A270 WeakPolarHBondContact O-CB 3.25Å; K266-A270 PolarHBondContact O-N 3.01Å
267	A	82.4	Confident	83.4	Confident	52 Å²	52	43.2 Å²	43.2	43%	0.43	23%	0.225	S	C	.	.	H	α-helix	trans	-65.6	-48.4	178.9	0	0	0	0	0	111.1	K263 D264 L265 L269 A270 Q271	K263-A267 PolarHBondContact O-N 3.25Å; D264-A267 PolarHBondContact O-N 3.36Å; D264-A267 VanDerWaalsContact O-N 3.16Å; L265-A267 VanDerWaalsContact C-N 3.33Å; L265-A267 PolarHBondContact O-N 3.36Å; A267-L269 VanDerWaalsContact C-N 3.33Å; A267-L269 PolarHBondContact O-N 3.05Å; A267-A270 PolarHBondContact O-N 3.19Å; A267-Q271 WeakPolarHBondContact O-CG 3.37Å; A267-Q271 PolarHBondContact O-N 2.88Å; A267-Q271 VanDerWaalsContact O-N 3.11Å
268	T	80.9	Confident	84.8	Confident	22 Å²	22	41.2 Å²	41.2	14%	0.135	20%	0.204	C	C	.	.	H	α-helix	trans	-55.5	-47.1	174.4	-66.3	0	0	0	0	112	D264 L265 A270 Q271 E272 L382	D264-T268 PolarHBondContact O-N 3.45Å; D264-T268 PolarHBondContact O-OG1 3.18Å; L265-T268 PolarHBondContact O-N 3.19Å; T268-A270 VanDerWaalsContact C-N 3.33Å; T268-A270 PolarHBondContact O-N 3.16Å; T268-Q271 WeakPolarHBondContact O-CB 3.42Å; T268-Q271 PolarHBondContact O-N 3.11Å; T268-Q271 VanDerWaalsContact O-N 3.17Å; T268-E272 PolarHBondContact O-N 3.43Å; T268-E272 VanDerWaalsContact O-N 3.08Å; T268-L382 HydrophobicContact CG2-CD1 3.51Å; T268-L382 HydrophobicContact CG2-CD2 3.57Å; T268-L382 HydrophobicContact CG2-CG 4.13Å
269	L	82.9	Confident	86	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-69.6	-32.1	-177.7	-168.9	50.4	0	0	0	112.9	L141 K144 L145 L208 F235 L265 A267 Q271 E272 L273	L141-L269 HydrophobicContact CD1-CD1 4.47Å; L141-L269 HydrophobicContact CD1-CD2 3.24Å; L141-L269 HydrophobicContact CD1-CG 3.93Å; L141-L269 HydrophobicContact CG-CD2 3.81Å; K144-L269 HydrophobicContact CB-CD1 4.18Å; K144-L269 HydrophobicContact CD-CD1 4.5Å; K144-L269 HydrophobicContact CG-CD1 3.39Å; L145-L269 HydrophobicContact CD2-CD2 3.78Å; L145-L269 HydrophobicContact CG-CD2 3.88Å; L208-L269 HydrophobicContact CD1-CD1 3.86Å; L208-L269 HydrophobicContact CD2-CD1 4.28Å; F235-L269 HydrophobicContact CD2-CG 4.46Å; F235-L269 HydrophobicContact CE2-CB 4.13Å; F235-L269 HydrophobicContact CE2-CD2 3.99Å; F235-L269 HydrophobicContact CE2-CG 3.76Å; L265-L269 WeakPolarHBondContact O-CB 3.44Å; L265-L269 PolarHBondContact O-N 2.96Å; A267-L269 VanDerWaalsContact C-N 3.33Å; A267-L269 PolarHBondContact O-N 3.05Å; L269-Q271 VanDerWaalsContact C-N 3.34Å; L269-E272 PolarHBondContact O-N 3.42Å; L269-L273 WeakPolarHBondContact O-CG 3.17Å; L269-L273 PolarHBondContact O-N 3.4Å; L269-L273 VanDerWaalsContact O-N 3.14Å
270	A	85.8	Confident	87	Confident	47 Å²	47	39.3 Å²	39.3	39%	0.388	20%	0.195	S	C	.	.	H	α-helix	trans	-65.7	-37.8	172.1	0	0	0	0	0	111.9	F235 K266 A267 T268 L273	F235-A270 HydrophobicContact CZ-CB 4.26Å; K266-A270 WeakPolarHBondContact O-CB 3.25Å; K266-A270 PolarHBondContact O-N 3.01Å; A267-A270 PolarHBondContact O-N 3.19Å; T268-A270 VanDerWaalsContact C-N 3.33Å; T268-A270 PolarHBondContact O-N 3.16Å; A270-L273 PolarHBondContact O-N 2.94Å
271	Q	86.8	Confident	88	Confident	46 Å²	46	37.1 Å²	37.1	22%	0.215	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-44	173.9	-65.4	175.6	18.5	0	0	111.3	A267 T268 L269 L273 D274 Y383 E384	A267-Q271 WeakPolarHBondContact O-CG 3.37Å; A267-Q271 PolarHBondContact O-N 2.88Å; A267-Q271 VanDerWaalsContact O-N 3.11Å; T268-Q271 WeakPolarHBondContact O-CB 3.42Å; T268-Q271 PolarHBondContact O-N 3.11Å; T268-Q271 VanDerWaalsContact O-N 3.17Å; L269-Q271 VanDerWaalsContact C-N 3.34Å; Q271-L273 VanDerWaalsContact C-N 3.26Å; Q271-L273 PolarHBondContact O-N 3.43Å; Q271-D274 PolarHBondContact O-N 3.45Å; Q271-D274 VanDerWaalsContact O-N 3.14Å; Q271-Y383 PolarHBondContact OE1-O 2.94Å; Q271-E384 PolarHBondContact NE2-OE1 3.46Å; Q271-E384 VanDerWaalsContact NE2-OE1 3.07Å
272	E	85.4	Confident	88.9	Confident	19 Å²	19	37.3 Å²	37.3	9%	0.089	19%	0.19	C	C	.	.	H	α-helix	trans	-67.7	-22.5	179.1	-70.6	-168.6	-156	0	0	114.4	K144 L208 T268 L269 D274 F275	K144-E272 VanDerWaalsContact CE-CD 3.45Å; K144-E272 VanDerWaalsContact CE-OE1 3.22Å; K144-E272 WeakPolarHBondContact CE-OE1 3.4Å; K144-E272 WeakPolarHBondContact CE-OE2 3.39Å; K144-E272 IonicContact NZ-OE1 2.65Å; K144-E272 PolarHBondContact NZ-OE1 3.17Å; K144-E272 IonicContact NZ-OE2 2.68Å; K144-E272 PolarHBondContact NZ-OE2 2.9Å; L208-E272 HydrophobicContact CD1-CB 3.93Å; L208-E272 WeakPolarHBondContact CD1-OE2 3.08Å; T268-E272 PolarHBondContact O-N 3.43Å; T268-E272 VanDerWaalsContact O-N 3.08Å; L269-E272 PolarHBondContact O-N 3.42Å; E272-D274 VanDerWaalsContact C-N 3.32Å; E272-F275 WeakPolarHBondContact O-CE1 3.41Å
273	L	87.9	Confident	89.7	Confident	10 Å²	10	40.6 Å²	40.6	5%	0.052	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	0.3	175.4	-71.9	174.4	0	0	0	113.3	L208 Q227 L231 F235 L269 A270 Q271	L208-L273 HydrophobicContact CD1-CD2 4.2Å; L208-L273 HydrophobicContact CD2-CD2 4.28Å; Q227-L273 VanDerWaalsContact NE2-C 3.27Å; Q227-L273 PolarHBondContact NE2-O 2.98Å; L231-L273 HydrophobicContact CB-CD2 4.4Å; F235-L273 HydrophobicContact CB-CD1 4.38Å; F235-L273 HydrophobicContact CD2-CD1 3.36Å; F235-L273 HydrophobicContact CE2-CD1 3.86Å; F235-L273 HydrophobicContact CG-CD1 4.02Å; L269-L273 WeakPolarHBondContact O-CG 3.17Å; L269-L273 PolarHBondContact O-N 3.4Å; L269-L273 VanDerWaalsContact O-N 3.14Å; A270-L273 PolarHBondContact O-N 2.94Å; Q271-L273 VanDerWaalsContact C-N 3.26Å; Q271-L273 PolarHBondContact O-N 3.43Å
274	D	92.8	Very high	90.4	Very high	34 Å²	34	38.1 Å²	38.1	18%	0.182	19%	0.191	C	C	.	.			trans	-112	94.8	174.4	-161.5	-32.1	0	0	0	110.6	Q271 E272 E276 N277 E278 K307	Q271-D274 PolarHBondContact O-N 3.45Å; Q271-D274 VanDerWaalsContact O-N 3.14Å; E272-D274 VanDerWaalsContact C-N 3.32Å; D274-E276 VanDerWaalsContact C-N 3.25Å; D274-E276 PolarHBondContact O-N 3.34Å; D274-E276 WeakPolarHBondContact OD1-CB 3.5Å; D274-E276 PolarHBondContact OD1-N 3.33Å; D274-N277 HydrophobicContact CB-CB 4Å; D274-N277 WeakPolarHBondContact O-CA 3.1Å; D274-N277 VanDerWaalsContact O-CB 3.27Å; D274-N277 WeakPolarHBondContact O-CB 3.38Å; D274-N277 PolarHBondContact O-N 2.88Å; D274-N277 PolarHBondContact OD1-N 3.12Å; D274-E278 PolarHBondContact O-N 3.29Å; D274-E278 VanDerWaalsContact O-N 3.13Å; D274-K307 IonicContact OD2-NZ 3.22Å
275	F	95.8	Very high	91.3	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.009	18%	0.182	C	C	.	.	H	α-helix	trans	-70.5	-17.6	-178.4	-79.7	-0.7	0	0	0	114.5	A209 K225 Q227 E272 N277 E278 A279 S306 K307 L310	A209-F275 HydrophobicContact CB-CE2 4.25Å; A209-F275 HydrophobicContact CB-CZ 3.72Å; K225-F275 HydrophobicContact CB-CE2 4.21Å; K225-F275 HydrophobicContact CD-CE1 4.02Å; K225-F275 HydrophobicContact CD-CE2 3.94Å; K225-F275 HydrophobicContact CD-CZ 3.57Å; K225-F275 HydrophobicContact CG-CE2 3.7Å; K225-F275 HydrophobicContact CG-CZ 3.67Å; K225-F275 WeakPolarHBondContact O-CE2 3.32Å; Q227-F275 HydrophobicContact CB-CE2 4.47Å; Q227-F275 HydrophobicContact CG-CD2 3.96Å; Q227-F275 HydrophobicContact CG-CE1 4.06Å; Q227-F275 HydrophobicContact CG-CE2 3.37Å; Q227-F275 HydrophobicContact CG-CZ 3.43Å; Q227-F275 VanDerWaalsContact CG-CZ 3.43Å; E272-F275 WeakPolarHBondContact O-CE1 3.41Å; F275-N277 VanDerWaalsContact C-N 3.34Å; F275-E278 WeakPolarHBondContact CD1-OE2 3.36Å; F275-E278 WeakPolarHBondContact CE1-OE2 3.28Å; F275-A279 WeakPolarHBondContact O-CB 3.44Å; F275-A279 PolarHBondContact O-N 2.9Å; F275-S306 WeakPolarHBondContact CB-O 3.36Å; F275-K307 PolarHBondContact N-O 3.5Å; F275-K307 VanDerWaalsContact N-O 3.12Å; F275-L310 HydrophobicContact CB-CB 3.97Å; F275-L310 HydrophobicContact CD2-CB 3.84Å; F275-L310 HydrophobicContact CG-CB 4Å
276	E	96.5	Very high	92.1	Very high	48 Å²	48	37.6 Å²	37.6	22%	0.224	19%	0.194	C	C	.	.	H	α-helix	trans	-71.1	-35.5	167.9	-63.2	174.3	-172.6	0	0	110.8	D274 A279 R280 W302 K307	D274-E276 VanDerWaalsContact C-N 3.25Å; D274-E276 PolarHBondContact O-N 3.34Å; D274-E276 WeakPolarHBondContact OD1-CB 3.5Å; D274-E276 PolarHBondContact OD1-N 3.33Å; E276-A279 PolarHBondContact O-N 3.03Å; E276-R280 WeakPolarHBondContact O-CG 3.41Å; E276-R280 PolarHBondContact O-N 2.81Å; E276-R280 IonicContact OE2-NH2 3.83Å; E276-R280 PolarHBondContact OE2-NH2 3.23Å; E276-W302 HydrophobicContact CB-CZ3 4.21Å; E276-W302 HydrophobicContact CG-CZ3 4.34Å; E276-K307 HydrophobicContact CG-CG 4.05Å; E276-K307 WeakPolarHBondContact OE1-CG 3.37Å
277	N	95.9	Very high	92.6	Very high	47 Å²	47	39.7 Å²	39.7	25%	0.251	21%	0.205	S	C	.	.	H	α-helix	trans	-66	-44.3	174.1	-173.5	67.6	0	0	0	111	D274 F275 A279 R280 N281	D274-N277 HydrophobicContact CB-CB 4Å; D274-N277 WeakPolarHBondContact O-CA 3.1Å; D274-N277 VanDerWaalsContact O-CB 3.27Å; D274-N277 WeakPolarHBondContact O-CB 3.38Å; D274-N277 PolarHBondContact O-N 2.88Å; D274-N277 PolarHBondContact OD1-N 3.12Å; F275-N277 VanDerWaalsContact C-N 3.34Å; N277-A279 VanDerWaalsContact C-N 3.34Å; N277-A279 PolarHBondContact O-N 2.94Å; N277-R280 PolarHBondContact O-N 3.48Å; N277-N281 PolarHBondContact ND2-ND2 2.99Å; N277-N281 WeakPolarHBondContact O-CB 3.48Å; N277-N281 PolarHBondContact O-N 3.1Å; N277-N281 PolarHBondContact O-ND2 2.83Å
278	E	95.9	Very high	93.2	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.019	19%	0.194	C	C	.	.	H	α-helix	trans	-57.2	-44.9	173.5	179.5	167.4	177.2	0	0	112	K225 D274 F275 N281 S282 L310 H380	K225-E278 IonicContact NZ-OE1 3.76Å; K225-E278 PolarHBondContact NZ-OE1 3.06Å; K225-E278 IonicContact NZ-OE2 3.92Å; K225-E278 PolarHBondContact NZ-OE2 3.39Å; D274-E278 PolarHBondContact O-N 3.29Å; D274-E278 VanDerWaalsContact O-N 3.13Å; F275-E278 WeakPolarHBondContact CD1-OE2 3.36Å; F275-E278 WeakPolarHBondContact CE1-OE2 3.28Å; E278-N281 WeakPolarHBondContact O-CB 3.31Å; E278-N281 PolarHBondContact O-N 2.75Å; E278-S282 PolarHBondContact O-N 3.46Å; E278-L310 HydrophobicContact CB-CD2 4.5Å; E278-L310 HydrophobicContact CG-CD2 3.81Å; E278-H380 HydrophobicContact CG-CB 4.07Å; E278-H380 PolarHBondContact OE1-N 3.37Å
279	A	97.7	Very high	94	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.1	-44.8	174.7	0	0	0	0	0	113.6	F275 E276 N277 N281 S282 E283 V300 W302 T305 L310	F275-A279 WeakPolarHBondContact O-CB 3.44Å; F275-A279 PolarHBondContact O-N 2.9Å; E276-A279 PolarHBondContact O-N 3.03Å; N277-A279 VanDerWaalsContact C-N 3.34Å; N277-A279 PolarHBondContact O-N 2.94Å; A279-N281 VanDerWaalsContact C-N 3.31Å; A279-N281 PolarHBondContact O-N 2.85Å; A279-S282 PolarHBondContact O-N 3.15Å; A279-S282 PolarHBondContact O-OG 2.87Å; A279-E283 PolarHBondContact O-N 2.94Å; A279-E283 VanDerWaalsContact O-N 3.13Å; A279-V300 HydrophobicContact CB-CG1 3.8Å; A279-V300 HydrophobicContact CB-CG2 4Å; A279-W302 HydrophobicContact CB-CH2 3.32Å; A279-W302 HydrophobicContact CB-CZ2 3.64Å; A279-W302 HydrophobicContact CB-CZ3 3.93Å; A279-T305 HydrophobicContact CB-CG2 4.34Å; A279-L310 HydrophobicContact CB-CD1 3.77Å
280	R	97.8	Very high	94.6	Very high	131 Å²	131	44.2 Å²	44.2	49%	0.494	21%	0.213	S	C	.	.	H	α-helix	trans	-65.8	-36.8	176.6	-67.7	-179.8	-162.9	117.2	9.2	111.6	E276 N277 R284 W302	E276-R280 WeakPolarHBondContact O-CG 3.41Å; E276-R280 PolarHBondContact O-N 2.81Å; E276-R280 IonicContact OE2-NH2 3.83Å; E276-R280 PolarHBondContact OE2-NH2 3.23Å; N277-R280 PolarHBondContact O-N 3.48Å; R280-R284 WeakPolarHBondContact O-CB 3.46Å; R280-R284 PolarHBondContact O-N 3.01Å; R280-W302 HydrophobicContact CG-CH2 3.73Å; R280-W302 HydrophobicContact CG-CZ2 4.01Å
281	N	97.3	Very high	95	Very high	17 Å²	17	46.1 Å²	46.1	9%	0.091	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-40.9	176.3	-71.4	-21.4	0	0	0	111.6	N277 E278 A279 C285 F353 H380 Y383	N277-N281 PolarHBondContact ND2-ND2 2.99Å; N277-N281 WeakPolarHBondContact O-CB 3.48Å; N277-N281 PolarHBondContact O-N 3.1Å; N277-N281 PolarHBondContact O-ND2 2.83Å; E278-N281 WeakPolarHBondContact O-CB 3.31Å; E278-N281 PolarHBondContact O-N 2.75Å; A279-N281 VanDerWaalsContact C-N 3.31Å; A279-N281 PolarHBondContact O-N 2.85Å; N281-C285 VanDerWaalsContact O-CB 3.25Å; N281-C285 WeakPolarHBondContact O-CB 3.27Å; N281-C285 PolarHBondContact O-N 2.96Å; N281-F353 HydrophobicContact CB-CZ 4.11Å; N281-H380 HydrophobicContact CB-CB 4.04Å; N281-H380 WeakPolarHBondContact CB-O 3.28Å; N281-H380 PolarHBondContact ND2-O 2.92Å; N281-Y383 HydrophobicContact CB-CD2 3.84Å; N281-Y383 HydrophobicContact CB-CE2 4.19Å; N281-Y383 HydrophobicContact CB-CG 4.35Å
282	S	97.1	Very high	95.4	Very high	8 Å²	8	44.9 Å²	44.9	6%	0.056	21%	0.208	C	C	.	.	H	α-helix	trans	-65.3	-47.9	178.6	72.9	0	0	0	0	111.4	E278 A279 R284 C285 A286 V297 V300 H380	E278-S282 PolarHBondContact O-N 3.46Å; A279-S282 PolarHBondContact O-N 3.15Å; A279-S282 PolarHBondContact O-OG 2.87Å; S282-R284 VanDerWaalsContact C-N 3.34Å; S282-R284 PolarHBondContact O-N 3.48Å; S282-C285 WeakPolarHBondContact O-CB 3.49Å; S282-C285 PolarHBondContact O-N 3.24Å; S282-C285 VanDerWaalsContact O-N 3.15Å; S282-A286 PolarHBondContact O-N 3.21Å; S282-V297 WeakPolarHBondContact O-CG1 3.32Å; S282-V300 VanDerWaalsContact OG-CG2 3.29Å; S282-V300 WeakPolarHBondContact OG-CG2 3.44Å; S282-H380 WeakPolarHBondContact CB-CD2 3.34Å
283	E	97.9	Very high	95.9	Very high	86 Å²	86	52 Å²	52	40%	0.402	24%	0.241	S	C	.	.	H	α-helix	trans	-60	-43.2	177	-70.8	-177.3	151	0	0	112	A279 A286 E287 V300 W302	A279-E283 PolarHBondContact O-N 2.94Å; A279-E283 VanDerWaalsContact O-N 3.13Å; E283-A286 WeakPolarHBondContact O-CB 3.12Å; E283-A286 PolarHBondContact O-N 2.84Å; E283-E287 PolarHBondContact O-N 3.24Å; E283-V300 HydrophobicContact CG-CG2 4.31Å; E283-W302 PolarHBondContact OE1-NE1 3.36Å; E283-W302 PolarHBondContact OE2-NE1 3.46Å
284	R	97.6	Very high	96.3	Very high	104 Å²	104	52.7 Å²	52.7	39%	0.392	24%	0.244	S	C	.	.	H	α-helix	trans	-62.9	-44	174.8	-180	175.2	174.7	174.6	-0.9	111.9	R280 S282 A286 E287 E288 F353	R280-R284 WeakPolarHBondContact O-CB 3.46Å; R280-R284 PolarHBondContact O-N 3.01Å; S282-R284 VanDerWaalsContact C-N 3.34Å; S282-R284 PolarHBondContact O-N 3.48Å; R284-A286 VanDerWaalsContact C-N 3.29Å; R284-A286 PolarHBondContact O-N 3.31Å; R284-E287 PolarHBondContact O-N 3.08Å; R284-E288 HydrophobicContact CG-CG 4.36Å; R284-E288 IonicContact CZ-OE1 3.9Å; R284-E288 IonicContact NE-OE1 3.11Å; R284-E288 PolarHBondContact NE-OE1 3.37Å; R284-E288 IonicContact NH2-OE1 2.71Å; R284-E288 PolarHBondContact NH2-OE1 3.37Å; R284-E288 WeakPolarHBondContact O-CG 3.47Å; R284-E288 PolarHBondContact O-N 3.19Å; R284-F353 HydrophobicContact CB-CE1 4.03Å; R284-F353 HydrophobicContact CB-CZ 4.43Å; R284-F353 HydrophobicContact CG-CD1 4.01Å; R284-F353 HydrophobicContact CG-CE1 3.78Å; R284-F353 HydrophobicContact CG-CZ 4.3Å
285	C	97.1	Very high	96.5	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60	-41.8	176.7	-176	0	0	0	0	111.2	N281 S282 L289 Q347 F353 Y383	N281-C285 VanDerWaalsContact O-CB 3.25Å; N281-C285 WeakPolarHBondContact O-CB 3.27Å; N281-C285 PolarHBondContact O-N 2.96Å; S282-C285 WeakPolarHBondContact O-CB 3.49Å; S282-C285 PolarHBondContact O-N 3.24Å; S282-C285 VanDerWaalsContact O-N 3.15Å; C285-L289 VanDerWaalsContact O-CB 3.3Å; C285-L289 WeakPolarHBondContact O-CB 3.46Å; C285-L289 WeakPolarHBondContact O-CG 3.39Å; C285-L289 PolarHBondContact O-N 3.43Å; C285-L289 VanDerWaalsContact SG-CD1 3.55Å; C285-Q347 PolarHBondContact SG-NE2 3.15Å; C285-F353 HydrophobicContact CB-CE1 4.48Å; C285-Y383 HydrophobicContact CB-CE1 4.41Å; C285-Y383 WeakPolarHBondContact CB-OH 3.01Å; C285-Y383 PolarHBondContact SG-OH 3.49Å
286	A	97	Very high	96.6	Very high	38 Å²	38	53.2 Å²	53.2	31%	0.314	25%	0.248	S	C	.	.	H	α-helix	trans	-60	-46	176.2	0	0	0	0	0	111.3	S282 E283 R284 L289 K290 V297	S282-A286 PolarHBondContact O-N 3.21Å; E283-A286 WeakPolarHBondContact O-CB 3.12Å; E283-A286 PolarHBondContact O-N 2.84Å; R284-A286 VanDerWaalsContact C-N 3.29Å; R284-A286 PolarHBondContact O-N 3.31Å; A286-L289 PolarHBondContact O-N 3.43Å; A286-K290 WeakPolarHBondContact O-CA 3.44Å; A286-K290 PolarHBondContact O-N 3.47Å; A286-V297 HydrophobicContact CB-CB 3.79Å; A286-V297 HydrophobicContact CB-CG1 4.18Å; A286-V297 HydrophobicContact CB-CG2 4.14Å
287	E	97.1	Very high	96.6	Very high	114 Å²	114	52 Å²	52	53%	0.533	24%	0.244	S	C	.	.	H	α-helix	trans	-66.4	-44.5	179.8	-179.6	56.8	-155.8	0	0	112.4	E283 R284 L289 K290	E283-E287 PolarHBondContact O-N 3.24Å; R284-E287 PolarHBondContact O-N 3.08Å; E287-L289 VanDerWaalsContact C-N 3.34Å; E287-L289 PolarHBondContact O-N 3.44Å; E287-K290 WeakPolarHBondContact O-CD 3.29Å; E287-K290 VanDerWaalsContact O-CG 3.24Å; E287-K290 WeakPolarHBondContact O-CG 3.34Å; E287-K290 PolarHBondContact O-N 2.87Å; E287-K290 WeakPolarHBondContact OE1-CE 3.14Å; E287-K290 IonicContact OE1-NZ 3.41Å; E287-K290 PolarHBondContact OE1-NZ 2.8Å; E287-K290 IonicContact OE2-NZ 3.62Å
288	E	95.2	Very high	96.7	Very high	43 Å²	43	50.3 Å²	50.3	20%	0.201	24%	0.236	C	C	.	.	H	α-helix	trans	-67.1	-34.6	179.1	-73	-173.7	-175.2	0	0	112.3	R284 H291 T351 F353	R284-E288 HydrophobicContact CG-CG 4.36Å; R284-E288 IonicContact CZ-OE1 3.9Å; R284-E288 IonicContact NE-OE1 3.11Å; R284-E288 PolarHBondContact NE-OE1 3.37Å; R284-E288 IonicContact NH2-OE1 2.71Å; R284-E288 PolarHBondContact NH2-OE1 3.37Å; R284-E288 WeakPolarHBondContact O-CG 3.47Å; R284-E288 PolarHBondContact O-N 3.19Å; E288-H291 PolarHBondContact O-CE1 3.13Å; E288-H291 PolarHBondContact O-ND1 3.09Å; E288-H291 VanDerWaalsContact O-ND1 3.08Å; E288-T351 HydrophobicContact CB-CG2 4.19Å; E288-T351 WeakPolarHBondContact OE2-CB 3.4Å; E288-T351 PolarHBondContact OE2-OG1 3.07Å; E288-F353 VanDerWaalsContact OE2-CB 3.28Å; E288-F353 WeakPolarHBondContact OE2-CB 3.43Å
289	L	96.3	Very high	96.8	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-95.1	3.9	-179	-61.1	-179	0	0	0	114.3	C285 A286 E287 H291 F292 V295 I343 E346 Q347 L377	C285-L289 VanDerWaalsContact O-CB 3.3Å; C285-L289 WeakPolarHBondContact O-CB 3.46Å; C285-L289 WeakPolarHBondContact O-CG 3.39Å; C285-L289 PolarHBondContact O-N 3.43Å; C285-L289 VanDerWaalsContact SG-CD1 3.55Å; A286-L289 PolarHBondContact O-N 3.43Å; E287-L289 VanDerWaalsContact C-N 3.34Å; E287-L289 PolarHBondContact O-N 3.44Å; L289-H291 PolarHBondContact O-N 2.93Å; L289-F292 HydrophobicContact CD2-CD2 4.11Å; L289-F292 HydrophobicContact CD2-CE2 4.3Å; L289-F292 WeakPolarHBondContact O-CB 3.41Å; L289-F292 PolarHBondContact O-N 3.33Å; L289-V295 HydrophobicContact CB-CG1 4.38Å; L289-V295 HydrophobicContact CD1-CG1 4.09Å; L289-I343 HydrophobicContact CD1-CG2 3.72Å; L289-E346 HydrophobicContact CD2-CB 4.39Å; L289-E346 HydrophobicContact CD2-CG 4.24Å; L289-Q347 HydrophobicContact CD2-CG 4.49Å; L289-L377 HydrophobicContact CD1-CD1 4.1Å
290	K	95.5	Very high	96.9	Very high	127 Å²	127	56.9 Å²	56.9	55%	0.552	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-24.7	-175.9	73.4	-174.6	178	-177	0	115.2	A286 E287 F292	A286-K290 WeakPolarHBondContact O-CA 3.44Å; A286-K290 PolarHBondContact O-N 3.47Å; E287-K290 WeakPolarHBondContact O-CD 3.29Å; E287-K290 VanDerWaalsContact O-CG 3.24Å; E287-K290 WeakPolarHBondContact O-CG 3.34Å; E287-K290 PolarHBondContact O-N 2.87Å; E287-K290 WeakPolarHBondContact OE1-CE 3.14Å; E287-K290 IonicContact OE1-NZ 3.41Å; E287-K290 PolarHBondContact OE1-NZ 2.8Å; E287-K290 IonicContact OE2-NZ 3.62Å; K290-F292 VanDerWaalsContact C-N 3.26Å; K290-F292 PolarHBondContact O-N 2.79Å
291	H	94.5	Very high	96.9	Very high	87 Å²	87	52 Å²	52	40%	0.403	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-13.8	178.2	65.9	-84.3	0	0	0	112.9	E288 L289 E346	E288-H291 PolarHBondContact O-CE1 3.13Å; E288-H291 PolarHBondContact O-ND1 3.09Å; E288-H291 VanDerWaalsContact O-ND1 3.08Å; L289-H291 PolarHBondContact O-N 2.93Å; H291-E346 IonicContact CE1-OE1 3.45Å; H291-E346 IonicContact NE2-OE1 2.67Å
292	F	96.3	Very high	96.9	Very high	20 Å²	20	55.8 Å²	55.8	9%	0.088	26%	0.26	C	S	.	.			trans	-94.9	90.4	167.4	-65.7	-31	0	0	0	109.9	L289 K290 F294 V295 I343 E346	L289-F292 HydrophobicContact CD2-CD2 4.11Å; L289-F292 HydrophobicContact CD2-CE2 4.3Å; L289-F292 WeakPolarHBondContact O-CB 3.41Å; L289-F292 PolarHBondContact O-N 3.33Å; K290-F292 VanDerWaalsContact C-N 3.26Å; K290-F292 PolarHBondContact O-N 2.79Å; F292-F294 HydrophobicContact CB-CD1 4.15Å; F292-F294 HydrophobicContact CB-CE1 3.67Å; F292-F294 HydrophobicContact CB-CE2 4.17Å; F292-F294 HydrophobicContact CB-CZ 3.69Å; F292-F294 AromaticContact CD1-CE1 3.75Å; F292-F294 HydrophobicContact CD1-CE1 3.75Å; F292-F294 AromaticContact CD1-CZ 3.88Å; F292-F294 HydrophobicContact CD1-CZ 3.88Å; F292-F294 HydrophobicContact CD2-CZ 4.03Å; F292-F294 AromaticContact CG-CE1 3.79Å; F292-F294 HydrophobicContact CG-CE1 3.79Å; F292-F294 HydrophobicContact CG-CE2 4.41Å; F292-F294 AromaticContact CG-CZ 3.6Å; F292-F294 HydrophobicContact CG-CZ 3.6Å; F292-F294 PolarHBondContact O-N 2.95Å; F292-V295 HydrophobicContact CB-CB 4.35Å; F292-V295 HydrophobicContact CB-CG2 3.6Å; F292-V295 HydrophobicContact CD2-CG2 4.37Å; F292-V295 HydrophobicContact CG-CG2 4.47Å; F292-V295 WeakPolarHBondContact O-CB 3.2Å; F292-V295 PolarHBondContact O-N 3.07Å; F292-I343 HydrophobicContact CD2-CG1 4.35Å; F292-E346 HydrophobicContact CE2-CB 3.74Å; F292-E346 HydrophobicContact CE2-CG 3.83Å; F292-E346 HydrophobicContact CZ-CB 4.16Å; F292-E346 HydrophobicContact CZ-CG 4.1Å
293	H	94.9	Very high	96.9	Very high	168 Å²	168	63.1 Å²	63.1	78%	0.778	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-7.4	178.3	-55.7	-57.6	0	0	0	115.3
294	F	96.5	Very high	96.8	Very high	25 Å²	25	60 Å²	60	11%	0.11	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	3.7	174.9	61.5	-98	0	0	0	113	F292 K339 I343 E374 L375	F292-F294 HydrophobicContact CB-CD1 4.15Å; F292-F294 HydrophobicContact CB-CE1 3.67Å; F292-F294 HydrophobicContact CB-CE2 4.17Å; F292-F294 HydrophobicContact CB-CZ 3.69Å; F292-F294 AromaticContact CD1-CE1 3.75Å; F292-F294 HydrophobicContact CD1-CE1 3.75Å; F292-F294 AromaticContact CD1-CZ 3.88Å; F292-F294 HydrophobicContact CD1-CZ 3.88Å; F292-F294 HydrophobicContact CD2-CZ 4.03Å; F292-F294 AromaticContact CG-CE1 3.79Å; F292-F294 HydrophobicContact CG-CE1 3.79Å; F292-F294 HydrophobicContact CG-CE2 4.41Å; F292-F294 AromaticContact CG-CZ 3.6Å; F292-F294 HydrophobicContact CG-CZ 3.6Å; F292-F294 PolarHBondContact O-N 2.95Å; F294-K339 HydrophobicContact CB-CD 3.92Å; F294-K339 HydrophobicContact CD1-CD 4.27Å; F294-K339 HydrophobicContact CD1-CG 4.17Å; F294-K339 HydrophobicContact CD2-CB 3.62Å; F294-K339 HydrophobicContact CD2-CD 3.62Å; F294-K339 HydrophobicContact CD2-CG 3.52Å; F294-K339 HydrophobicContact CE1-CG 4.19Å; F294-K339 HydrophobicContact CE2-CB 3.42Å; F294-K339 VanDerWaalsContact CE2-CB 3.42Å; F294-K339 HydrophobicContact CE2-CD 4.19Å; F294-K339 HydrophobicContact CE2-CG 3.55Å; F294-K339 HydrophobicContact CG-CB 4.44Å; F294-K339 HydrophobicContact CG-CD 3.66Å; F294-K339 HydrophobicContact CG-CG 3.85Å; F294-K339 HydrophobicContact CZ-CB 4.11Å; F294-K339 HydrophobicContact CZ-CG 3.9Å; F294-I343 HydrophobicContact CE2-CD1 3.93Å; F294-I343 HydrophobicContact CE2-CG1 3.86Å; F294-I343 HydrophobicContact CZ-CG1 4.5Å; F294-E374 WeakPolarHBondContact O-CA 3.39Å; F294-E374 WeakPolarHBondContact O-CG 3.25Å; F294-L375 PolarHBondContact O-N 3.36Å
295	V	97.3	Very high	96.8	Very high	21 Å²	21	55.7 Å²	55.7	13%	0.127	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.2	178.7	-176.8	0	0	0	0	108.8	L289 F292 V297 I343 L375 L377	L289-V295 HydrophobicContact CB-CG1 4.38Å; L289-V295 HydrophobicContact CD1-CG1 4.09Å; F292-V295 HydrophobicContact CB-CB 4.35Å; F292-V295 HydrophobicContact CB-CG2 3.6Å; F292-V295 HydrophobicContact CD2-CG2 4.37Å; F292-V295 HydrophobicContact CG-CG2 4.47Å; F292-V295 WeakPolarHBondContact O-CB 3.2Å; F292-V295 PolarHBondContact O-N 3.07Å; V295-V297 HydrophobicContact CG1-CG2 4.39Å; V295-I343 HydrophobicContact CG2-CD1 3.53Å; V295-I343 HydrophobicContact CG2-CG1 3.57Å; V295-L375 WeakPolarHBondContact CA-O 3.4Å; V295-L377 HydrophobicContact CG1-CD1 4.04Å; V295-L377 HydrophobicContact CG1-CG 4.32Å
296	V	97.2	Very high	96.8	Very high	27 Å²	27	56.1 Å²	56.1	16%	0.164	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.1	173.2	177.8	0	0	0	0	108	E374 L375 V376 L377	V296-E374 VanDerWaalsContact CG2-CD 3.41Å; V296-E374 HydrophobicContact CG2-CG 3.7Å; V296-E374 WeakPolarHBondContact CG2-OE2 3.42Å; V296-L375 PolarHBondContact N-O 3.08Å; V296-V376 HydrophobicContact CB-CG1 4.37Å; V296-V376 HydrophobicContact CB-CG2 4.2Å; V296-V376 HydrophobicContact CG1-CG1 4.25Å; V296-V376 VanDerWaalsContact O-CA 3.29Å; V296-V376 WeakPolarHBondContact O-CA 3.37Å; V296-L377 PolarHBondContact O-N 3.49Å
297	V	97.6	Very high	96.7	Very high	23 Å²	23	58.2 Å²	58.2	14%	0.139	27%	0.269	C	S	.	.			trans	-115.8	121.8	168.4	178.4	0	0	0	0	106.3	S282 A286 V295 K299 L377	S282-V297 WeakPolarHBondContact O-CG1 3.32Å; A286-V297 HydrophobicContact CB-CB 3.79Å; A286-V297 HydrophobicContact CB-CG1 4.18Å; A286-V297 HydrophobicContact CB-CG2 4.14Å; V295-V297 HydrophobicContact CG1-CG2 4.39Å; V297-K299 PolarHBondContact O-N 3.02Å; V297-L377 HydrophobicContact CG2-CB 4.47Å
298	P	97.4	Very high	96.5	Very high	11 Å²	11	53.7 Å²	53.7	7%	0.071	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-54.1	134.3	-178.8	-28.2	35.4	0	0	0	112.5	V300 A312 E313 V376 L377 L378	P298-V300 PolarHBondContact O-N 3.07Å; P298-A312 HydrophobicContact CB-CB 4.04Å; P298-E313 HydrophobicContact CB-CB 4.15Å; P298-V376 HydrophobicContact CG-CG1 4.12Å; P298-L377 WeakPolarHBondContact CD-O 3.16Å; P298-L378 HydrophobicContact CG-CD2 3.95Å
299	K	98	Very high	96.6	Very high	136 Å²	136	51.7 Å²	51.7	59%	0.591	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-65.1	134.8	175.8	-176.1	-177.2	175.4	-171.9	0	110.7	V297 F301 A312 E313	V297-K299 PolarHBondContact O-N 3.02Å; K299-F301 WeakPolarHBondContact O-CE2 3.25Å; K299-A312 CarbonylContact O-C 3.55Å; K299-A312 WeakPolarHBondContact O-CA 3.3Å; K299-E313 HydrophobicContact CB-CB 4.33Å; K299-E313 PolarHBondContact O-N 3.29Å
300	V	98.4	Very high	96.6	Very high	6 Å²	6	52.1 Å²	52.1	4%	0.036	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-83.6	142.9	175.2	176.8	0	0	0	0	111	A279 S282 E283 P298 W302 L310	A279-V300 HydrophobicContact CB-CG1 3.8Å; A279-V300 HydrophobicContact CB-CG2 4Å; S282-V300 VanDerWaalsContact OG-CG2 3.29Å; S282-V300 WeakPolarHBondContact OG-CG2 3.44Å; E283-V300 HydrophobicContact CG-CG2 4.31Å; P298-V300 PolarHBondContact O-N 3.07Å; V300-W302 HydrophobicContact CG1-CD2 4.11Å; V300-W302 HydrophobicContact CG1-CG 4.27Å; V300-W302 HydrophobicContact CG1-CZ2 4.38Å; V300-L310 HydrophobicContact CG1-CD1 4.33Å; V300-L310 HydrophobicContact CG2-CD1 4.46Å
301	F	98.3	Very high	96.8	Very high	29 Å²	29	46 Å²	46	13%	0.127	21%	0.214	C	C	.	.			trans	-111.1	95.8	172.6	-62.5	-92.6	0	0	0	109.9	L216 T220 V222 K299 E303 Q304 T305 T311 E313	L216-F301 HydrophobicContact CD1-CD1 3.4Å; L216-F301 VanDerWaalsContact CD1-CD1 3.4Å; L216-F301 HydrophobicContact CD1-CE1 3.5Å; L216-F301 HydrophobicContact CD1-CG 3.96Å; L216-F301 HydrophobicContact CD1-CZ 4.15Å; T220-F301 HydrophobicContact CG2-CE1 4.32Å; T220-F301 HydrophobicContact CG2-CZ 3.74Å; V222-F301 HydrophobicContact CG1-CD2 3.8Å; V222-F301 HydrophobicContact CG1-CE2 3.62Å; V222-F301 HydrophobicContact CG1-CG 4.47Å; V222-F301 HydrophobicContact CG1-CZ 4.14Å; K299-F301 WeakPolarHBondContact O-CE2 3.25Å; F301-E303 VanDerWaalsContact C-N 3.33Å; F301-E303 PolarHBondContact O-N 2.99Å; F301-Q304 CarbonylContact O-C 3.11Å; F301-Q304 PolarHBondContact O-N 3.48Å; F301-T305 WeakPolarHBondContact O-CB 3.28Å; F301-T305 PolarHBondContact O-N 3.38Å; F301-T305 PolarHBondContact O-OG1 3.45Å; F301-T311 HydrophobicContact CB-CG2 3.97Å; F301-T311 HydrophobicContact CD2-CG2 4.25Å; F301-T311 HydrophobicContact CG-CG2 4.42Å; F301-T311 PolarHBondContact N-O 2.96Å; F301-E313 HydrophobicContact CE2-CB 4.24Å
302	W	97.8	Very high	96.9	Very high	95 Å²	95	42.7 Å²	42.7	36%	0.36	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-65.6	-30	-171.7	-75.8	103.2	0	0	0	114.3	E276 A279 R280 E283 V300 Q304 T305	E276-W302 HydrophobicContact CB-CZ3 4.21Å; E276-W302 HydrophobicContact CG-CZ3 4.34Å; A279-W302 HydrophobicContact CB-CH2 3.32Å; A279-W302 HydrophobicContact CB-CZ2 3.64Å; A279-W302 HydrophobicContact CB-CZ3 3.93Å; R280-W302 HydrophobicContact CG-CH2 3.73Å; R280-W302 HydrophobicContact CG-CZ2 4.01Å; E283-W302 PolarHBondContact OE1-NE1 3.36Å; E283-W302 PolarHBondContact OE2-NE1 3.46Å; V300-W302 HydrophobicContact CG1-CD2 4.11Å; V300-W302 HydrophobicContact CG1-CG 4.27Å; V300-W302 HydrophobicContact CG1-CZ2 4.38Å; W302-Q304 PolarHBondContact O-N 2.58Å; W302-T305 HydrophobicContact CE3-CG2 4.15Å; W302-T305 HydrophobicContact CZ3-CG2 4.17Å; W302-T305 PolarHBondContact O-N 3.04Å; W302-T305 VanDerWaalsContact O-N 3.17Å
303	E	96.2	Very high	97	Very high	162 Å²	162	45.4 Å²	45.4	76%	0.757	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-65.3	-27.6	177.8	-66.2	-177	178.7	0	0	112.9	F301	F301-E303 VanDerWaalsContact C-N 3.33Å; F301-E303 PolarHBondContact O-N 2.99Å
304	Q	96.9	Very high	97.1	Very high	22 Å²	22	40.4 Å²	40.4	10%	0.103	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-108.5	19.3	177.3	-59.2	74.9	21.6	0	0	111.4	L194 F195 L216 F301 W302 T311	L194-Q304 HydrophobicContact CD2-CG 4.21Å; F195-Q304 HydrophobicContact CE1-CB 4.12Å; F195-Q304 HydrophobicContact CE1-CG 3.93Å; F195-Q304 HydrophobicContact CZ-CB 3.88Å; F195-Q304 HydrophobicContact CZ-CG 4.02Å; L216-Q304 HydrophobicContact CD2-CG 4.09Å; F301-Q304 CarbonylContact O-C 3.11Å; F301-Q304 PolarHBondContact O-N 3.48Å; W302-Q304 PolarHBondContact O-N 2.58Å; Q304-T311 HydrophobicContact CB-CG2 4.02Å; Q304-T311 WeakPolarHBondContact CB-OG1 3.44Å; Q304-T311 WeakPolarHBondContact O-CB 3.47Å; Q304-T311 PolarHBondContact O-OG1 3.08Å
305	T	97.8	Very high	97.1	Very high	12 Å²	12	39.9 Å²	39.9	7%	0.074	19%	0.189	C	C	.	.			trans	-117.7	137.6	178.7	-64.5	0	0	0	0	110.1	A279 F301 W302 V309 L310 T311	A279-T305 HydrophobicContact CB-CG2 4.34Å; F301-T305 WeakPolarHBondContact O-CB 3.28Å; F301-T305 PolarHBondContact O-N 3.38Å; F301-T305 PolarHBondContact O-OG1 3.45Å; W302-T305 HydrophobicContact CE3-CG2 4.15Å; W302-T305 HydrophobicContact CZ3-CG2 4.17Å; W302-T305 PolarHBondContact O-N 3.04Å; W302-T305 VanDerWaalsContact O-N 3.17Å; T305-V309 CarbonylContact C-O 3.5Å; T305-V309 VanDerWaalsContact CA-O 3.3Å; T305-V309 WeakPolarHBondContact CA-O 3.34Å; T305-L310 HydrophobicContact CG2-CD1 4.14Å; T305-T311 PolarHBondContact OG1-N 3.42Å
306	S	96.7	Very high	96.8	Very high	10 Å²	10	42.7 Å²	42.7	7%	0.07	21%	0.21	C	C	.	.			trans	-139.9	-176.4	176.2	74.3	0	0	0	0	108.8	D186 F275 R308 V309	D186-S306 WeakPolarHBondContact OD2-CB 3.34Å; D186-S306 PolarHBondContact OD2-OG 3.03Å; F275-S306 WeakPolarHBondContact CB-O 3.36Å; S306-R308 PolarHBondContact O-N 2.82Å; S306-R308 VanDerWaalsContact O-N 3.15Å; S306-R308 PolarHBondContact OG-N 3.23Å; S306-R308 VanDerWaalsContact OG-N 3.13Å; S306-V309 PolarHBondContact N-O 3.27Å; S306-V309 PolarHBondContact OG-N 2.98Å
307	K	94.1	Very high	96.7	Very high	81 Å²	81	43 Å²	43	35%	0.352	22%	0.219	S	C	.	.	S	Bend	trans	-62.3	-19.5	173.2	-59.4	-164	175.1	-161.9	0	114.7	Q227 R232 D274 F275 E276	Q227-K307 PolarHBondContact NE2-O 3.07Å; Q227-K307 VanDerWaalsContact NE2-O 3.1Å; R232-K307 VanDerWaalsContact NH1-CB 3.28Å; D274-K307 IonicContact OD2-NZ 3.22Å; F275-K307 PolarHBondContact N-O 3.5Å; F275-K307 VanDerWaalsContact N-O 3.12Å; E276-K307 HydrophobicContact CG-CG 4.05Å; E276-K307 WeakPolarHBondContact OE1-CG 3.37Å
308	R	94.1	Very high	96.5	Very high	20 Å²	20	42 Å²	42	8%	0.075	21%	0.213	C	C	.	.	S	Bend	trans	-120.7	-7.1	-176.4	-54.7	-179.9	-79.3	178.6	-6.9	114.1	L182 E185 D186 Q227 S306	L182-R308 HydrophobicContact CD1-CB 4.1Å; L182-R308 HydrophobicContact CD2-CB 4.01Å; L182-R308 HydrophobicContact CG-CB 4.29Å; E185-R308 IonicContact OE2-CZ 3.61Å; E185-R308 IonicContact OE2-NH1 2.6Å; E185-R308 PolarHBondContact OE2-NH1 3.32Å; E185-R308 IonicContact OE2-NH2 2.81Å; E185-R308 PolarHBondContact OE2-NH2 3.33Å; D186-R308 IonicContact OD1-CZ 2.92Å; D186-R308 IonicContact OD1-NE 3.04Å; D186-R308 PolarHBondContact OD1-NE 2.91Å; D186-R308 IonicContact OD1-NH2 3.85Å; D186-R308 PolarHBondContact OD1-NH2 3.34Å; D186-R308 WeakPolarHBondContact OD2-CB 3.44Å; D186-R308 IonicContact OD2-NE 3.41Å; D186-R308 PolarHBondContact OD2-NE 2.74Å; Q227-R308 HydrophobicContact CB-CB 4.32Å; Q227-R308 HydrophobicContact CG-CB 4.42Å; Q227-R308 PolarHBondContact N-O 2.97Å; S306-R308 PolarHBondContact O-N 2.82Å; S306-R308 VanDerWaalsContact O-N 3.15Å; S306-R308 PolarHBondContact OG-N 3.23Å; S306-R308 VanDerWaalsContact OG-N 3.13Å
309	V	96.3	Very high	96.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	125.3	174.6	-178.3	0	0	0	0	109	L182 F183 F187 V224 K225 V226 T305 S306	L182-V309 HydrophobicContact CD2-CG2 3.2Å; F183-V309 HydrophobicContact CD2-CG2 4.43Å; F183-V309 HydrophobicContact CE1-CG1 4.14Å; F183-V309 HydrophobicContact CE1-CG2 4.45Å; F183-V309 HydrophobicContact CE2-CG1 4.33Å; F183-V309 HydrophobicContact CE2-CG2 4.01Å; F183-V309 HydrophobicContact CZ-CB 4.48Å; F183-V309 HydrophobicContact CZ-CG1 3.65Å; F183-V309 HydrophobicContact CZ-CG2 4.03Å; F187-V309 HydrophobicContact CE2-CB 3.78Å; F187-V309 HydrophobicContact CE2-CG1 4.2Å; F187-V309 HydrophobicContact CE2-CG2 3.76Å; F187-V309 HydrophobicContact CZ-CB 3.99Å; F187-V309 HydrophobicContact CZ-CG1 4.38Å; F187-V309 HydrophobicContact CZ-CG2 4.45Å; V224-V309 HydrophobicContact CG1-CG1 3.65Å; K225-V309 CarbonylContact O-C 3.42Å; K225-V309 WeakPolarHBondContact O-CA 3.48Å; V226-V309 HydrophobicContact CG1-CG2 4.48Å; T305-V309 CarbonylContact C-O 3.5Å; T305-V309 VanDerWaalsContact CA-O 3.3Å; T305-V309 WeakPolarHBondContact CA-O 3.34Å; S306-V309 PolarHBondContact N-O 3.27Å; S306-V309 PolarHBondContact OG-N 2.98Å
310	L	97.6	Very high	96.1	Very high	12 Å²	12	40.7 Å²	40.7	6%	0.063	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	121.8	171.1	169.8	66.9	0	0	0	108.4	V224 K225 F275 E278 A279 V300 T305	V224-L310 CarbonylContact C-O 3.58Å; V224-L310 WeakPolarHBondContact CA-O 3.35Å; K225-L310 HydrophobicContact CB-CB 4.19Å; K225-L310 HydrophobicContact CD-CD2 4.29Å; K225-L310 PolarHBondContact N-O 3.4Å; K225-L310 PolarHBondContact O-N 2.97Å; F275-L310 HydrophobicContact CB-CB 3.97Å; F275-L310 HydrophobicContact CD2-CB 3.84Å; F275-L310 HydrophobicContact CG-CB 4Å; E278-L310 HydrophobicContact CB-CD2 4.5Å; E278-L310 HydrophobicContact CG-CD2 3.81Å; A279-L310 HydrophobicContact CB-CD1 3.77Å; V300-L310 HydrophobicContact CG1-CD1 4.33Å; V300-L310 HydrophobicContact CG2-CD1 4.46Å; T305-L310 HydrophobicContact CG2-CD1 4.14Å
311	T	98.1	Very high	95.7	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	120.9	174.8	-60.8	0	0	0	0	109.4	F195 V222 V224 F301 Q304 T305	F195-T311 HydrophobicContact CE1-CG2 3.97Å; F195-T311 HydrophobicContact CZ-CG2 4.3Å; V222-T311 HydrophobicContact CB-CG2 3.85Å; V222-T311 HydrophobicContact CG1-CG2 4.13Å; V222-T311 HydrophobicContact CG2-CG2 3.87Å; V224-T311 HydrophobicContact CG2-CG2 4.25Å; F301-T311 HydrophobicContact CB-CG2 3.97Å; F301-T311 HydrophobicContact CD2-CG2 4.25Å; F301-T311 HydrophobicContact CG-CG2 4.42Å; F301-T311 PolarHBondContact N-O 2.96Å; Q304-T311 HydrophobicContact CB-CG2 4.02Å; Q304-T311 WeakPolarHBondContact CB-OG1 3.44Å; Q304-T311 WeakPolarHBondContact O-CB 3.47Å; Q304-T311 PolarHBondContact O-OG1 3.08Å; T305-T311 PolarHBondContact OG1-N 3.42Å
312	A	98.2	Very high	95.5	Very high	16 Å²	16	45.2 Å²	45.2	13%	0.132	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	162.5	-179.7	0	0	0	0	0	111.8	V222 A223 P298 K299 F314	V222-A312 CarbonylContact C-O 3.49Å; V222-A312 VanDerWaalsContact CA-O 3.27Å; V222-A312 WeakPolarHBondContact CA-O 3.49Å; V222-A312 WeakPolarHBondContact CB-O 3.39Å; A223-A312 PolarHBondContact N-O 2.81Å; A223-A312 PolarHBondContact O-N 3.1Å; P298-A312 HydrophobicContact CB-CB 4.04Å; K299-A312 CarbonylContact O-C 3.55Å; K299-A312 WeakPolarHBondContact O-CA 3.3Å; A312-F314 PolarHBondContact O-N 2.84Å
313	E	98.1	Very high	95.4	Very high	78 Å²	78	42.3 Å²	42.3	36%	0.364	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	131.8	178.3	-176.8	-177.6	176.8	0	0	111.5	P298 K299 F301 C315	P298-E313 HydrophobicContact CB-CB 4.15Å; K299-E313 HydrophobicContact CB-CB 4.33Å; K299-E313 PolarHBondContact O-N 3.29Å; F301-E313 HydrophobicContact CE2-CB 4.24Å; E313-C315 PolarHBondContact O-N 3.11Å
314	F	97.1	Very high	95.3	Very high	63 Å²	63	42.3 Å²	42.3	28%	0.276	22%	0.221	S	C	.	.			trans	-74.5	115.2	176.8	-177.4	-96.5	0	0	0	110.4	I203 K213 S221 A223 A312	I203-F314 HydrophobicContact CD1-CD2 4.37Å; I203-F314 HydrophobicContact CD1-CE2 3.68Å; K213-F314 HydrophobicContact CD-CE2 4.38Å; K213-F314 HydrophobicContact CD-CZ 4.45Å; K213-F314 HydrophobicContact CG-CD2 4.34Å; K213-F314 HydrophobicContact CG-CE2 4.42Å; S221-F314 WeakPolarHBondContact O-CB 3.46Å; S221-F314 PolarHBondContact O-N 3.47Å; S221-F314 WeakPolarHBondContact OG-CB 3.27Å; A223-F314 HydrophobicContact CB-CD2 4.19Å; A312-F314 PolarHBondContact O-N 2.84Å
315	C	95.2	Very high	95.3	Very high	13 Å²	13	44.4 Å²	44.4	9%	0.088	23%	0.231	C	C	.	.			trans	-105.8	134.6	177.2	-68.3	0	0	0	0	111.8	E313 V376	E313-C315 PolarHBondContact O-N 3.11Å; C315-V376 HydrophobicContact CB-CG1 3.74Å; C315-V376 HydrophobicContact CB-CG2 4.44Å
316	S	92.4	Very high	95.1	Very high	81 Å²	81	43.9 Å²	43.9	57%	0.566	23%	0.228	S	C	*	.			trans	-96.3	149.5	171.3	58.7	0	0	0	0	111.8	R366	S316-R366 VanDerWaalsContact O-CD 3.28Å; S316-R366 WeakPolarHBondContact O-CD 3.24Å
317	G	93.6	Very high	95	Very high	34 Å²	34	49.7 Å²	49.7	35%	0.351	25%	0.252	S	S	.	.			trans	164.4	171	177.7	0	0	0	0	0	111.3
318	C	93.8	Very high	95.1	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.014	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	149.3	174.3	65.1	0	0	0	0	110.6	E325 I326 L364 V365	C318-E325 HydrophobicContact CB-CB 4.09Å; C318-E325 HydrophobicContact CB-CG 3.67Å; C318-E325 WeakPolarHBondContact CB-OE1 3.27Å; C318-E325 WeakPolarHBondContact CB-OE2 3.2Å; C318-I326 WeakPolarHBondContact SG-CG1 3.38Å; C318-L364 CarbonylContact O-C 3.37Å; C318-L364 VanDerWaalsContact O-CA 3.3Å; C318-L364 WeakPolarHBondContact O-CA 3.05Å; C318-V365 PolarHBondContact N-O 3.01Å; C318-V365 PolarHBondContact O-N 2.81Å; C318-V365 PolarHBondContact SG-O 2.89Å
319	K	93.8	Very high	95	Very high	118 Å²	118	55.7 Å²	55.7	51%	0.513	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	143.3	176.5	-64.8	-179.6	179.2	178.2	0	110.3	N321 N322 L364	K319-N321 VanDerWaalsContact CB-OD1 3.25Å; K319-N321 WeakPolarHBondContact CB-OD1 3.35Å; K319-N321 PolarHBondContact O-N 3.25Å; K319-N321 VanDerWaalsContact O-N 3.09Å; K319-N322 WeakPolarHBondContact O-CB 3.42Å; K319-N322 PolarHBondContact O-N 3.43Å; K319-L364 HydrophobicContact CG-CD2 4.35Å
320	I	93.9	Very high	94.9	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-24.3	-176.7	-166	161.2	0	0	0	114.2	N322 I326 T336 L340 P360 V363 V365 I487 L491	I320-N322 VanDerWaalsContact C-N 3.35Å; I320-I326 WeakPolarHBondContact O-CD1 3.49Å; I320-T336 HydrophobicContact CD1-CG2 3.92Å; I320-T336 HydrophobicContact CG1-CG2 3.92Å; I320-L340 HydrophobicContact CD1-CB 4.33Å; I320-L340 HydrophobicContact CD1-CD1 3.57Å; I320-L340 HydrophobicContact CD1-CD2 3.79Å; I320-L340 HydrophobicContact CD1-CG 4.11Å; I320-P360 HydrophobicContact CG2-CB 3.95Å; I320-V363 HydrophobicContact CB-CB 4.23Å; I320-V363 HydrophobicContact CB-CG1 4.19Å; I320-V363 HydrophobicContact CD1-CG1 3.85Å; I320-V363 HydrophobicContact CG2-CB 4Å; I320-V363 HydrophobicContact CG2-CG1 4.44Å; I320-V363 PolarHBondContact N-O 3.23Å; I320-V365 HydrophobicContact CB-CG2 3.86Å; I320-V365 HydrophobicContact CD1-CG2 4.29Å; I320-V365 HydrophobicContact CG1-CG2 3.81Å; I320-I487 HydrophobicContact CD1-CG2 3.79Å; I320-I487 HydrophobicContact CG1-CG2 3.81Å; I320-I487 HydrophobicContact CG2-CD1 4.23Å; I320-I487 HydrophobicContact CG2-CG1 4.4Å; I320-I487 HydrophobicContact CG2-CG2 4Å; I320-L491 HydrophobicContact CG1-CD1 4.37Å; I320-L491 WeakPolarHBondContact O-CD2 3.39Å
321	N	90.8	Very high	94.8	Very high	71 Å²	71	58.4 Å²	58.4	38%	0.38	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-7.2	174.8	62.9	-8.8	0	0	0	113.7	K319 V323 P360 T490	K319-N321 VanDerWaalsContact CB-OD1 3.25Å; K319-N321 WeakPolarHBondContact CB-OD1 3.35Å; K319-N321 PolarHBondContact O-N 3.25Å; K319-N321 VanDerWaalsContact O-N 3.09Å; N321-V323 VanDerWaalsContact C-N 3.3Å; N321-V323 PolarHBondContact O-N 3.05Å; N321-P360 HydrophobicContact CB-CB 3.96Å; N321-T490 HydrophobicContact CB-CG2 4.07Å
322	N	93.6	Very high	94.7	Very high	60 Å²	60	61.5 Å²	61.5	32%	0.321	33%	0.333	S	S	.	.			trans	-83.4	72.8	176.9	-165.3	-9.4	0	0	0	111.7	K319 I320 K324 E325 I326	K319-N322 WeakPolarHBondContact O-CB 3.42Å; K319-N322 PolarHBondContact O-N 3.43Å; I320-N322 VanDerWaalsContact C-N 3.35Å; N322-K324 PolarHBondContact O-N 3.08Å; N322-K324 VanDerWaalsContact O-N 3.15Å; N322-E325 HydrophobicContact CB-CB 4.19Å; N322-E325 VanDerWaalsContact CG-CB 3.46Å; N322-E325 WeakPolarHBondContact ND2-CB 3.47Å; N322-E325 PolarHBondContact ND2-OE2 2.92Å; N322-E325 PolarHBondContact O-N 3.28Å; N322-E325 PolarHBondContact OD1-N 3.22Å; N322-I326 WeakPolarHBondContact O-CG1 3.26Å; N322-I326 PolarHBondContact O-N 3.26Å; N322-I326 VanDerWaalsContact O-N 3.09Å
323	V	94.6	Very high	94.6	Very high	33 Å²	33	62 Å²	62	20%	0.2	33%	0.334	C	S	.	.	H	α-helix	trans	-54.4	-36.3	-178.1	-179.9	0	0	0	0	112.8	N321 K327 L333 T490 L491	N321-V323 VanDerWaalsContact C-N 3.3Å; N321-V323 PolarHBondContact O-N 3.05Å; V323-K327 HydrophobicContact CG1-CD 4.44Å; V323-K327 WeakPolarHBondContact O-CG 3.44Å; V323-K327 PolarHBondContact O-N 2.97Å; V323-L333 HydrophobicContact CG1-CD1 3.77Å; V323-L333 HydrophobicContact CG1-CD2 4.06Å; V323-T490 HydrophobicContact CG2-CG2 4.31Å; V323-T490 WeakPolarHBondContact CG2-O 3.23Å; V323-L491 HydrophobicContact CG2-CD2 4.35Å
324	K	95.5	Very high	94.5	Very high	163 Å²	163	64.5 Å²	64.5	71%	0.709	34%	0.343	S	S	*	.	H	α-helix	trans	-65.9	-47.8	-178.4	-68.8	-178.6	-179.4	177.7	0	111	N322 K327 Q328	N322-K324 PolarHBondContact O-N 3.08Å; N322-K324 VanDerWaalsContact O-N 3.15Å; K324-K327 PolarHBondContact O-N 3.48Å; K324-Q328 WeakPolarHBondContact O-CG 2.91Å; K324-Q328 PolarHBondContact O-N 3.25Å
325	E	95.1	Very high	94.5	Very high	66 Å²	66	63.3 Å²	63.3	31%	0.308	34%	0.34	S	S	.	.	H	α-helix	trans	-68.9	-40.6	-178.2	-167.8	177.5	175.5	0	0	111.8	C318 N322 K327 Q328 Q329	C318-E325 HydrophobicContact CB-CB 4.09Å; C318-E325 HydrophobicContact CB-CG 3.67Å; C318-E325 WeakPolarHBondContact CB-OE1 3.27Å; C318-E325 WeakPolarHBondContact CB-OE2 3.2Å; N322-E325 HydrophobicContact CB-CB 4.19Å; N322-E325 VanDerWaalsContact CG-CB 3.46Å; N322-E325 WeakPolarHBondContact ND2-CB 3.47Å; N322-E325 PolarHBondContact ND2-OE2 2.92Å; N322-E325 PolarHBondContact O-N 3.28Å; N322-E325 PolarHBondContact OD1-N 3.22Å; E325-K327 VanDerWaalsContact C-N 3.28Å; E325-K327 PolarHBondContact O-N 3.44Å; E325-Q328 WeakPolarHBondContact O-CB 3.23Å; E325-Q328 PolarHBondContact O-N 3.3Å; E325-Q328 VanDerWaalsContact O-N 3.1Å; E325-Q329 WeakPolarHBondContact O-CG 3.46Å; E325-Q329 PolarHBondContact O-N 3Å
326	I	95.3	Very high	94.5	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-56.9	-44.2	174.6	-63.4	168.2	0	0	0	110.7	C318 I320 N322 Q329 G330 I331 L333 V365 L491	C318-I326 WeakPolarHBondContact SG-CG1 3.38Å; I320-I326 WeakPolarHBondContact O-CD1 3.49Å; N322-I326 WeakPolarHBondContact O-CG1 3.26Å; N322-I326 PolarHBondContact O-N 3.26Å; N322-I326 VanDerWaalsContact O-N 3.09Å; I326-Q329 PolarHBondContact O-N 3.01Å; I326-G330 PolarHBondContact O-N 3.44Å; I326-I331 HydrophobicContact CG2-CB 3.74Å; I326-I331 HydrophobicContact CG2-CG2 3.89Å; I326-I331 PolarHBondContact O-N 2.88Å; I326-I331 VanDerWaalsContact O-N 3.08Å; I326-L333 HydrophobicContact CB-CD2 4.05Å; I326-L333 HydrophobicContact CD1-CD2 4.42Å; I326-L333 HydrophobicContact CG2-CD2 3.69Å; I326-V365 HydrophobicContact CD1-CB 4.45Å; I326-V365 HydrophobicContact CD1-CG2 4.17Å; I326-V365 HydrophobicContact CG1-CB 4.34Å; I326-V365 HydrophobicContact CG1-CG1 4.42Å; I326-L491 HydrophobicContact CD1-CD2 4.18Å
327	K	94.6	Very high	94.7	Very high	133 Å²	133	58.9 Å²	58.9	58%	0.578	31%	0.309	S	S	*	.	H	α-helix	trans	-66.2	-39.9	176.4	-73.4	-177	-176	-173.3	0	112.5	V323 K324 E325 Q329 G330 L333	V323-K327 HydrophobicContact CG1-CD 4.44Å; V323-K327 WeakPolarHBondContact O-CG 3.44Å; V323-K327 PolarHBondContact O-N 2.97Å; K324-K327 PolarHBondContact O-N 3.48Å; E325-K327 VanDerWaalsContact C-N 3.28Å; E325-K327 PolarHBondContact O-N 3.44Å; K327-Q329 VanDerWaalsContact C-N 3.27Å; K327-Q329 PolarHBondContact O-N 3.2Å; K327-G330 PolarHBondContact O-N 3.33Å; K327-L333 HydrophobicContact CG-CD2 4.5Å; K327-L333 HydrophobicContact CG-CG 4.5Å
328	Q	94.9	Very high	94.8	Very high	160 Å²	160	59.4 Å²	59.4	75%	0.748	30%	0.303	S	S	*	.	H	α-helix	trans	-63	-34.2	177.3	-75.3	170.5	-12.7	0	0	112.2	K324 E325 G330	K324-Q328 WeakPolarHBondContact O-CG 2.91Å; K324-Q328 PolarHBondContact O-N 3.25Å; E325-Q328 WeakPolarHBondContact O-CB 3.23Å; E325-Q328 PolarHBondContact O-N 3.3Å; E325-Q328 VanDerWaalsContact O-N 3.1Å; Q328-G330 PolarHBondContact O-N 3.47Å
329	Q	92.8	Very high	94.9	Very high	66 Å²	66	59.8 Å²	59.8	31%	0.308	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	0.1	173.2	-64.7	-179.1	26.6	0	0	113.3	E325 I326 K327 I331	E325-Q329 WeakPolarHBondContact O-CG 3.46Å; E325-Q329 PolarHBondContact O-N 3Å; I326-Q329 PolarHBondContact O-N 3.01Å; K327-Q329 VanDerWaalsContact C-N 3.27Å; K327-Q329 PolarHBondContact O-N 3.2Å; Q329-I331 VanDerWaalsContact C-N 3.25Å; Q329-I331 HydrophobicContact CB-CD1 3.87Å; Q329-I331 HydrophobicContact CB-CG1 4Å; Q329-I331 PolarHBondContact O-N 3.31Å
330	G	93.6	Very high	95.1	Very high	63 Å²	63	54.1 Å²	54.1	65%	0.649	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	15.9	-178.7	0	0	0	0	0	114.3	I326 K327 Q328	I326-G330 PolarHBondContact O-N 3.44Å; K327-G330 PolarHBondContact O-N 3.33Å; Q328-G330 PolarHBondContact O-N 3.47Å
331	I	96.3	Very high	95.2	Very high	7 Å²	7	54.2 Å²	54.2	4%	0.036	28%	0.281	C	S	.	.			trans	-86.1	135.7	-177.2	-59.4	170.4	0	0	0	109.7	I326 Q329 L333 V365 R366 Q367 A373	I326-I331 HydrophobicContact CG2-CB 3.74Å; I326-I331 HydrophobicContact CG2-CG2 3.89Å; I326-I331 PolarHBondContact O-N 2.88Å; I326-I331 VanDerWaalsContact O-N 3.08Å; Q329-I331 VanDerWaalsContact C-N 3.25Å; Q329-I331 HydrophobicContact CB-CD1 3.87Å; Q329-I331 HydrophobicContact CB-CG1 4Å; Q329-I331 PolarHBondContact O-N 3.31Å; I331-L333 PolarHBondContact O-N 2.75Å; I331-V365 HydrophobicContact CD1-CG1 4.09Å; I331-V365 HydrophobicContact CG2-CG1 4.11Å; I331-R366 VanDerWaalsContact CD1-C 3.49Å; I331-Q367 HydrophobicContact CD1-CB 4.27Å; I331-Q367 HydrophobicContact CG1-CB 4.44Å; I331-A373 HydrophobicContact CG2-CB 3.55Å
332	S	96.3	Very high	95.4	Very high	65 Å²	65	54.6 Å²	54.6	46%	0.455	28%	0.277	S	S	.	.			trans	-75.6	119.5	180	172.9	0	0	0	0	111.9	K334 D335 T336	S332-K334 PolarHBondContact O-N 3.13Å; S332-K334 PolarHBondContact OG-N 3.5Å; S332-D335 PolarHBondContact O-N 3.47Å; S332-D335 VanDerWaalsContact O-N 3.08Å; S332-D335 PolarHBondContact OG-N 3.16Å; S332-T336 PolarHBondContact O-N 2.95Å; S332-T336 PolarHBondContact O-OG1 2.71Å; S332-T336 VanDerWaalsContact O-OG1 3.13Å
333	L	96	Very high	95.5	Very high	27 Å²	27	51.8 Å²	51.8	14%	0.141	26%	0.262	C	S	.	.	H	α-helix	trans	-57.2	-33.9	174.5	-58.2	179.7	0	0	0	112.8	V323 I326 K327 I331 A337 L491	V323-L333 HydrophobicContact CG1-CD1 3.77Å; V323-L333 HydrophobicContact CG1-CD2 4.06Å; I326-L333 HydrophobicContact CB-CD2 4.05Å; I326-L333 HydrophobicContact CD1-CD2 4.42Å; I326-L333 HydrophobicContact CG2-CD2 3.69Å; K327-L333 HydrophobicContact CG-CD2 4.5Å; K327-L333 HydrophobicContact CG-CG 4.5Å; I331-L333 PolarHBondContact O-N 2.75Å; L333-A337 VanDerWaalsContact O-CB 3.31Å; L333-A337 WeakPolarHBondContact O-CB 3.29Å; L333-A337 PolarHBondContact O-N 3.24Å; L333-L491 HydrophobicContact CD2-CD2 3.9Å
334	K	95.2	Very high	95.6	Very high	130 Å²	130	50.3 Å²	50.3	57%	0.565	25%	0.252	S	S	*	.	H	α-helix	trans	-67.5	-42.2	177.3	-174.8	179.7	179.9	-178.5	0	111.5	S332 D338 P494 V495	S332-K334 PolarHBondContact O-N 3.13Å; S332-K334 PolarHBondContact OG-N 3.5Å; K334-D338 WeakPolarHBondContact O-CB 3.46Å; K334-D338 PolarHBondContact O-N 2.99Å; K334-P494 HydrophobicContact CB-CB 3.94Å; K334-P494 HydrophobicContact CB-CG 4.4Å; K334-P494 HydrophobicContact CG-CB 4.19Å; K334-V495 HydrophobicContact CG-CG2 3.82Å; K334-V495 WeakPolarHBondContact O-CG2 3.39Å
335	D	96.3	Very high	95.5	Very high	38 Å²	38	42.6 Å²	42.6	20%	0.203	22%	0.219	C	C	.	.	H	α-helix	trans	-66.4	-44.6	177.3	-175.8	59.9	0	0	0	110.7	S332 A337 D338 K339 K372 A373	S332-D335 PolarHBondContact O-N 3.47Å; S332-D335 VanDerWaalsContact O-N 3.08Å; S332-D335 PolarHBondContact OG-N 3.16Å; D335-A337 PolarHBondContact O-N 3.07Å; D335-D338 PolarHBondContact O-N 3.23Å; D335-K339 WeakPolarHBondContact O-CB 3.12Å; D335-K339 WeakPolarHBondContact O-CG 3.48Å; D335-K339 PolarHBondContact O-N 2.87Å; D335-K339 VanDerWaalsContact OD1-CE 3.29Å; D335-K339 WeakPolarHBondContact OD1-CE 3.5Å; D335-K339 IonicContact OD1-NZ 3.09Å; D335-K339 PolarHBondContact OD1-NZ 3.28Å; D335-K339 WeakPolarHBondContact OD2-CE 3.38Å; D335-K339 IonicContact OD2-NZ 2.59Å; D335-K339 PolarHBondContact OD2-NZ 3.12Å; D335-K372 WeakPolarHBondContact OD2-CB 3.42Å; D335-A373 VanDerWaalsContact OD2-CB 3.29Å; D335-A373 WeakPolarHBondContact OD2-CB 3.37Å; D335-A373 PolarHBondContact OD2-N 2.96Å
336	T	96.8	Very high	95.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-55.5	-50.3	173.3	-57.2	0	0	0	0	111.7	I320 S332 L340 V365 A373 L375 L491	I320-T336 HydrophobicContact CD1-CG2 3.92Å; I320-T336 HydrophobicContact CG1-CG2 3.92Å; S332-T336 PolarHBondContact O-N 2.95Å; S332-T336 PolarHBondContact O-OG1 2.71Å; S332-T336 VanDerWaalsContact O-OG1 3.13Å; T336-L340 WeakPolarHBondContact O-CB 3.39Å; T336-L340 PolarHBondContact O-N 3.19Å; T336-V365 HydrophobicContact CG2-CG1 4.17Å; T336-V365 HydrophobicContact CG2-CG2 3.75Å; T336-A373 WeakPolarHBondContact OG1-CB 3.46Å; T336-L375 HydrophobicContact CG2-CD2 4.02Å; T336-L491 HydrophobicContact CG2-CD1 4.17Å
337	A	95.8	Very high	95.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.6	-43.4	179.7	0	0	0	0	0	112.7	L333 D335 L340 I341 L491 P494 V495	L333-A337 VanDerWaalsContact O-CB 3.31Å; L333-A337 WeakPolarHBondContact O-CB 3.29Å; L333-A337 PolarHBondContact O-N 3.24Å; D335-A337 PolarHBondContact O-N 3.07Å; A337-L340 PolarHBondContact O-N 3.12Å; A337-I341 WeakPolarHBondContact O-CD1 3.3Å; A337-I341 VanDerWaalsContact O-CG1 3.24Å; A337-I341 WeakPolarHBondContact O-CG1 3.39Å; A337-I341 PolarHBondContact O-N 3.01Å; A337-L491 HydrophobicContact CB-CD1 3.82Å; A337-P494 HydrophobicContact CB-CG 3.82Å; A337-V495 HydrophobicContact CB-CB 4.29Å; A337-V495 HydrophobicContact CB-CG2 3.81Å
338	D	95.8	Very high	95.6	Very high	45 Å²	45	34 Å²	34	24%	0.241	18%	0.181	C	C	.	.	H	α-helix	trans	-60.9	-47.7	179.1	-179.9	77.1	0	0	0	110.9	K334 D335 L340 I341 R342 V495	K334-D338 WeakPolarHBondContact O-CB 3.46Å; K334-D338 PolarHBondContact O-N 2.99Å; D335-D338 PolarHBondContact O-N 3.23Å; D338-L340 PolarHBondContact O-N 2.96Å; D338-I341 PolarHBondContact O-N 2.9Å; D338-R342 WeakPolarHBondContact O-CB 3.28Å; D338-R342 WeakPolarHBondContact O-CG 3.27Å; D338-R342 PolarHBondContact O-N 2.75Å; D338-R342 WeakPolarHBondContact OD2-CD 3.44Å; D338-R342 IonicContact OD2-NH1 3.72Å; D338-R342 PolarHBondContact OD2-NH1 3.09Å; D338-V495 HydrophobicContact CB-CG2 4.05Å
339	K	96.9	Very high	95.5	Very high	10 Å²	10	26.4 Å²	26.4	4%	0.043	15%	0.146	C	C	.	.	H	α-helix	trans	-60.9	-44.9	178.2	-76	172.3	172.6	169.3	0	111.7	F294 D335 R342 I343 A373 L375	F294-K339 HydrophobicContact CB-CD 3.92Å; F294-K339 HydrophobicContact CD1-CD 4.27Å; F294-K339 HydrophobicContact CD1-CG 4.17Å; F294-K339 HydrophobicContact CD2-CB 3.62Å; F294-K339 HydrophobicContact CD2-CD 3.62Å; F294-K339 HydrophobicContact CD2-CG 3.52Å; F294-K339 HydrophobicContact CE1-CG 4.19Å; F294-K339 HydrophobicContact CE2-CB 3.42Å; F294-K339 VanDerWaalsContact CE2-CB 3.42Å; F294-K339 HydrophobicContact CE2-CD 4.19Å; F294-K339 HydrophobicContact CE2-CG 3.55Å; F294-K339 HydrophobicContact CG-CB 4.44Å; F294-K339 HydrophobicContact CG-CD 3.66Å; F294-K339 HydrophobicContact CG-CG 3.85Å; F294-K339 HydrophobicContact CZ-CB 4.11Å; F294-K339 HydrophobicContact CZ-CG 3.9Å; D335-K339 WeakPolarHBondContact O-CB 3.12Å; D335-K339 WeakPolarHBondContact O-CG 3.48Å; D335-K339 PolarHBondContact O-N 2.87Å; D335-K339 VanDerWaalsContact OD1-CE 3.29Å; D335-K339 WeakPolarHBondContact OD1-CE 3.5Å; D335-K339 IonicContact OD1-NZ 3.09Å; D335-K339 PolarHBondContact OD1-NZ 3.28Å; D335-K339 WeakPolarHBondContact OD2-CE 3.38Å; D335-K339 IonicContact OD2-NZ 2.59Å; D335-K339 PolarHBondContact OD2-NZ 3.12Å; K339-R342 PolarHBondContact O-N 2.68Å; K339-I343 WeakPolarHBondContact O-CD1 3.35Å; K339-I343 VanDerWaalsContact O-CG1 3.25Å; K339-I343 WeakPolarHBondContact O-CG1 3.4Å; K339-I343 PolarHBondContact O-N 2.86Å; K339-A373 HydrophobicContact CD-CB 4.24Å; K339-A373 VanDerWaalsContact CD-O 3.3Å; K339-A373 WeakPolarHBondContact CD-O 3.2Å; K339-A373 WeakPolarHBondContact CE-O 3.49Å; K339-A373 PolarHBondContact NZ-O 3.49Å; K339-L375 HydrophobicContact CB-CD1 3.74Å; K339-L375 HydrophobicContact CB-CG 4.35Å
340	L	96.6	Very high	95.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-58.4	-52	176.5	-171.4	78.5	0	0	0	111.6	I320 T336 A337 D338 R342 I343 F344 V363 L375 I487	I320-L340 HydrophobicContact CD1-CB 4.33Å; I320-L340 HydrophobicContact CD1-CD1 3.57Å; I320-L340 HydrophobicContact CD1-CD2 3.79Å; I320-L340 HydrophobicContact CD1-CG 4.11Å; T336-L340 WeakPolarHBondContact O-CB 3.39Å; T336-L340 PolarHBondContact O-N 3.19Å; A337-L340 PolarHBondContact O-N 3.12Å; D338-L340 PolarHBondContact O-N 2.96Å; L340-R342 VanDerWaalsContact C-N 3.27Å; L340-R342 PolarHBondContact O-N 2.98Å; L340-I343 PolarHBondContact O-N 2.94Å; L340-F344 HydrophobicContact CD1-CD2 4.2Å; L340-F344 HydrophobicContact CD1-CE2 3.54Å; L340-F344 HydrophobicContact CG-CD2 4.1Å; L340-F344 HydrophobicContact CG-CE2 3.94Å; L340-F344 WeakPolarHBondContact O-CD2 3.43Å; L340-F344 PolarHBondContact O-N 3.24Å; L340-V363 HydrophobicContact CD1-CG1 4.07Å; L340-V363 HydrophobicContact CD1-CG2 4.44Å; L340-L375 HydrophobicContact CB-CD1 4.05Å; L340-L375 HydrophobicContact CD1-CD1 4.24Å; L340-I487 HydrophobicContact CD2-CB 3.76Å; L340-I487 HydrophobicContact CD2-CD1 3.98Å; L340-I487 HydrophobicContact CD2-CG1 4.47Å; L340-I487 HydrophobicContact CD2-CG2 3.39Å
341	I	95.6	Very high	95.4	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-62.4	-39.6	-178.7	-63.6	159.3	0	0	0	110	A337 D338 A345 V484 V495 R497 V500 M501	A337-I341 WeakPolarHBondContact O-CD1 3.3Å; A337-I341 VanDerWaalsContact O-CG1 3.24Å; A337-I341 WeakPolarHBondContact O-CG1 3.39Å; A337-I341 PolarHBondContact O-N 3.01Å; D338-I341 PolarHBondContact O-N 2.9Å; I341-A345 WeakPolarHBondContact O-CB 3.49Å; I341-A345 PolarHBondContact O-N 3.02Å; I341-V484 HydrophobicContact CB-CG1 4.47Å; I341-V484 HydrophobicContact CG1-CG1 3.79Å; I341-V495 HydrophobicContact CD1-CB 3.9Å; I341-V495 HydrophobicContact CD1-CG1 3.67Å; I341-R497 HydrophobicContact CD1-CB 3.81Å; I341-R497 HydrophobicContact CG1-CB 4.35Å; I341-R497 HydrophobicContact CG2-CB 4.34Å; I341-V500 HydrophobicContact CB-CG1 4.24Å; I341-V500 HydrophobicContact CG2-CB 3.82Å; I341-V500 HydrophobicContact CG2-CG1 3.59Å; I341-M501 HydrophobicContact CG2-CG 4.01Å
342	R	96.1	Very high	95.3	Very high	79 Å²	79	24.6 Å²	24.6	30%	0.298	12%	0.118	S	C	.	.	H	α-helix	trans	-63.9	-42.6	178.3	-75.7	171	61.7	-169.1	-5.1	113	D338 K339 L340 E346 V500	D338-R342 WeakPolarHBondContact O-CB 3.28Å; D338-R342 WeakPolarHBondContact O-CG 3.27Å; D338-R342 PolarHBondContact O-N 2.75Å; D338-R342 WeakPolarHBondContact OD2-CD 3.44Å; D338-R342 IonicContact OD2-NH1 3.72Å; D338-R342 PolarHBondContact OD2-NH1 3.09Å; K339-R342 PolarHBondContact O-N 2.68Å; L340-R342 VanDerWaalsContact C-N 3.27Å; L340-R342 PolarHBondContact O-N 2.98Å; R342-E346 VanDerWaalsContact O-CB 3.32Å; R342-E346 WeakPolarHBondContact O-CB 3.44Å; R342-E346 PolarHBondContact O-N 3.09Å; R342-V500 HydrophobicContact CG-CG1 3.72Å
343	I	96.1	Very high	95.3	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-56.8	-54.4	176.9	-70	161.2	0	0	0	110.5	L289 F292 F294 V295 K339 L340 E346 Q347 L375 L377	L289-I343 HydrophobicContact CD1-CG2 3.72Å; F292-I343 HydrophobicContact CD2-CG1 4.35Å; F294-I343 HydrophobicContact CE2-CD1 3.93Å; F294-I343 HydrophobicContact CE2-CG1 3.86Å; F294-I343 HydrophobicContact CZ-CG1 4.5Å; V295-I343 HydrophobicContact CG2-CD1 3.53Å; V295-I343 HydrophobicContact CG2-CG1 3.57Å; K339-I343 WeakPolarHBondContact O-CD1 3.35Å; K339-I343 VanDerWaalsContact O-CG1 3.25Å; K339-I343 WeakPolarHBondContact O-CG1 3.4Å; K339-I343 PolarHBondContact O-N 2.86Å; L340-I343 PolarHBondContact O-N 2.94Å; I343-E346 WeakPolarHBondContact O-CB 3.41Å; I343-E346 PolarHBondContact O-N 2.75Å; I343-Q347 PolarHBondContact O-N 3.32Å; I343-Q347 VanDerWaalsContact O-N 3.11Å; I343-L375 HydrophobicContact CD1-CB 4.24Å; I343-L375 HydrophobicContact CD1-CD1 3.69Å; I343-L377 HydrophobicContact CG2-CD1 4.16Å
344	F	95.5	Very high	95.1	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.009	9%	0.093	C	C	.	.	H	α-helix	trans	-74.2	-31.6	-175.1	-66.4	-62.5	0	0	0	112.6	L340 E346 Q347 I348 H355 P358 L377 N480 V484	L340-F344 HydrophobicContact CD1-CD2 4.2Å; L340-F344 HydrophobicContact CD1-CE2 3.54Å; L340-F344 HydrophobicContact CG-CD2 4.1Å; L340-F344 HydrophobicContact CG-CE2 3.94Å; L340-F344 WeakPolarHBondContact O-CD2 3.43Å; L340-F344 PolarHBondContact O-N 3.24Å; F344-E346 VanDerWaalsContact C-N 3.32Å; F344-Q347 VanDerWaalsContact CD1-OE1 3.23Å; F344-Q347 PolarHBondContact O-N 3.19Å; F344-I348 VanDerWaalsContact O-CG1 3.28Å; F344-I348 WeakPolarHBondContact O-CG1 3.35Å; F344-I348 PolarHBondContact O-N 2.96Å; F344-H355 HydrophobicContact CE1-CB 4.07Å; F344-H355 AromaticContact CE1-CD2 3.97Å; F344-P358 HydrophobicContact CD1-CB 4.24Å; F344-P358 HydrophobicContact CD1-CG 4.45Å; F344-P358 HydrophobicContact CD2-CB 4.41Å; F344-P358 HydrophobicContact CE1-CB 3.45Å; F344-P358 VanDerWaalsContact CE1-CB 3.45Å; F344-P358 HydrophobicContact CE1-CG 4.11Å; F344-P358 HydrophobicContact CE2-CB 3.62Å; F344-P358 HydrophobicContact CE2-CG 4.3Å; F344-P358 HydrophobicContact CZ-CB 3.1Å; F344-P358 HydrophobicContact CZ-CG 4.05Å; F344-L377 HydrophobicContact CZ-CD2 4.47Å; F344-N480 WeakPolarHBondContact CD1-ND2 3.37Å; F344-V484 HydrophobicContact CB-CG2 3.85Å; F344-V484 HydrophobicContact CD2-CG2 3.45Å; F344-V484 VanDerWaalsContact CD2-CG2 3.45Å; F344-V484 HydrophobicContact CE2-CG2 4.25Å; F344-V484 HydrophobicContact CG-CG2 3.77Å
345	A	94.9	Very high	94.9	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.008	7%	0.067	C	C	.	.	H	α-helix	trans	-64.8	-37.1	170.7	0	0	0	0	0	111.9	I341 I348 F349 M501	I341-A345 WeakPolarHBondContact O-CB 3.49Å; I341-A345 PolarHBondContact O-N 3.02Å; A345-I348 PolarHBondContact O-N 3.1Å; A345-F349 HydrophobicContact CB-CD2 4.07Å; A345-F349 HydrophobicContact CB-CE2 4.26Å; A345-F349 WeakPolarHBondContact O-CB 3.49Å; A345-F349 WeakPolarHBondContact O-CD2 3.41Å; A345-F349 PolarHBondContact O-N 2.68Å; A345-M501 HydrophobicContact CB-CG 4.19Å
346	E	95.1	Very high	94.1	Very high	17 Å²	17	13 Å²	13	8%	0.079	6%	0.057	C	C	.	.	H	α-helix	trans	-61.3	-46.9	173.8	-167.8	70.5	-163.6	0	0	110.8	L289 H291 F292 R342 I343 F344 I348 Y350 T351	L289-E346 HydrophobicContact CD2-CB 4.39Å; L289-E346 HydrophobicContact CD2-CG 4.24Å; H291-E346 IonicContact CE1-OE1 3.45Å; H291-E346 IonicContact NE2-OE1 2.67Å; F292-E346 HydrophobicContact CE2-CB 3.74Å; F292-E346 HydrophobicContact CE2-CG 3.83Å; F292-E346 HydrophobicContact CZ-CB 4.16Å; F292-E346 HydrophobicContact CZ-CG 4.1Å; R342-E346 VanDerWaalsContact O-CB 3.32Å; R342-E346 WeakPolarHBondContact O-CB 3.44Å; R342-E346 PolarHBondContact O-N 3.09Å; I343-E346 WeakPolarHBondContact O-CB 3.41Å; I343-E346 PolarHBondContact O-N 2.75Å; F344-E346 VanDerWaalsContact C-N 3.32Å; E346-I348 PolarHBondContact O-N 3.32Å; E346-Y350 WeakPolarHBondContact O-CA 3.22Å; E346-Y350 WeakPolarHBondContact O-CB 3.22Å; E346-Y350 PolarHBondContact O-N 3Å; E346-Y350 WeakPolarHBondContact OE1-CB 3.48Å; E346-Y350 WeakPolarHBondContact OE1-CD1 3.43Å; E346-T351 HydrophobicContact CG-CG2 4.34Å; E346-T351 PolarHBondContact O-N 2.66Å
347	Q	95.5	Very high	93.2	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.005	6%	0.061	C	C	.	.	I	π-helix	trans	-60.9	-45.9	176.9	-74.1	-178	-27	0	0	112.8	C285 L289 I343 F344 G352 F353	C285-Q347 PolarHBondContact SG-NE2 3.15Å; L289-Q347 HydrophobicContact CD2-CG 4.49Å; I343-Q347 PolarHBondContact O-N 3.32Å; I343-Q347 VanDerWaalsContact O-N 3.11Å; F344-Q347 VanDerWaalsContact CD1-OE1 3.23Å; F344-Q347 PolarHBondContact O-N 3.19Å; Q347-G352 CarbonylContact O-C 3.58Å; Q347-G352 VanDerWaalsContact O-CA 3.22Å; Q347-G352 WeakPolarHBondContact O-CA 3.22Å; Q347-G352 PolarHBondContact O-N 3.2Å; Q347-F353 WeakPolarHBondContact CB-O 3.33Å; Q347-F353 WeakPolarHBondContact CG-O 3.17Å
348	I	94.8	Very high	92.4	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.005	6%	0.061	C	C	.	.	I	π-helix	trans	-67.8	-51.4	-179.1	-67.5	166.3	0	0	0	111.4	F344 A345 E346 I354 R391 L394 V477 N480 I481 M501	F344-I348 VanDerWaalsContact O-CG1 3.28Å; F344-I348 WeakPolarHBondContact O-CG1 3.35Å; F344-I348 PolarHBondContact O-N 2.96Å; A345-I348 PolarHBondContact O-N 3.1Å; E346-I348 PolarHBondContact O-N 3.32Å; I348-I354 HydrophobicContact CG1-CD1 4.25Å; I348-I354 HydrophobicContact CG1-CG2 4.16Å; I348-R391 WeakPolarHBondContact O-CG 3.49Å; I348-L394 HydrophobicContact CG2-CD2 3.6Å; I348-V477 HydrophobicContact CD1-CG1 4.27Å; I348-V477 HydrophobicContact CG1-CG1 4.45Å; I348-V477 HydrophobicContact CG2-CG1 4.16Å; I348-N480 WeakPolarHBondContact CD1-OD1 3.34Å; I348-I481 HydrophobicContact CD1-CG1 4.21Å; I348-M501 HydrophobicContact CD1-CE 4.28Å
349	F	94.5	Very high	91.8	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.068	C	C	.	.	I	π-helix	trans	-97.6	-24.9	-166.2	-60.9	-64.8	0	0	0	114.2	A345 L394 C395 W398 M501 A505 G508	A345-F349 HydrophobicContact CB-CD2 4.07Å; A345-F349 HydrophobicContact CB-CE2 4.26Å; A345-F349 WeakPolarHBondContact O-CB 3.49Å; A345-F349 WeakPolarHBondContact O-CD2 3.41Å; A345-F349 PolarHBondContact O-N 2.68Å; F349-L394 HydrophobicContact CD1-CG 4.46Å; F349-L394 HydrophobicContact CE1-CD2 4.3Å; F349-L394 HydrophobicContact CE1-CG 4Å; F349-C395 PolarHBondContact O-SG 3.13Å; F349-W398 HydrophobicContact CE1-CB 4.13Å; F349-W398 AromaticContact CE1-CD2 4Å; F349-W398 HydrophobicContact CE1-CD2 4Å; F349-W398 AromaticContact CE1-CE3 3.8Å; F349-W398 HydrophobicContact CE1-CE3 3.8Å; F349-W398 HydrophobicContact CE1-CG 4.14Å; F349-W398 HydrophobicContact CZ-CB 4.39Å; F349-W398 AromaticContact CZ-CD2 3.55Å; F349-W398 HydrophobicContact CZ-CD2 3.55Å; F349-W398 AromaticContact CZ-CE3 3.56Å; F349-W398 HydrophobicContact CZ-CE3 3.56Å; F349-W398 AromaticContact CZ-CG 3.91Å; F349-W398 HydrophobicContact CZ-CG 3.91Å; F349-W398 HydrophobicContact CZ-CZ3 4.07Å; F349-M501 HydrophobicContact CE2-CB 3.84Å; F349-M501 HydrophobicContact CE2-CE 3.85Å; F349-M501 HydrophobicContact CE2-CG 4.3Å; F349-M501 WeakPolarHBondContact CE2-O 3.09Å; F349-M501 HydrophobicContact CZ-CB 4.35Å; F349-M501 HydrophobicContact CZ-CE 3.99Å; F349-A505 HydrophobicContact CD1-CB 3.68Å; F349-A505 HydrophobicContact CD2-CB 4.29Å; F349-A505 HydrophobicContact CE1-CB 3.84Å; F349-A505 HydrophobicContact CE2-CB 4.47Å; F349-A505 HydrophobicContact CG-CB 3.92Å; F349-A505 HydrophobicContact CZ-CB 4.26Å; F349-G508 WeakPolarHBondContact O-CA 3.37Å
350	Y	91.3	Very high	91.1	Very high	81 Å²	81	16 Å²	16	32%	0.318	7%	0.072	S	C	.	.	I	π-helix	trans	-110.9	-49.4	-171.5	-166	-90.1	0	0	0	113.5	E346 K511	E346-Y350 WeakPolarHBondContact O-CA 3.22Å; E346-Y350 WeakPolarHBondContact O-CB 3.22Å; E346-Y350 PolarHBondContact O-N 3Å; E346-Y350 WeakPolarHBondContact OE1-CB 3.48Å; E346-Y350 WeakPolarHBondContact OE1-CD1 3.43Å; Y350-K511 HydrophobicContact CD1-CD 3.97Å; Y350-K511 HydrophobicContact CD2-CB 4.29Å; Y350-K511 HydrophobicContact CD2-CD 3.93Å; Y350-K511 HydrophobicContact CE1-CD 3.47Å; Y350-K511 VanDerWaalsContact CE1-CD 3.47Å; Y350-K511 HydrophobicContact CE2-CB 3.78Å; Y350-K511 HydrophobicContact CE2-CD 3.42Å; Y350-K511 VanDerWaalsContact CE2-CD 3.42Å; Y350-K511 HydrophobicContact CE2-CG 4.22Å; Y350-K511 HydrophobicContact CG-CD 4.19Å; Y350-K511 PolarHBondContact O-NZ 3.35Å; Y350-K511 WeakPolarHBondContact OH-CD 3.35Å
351	T	92.9	Very high	90.4	Very high	17 Å²	17	17.1 Å²	17.1	10%	0.104	8%	0.083	C	C	.	.	I	π-helix	trans	-92.8	-29.3	-177.4	82	0	0	0	0	112.9	E288 E346 F353 R391	E288-T351 HydrophobicContact CB-CG2 4.19Å; E288-T351 WeakPolarHBondContact OE2-CB 3.4Å; E288-T351 PolarHBondContact OE2-OG1 3.07Å; E346-T351 HydrophobicContact CG-CG2 4.34Å; E346-T351 PolarHBondContact O-N 2.66Å; T351-F353 PolarHBondContact O-N 2.95Å; T351-F353 PolarHBondContact OG1-N 2.84Å; T351-R391 PolarHBondContact O-NH1 3.14Å
352	G	93.6	Very high	90.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.091	C	C	.	.			trans	70	2.9	-174.6	0	0	0	0	0	113.9	Q347 F385 L386	Q347-G352 CarbonylContact O-C 3.58Å; Q347-G352 VanDerWaalsContact O-CA 3.22Å; Q347-G352 WeakPolarHBondContact O-CA 3.22Å; Q347-G352 PolarHBondContact O-N 3.2Å; G352-F385 CarbonylContact O-C 3.2Å; G352-F385 WeakPolarHBondContact O-CA 3.44Å; G352-F385 WeakPolarHBondContact O-CD2 3.25Å; G352-L386 PolarHBondContact O-N 2.92Å
353	F	95.4	Very high	90	Very high	10 Å²	10	15 Å²	15	4%	0.044	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	94.8	176	-176.2	-123.8	0	0	0	108.7	N281 R284 C285 E288 Q347 T351 Y383	N281-F353 HydrophobicContact CB-CZ 4.11Å; R284-F353 HydrophobicContact CB-CE1 4.03Å; R284-F353 HydrophobicContact CB-CZ 4.43Å; R284-F353 HydrophobicContact CG-CD1 4.01Å; R284-F353 HydrophobicContact CG-CE1 3.78Å; R284-F353 HydrophobicContact CG-CZ 4.3Å; C285-F353 HydrophobicContact CB-CE1 4.48Å; E288-F353 VanDerWaalsContact OE2-CB 3.28Å; E288-F353 WeakPolarHBondContact OE2-CB 3.43Å; Q347-F353 WeakPolarHBondContact CB-O 3.33Å; Q347-F353 WeakPolarHBondContact CG-O 3.17Å; T351-F353 PolarHBondContact O-N 2.95Å; T351-F353 PolarHBondContact OG1-N 2.84Å; F353-Y383 AromaticContact CD1-CD1 3.52Å; F353-Y383 HydrophobicContact CD1-CD1 3.52Å; F353-Y383 AromaticContact CD1-CE1 3.59Å; F353-Y383 HydrophobicContact CD1-CE1 3.59Å; F353-Y383 AromaticContact CD2-CD1 3.82Å; F353-Y383 HydrophobicContact CD2-CD1 3.82Å; F353-Y383 HydrophobicContact CD2-CG 4.45Å; F353-Y383 AromaticContact CE1-CD1 3.2Å; F353-Y383 HydrophobicContact CE1-CD1 3.2Å; F353-Y383 AromaticContact CE1-CE1 3.3Å; F353-Y383 HydrophobicContact CE1-CE1 3.3Å; F353-Y383 AromaticContact CE1-CG 3.93Å; F353-Y383 HydrophobicContact CE1-CG 3.93Å; F353-Y383 AromaticContact CE2-CD1 3.53Å; F353-Y383 HydrophobicContact CE2-CD1 3.53Å; F353-Y383 HydrophobicContact CE2-CE1 4.47Å; F353-Y383 AromaticContact CE2-CG 3.79Å; F353-Y383 HydrophobicContact CE2-CG 3.79Å; F353-Y383 AromaticContact CG-CD1 3.82Å; F353-Y383 HydrophobicContact CG-CD1 3.82Å; F353-Y383 HydrophobicContact CG-CE1 4.28Å; F353-Y383 AromaticContact CZ-CD1 3.2Å; F353-Y383 HydrophobicContact CZ-CD1 3.2Å; F353-Y383 HydrophobicContact CZ-CD2 4.31Å; F353-Y383 AromaticContact CZ-CE1 3.8Å; F353-Y383 HydrophobicContact CZ-CE1 3.8Å; F353-Y383 AromaticContact CZ-CG 3.48Å; F353-Y383 HydrophobicContact CZ-CG 3.48Å; F353-Y383 VanDerWaalsContact CZ-CG 3.48Å
354	I	91.9	Very high	90	Very high	2 Å²	2	15.8 Å²	15.8	1%	0.01	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	117.2	-160.7	-53.9	-175.9	0	0	0	109.2	I348 A356 Y383 E384 L386 V477 N480	I348-I354 HydrophobicContact CG1-CD1 4.25Å; I348-I354 HydrophobicContact CG1-CG2 4.16Å; I354-A356 PolarHBondContact O-N 3.19Å; I354-Y383 VanDerWaalsContact O-CA 3.3Å; I354-Y383 WeakPolarHBondContact O-CA 3.49Å; I354-E384 PolarHBondContact N-O 2.8Å; I354-E384 PolarHBondContact O-N 3.02Å; I354-L386 HydrophobicContact CD1-CB 3.77Å; I354-L386 HydrophobicContact CD1-CD2 4.18Å; I354-V477 HydrophobicContact CD1-CG2 3.51Å; I354-N480 HydrophobicContact CG2-CB 4.49Å
355	H	91.6	Very high	90.1	Very high	4 Å²	4	15.7 Å²	15.7	2%	0.019	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	113.1	167.3	-175.8	5.3	0	0	0	109	F344 D357 D379 L382 Y383 N480	F344-H355 HydrophobicContact CE1-CB 4.07Å; F344-H355 AromaticContact CE1-CD2 3.97Å; H355-D357 VanDerWaalsContact CE1-C 3.4Å; H355-D357 PolarHBondContact CE1-O 2.77Å; H355-D357 PolarHBondContact ND1-N 2.83Å; H355-D357 PolarHBondContact NE2-O 3.23Å; H355-D379 PolarHBondContact CE1-O 2.65Å; H355-D379 PolarHBondContact NE2-O 2.89Å; H355-D379 VanDerWaalsContact NE2-O 3.08Å; H355-L382 PolarHBondContact ND1-O 3.24Å; H355-Y383 HydrophobicContact CB-CD1 4.26Å; H355-Y383 HydrophobicContact CB-CE1 3.69Å; H355-Y383 HydrophobicContact CB-CE2 4.01Å; H355-Y383 AromaticContact CG-CE2 3.89Å; H355-Y383 AromaticContact CG-CZ 3.85Å; H355-Y383 AromaticContact ND1-CE2 3.99Å; H355-N480 PolarHBondContact O-ND2 3.3Å
356	A	79.7	Confident	90.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.093	C	C	.	.	S	Bend	trans	-81.8	-18	-171.2	0	0	0	0	0	114.3	I354 L382 L476 R479	I354-A356 PolarHBondContact O-N 3.19Å; A356-L382 HydrophobicContact CB-CB 4.41Å; A356-L382 HydrophobicContact CB-CD2 3.71Å; A356-L382 HydrophobicContact CB-CG 3.68Å; A356-L382 PolarHBondContact N-O 2.82Å; A356-L476 HydrophobicContact CB-CB 3.63Å; A356-L476 HydrophobicContact CB-CD1 3.43Å; A356-L476 VanDerWaalsContact CB-CD1 3.43Å; A356-L476 HydrophobicContact CB-CD2 4.02Å; A356-L476 HydrophobicContact CB-CG 3.88Å; A356-R479 WeakPolarHBondContact O-CD 3.48Å; A356-R479 VanDerWaalsContact O-CG 3.26Å; A356-R479 WeakPolarHBondContact O-CG 3.46Å
357	D	77.9	Confident	90.2	Very high	18 Å²	18	22.9 Å²	22.9	10%	0.096	11%	0.112	C	C	.	.			trans	-132.4	65.5	-171.3	-163.5	30.3	0	0	0	113.4	H355 H359 R479	H355-D357 VanDerWaalsContact CE1-C 3.4Å; H355-D357 PolarHBondContact CE1-O 2.77Å; H355-D357 PolarHBondContact ND1-N 2.83Å; H355-D357 PolarHBondContact NE2-O 3.23Å; D357-H359 PolarHBondContact O-N 3.41Å; D357-R479 VanDerWaalsContact CG-CZ 3.48Å; D357-R479 IonicContact OD1-CZ 3.67Å; D357-R479 IonicContact OD1-NE 2.64Å; D357-R479 PolarHBondContact OD1-NE 2.87Å; D357-R479 IonicContact OD1-NH2 3.11Å; D357-R479 PolarHBondContact OD1-NH2 3.04Å; D357-R479 IonicContact OD2-CZ 2.83Å; D357-R479 IonicContact OD2-NH2 2.98Å; D357-R479 PolarHBondContact OD2-NH2 2.92Å
358	P	79.3	Confident	90	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.116	C	C	.	.			trans	-79.1	49.2	-179.5	36.3	-37.6	0	0	0	111.6	F344 T483 V484 I487	F344-P358 HydrophobicContact CD1-CB 4.24Å; F344-P358 HydrophobicContact CD1-CG 4.45Å; F344-P358 HydrophobicContact CD2-CB 4.41Å; F344-P358 HydrophobicContact CE1-CB 3.45Å; F344-P358 VanDerWaalsContact CE1-CB 3.45Å; F344-P358 HydrophobicContact CE1-CG 4.11Å; F344-P358 HydrophobicContact CE2-CB 3.62Å; F344-P358 HydrophobicContact CE2-CG 4.3Å; F344-P358 HydrophobicContact CZ-CB 3.1Å; F344-P358 HydrophobicContact CZ-CG 4.05Å; P358-T483 HydrophobicContact CB-CG2 4.5Å; P358-T483 HydrophobicContact CG-CG2 3.79Å; P358-T483 WeakPolarHBondContact O-CG2 3.3Å; P358-V484 HydrophobicContact CG-CG2 4.39Å; P358-I487 WeakPolarHBondContact O-CD1 3.32Å
359	H	81.9	Confident	89.8	Confident	81 Å²	81	29.2 Å²	29.2	38%	0.375	16%	0.155	S	C	.	.			trans	-52.7	142.1	-175.9	-173.7	-97.6	0	0	0	110.3	D357 G361 N362	D357-H359 PolarHBondContact O-N 3.41Å; H359-G361 PolarHBondContact ND1-N 3.18Å; H359-G361 PolarHBondContact O-N 3.47Å; H359-N362 WeakPolarHBondContact O-CB 3.45Å; H359-N362 PolarHBondContact O-N 2.89Å
360	P	82.4	Confident	89.7	Confident	20 Å²	20	33.5 Å²	33.5	13%	0.13	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-56.8	-23.6	-176.8	-21.7	28.3	0	0	0	114.6	I320 N321 N362 I487	I320-P360 HydrophobicContact CG2-CB 3.95Å; N321-P360 HydrophobicContact CB-CB 3.96Å; P360-N362 VanDerWaalsContact C-N 3.29Å; P360-N362 PolarHBondContact O-N 3.47Å; P360-I487 HydrophobicContact CB-CD1 4.5Å; P360-I487 HydrophobicContact CB-CG1 4.28Å; P360-I487 HydrophobicContact CG-CD1 4.15Å; P360-I487 HydrophobicContact CG-CG1 3.76Å
361	G	83.1	Confident	89.7	Confident	23 Å²	23	37.5 Å²	37.5	24%	0.237	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-70	-20.8	173.8	0	0	0	0	0	114.7	H359	H359-G361 PolarHBondContact ND1-N 3.18Å; H359-G361 PolarHBondContact O-N 3.47Å
362	N	89.1	Confident	89.8	Confident	34 Å²	34	42.2 Å²	42.2	18%	0.182	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-100.1	2.9	-174.3	-64.8	-16.5	0	0	0	113	H359 P360 L378 D379	H359-N362 WeakPolarHBondContact O-CB 3.45Å; H359-N362 PolarHBondContact O-N 2.89Å; P360-N362 VanDerWaalsContact C-N 3.29Å; P360-N362 PolarHBondContact O-N 3.47Å; N362-L378 PolarHBondContact O-N 2.9Å; N362-D379 HydrophobicContact CB-CB 3.7Å; N362-D379 WeakPolarHBondContact ND2-CB 3.35Å; N362-D379 PolarHBondContact ND2-OD2 3.26Å
363	V	94.3	Very high	90	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.012	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	114.8	178.1	-174.4	0	0	0	0	109.4	I320 L340 V376 L377	I320-V363 HydrophobicContact CB-CB 4.23Å; I320-V363 HydrophobicContact CB-CG1 4.19Å; I320-V363 HydrophobicContact CD1-CG1 3.85Å; I320-V363 HydrophobicContact CG2-CB 4Å; I320-V363 HydrophobicContact CG2-CG1 4.44Å; I320-V363 PolarHBondContact N-O 3.23Å; L340-V363 HydrophobicContact CD1-CG1 4.07Å; L340-V363 HydrophobicContact CD1-CG2 4.44Å; V363-V376 WeakPolarHBondContact CA-O 3.39Å; V363-L377 HydrophobicContact CG1-CD2 4.3Å; V363-L377 HydrophobicContact CG2-CD2 4.1Å
364	L	95.9	Very high	90.1	Very high	18 Å²	18	42.7 Å²	42.7	9%	0.094	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	151.7	171.6	-51.1	178.3	0	0	0	110.8	C318 K319 L375 V376 L378	C318-L364 CarbonylContact O-C 3.37Å; C318-L364 VanDerWaalsContact O-CA 3.3Å; C318-L364 WeakPolarHBondContact O-CA 3.05Å; K319-L364 HydrophobicContact CG-CD2 4.35Å; L364-L375 WeakPolarHBondContact O-CA 3.37Å; L364-V376 HydrophobicContact CB-CB 4.06Å; L364-V376 HydrophobicContact CB-CG2 4.34Å; L364-V376 PolarHBondContact N-O 2.89Å; L364-V376 PolarHBondContact O-N 3.48Å; L364-L378 HydrophobicContact CD1-CD1 3.89Å; L364-L378 HydrophobicContact CD1-CD2 4.28Å; L364-L378 HydrophobicContact CD1-CG 4.41Å; L364-L378 HydrophobicContact CD2-CD1 4.2Å; L364-L378 HydrophobicContact CG-CD1 3.77Å; L364-L378 HydrophobicContact CG-CG 4.28Å
365	V	97.5	Very high	90.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	129.2	174.8	-173.1	0	0	0	0	107.7	C318 I320 I326 I331 T336 A373 E374 L375	C318-V365 PolarHBondContact N-O 3.01Å; C318-V365 PolarHBondContact O-N 2.81Å; C318-V365 PolarHBondContact SG-O 2.89Å; I320-V365 HydrophobicContact CB-CG2 3.86Å; I320-V365 HydrophobicContact CD1-CG2 4.29Å; I320-V365 HydrophobicContact CG1-CG2 3.81Å; I326-V365 HydrophobicContact CD1-CB 4.45Å; I326-V365 HydrophobicContact CD1-CG2 4.17Å; I326-V365 HydrophobicContact CG1-CB 4.34Å; I326-V365 HydrophobicContact CG1-CG1 4.42Å; I331-V365 HydrophobicContact CD1-CG1 4.09Å; I331-V365 HydrophobicContact CG2-CG1 4.11Å; T336-V365 HydrophobicContact CG2-CG1 4.17Å; T336-V365 HydrophobicContact CG2-CG2 3.75Å; V365-A373 HydrophobicContact CG1-CB 4.4Å; V365-E374 WeakPolarHBondContact CA-O 3.49Å; V365-L375 HydrophobicContact CB-CD2 4.43Å; V365-L375 HydrophobicContact CG1-CD2 4.33Å; V365-L375 HydrophobicContact CG2-CD2 3.8Å
366	R	96.1	Very high	90.6	Very high	63 Å²	63	42.4 Å²	42.4	24%	0.238	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	169.7	171	70.3	-173.7	-172.8	-170.8	-0.9	110.5	S316 I331 G368 E374	S316-R366 VanDerWaalsContact O-CD 3.28Å; S316-R366 WeakPolarHBondContact O-CD 3.24Å; I331-R366 VanDerWaalsContact CD1-C 3.49Å; R366-G368 PolarHBondContact O-N 3.48Å; R366-E374 HydrophobicContact CG-CB 4.13Å; R366-E374 IonicContact CZ-OE2 3.74Å; R366-E374 PolarHBondContact N-O 3.36Å; R366-E374 IonicContact NE-OE2 2.75Å; R366-E374 PolarHBondContact NE-OE2 3.47Å; R366-E374 IonicContact NH2-OE2 3.39Å; R366-E374 PolarHBondContact NH2-OE2 3.22Å; R366-E374 PolarHBondContact O-N 2.84Å
367	Q	94.9	Very high	91.4	Very high	105 Å²	105	42.5 Å²	42.5	49%	0.491	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	119.5	174	-173.2	169.4	58.1	0	0	109.5	I331	I331-Q367 HydrophobicContact CD1-CB 4.27Å; I331-Q367 HydrophobicContact CG1-CB 4.44Å
368	G	92.8	Very high	92.1	Very high	7 Å²	7	44.7 Å²	44.7	7%	0.072	23%	0.229	C	C	.	.			trans	-75.7	172.4	175.1	0	0	0	0	0	112.7	R366 D370 K371 K372	R366-G368 PolarHBondContact O-N 3.48Å; G368-D370 PolarHBondContact O-N 3.02Å; G368-D370 VanDerWaalsContact O-N 3.14Å; G368-K371 WeakPolarHBondContact O-CA 3.46Å; G368-K371 PolarHBondContact O-N 3.13Å; G368-K372 PolarHBondContact N-O 3.48Å
369	P	90.8	Very high	92.6	Very high	129 Å²	129	46.3 Å²	46.3	84%	0.838	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-27.1	179.6	-23.6	33.6	0	0	0	113.9	K371	P369-K371 PolarHBondContact O-N 2.95Å
370	D	92.1	Very high	93.2	Very high	90 Å²	90	42.6 Å²	42.6	48%	0.481	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	9.2	177.5	72.1	-17.5	0	0	0	113.6	G368 K372	G368-D370 PolarHBondContact O-N 3.02Å; G368-D370 VanDerWaalsContact O-N 3.14Å; D370-K372 PolarHBondContact O-N 3.03Å; D370-K372 VanDerWaalsContact OD1-CB 3.31Å; D370-K372 WeakPolarHBondContact OD1-CB 3.28Å; D370-K372 PolarHBondContact OD1-N 3.28Å; D370-K372 WeakPolarHBondContact OD2-CD 3.45Å; D370-K372 WeakPolarHBondContact OD2-CG 3.49Å
371	K	90.9	Very high	93.5	Very high	165 Å²	165	41.7 Å²	41.7	72%	0.717	22%	0.215	S	C	*	.	S	Bend	trans	62.4	13.7	-173.5	-54.6	-176.5	179.2	-177.9	0	114.5	G368 P369	G368-K371 WeakPolarHBondContact O-CA 3.46Å; G368-K371 PolarHBondContact O-N 3.13Å; P369-K371 PolarHBondContact O-N 2.95Å
372	K	94.9	Very high	93.7	Very high	115 Å²	115	40.7 Å²	40.7	50%	0.5	20%	0.204	S	C	.	.	S	Bend	trans	-101.6	177.6	175.5	-57.3	-172.9	-173.7	163.5	0	111.1	D335 G368 D370 E374	D335-K372 WeakPolarHBondContact OD2-CB 3.42Å; G368-K372 PolarHBondContact N-O 3.48Å; D370-K372 PolarHBondContact O-N 3.03Å; D370-K372 VanDerWaalsContact OD1-CB 3.31Å; D370-K372 WeakPolarHBondContact OD1-CB 3.28Å; D370-K372 PolarHBondContact OD1-N 3.28Å; D370-K372 WeakPolarHBondContact OD2-CD 3.45Å; D370-K372 WeakPolarHBondContact OD2-CG 3.49Å; K372-E374 PolarHBondContact O-N 3.11Å
373	A	96.7	Very high	93.8	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.008	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	128.2	178.9	0	0	0	0	0	110.9	I331 D335 T336 K339 V365	I331-A373 HydrophobicContact CG2-CB 3.55Å; D335-A373 VanDerWaalsContact OD2-CB 3.29Å; D335-A373 WeakPolarHBondContact OD2-CB 3.37Å; D335-A373 PolarHBondContact OD2-N 2.96Å; T336-A373 WeakPolarHBondContact OG1-CB 3.46Å; K339-A373 HydrophobicContact CD-CB 4.24Å; K339-A373 VanDerWaalsContact CD-O 3.3Å; K339-A373 WeakPolarHBondContact CD-O 3.2Å; K339-A373 WeakPolarHBondContact CE-O 3.49Å; K339-A373 PolarHBondContact NZ-O 3.49Å; V365-A373 HydrophobicContact CG1-CB 4.4Å
374	E	97.4	Very high	93.5	Very high	19 Å²	19	42.2 Å²	42.2	9%	0.089	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.2	166.5	-170.3	174.9	-98.6	0	0	108.2	F294 V296 V365 R366 K372	F294-E374 WeakPolarHBondContact O-CA 3.39Å; F294-E374 WeakPolarHBondContact O-CG 3.25Å; V296-E374 VanDerWaalsContact CG2-CD 3.41Å; V296-E374 HydrophobicContact CG2-CG 3.7Å; V296-E374 WeakPolarHBondContact CG2-OE2 3.42Å; V365-E374 WeakPolarHBondContact CA-O 3.49Å; R366-E374 HydrophobicContact CG-CB 4.13Å; R366-E374 IonicContact CZ-OE2 3.74Å; R366-E374 PolarHBondContact N-O 3.36Å; R366-E374 IonicContact NE-OE2 2.75Å; R366-E374 PolarHBondContact NE-OE2 3.47Å; R366-E374 IonicContact NH2-OE2 3.39Å; R366-E374 PolarHBondContact NH2-OE2 3.22Å; R366-E374 PolarHBondContact O-N 2.84Å; K372-E374 PolarHBondContact O-N 3.11Å
375	L	97.8	Very high	93.4	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	122.1	-176	-58.9	-172.9	0	0	0	109.7	F294 V295 V296 T336 K339 L340 I343 L364 V365	F294-L375 PolarHBondContact O-N 3.36Å; V295-L375 WeakPolarHBondContact CA-O 3.4Å; V296-L375 PolarHBondContact N-O 3.08Å; T336-L375 HydrophobicContact CG2-CD2 4.02Å; K339-L375 HydrophobicContact CB-CD1 3.74Å; K339-L375 HydrophobicContact CB-CG 4.35Å; L340-L375 HydrophobicContact CB-CD1 4.05Å; L340-L375 HydrophobicContact CD1-CD1 4.24Å; I343-L375 HydrophobicContact CD1-CB 4.24Å; I343-L375 HydrophobicContact CD1-CD1 3.69Å; L364-L375 WeakPolarHBondContact O-CA 3.37Å; V365-L375 HydrophobicContact CB-CD2 4.43Å; V365-L375 HydrophobicContact CG1-CD2 4.33Å; V365-L375 HydrophobicContact CG2-CD2 3.8Å
376	V	97.4	Very high	93.1	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	122.2	174.5	-167.5	0	0	0	0	108.9	V296 P298 C315 V363 L364 L378	V296-V376 HydrophobicContact CB-CG1 4.37Å; V296-V376 HydrophobicContact CB-CG2 4.2Å; V296-V376 HydrophobicContact CG1-CG1 4.25Å; V296-V376 VanDerWaalsContact O-CA 3.29Å; V296-V376 WeakPolarHBondContact O-CA 3.37Å; P298-V376 HydrophobicContact CG-CG1 4.12Å; C315-V376 HydrophobicContact CB-CG1 3.74Å; C315-V376 HydrophobicContact CB-CG2 4.44Å; V363-V376 WeakPolarHBondContact CA-O 3.39Å; L364-V376 HydrophobicContact CB-CB 4.06Å; L364-V376 HydrophobicContact CB-CG2 4.34Å; L364-V376 PolarHBondContact N-O 2.89Å; L364-V376 PolarHBondContact O-N 3.48Å; V376-L378 HydrophobicContact CG1-CD2 3.85Å
377	L	96.7	Very high	93	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	122.5	175.1	-51.9	-179.5	0	0	0	108.5	L289 V295 V296 V297 P298 I343 F344 V363 H380	L289-L377 HydrophobicContact CD1-CD1 4.1Å; V295-L377 HydrophobicContact CG1-CD1 4.04Å; V295-L377 HydrophobicContact CG1-CG 4.32Å; V296-L377 PolarHBondContact O-N 3.49Å; V297-L377 HydrophobicContact CG2-CB 4.47Å; P298-L377 WeakPolarHBondContact CD-O 3.16Å; I343-L377 HydrophobicContact CG2-CD1 4.16Å; F344-L377 HydrophobicContact CZ-CD2 4.47Å; V363-L377 HydrophobicContact CG1-CD2 4.3Å; V363-L377 HydrophobicContact CG2-CD2 4.1Å; L377-H380 PolarHBondContact O-NE2 3.46Å
378	L	92.3	Very high	92.9	Very high	65 Å²	65	43.2 Å²	43.2	34%	0.34	22%	0.219	S	C	.	.			trans	-104.1	-42.8	-171.3	-62.6	179.5	0	0	0	114.2	P298 N362 L364 V376	P298-L378 HydrophobicContact CG-CD2 3.95Å; N362-L378 PolarHBondContact O-N 2.9Å; L364-L378 HydrophobicContact CD1-CD1 3.89Å; L364-L378 HydrophobicContact CD1-CD2 4.28Å; L364-L378 HydrophobicContact CD1-CG 4.41Å; L364-L378 HydrophobicContact CD2-CD1 4.2Å; L364-L378 HydrophobicContact CG-CD1 3.77Å; L364-L378 HydrophobicContact CG-CG 4.28Å; V376-L378 HydrophobicContact CG1-CD2 3.85Å
379	D	90	Very high	93	Very high	33 Å²	33	47.3 Å²	47.3	18%	0.176	24%	0.243	C	C	.	.			trans	-100.3	125.6	-173.2	-170.9	-21.4	0	0	0	109.8	H355 N362 G381	H355-D379 PolarHBondContact CE1-O 2.65Å; H355-D379 PolarHBondContact NE2-O 2.89Å; H355-D379 VanDerWaalsContact NE2-O 3.08Å; N362-D379 HydrophobicContact CB-CB 3.7Å; N362-D379 WeakPolarHBondContact ND2-CB 3.35Å; N362-D379 PolarHBondContact ND2-OD2 3.26Å; D379-G381 PolarHBondContact OD1-N 3.28Å
380	H	93.7	Very high	93.2	Very high	3 Å²	3	42.7 Å²	42.7	1%	0.014	21%	0.211	C	C	.	.			trans	-125.7	21.5	178.9	-62.7	-90.2	0	0	0	113	E278 N281 S282 L377 L382 Y383	E278-H380 HydrophobicContact CG-CB 4.07Å; E278-H380 PolarHBondContact OE1-N 3.37Å; N281-H380 HydrophobicContact CB-CB 4.04Å; N281-H380 WeakPolarHBondContact CB-O 3.28Å; N281-H380 PolarHBondContact ND2-O 2.92Å; S282-H380 WeakPolarHBondContact CB-CD2 3.34Å; L377-H380 PolarHBondContact O-NE2 3.46Å; H380-L382 VanDerWaalsContact C-N 3.3Å; H380-L382 PolarHBondContact O-N 3.48Å; H380-Y383 HydrophobicContact CB-CD2 4.44Å; H380-Y383 HydrophobicContact CB-CE2 3.76Å; H380-Y383 PolarHBondContact CE1-OH 2.91Å; H380-Y383 AromaticContact ND1-CE2 3.51Å; H380-Y383 AromaticContact ND1-CZ 3.56Å; H380-Y383 PolarHBondContact ND1-OH 3.43Å; H380-Y383 WeakPolarHBondContact O-CD2 3.27Å
381	G	88	Confident	93.3	Very high	1 Å²	1	39 Å²	39	1%	0.01	19%	0.19	C	C	.	.	S	Bend	trans	-69.4	-24	-173.9	0	0	0	0	0	114.3	D379	D379-G381 PolarHBondContact OD1-N 3.28Å
382	L	87.6	Confident	93.5	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.01	16%	0.162	C	C	.	.			trans	-130.1	105.2	-177.1	-169.6	58.1	0	0	0	113.1	T268 H355 A356 H380 L476	T268-L382 HydrophobicContact CG2-CD1 3.51Å; T268-L382 HydrophobicContact CG2-CD2 3.57Å; T268-L382 HydrophobicContact CG2-CG 4.13Å; H355-L382 PolarHBondContact ND1-O 3.24Å; A356-L382 HydrophobicContact CB-CB 4.41Å; A356-L382 HydrophobicContact CB-CD2 3.71Å; A356-L382 HydrophobicContact CB-CG 3.68Å; A356-L382 PolarHBondContact N-O 2.82Å; H380-L382 VanDerWaalsContact C-N 3.3Å; H380-L382 PolarHBondContact O-N 3.48Å; L382-L476 HydrophobicContact CD1-CD1 4.34Å; L382-L476 HydrophobicContact CD2-CD1 4.42Å; L382-L476 HydrophobicContact CG-CD1 4.3Å
383	Y	91.5	Very high	93.6	Very high	8 Å²	8	27.2 Å²	27.2	3%	0.031	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	144.4	173.9	-84.2	-103.2	0	0	0	110.6	Q271 N281 C285 F353 I354 H355 H380	Q271-Y383 PolarHBondContact OE1-O 2.94Å; N281-Y383 HydrophobicContact CB-CD2 3.84Å; N281-Y383 HydrophobicContact CB-CE2 4.19Å; N281-Y383 HydrophobicContact CB-CG 4.35Å; C285-Y383 HydrophobicContact CB-CE1 4.41Å; C285-Y383 WeakPolarHBondContact CB-OH 3.01Å; C285-Y383 PolarHBondContact SG-OH 3.49Å; F353-Y383 AromaticContact CD1-CD1 3.52Å; F353-Y383 HydrophobicContact CD1-CD1 3.52Å; F353-Y383 AromaticContact CD1-CE1 3.59Å; F353-Y383 HydrophobicContact CD1-CE1 3.59Å; F353-Y383 AromaticContact CD2-CD1 3.82Å; F353-Y383 HydrophobicContact CD2-CD1 3.82Å; F353-Y383 HydrophobicContact CD2-CG 4.45Å; F353-Y383 AromaticContact CE1-CD1 3.2Å; F353-Y383 HydrophobicContact CE1-CD1 3.2Å; F353-Y383 AromaticContact CE1-CE1 3.3Å; F353-Y383 HydrophobicContact CE1-CE1 3.3Å; F353-Y383 AromaticContact CE1-CG 3.93Å; F353-Y383 HydrophobicContact CE1-CG 3.93Å; F353-Y383 AromaticContact CE2-CD1 3.53Å; F353-Y383 HydrophobicContact CE2-CD1 3.53Å; F353-Y383 HydrophobicContact CE2-CE1 4.47Å; F353-Y383 AromaticContact CE2-CG 3.79Å; F353-Y383 HydrophobicContact CE2-CG 3.79Å; F353-Y383 AromaticContact CG-CD1 3.82Å; F353-Y383 HydrophobicContact CG-CD1 3.82Å; F353-Y383 HydrophobicContact CG-CE1 4.28Å; F353-Y383 AromaticContact CZ-CD1 3.2Å; F353-Y383 HydrophobicContact CZ-CD1 3.2Å; F353-Y383 HydrophobicContact CZ-CD2 4.31Å; F353-Y383 AromaticContact CZ-CE1 3.8Å; F353-Y383 HydrophobicContact CZ-CE1 3.8Å; F353-Y383 AromaticContact CZ-CG 3.48Å; F353-Y383 HydrophobicContact CZ-CG 3.48Å; F353-Y383 VanDerWaalsContact CZ-CG 3.48Å; I354-Y383 VanDerWaalsContact O-CA 3.3Å; I354-Y383 WeakPolarHBondContact O-CA 3.49Å; H355-Y383 HydrophobicContact CB-CD1 4.26Å; H355-Y383 HydrophobicContact CB-CE1 3.69Å; H355-Y383 HydrophobicContact CB-CE2 4.01Å; H355-Y383 AromaticContact CG-CE2 3.89Å; H355-Y383 AromaticContact CG-CZ 3.85Å; H355-Y383 AromaticContact ND1-CE2 3.99Å; H380-Y383 HydrophobicContact CB-CD2 4.44Å; H380-Y383 HydrophobicContact CB-CE2 3.76Å; H380-Y383 PolarHBondContact CE1-OH 2.91Å; H380-Y383 AromaticContact ND1-CE2 3.51Å; H380-Y383 AromaticContact ND1-CZ 3.56Å; H380-Y383 PolarHBondContact ND1-OH 3.43Å; H380-Y383 WeakPolarHBondContact O-CD2 3.27Å
384	E	89.1	Confident	93.5	Very high	60 Å²	60	27.2 Å²	27.2	28%	0.28	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	156.9	170	-79.8	-63.2	161.5	0	0	111	Q271 I354 L476	Q271-E384 PolarHBondContact NE2-OE1 3.46Å; Q271-E384 VanDerWaalsContact NE2-OE1 3.07Å; I354-E384 PolarHBondContact N-O 2.8Å; I354-E384 PolarHBondContact O-N 3.02Å; E384-L476 HydrophobicContact CB-CD1 3.85Å; E384-L476 HydrophobicContact CG-CD1 3.17Å; E384-L476 HydrophobicContact CG-CG 4.26Å
385	F	92.3	Very high	93.3	Very high	98 Å²	98	26.4 Å²	26.4	43%	0.43	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	123.1	177.2	-165.3	-99.4	0	0	0	111	G352 P473	G352-F385 CarbonylContact O-C 3.2Å; G352-F385 WeakPolarHBondContact O-CA 3.44Å; G352-F385 WeakPolarHBondContact O-CD2 3.25Å; F385-P473 WeakPolarHBondContact O-CG 3.47Å
386	L	93	Very high	93.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-87.4	122.3	168.9	-169.8	65.2	0	0	0	108.7	G352 I354 D390 R391 L394 P473 M474	G352-L386 PolarHBondContact O-N 2.92Å; I354-L386 HydrophobicContact CD1-CB 3.77Å; I354-L386 HydrophobicContact CD1-CD2 4.18Å; L386-D390 HydrophobicContact CD1-CB 3.59Å; L386-D390 HydrophobicContact CG-CB 4Å; L386-R391 HydrophobicContact CD2-CB 3.84Å; L386-R391 HydrophobicContact CD2-CG 4.27Å; L386-R391 HydrophobicContact CG-CB 4.07Å; L386-L394 HydrophobicContact CD2-CD2 3.79Å; L386-P473 HydrophobicContact CD1-CB 4.07Å; L386-M474 HydrophobicContact CD1-SD 4.16Å
387	S	94	Very high	93	Very high	36 Å²	36	28.4 Å²	28.4	25%	0.252	15%	0.146	S	C	.	.	P	Polyproline II helix	trans	-55.5	150.6	178.5	76.8	0	0	0	0	110.7	T389 D390 R391	S387-T389 PolarHBondContact O-N 3.23Å; S387-T389 PolarHBondContact OG-OG1 2.83Å; S387-D390 PolarHBondContact O-N 3.01Å; S387-D390 WeakPolarHBondContact OG-CB 3.21Å; S387-D390 PolarHBondContact OG-N 3.37Å; S387-D390 VanDerWaalsContact OG-N 3.13Å; S387-D390 PolarHBondContact OG-OD2 2.87Å; S387-R391 VanDerWaalsContact O-CB 3.25Å; S387-R391 WeakPolarHBondContact O-CB 3.32Å; S387-R391 PolarHBondContact O-N 3.48Å
388	E	92.8	Very high	92.7	Very high	74 Å²	74	28.3 Å²	28.3	35%	0.346	15%	0.146	S	C	.	.	H	α-helix	trans	-59.1	-35.6	-179.9	-172.2	-175	121.1	0	0	112.1	E392 I512 K516	E388-E392 WeakPolarHBondContact O-CB 3.46Å; E388-E392 PolarHBondContact O-N 3.27Å; E388-I512 HydrophobicContact CG-CD1 4.48Å; E388-I512 HydrophobicContact CG-CG1 4.31Å; E388-I512 HydrophobicContact CG-CG2 3.94Å; E388-K516 WeakPolarHBondContact OE1-CE 3.25Å; E388-K516 IonicContact OE1-NZ 2.63Å
389	T	93.7	Very high	92.5	Very high	93 Å²	93	27.1 Å²	27.1	57%	0.571	14%	0.136	S	C	*	.	H	α-helix	trans	-65.1	-48.4	176.9	46.3	0	0	0	0	112	S387 R391 E392 A393	S387-T389 PolarHBondContact O-N 3.23Å; S387-T389 PolarHBondContact OG-OG1 2.83Å; T389-R391 VanDerWaalsContact C-N 3.34Å; T389-E392 PolarHBondContact O-N 3.48Å; T389-A393 PolarHBondContact O-N 3.35Å
390	D	95.3	Very high	92.4	Very high	31 Å²	31	25.5 Å²	25.5	17%	0.166	13%	0.128	C	C	.	.	H	α-helix	trans	-68.1	-38.8	179.1	-59.8	-30.7	0	0	0	110.6	L386 S387 A393 L394 L416 P471	L386-D390 HydrophobicContact CD1-CB 3.59Å; L386-D390 HydrophobicContact CG-CB 4Å; S387-D390 PolarHBondContact O-N 3.01Å; S387-D390 WeakPolarHBondContact OG-CB 3.21Å; S387-D390 PolarHBondContact OG-N 3.37Å; S387-D390 VanDerWaalsContact OG-N 3.13Å; S387-D390 PolarHBondContact OG-OD2 2.87Å; D390-A393 PolarHBondContact O-N 3.49Å; D390-L394 VanDerWaalsContact O-CB 3.3Å; D390-L394 WeakPolarHBondContact O-CB 3.35Å; D390-L394 PolarHBondContact O-N 3.49Å; D390-L416 HydrophobicContact CB-CD2 3.87Å; D390-P471 HydrophobicContact CB-CG 4.43Å
391	R	95.1	Very high	92.2	Very high	12 Å²	12	25.4 Å²	25.4	5%	0.045	13%	0.127	C	C	.	.	H	α-helix	trans	-62.8	-42.7	175.8	-172.7	175.1	68.4	-154.3	0.3	111.6	I348 T351 L386 S387 T389 L394 C395 I512	I348-R391 WeakPolarHBondContact O-CG 3.49Å; T351-R391 PolarHBondContact O-NH1 3.14Å; L386-R391 HydrophobicContact CD2-CB 3.84Å; L386-R391 HydrophobicContact CD2-CG 4.27Å; L386-R391 HydrophobicContact CG-CB 4.07Å; S387-R391 VanDerWaalsContact O-CB 3.25Å; S387-R391 WeakPolarHBondContact O-CB 3.32Å; S387-R391 PolarHBondContact O-N 3.48Å; T389-R391 VanDerWaalsContact C-N 3.34Å; R391-L394 PolarHBondContact O-N 3.3Å; R391-C395 WeakPolarHBondContact O-CB 3.47Å; R391-C395 PolarHBondContact O-N 2.89Å; R391-C395 PolarHBondContact O-SG 3.14Å; R391-I512 HydrophobicContact CG-CD1 4.31Å
392	E	94.3	Very high	91.9	Very high	27 Å²	27	25.6 Å²	25.6	13%	0.126	13%	0.129	C	C	.	.	H	α-helix	trans	-61.9	-46.4	175	-176.3	176.4	178.5	0	0	111.3	E388 T389 L394 C395 K396 I512 K516	E388-E392 WeakPolarHBondContact O-CB 3.46Å; E388-E392 PolarHBondContact O-N 3.27Å; T389-E392 PolarHBondContact O-N 3.48Å; E392-L394 VanDerWaalsContact C-N 3.33Å; E392-L394 PolarHBondContact O-N 2.84Å; E392-C395 PolarHBondContact O-N 2.94Å; E392-K396 HydrophobicContact CG-CD 4.34Å; E392-K396 WeakPolarHBondContact O-CG 3.46Å; E392-K396 PolarHBondContact O-N 2.98Å; E392-K396 VanDerWaalsContact O-N 3.08Å; E392-K396 WeakPolarHBondContact OE1-CE 3.33Å; E392-K396 IonicContact OE1-NZ 3.77Å; E392-K396 PolarHBondContact OE1-NZ 2.88Å; E392-I512 HydrophobicContact CB-CD1 4.06Å; E392-I512 HydrophobicContact CB-CG2 4.38Å; E392-I512 HydrophobicContact CG-CG2 4.48Å; E392-K516 IonicContact OE2-NZ 3.15Å; E392-K516 PolarHBondContact OE2-NZ 2.83Å
393	A	95.9	Very high	91.5	Very high	7 Å²	7	28 Å²	28	6%	0.058	14%	0.141	C	C	.	.	H	α-helix	trans	-60	-44.6	176.5	0	0	0	0	0	111.2	T389 D390 C395 K396 L397 A415 L416	T389-A393 PolarHBondContact O-N 3.35Å; D390-A393 PolarHBondContact O-N 3.49Å; A393-C395 PolarHBondContact O-N 3.3Å; A393-K396 PolarHBondContact O-N 3.37Å; A393-L397 VanDerWaalsContact O-CB 3.28Å; A393-L397 WeakPolarHBondContact O-CB 3.4Å; A393-L397 PolarHBondContact O-N 2.92Å; A393-A415 HydrophobicContact CB-CB 3.91Å; A393-L416 HydrophobicContact CB-CD1 4.43Å; A393-L416 HydrophobicContact CB-CD2 4.08Å; A393-L416 HydrophobicContact CB-CG 3.86Å
394	L	95.9	Very high	91.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.1	-43.7	177.4	-178	60.1	0	0	0	112.3	I348 F349 L386 D390 R391 E392 K396 L397 W398 L416 L428 M474 V477	I348-L394 HydrophobicContact CG2-CD2 3.6Å; F349-L394 HydrophobicContact CD1-CG 4.46Å; F349-L394 HydrophobicContact CE1-CD2 4.3Å; F349-L394 HydrophobicContact CE1-CG 4Å; L386-L394 HydrophobicContact CD2-CD2 3.79Å; D390-L394 VanDerWaalsContact O-CB 3.3Å; D390-L394 WeakPolarHBondContact O-CB 3.35Å; D390-L394 PolarHBondContact O-N 3.49Å; R391-L394 PolarHBondContact O-N 3.3Å; E392-L394 VanDerWaalsContact C-N 3.33Å; E392-L394 PolarHBondContact O-N 2.84Å; L394-K396 VanDerWaalsContact C-N 3.34Å; L394-K396 PolarHBondContact O-N 3.46Å; L394-L397 PolarHBondContact O-N 3.21Å; L394-W398 HydrophobicContact CD1-CE3 4Å; L394-W398 HydrophobicContact CD1-CZ3 4.33Å; L394-W398 WeakPolarHBondContact O-CB 3.46Å; L394-W398 PolarHBondContact O-N 2.93Å; L394-L416 HydrophobicContact CB-CD1 4.44Å; L394-L428 HydrophobicContact CD1-CD1 4.39Å; L394-L428 HydrophobicContact CD1-CD2 3.9Å; L394-M474 HydrophobicContact CD1-CE 3.85Å; L394-M474 HydrophobicContact CD1-SD 4.46Å; L394-M474 HydrophobicContact CD2-CE 4.26Å; L394-M474 HydrophobicContact CD2-SD 4.04Å; L394-V477 HydrophobicContact CD2-CG1 4.2Å
395	C	93.7	Very high	91	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.014	15%	0.146	C	C	.	.	H	α-helix	trans	-59.5	-45.2	176.3	-74.2	0	0	0	0	111.9	F349 R391 E392 A393 R399 A505 W509	F349-C395 PolarHBondContact O-SG 3.13Å; R391-C395 WeakPolarHBondContact O-CB 3.47Å; R391-C395 PolarHBondContact O-N 2.89Å; R391-C395 PolarHBondContact O-SG 3.14Å; E392-C395 PolarHBondContact O-N 2.94Å; A393-C395 PolarHBondContact O-N 3.3Å; C395-R399 PolarHBondContact O-N 2.92Å; C395-A505 HydrophobicContact CB-CB 4.32Å; C395-A505 WeakPolarHBondContact CB-O 3.44Å; C395-A505 PolarHBondContact SG-O 3.27Å; C395-W509 HydrophobicContact CB-CB 3.93Å
396	K	92.5	Very high	91	Very high	43 Å²	43	28.7 Å²	28.7	19%	0.187	15%	0.147	C	C	.	.	H	α-helix	trans	-69.4	-39.5	179.2	-67.5	177.7	-173.9	167.4	0	111.9	E392 A393 L394 R399 A400 Y412 W509	E392-K396 HydrophobicContact CG-CD 4.34Å; E392-K396 WeakPolarHBondContact O-CG 3.46Å; E392-K396 PolarHBondContact O-N 2.98Å; E392-K396 VanDerWaalsContact O-N 3.08Å; E392-K396 WeakPolarHBondContact OE1-CE 3.33Å; E392-K396 IonicContact OE1-NZ 3.77Å; E392-K396 PolarHBondContact OE1-NZ 2.88Å; A393-K396 PolarHBondContact O-N 3.37Å; L394-K396 VanDerWaalsContact C-N 3.34Å; L394-K396 PolarHBondContact O-N 3.46Å; K396-R399 PolarHBondContact O-N 3.46Å; K396-A400 WeakPolarHBondContact O-CB 3.35Å; K396-A400 PolarHBondContact O-N 2.68Å; K396-Y412 HydrophobicContact CB-CD1 3.78Å; K396-Y412 HydrophobicContact CB-CD2 3.53Å; K396-Y412 HydrophobicContact CB-CE1 3.81Å; K396-Y412 HydrophobicContact CB-CE2 3.58Å; K396-Y412 HydrophobicContact CB-CG 3.66Å; K396-Y412 HydrophobicContact CD-CD1 3.83Å; K396-Y412 HydrophobicContact CD-CE1 3.28Å; K396-Y412 HydrophobicContact CD-CE2 4.32Å; K396-Y412 HydrophobicContact CG-CE1 4.18Å; K396-Y412 HydrophobicContact CG-CE2 4.46Å; K396-W509 HydrophobicContact CG-CD2 4.37Å; K396-W509 HydrophobicContact CG-CG 4.39Å
397	L	94.9	Very high	91	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-47.9	175	-179.1	57.7	0	0	0	111	A393 L394 R399 A400 I401 M409 L416 F424 L428	A393-L397 VanDerWaalsContact O-CB 3.28Å; A393-L397 WeakPolarHBondContact O-CB 3.4Å; A393-L397 PolarHBondContact O-N 2.92Å; L394-L397 PolarHBondContact O-N 3.21Å; L397-R399 VanDerWaalsContact C-N 3.3Å; L397-R399 PolarHBondContact O-N 2.86Å; L397-A400 WeakPolarHBondContact O-CB 3.44Å; L397-A400 PolarHBondContact O-N 3.39Å; L397-A400 VanDerWaalsContact O-N 3.08Å; L397-I401 HydrophobicContact CD1-CD1 4.16Å; L397-I401 HydrophobicContact CD1-CG1 4.21Å; L397-I401 HydrophobicContact CG-CD1 3.91Å; L397-I401 HydrophobicContact CG-CG1 4.43Å; L397-I401 VanDerWaalsContact O-CG1 3.27Å; L397-I401 WeakPolarHBondContact O-CG1 3.4Å; L397-I401 PolarHBondContact O-N 3.32Å; L397-M409 HydrophobicContact CD1-CB 4.38Å; L397-M409 WeakPolarHBondContact CD1-O 3.36Å; L397-L416 HydrophobicContact CD2-CD1 3.91Å; L397-F424 HydrophobicContact CD2-CD1 3.93Å; L397-F424 HydrophobicContact CD2-CE1 3.42Å; L397-F424 VanDerWaalsContact CD2-CE1 3.42Å; L397-F424 HydrophobicContact CD2-CZ 4.3Å; L397-L428 HydrophobicContact CD2-CD2 4.08Å
398	W	91.6	Very high	91	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.2	-41.4	179.4	-145.4	-76.8	0	0	0	112.4	F349 L394 V402 L428 L429 I481 M501 A505	F349-W398 HydrophobicContact CE1-CB 4.13Å; F349-W398 AromaticContact CE1-CD2 4Å; F349-W398 HydrophobicContact CE1-CD2 4Å; F349-W398 AromaticContact CE1-CE3 3.8Å; F349-W398 HydrophobicContact CE1-CE3 3.8Å; F349-W398 HydrophobicContact CE1-CG 4.14Å; F349-W398 HydrophobicContact CZ-CB 4.39Å; F349-W398 AromaticContact CZ-CD2 3.55Å; F349-W398 HydrophobicContact CZ-CD2 3.55Å; F349-W398 AromaticContact CZ-CE3 3.56Å; F349-W398 HydrophobicContact CZ-CE3 3.56Å; F349-W398 AromaticContact CZ-CG 3.91Å; F349-W398 HydrophobicContact CZ-CG 3.91Å; F349-W398 HydrophobicContact CZ-CZ3 4.07Å; L394-W398 HydrophobicContact CD1-CE3 4Å; L394-W398 HydrophobicContact CD1-CZ3 4.33Å; L394-W398 WeakPolarHBondContact O-CB 3.46Å; L394-W398 PolarHBondContact O-N 2.93Å; W398-V402 WeakPolarHBondContact O-CG2 3.46Å; W398-V402 PolarHBondContact O-N 3.35Å; W398-L428 HydrophobicContact CE3-CD2 3.64Å; W398-L428 HydrophobicContact CE3-CG 4.02Å; W398-L428 HydrophobicContact CH2-CD1 4.29Å; W398-L428 HydrophobicContact CH2-CD2 4.42Å; W398-L428 HydrophobicContact CH2-CG 3.89Å; W398-L428 HydrophobicContact CZ3-CD1 3.65Å; W398-L428 HydrophobicContact CZ3-CD2 3.53Å; W398-L428 HydrophobicContact CZ3-CG 3.36Å; W398-L429 HydrophobicContact CZ2-CD2 4.18Å; W398-I481 HydrophobicContact CH2-CD1 3.52Å; W398-I481 HydrophobicContact CH2-CG1 4.21Å; W398-I481 HydrophobicContact CZ3-CD1 3.75Å; W398-M501 HydrophobicContact CH2-CE 3.53Å; W398-M501 HydrophobicContact CH2-SD 4.32Å; W398-M501 HydrophobicContact CZ2-CB 4.29Å; W398-M501 HydrophobicContact CZ2-CE 3.46Å; W398-M501 VanDerWaalsContact CZ2-CE 3.46Å; W398-M501 HydrophobicContact CZ2-SD 3.75Å; W398-M501 HydrophobicContact CZ3-CE 4.24Å; W398-A505 HydrophobicContact CB-CB 3.98Å; W398-A505 HydrophobicContact CG-CB 4.49Å
399	R	86.8	Confident	91.2	Very high	39 Å²	39	31.3 Å²	31.3	15%	0.147	16%	0.156	C	C	.	.	H	α-helix	trans	-62.1	-46.3	172.8	177.8	-175.2	170.3	-85.6	11.7	111.2	C395 K396 L397 I401 V402 L403 V506 E534 F538	C395-R399 PolarHBondContact O-N 2.92Å; K396-R399 PolarHBondContact O-N 3.46Å; L397-R399 VanDerWaalsContact C-N 3.3Å; L397-R399 PolarHBondContact O-N 2.86Å; R399-I401 PolarHBondContact O-N 2.97Å; R399-V402 PolarHBondContact O-N 3.45Å; R399-L403 HydrophobicContact CG-CD1 3.81Å; R399-L403 HydrophobicContact CG-CG 4.39Å; R399-L403 WeakPolarHBondContact O-CB 3.3Å; R399-L403 WeakPolarHBondContact O-CG 3.49Å; R399-L403 PolarHBondContact O-N 3.36Å; R399-V506 HydrophobicContact CB-CG2 4.45Å; R399-V506 HydrophobicContact CG-CG2 4.29Å; R399-E534 IonicContact CZ-OE2 3.88Å; R399-E534 IonicContact NH2-OE2 3.43Å; R399-E534 PolarHBondContact NH2-OE2 3.02Å; R399-F538 HydrophobicContact CG-CD2 4.19Å; R399-F538 HydrophobicContact CG-CE2 4.33Å
400	A	89.4	Confident	91.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.7	-42.9	-179.4	0	0	0	0	0	112	K396 L397 V402 L403 R404 D405 M409 Y412	K396-A400 WeakPolarHBondContact O-CB 3.35Å; K396-A400 PolarHBondContact O-N 2.68Å; L397-A400 WeakPolarHBondContact O-CB 3.44Å; L397-A400 PolarHBondContact O-N 3.39Å; L397-A400 VanDerWaalsContact O-N 3.08Å; A400-V402 VanDerWaalsContact C-N 3.34Å; A400-V402 PolarHBondContact O-N 2.84Å; A400-L403 CarbonylContact O-C 3.34Å; A400-L403 PolarHBondContact O-N 3.09Å; A400-R404 PolarHBondContact O-N 2.97Å; A400-D405 HydrophobicContact CB-CB 4.14Å; A400-D405 PolarHBondContact O-N 3.16Å; A400-M409 HydrophobicContact CB-CG 3.98Å; A400-Y412 HydrophobicContact CB-CD2 4.37Å
401	I	88.5	Confident	91.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59	-45	176.6	-68.2	166.8	0	0	0	111.6	L397 R399 R404 M409 C425 L428 L429 I433	L397-I401 HydrophobicContact CD1-CD1 4.16Å; L397-I401 HydrophobicContact CD1-CG1 4.21Å; L397-I401 HydrophobicContact CG-CD1 3.91Å; L397-I401 HydrophobicContact CG-CG1 4.43Å; L397-I401 VanDerWaalsContact O-CG1 3.27Å; L397-I401 WeakPolarHBondContact O-CG1 3.4Å; L397-I401 PolarHBondContact O-N 3.32Å; R399-I401 PolarHBondContact O-N 2.97Å; I401-R404 PolarHBondContact O-N 3.27Å; I401-R404 PolarHBondContact O-NH1 3.29Å; I401-M409 HydrophobicContact CG1-CE 4.39Å; I401-M409 HydrophobicContact CG1-CG 3.96Å; I401-M409 HydrophobicContact CG1-SD 4.42Å; I401-C425 HydrophobicContact CD1-CB 3.8Å; I401-C425 HydrophobicContact CG1-CB 3.97Å; I401-L428 HydrophobicContact CD1-CD2 4.1Å; I401-L429 HydrophobicContact CG2-CD1 3.24Å; I401-L429 HydrophobicContact CG2-CD2 3.93Å; I401-L429 HydrophobicContact CG2-CG 3.77Å; I401-I433 HydrophobicContact CG2-CD1 4.21Å
402	V	80.9	Confident	91.5	Very high	6 Å²	6	39.2 Å²	39.2	4%	0.036	18%	0.184	C	C	.	.	H	α-helix	trans	-72.4	-33.3	-178.7	171.4	0	0	0	0	111.9	W398 R399 A400 R404 L440 A502 F538 L542	W398-V402 WeakPolarHBondContact O-CG2 3.46Å; W398-V402 PolarHBondContact O-N 3.35Å; R399-V402 PolarHBondContact O-N 3.45Å; A400-V402 VanDerWaalsContact C-N 3.34Å; A400-V402 PolarHBondContact O-N 2.84Å; V402-R404 VanDerWaalsContact C-N 3.31Å; V402-L440 HydrophobicContact CG2-CD1 4.33Å; V402-A502 HydrophobicContact CB-CB 4.4Å; V402-A502 HydrophobicContact CG1-CB 4.49Å; V402-A502 HydrophobicContact CG2-CB 3.86Å; V402-F538 HydrophobicContact CB-CE2 4.36Å; V402-F538 HydrophobicContact CB-CZ 4.46Å; V402-F538 HydrophobicContact CG1-CE2 3.93Å; V402-F538 HydrophobicContact CG1-CZ 3.85Å; V402-L542 HydrophobicContact CG1-CD1 3.32Å
403	L	80.4	Confident	91.6	Very high	51 Å²	51	38 Å²	38	27%	0.267	18%	0.178	S	C	.	.	H	α-helix	trans	-84.8	-0.6	176.1	-66	-179.5	0	0	0	113.9	R399 A400 D405 F538 A541	R399-L403 HydrophobicContact CG-CD1 3.81Å; R399-L403 HydrophobicContact CG-CG 4.39Å; R399-L403 WeakPolarHBondContact O-CB 3.3Å; R399-L403 WeakPolarHBondContact O-CG 3.49Å; R399-L403 PolarHBondContact O-N 3.36Å; A400-L403 CarbonylContact O-C 3.34Å; A400-L403 PolarHBondContact O-N 3.09Å; L403-D405 PolarHBondContact O-N 3.47Å; L403-F538 HydrophobicContact CD1-CD2 4.14Å; L403-F538 HydrophobicContact CD2-CD2 3.86Å; L403-F538 HydrophobicContact CD2-CE2 4.01Å; L403-F538 HydrophobicContact CG-CD2 4.04Å; L403-F538 HydrophobicContact CG-CE2 4.07Å; L403-A541 HydrophobicContact CD2-CB 4.43Å
404	R	83.7	Confident	91.7	Very high	26 Å²	26	42.2 Å²	42.2	10%	0.098	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	34.5	-174.1	-53.4	-57.2	-170.8	-152.6	8.3	113.2	A400 I401 V402 E406 N434 M435 T437 L438	A400-R404 PolarHBondContact O-N 2.97Å; I401-R404 PolarHBondContact O-N 3.27Å; I401-R404 PolarHBondContact O-NH1 3.29Å; V402-R404 VanDerWaalsContact C-N 3.31Å; R404-E406 PolarHBondContact O-N 2.94Å; R404-N434 PolarHBondContact NE-O 2.9Å; R404-N434 VanDerWaalsContact NE-O 3.13Å; R404-N434 PolarHBondContact NH2-O 3.13Å; R404-M435 HydrophobicContact CB-CE 4.12Å; R404-M435 WeakPolarHBondContact O-CE 3.29Å; R404-T437 PolarHBondContact NE-O 2.84Å; R404-T437 PolarHBondContact NH2-O 2.84Å; R404-L438 HydrophobicContact CG-CD1 3.87Å; R404-L438 HydrophobicContact CG-CG 4.36Å
405	D	86.9	Confident	91.7	Very high	60 Å²	60	45.1 Å²	45.1	32%	0.321	22%	0.224	S	C	.	.			trans	-83.9	91	175.6	175.2	7.7	0	0	0	109.3	A400 L403 E407 G408 M409	A400-D405 HydrophobicContact CB-CB 4.14Å; A400-D405 PolarHBondContact O-N 3.16Å; L403-D405 PolarHBondContact O-N 3.47Å; D405-E407 PolarHBondContact O-N 3.28Å; D405-G408 PolarHBondContact O-N 3.19Å; D405-G408 PolarHBondContact OD1-N 3.36Å; D405-M409 VanDerWaalsContact O-CG 3.25Å; D405-M409 WeakPolarHBondContact O-CG 2.92Å; D405-M409 PolarHBondContact O-N 3.08Å
406	E	91.8	Very high	91.8	Very high	96 Å²	96	45.1 Å²	45.1	45%	0.449	22%	0.223	S	C	.	.	H	α-helix	trans	-62	-40.7	-175.7	-173.4	167.1	-160.8	0	0	112.9	R404 M409 K410 Y421 M435	R404-E406 PolarHBondContact O-N 2.94Å; E406-M409 WeakPolarHBondContact O-CB 3.36Å; E406-M409 PolarHBondContact O-N 3.38Å; E406-K410 PolarHBondContact O-N 3.48Å; E406-Y421 HydrophobicContact CG-CE2 4.02Å; E406-Y421 PolarHBondContact OE1-OH 3.42Å; E406-M435 HydrophobicContact CB-CE 3.82Å; E406-M435 HydrophobicContact CG-CE 4.48Å
407	E	93.8	Very high	91.9	Very high	161 Å²	161	45 Å²	45	75%	0.752	23%	0.234	S	C	*	.	H	α-helix	trans	-64.3	-43.7	177.3	-66.3	-169.6	163.9	0	0	110.8	D405 K410 M411	D405-E407 PolarHBondContact O-N 3.28Å; E407-K410 PolarHBondContact O-N 3.31Å; E407-M411 WeakPolarHBondContact O-CB 3.27Å; E407-M411 PolarHBondContact O-N 3.4Å
408	G	93.9	Very high	91.9	Very high	4 Å²	4	45 Å²	45	4%	0.041	23%	0.234	C	C	.	.	H	α-helix	trans	-60.4	-44.5	172.5	0	0	0	0	0	112.3	D405 K410 M411 Y412	D405-G408 PolarHBondContact O-N 3.19Å; D405-G408 PolarHBondContact OD1-N 3.36Å; G408-K410 VanDerWaalsContact C-N 3.33Å; G408-K410 PolarHBondContact O-N 2.99Å; G408-M411 PolarHBondContact O-N 3Å; G408-Y412 WeakPolarHBondContact O-CD2 3.48Å; G408-Y412 PolarHBondContact O-N 2.82Å
409	M	95.2	Very high	92	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57.7	-46.7	176.9	-72.7	167.2	62	0	0	111.2	L397 A400 I401 D405 E406 S413 Y421 C425 I433 M435	L397-M409 HydrophobicContact CD1-CB 4.38Å; L397-M409 WeakPolarHBondContact CD1-O 3.36Å; A400-M409 HydrophobicContact CB-CG 3.98Å; I401-M409 HydrophobicContact CG1-CE 4.39Å; I401-M409 HydrophobicContact CG1-CG 3.96Å; I401-M409 HydrophobicContact CG1-SD 4.42Å; D405-M409 VanDerWaalsContact O-CG 3.25Å; D405-M409 WeakPolarHBondContact O-CG 2.92Å; D405-M409 PolarHBondContact O-N 3.08Å; E406-M409 WeakPolarHBondContact O-CB 3.36Å; E406-M409 PolarHBondContact O-N 3.38Å; M409-S413 WeakPolarHBondContact O-CB 3.4Å; M409-S413 PolarHBondContact O-N 3.31Å; M409-S413 PolarHBondContact O-OG 3.02Å; M409-Y421 HydrophobicContact CB-CD2 3.98Å; M409-Y421 HydrophobicContact CB-CE2 4.49Å; M409-Y421 HydrophobicContact CE-CD2 4.43Å; M409-C425 HydrophobicContact CE-CB 3.86Å; M409-I433 HydrophobicContact CE-CD1 4.12Å; M409-M435 HydrophobicContact SD-CE 4.45Å; M409-M435 HydrophobicContact SD-SD 4.33Å
410	K	97	Very high	92.3	Very high	134 Å²	134	54.2 Å²	54.2	58%	0.583	28%	0.276	S	S	*	.	H	α-helix	trans	-63.2	-49.4	177.6	-175	177.8	179.5	-179.4	0	111.9	E406 E407 G408 S413 D414 Y421	E406-K410 PolarHBondContact O-N 3.48Å; E407-K410 PolarHBondContact O-N 3.31Å; G408-K410 VanDerWaalsContact C-N 3.33Å; G408-K410 PolarHBondContact O-N 2.99Å; K410-S413 PolarHBondContact O-N 3.23Å; K410-D414 PolarHBondContact O-N 3.37Å; K410-D414 VanDerWaalsContact O-N 3.08Å; K410-Y421 HydrophobicContact CB-CD1 4.1Å; K410-Y421 HydrophobicContact CB-CD2 4.38Å; K410-Y421 HydrophobicContact CB-CE1 4.39Å; K410-Y421 HydrophobicContact CB-CG 4.09Å; K410-Y421 HydrophobicContact CD-CE1 4.48Å; K410-Y421 HydrophobicContact CG-CD1 4.03Å; K410-Y421 HydrophobicContact CG-CE1 4.36Å; K410-Y421 HydrophobicContact CG-CG 4.44Å
411	M	97.3	Very high	92.5	Very high	118 Å²	118	56.5 Å²	56.5	58%	0.581	29%	0.285	S	S	*	.	H	α-helix	trans	-60.8	-48.5	-177.7	-177.7	-175.3	-63.6	0	0	112.4	E407 G408 D414 A415	E407-M411 WeakPolarHBondContact O-CB 3.27Å; E407-M411 PolarHBondContact O-N 3.4Å; G408-M411 PolarHBondContact O-N 3Å; M411-D414 PolarHBondContact O-N 3.43Å; M411-A415 PolarHBondContact O-N 3.23Å
412	Y	96.9	Very high	92.7	Very high	50 Å²	50	59.6 Å²	59.6	20%	0.196	30%	0.298	C	S	.	.	H	α-helix	trans	-80.9	-20.8	-175.2	-56.1	-51.8	0	0	0	113.2	K396 A400 G408 L416	K396-Y412 HydrophobicContact CB-CD1 3.78Å; K396-Y412 HydrophobicContact CB-CD2 3.53Å; K396-Y412 HydrophobicContact CB-CE1 3.81Å; K396-Y412 HydrophobicContact CB-CE2 3.58Å; K396-Y412 HydrophobicContact CB-CG 3.66Å; K396-Y412 HydrophobicContact CD-CD1 3.83Å; K396-Y412 HydrophobicContact CD-CE1 3.28Å; K396-Y412 HydrophobicContact CD-CE2 4.32Å; K396-Y412 HydrophobicContact CG-CE1 4.18Å; K396-Y412 HydrophobicContact CG-CE2 4.46Å; A400-Y412 HydrophobicContact CB-CD2 4.37Å; G408-Y412 WeakPolarHBondContact O-CD2 3.48Å; G408-Y412 PolarHBondContact O-N 2.82Å; Y412-L416 PolarHBondContact O-N 3.37Å
413	S	97.2	Very high	93.2	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-68.6	-42.4	166.6	-60	0	0	0	0	111.3	M409 K410 A415 L416 G417 V418 Y421	M409-S413 WeakPolarHBondContact O-CB 3.4Å; M409-S413 PolarHBondContact O-N 3.31Å; M409-S413 PolarHBondContact O-OG 3.02Å; K410-S413 PolarHBondContact O-N 3.23Å; S413-A415 VanDerWaalsContact C-N 3.32Å; S413-A415 PolarHBondContact O-N 3.04Å; S413-L416 CarbonylContact O-C 3.54Å; S413-L416 WeakPolarHBondContact O-CA 2.85Å; S413-L416 WeakPolarHBondContact O-CB 3.34Å; S413-L416 PolarHBondContact O-N 3.23Å; S413-G417 PolarHBondContact O-N 2.84Å; S413-V418 CarbonylContact C-O 3.56Å; S413-V418 WeakPolarHBondContact CB-O 3.48Å; S413-V418 PolarHBondContact O-N 3.36Å; S413-Y421 VanDerWaalsContact CB-CB 3.49Å; S413-Y421 WeakPolarHBondContact OG-CB 3.25Å
414	D	96.6	Very high	93.8	Very high	97 Å²	97	57.1 Å²	57.1	52%	0.519	29%	0.285	S	S	.	.	H	α-helix	trans	-65.2	-36.4	176.6	-169.1	64.5	0	0	0	111.9	K410 M411 L416 G417 V418	K410-D414 PolarHBondContact O-N 3.37Å; K410-D414 VanDerWaalsContact O-N 3.08Å; M411-D414 PolarHBondContact O-N 3.43Å; D414-L416 PolarHBondContact O-N 2.87Å; D414-G417 WeakPolarHBondContact O-CA 3.37Å; D414-G417 PolarHBondContact O-N 3.43Å; D414-V418 PolarHBondContact N-O 2.9Å
415	A	96.1	Very high	94.3	Very high	61 Å²	61	55.9 Å²	55.9	50%	0.504	28%	0.281	S	S	.	.	H	α-helix	trans	-61.6	-25.1	171.6	0	0	0	0	0	113.4	A393 M411 S413 G417	A393-A415 HydrophobicContact CB-CB 3.91Å; M411-A415 PolarHBondContact O-N 3.23Å; S413-A415 VanDerWaalsContact C-N 3.32Å; S413-A415 PolarHBondContact O-N 3.04Å; A415-G417 VanDerWaalsContact C-N 3.32Å
416	L	96.2	Very high	94.4	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	14.8	170.9	-70.1	168.4	0	0	0	112.2	D390 A393 L394 L397 Y412 S413 D414 V418 F424 M470 P471	D390-L416 HydrophobicContact CB-CD2 3.87Å; A393-L416 HydrophobicContact CB-CD1 4.43Å; A393-L416 HydrophobicContact CB-CD2 4.08Å; A393-L416 HydrophobicContact CB-CG 3.86Å; L394-L416 HydrophobicContact CB-CD1 4.44Å; L397-L416 HydrophobicContact CD2-CD1 3.91Å; Y412-L416 PolarHBondContact O-N 3.37Å; S413-L416 CarbonylContact O-C 3.54Å; S413-L416 WeakPolarHBondContact O-CA 2.85Å; S413-L416 WeakPolarHBondContact O-CB 3.34Å; S413-L416 PolarHBondContact O-N 3.23Å; D414-L416 PolarHBondContact O-N 2.87Å; L416-V418 VanDerWaalsContact C-N 3.29Å; L416-V418 PolarHBondContact O-N 2.91Å; L416-F424 HydrophobicContact CB-CE1 4.34Å; L416-F424 HydrophobicContact CD1-CE1 3.85Å; L416-F424 HydrophobicContact CD1-CZ 4.01Å; L416-M470 WeakPolarHBondContact O-CA 3.36Å; L416-P471 HydrophobicContact CD2-CG 4.21Å; L416-P471 WeakPolarHBondContact O-CD 3.42Å
417	G	95.1	Very high	94.2	Very high	39 Å²	39	49.5 Å²	49.5	40%	0.402	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	76	8	178	0	0	0	0	0	115.1	S413 D414 A415 S469	S413-G417 PolarHBondContact O-N 2.84Å; D414-G417 WeakPolarHBondContact O-CA 3.37Å; D414-G417 PolarHBondContact O-N 3.43Å; A415-G417 VanDerWaalsContact C-N 3.32Å; G417-S469 VanDerWaalsContact O-CB 3.27Å; G417-S469 WeakPolarHBondContact O-CB 3.41Å
418	V	95.4	Very high	94.1	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.006	21%	0.213	C	C	.	.			trans	-109.8	111.2	-173.7	-173.5	0	0	0	0	111.8	S413 D414 L416 F424 V466 M470	S413-V418 CarbonylContact C-O 3.56Å; S413-V418 WeakPolarHBondContact CB-O 3.48Å; S413-V418 PolarHBondContact O-N 3.36Å; D414-V418 PolarHBondContact N-O 2.9Å; L416-V418 VanDerWaalsContact C-N 3.29Å; L416-V418 PolarHBondContact O-N 2.91Å; V418-F424 HydrophobicContact CB-CB 4.44Å; V418-F424 HydrophobicContact CB-CD1 4.02Å; V418-F424 HydrophobicContact CB-CE1 4.44Å; V418-F424 HydrophobicContact CB-CG 4.15Å; V418-F424 HydrophobicContact CG1-CB 3.66Å; V418-F424 HydrophobicContact CG1-CD1 4.17Å; V418-F424 HydrophobicContact CG1-CD2 4.43Å; V418-F424 HydrophobicContact CG1-CG 3.85Å; V418-F424 HydrophobicContact CG2-CD1 4.27Å; V418-F424 HydrophobicContact CG2-CD2 4.33Å; V418-F424 HydrophobicContact CG2-CE1 4.32Å; V418-F424 HydrophobicContact CG2-CE2 4.4Å; V418-F424 HydrophobicContact CG2-CG 4.27Å; V418-F424 HydrophobicContact CG2-CZ 4.39Å; V418-V466 HydrophobicContact CG1-CB 4.25Å; V418-V466 HydrophobicContact CG1-CG1 3.89Å; V418-V466 HydrophobicContact CG1-CG2 3.86Å; V418-V466 HydrophobicContact CG2-CG1 4.43Å; V418-M470 HydrophobicContact CG2-CB 3.67Å
419	K	92.5	Very high	93.8	Very high	175 Å²	175	41.7 Å²	41.7	76%	0.761	21%	0.211	S	C	*	.	S	Bend	trans	-77.4	-36.5	179.2	-65.6	-175.5	178.3	-177.1	0	113.5	Y421	K419-Y421 PolarHBondContact O-N 3.38Å
420	E	93.2	Very high	93.3	Very high	58 Å²	58	43 Å²	43	27%	0.271	22%	0.217	S	C	.	.			trans	-76.8	65.1	175.7	-68.8	-163.7	-148.6	0	0	110.9	F422 L423 F424 S462 V466	E420-F422 VanDerWaalsContact C-N 3.3Å; E420-F422 PolarHBondContact O-N 3.25Å; E420-L423 HydrophobicContact CB-CB 4.4Å; E420-L423 PolarHBondContact O-N 2.83Å; E420-L423 WeakPolarHBondContact OE2-CD2 3.48Å; E420-F424 WeakPolarHBondContact O-CB 3.3Å; E420-F424 PolarHBondContact O-N 3.37Å; E420-S462 WeakPolarHBondContact OE1-CB 3.32Å; E420-S462 PolarHBondContact OE1-OG 3.25Å; E420-S462 VanDerWaalsContact OE2-CB 3.28Å; E420-S462 WeakPolarHBondContact OE2-CB 3.37Å; E420-S462 PolarHBondContact OE2-OG 3.41Å; E420-V466 HydrophobicContact CB-CG2 3.93Å
421	Y	94.5	Very high	92.8	Very high	47 Å²	47	37.1 Å²	37.1	18%	0.184	19%	0.192	C	C	.	.	H	α-helix	trans	-57.2	-40.2	-171.3	72.6	-84.2	0	0	0	113.1	E406 M409 K410 S413 K419 F424 C425	E406-Y421 HydrophobicContact CG-CE2 4.02Å; E406-Y421 PolarHBondContact OE1-OH 3.42Å; M409-Y421 HydrophobicContact CB-CD2 3.98Å; M409-Y421 HydrophobicContact CB-CE2 4.49Å; M409-Y421 HydrophobicContact CE-CD2 4.43Å; K410-Y421 HydrophobicContact CB-CD1 4.1Å; K410-Y421 HydrophobicContact CB-CD2 4.38Å; K410-Y421 HydrophobicContact CB-CE1 4.39Å; K410-Y421 HydrophobicContact CB-CG 4.09Å; K410-Y421 HydrophobicContact CD-CE1 4.48Å; K410-Y421 HydrophobicContact CG-CD1 4.03Å; K410-Y421 HydrophobicContact CG-CE1 4.36Å; K410-Y421 HydrophobicContact CG-CG 4.44Å; S413-Y421 VanDerWaalsContact CB-CB 3.49Å; S413-Y421 WeakPolarHBondContact OG-CB 3.25Å; K419-Y421 PolarHBondContact O-N 3.38Å; Y421-F424 PolarHBondContact O-N 3.25Å; Y421-C425 WeakPolarHBondContact O-CB 3.49Å; Y421-C425 PolarHBondContact O-N 3.31Å; Y421-C425 PolarHBondContact O-SG 3.45Å
422	F	92.9	Very high	92.2	Very high	65 Å²	65	32.5 Å²	32.5	29%	0.285	17%	0.17	S	C	.	.	H	α-helix	trans	-66.5	-50.8	-175.1	-163	-90.2	0	0	0	111.2	E420 F424 C425 E426 I433 M435	E420-F422 VanDerWaalsContact C-N 3.3Å; E420-F422 PolarHBondContact O-N 3.25Å; F422-F424 VanDerWaalsContact C-N 3.28Å; F422-F424 PolarHBondContact O-N 3.42Å; F422-C425 PolarHBondContact O-N 2.98Å; F422-C425 VanDerWaalsContact O-N 3.17Å; F422-E426 HydrophobicContact CD1-CG 4.2Å; F422-E426 VanDerWaalsContact CE1-CD 3.49Å; F422-E426 HydrophobicContact CE1-CG 4.02Å; F422-E426 WeakPolarHBondContact CE1-OE1 3.33Å; F422-E426 WeakPolarHBondContact O-CG 2.98Å; F422-E426 PolarHBondContact O-N 3.33Å; F422-I433 HydrophobicContact CE2-CB 4.35Å; F422-I433 HydrophobicContact CE2-CG2 4.19Å; F422-I433 HydrophobicContact CZ-CB 4Å; F422-I433 HydrophobicContact CZ-CG2 4.26Å; F422-I433 WeakPolarHBondContact CZ-O 3.28Å; F422-M435 HydrophobicContact CE2-CG 4.26Å; F422-M435 HydrophobicContact CE2-SD 4.44Å
423	L	91.3	Very high	91.6	Very high	5 Å²	5	30.7 Å²	30.7	3%	0.026	16%	0.164	C	C	.	.	H	α-helix	trans	-57.9	-43.7	174.9	177.7	59.7	0	0	0	110.9	E420 C425 E426 M427 M455 I463 V466	E420-L423 HydrophobicContact CB-CB 4.4Å; E420-L423 PolarHBondContact O-N 2.83Å; E420-L423 WeakPolarHBondContact OE2-CD2 3.48Å; L423-C425 VanDerWaalsContact C-N 3.35Å; L423-C425 PolarHBondContact O-N 3.03Å; L423-E426 PolarHBondContact O-N 3.02Å; L423-M427 HydrophobicContact CD1-CG 4.26Å; L423-M427 HydrophobicContact CD1-SD 4.22Å; L423-M427 HydrophobicContact CG-CG 4.44Å; L423-M427 HydrophobicContact CG-SD 3.88Å; L423-M427 WeakPolarHBondContact O-CB 3.48Å; L423-M427 WeakPolarHBondContact O-CG 3.2Å; L423-M427 PolarHBondContact O-N 3.36Å; L423-M455 HydrophobicContact CD1-CE 4.03Å; L423-M455 HydrophobicContact CD1-CG 4.27Å; L423-M455 HydrophobicContact CD1-SD 3.42Å; L423-M455 WeakPolarHBondContact CD1-SD 3.4Å; L423-I463 HydrophobicContact CD1-CG1 4.11Å; L423-I463 HydrophobicContact CD2-CG1 4Å; L423-I463 HydrophobicContact CG-CG1 4.45Å; L423-V466 HydrophobicContact CD2-CG2 4.05Å; L423-V466 HydrophobicContact CG-CG2 4.35Å
424	F	93.3	Very high	90.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.5	-42.7	177.4	179.7	-133.1	0	0	0	112.9	L397 L416 V418 E420 Y421 F422 M427 L428 V466 M470 M474 F478	L397-F424 HydrophobicContact CD2-CD1 3.93Å; L397-F424 HydrophobicContact CD2-CE1 3.42Å; L397-F424 VanDerWaalsContact CD2-CE1 3.42Å; L397-F424 HydrophobicContact CD2-CZ 4.3Å; L416-F424 HydrophobicContact CB-CE1 4.34Å; L416-F424 HydrophobicContact CD1-CE1 3.85Å; L416-F424 HydrophobicContact CD1-CZ 4.01Å; V418-F424 HydrophobicContact CB-CB 4.44Å; V418-F424 HydrophobicContact CB-CD1 4.02Å; V418-F424 HydrophobicContact CB-CE1 4.44Å; V418-F424 HydrophobicContact CB-CG 4.15Å; V418-F424 HydrophobicContact CG1-CB 3.66Å; V418-F424 HydrophobicContact CG1-CD1 4.17Å; V418-F424 HydrophobicContact CG1-CD2 4.43Å; V418-F424 HydrophobicContact CG1-CG 3.85Å; V418-F424 HydrophobicContact CG2-CD1 4.27Å; V418-F424 HydrophobicContact CG2-CD2 4.33Å; V418-F424 HydrophobicContact CG2-CE1 4.32Å; V418-F424 HydrophobicContact CG2-CE2 4.4Å; V418-F424 HydrophobicContact CG2-CG 4.27Å; V418-F424 HydrophobicContact CG2-CZ 4.39Å; E420-F424 WeakPolarHBondContact O-CB 3.3Å; E420-F424 PolarHBondContact O-N 3.37Å; Y421-F424 PolarHBondContact O-N 3.25Å; F422-F424 VanDerWaalsContact C-N 3.28Å; F422-F424 PolarHBondContact O-N 3.42Å; F424-M427 PolarHBondContact O-N 2.93Å; F424-L428 VanDerWaalsContact O-CB 3.25Å; F424-L428 WeakPolarHBondContact O-CB 3.4Å; F424-L428 PolarHBondContact O-N 2.89Å; F424-V466 HydrophobicContact CB-CG1 4.11Å; F424-V466 HydrophobicContact CD2-CG1 3.72Å; F424-V466 HydrophobicContact CG-CG1 4.25Å; F424-M470 HydrophobicContact CE2-SD 4.11Å; F424-M474 HydrophobicContact CZ-CE 4.17Å; F424-F478 HydrophobicContact CD2-CZ 4.02Å; F424-F478 AromaticContact CE2-CE2 3.89Å; F424-F478 HydrophobicContact CE2-CE2 3.89Å; F424-F478 AromaticContact CE2-CZ 3.71Å; F424-F478 HydrophobicContact CE2-CZ 3.71Å
425	C	92.6	Very high	89.9	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-66.6	-40.3	177.9	-66.3	0	0	0	0	111.8	I401 M409 Y421 F422 L423 L428 L429 I433	I401-C425 HydrophobicContact CD1-CB 3.8Å; I401-C425 HydrophobicContact CG1-CB 3.97Å; M409-C425 HydrophobicContact CE-CB 3.86Å; Y421-C425 WeakPolarHBondContact O-CB 3.49Å; Y421-C425 PolarHBondContact O-N 3.31Å; Y421-C425 PolarHBondContact O-SG 3.45Å; F422-C425 PolarHBondContact O-N 2.98Å; F422-C425 VanDerWaalsContact O-N 3.17Å; L423-C425 VanDerWaalsContact C-N 3.35Å; L423-C425 PolarHBondContact O-N 3.03Å; C425-L428 PolarHBondContact O-N 2.86Å; C425-L429 WeakPolarHBondContact O-CG 3.18Å; C425-L429 PolarHBondContact O-N 3.28Å; C425-I433 HydrophobicContact CB-CD1 3.33Å
426	E	90.1	Very high	88.5	Confident	6 Å²	6	41.1 Å²	41.1	3%	0.028	19%	0.192	C	C	.	.	H	α-helix	trans	-64.9	-41.8	175.3	-70.4	-169.5	135.7	0	0	112.1	F422 L423 L428 Q430 R431 P432 I433 Y451	F422-E426 HydrophobicContact CD1-CG 4.2Å; F422-E426 VanDerWaalsContact CE1-CD 3.49Å; F422-E426 HydrophobicContact CE1-CG 4.02Å; F422-E426 WeakPolarHBondContact CE1-OE1 3.33Å; F422-E426 WeakPolarHBondContact O-CG 2.98Å; F422-E426 PolarHBondContact O-N 3.33Å; L423-E426 PolarHBondContact O-N 3.02Å; E426-L428 VanDerWaalsContact C-N 3.34Å; E426-Q430 WeakPolarHBondContact O-CA 3.29Å; E426-Q430 PolarHBondContact O-N 3.5Å; E426-R431 WeakPolarHBondContact CA-O 3.4Å; E426-R431 PolarHBondContact O-N 3.42Å; E426-R431 VanDerWaalsContact O-N 3.13Å; E426-P432 VanDerWaalsContact OE1-CA 3.3Å; E426-P432 WeakPolarHBondContact OE1-CA 3.42Å; E426-I433 HydrophobicContact CG-CB 4.16Å; E426-I433 HydrophobicContact CG-CD1 4.01Å; E426-I433 HydrophobicContact CG-CG1 3.95Å; E426-I433 PolarHBondContact OE1-N 2.88Å; E426-I433 VanDerWaalsContact OE1-N 3.1Å; E426-Y451 PolarHBondContact OE2-OH 2.86Å
427	M	88.1	Confident	86.9	Confident	17 Å²	17	42.9 Å²	42.9	8%	0.084	20%	0.203	C	C	.	.	H	α-helix	trans	-59.3	-47.7	171.9	-69.8	167.8	60.8	0	0	110.2	L423 F424 L429 Q430 I463 V466 L467 F478	L423-M427 HydrophobicContact CD1-CG 4.26Å; L423-M427 HydrophobicContact CD1-SD 4.22Å; L423-M427 HydrophobicContact CG-CG 4.44Å; L423-M427 HydrophobicContact CG-SD 3.88Å; L423-M427 WeakPolarHBondContact O-CB 3.48Å; L423-M427 WeakPolarHBondContact O-CG 3.2Å; L423-M427 PolarHBondContact O-N 3.36Å; F424-M427 PolarHBondContact O-N 2.93Å; M427-L429 PolarHBondContact O-N 3.3Å; M427-Q430 VanDerWaalsContact O-CG 3.25Å; M427-Q430 WeakPolarHBondContact O-CG 3.39Å; M427-Q430 PolarHBondContact O-N 3.43Å; M427-I463 HydrophobicContact CE-CG2 3.81Å; M427-I463 HydrophobicContact SD-CB 4.49Å; M427-I463 HydrophobicContact SD-CG1 4.27Å; M427-I463 HydrophobicContact SD-CG2 4.1Å; M427-V466 HydrophobicContact CE-CB 4.44Å; M427-V466 HydrophobicContact CE-CG1 3.88Å; M427-V466 HydrophobicContact SD-CB 4.19Å; M427-V466 HydrophobicContact SD-CG1 3.83Å; M427-L467 HydrophobicContact CE-CD1 4.24Å; M427-L467 HydrophobicContact CE-CD2 3.54Å; M427-L467 HydrophobicContact CE-CG 3.77Å; M427-F478 VanDerWaalsContact C-CE1 3.45Å; M427-F478 HydrophobicContact CB-CE1 3.75Å; M427-F478 HydrophobicContact CB-CZ 4.16Å; M427-F478 HydrophobicContact CE-CZ 4.5Å; M427-F478 WeakPolarHBondContact O-CE1 3.42Å
428	L	89.9	Confident	85.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65.3	-41.3	-174.3	-171.8	67.4	0	0	0	111.6	L394 L397 W398 I401 F424 C425 E426 Q430 M474 F478 I481	L394-L428 HydrophobicContact CD1-CD1 4.39Å; L394-L428 HydrophobicContact CD1-CD2 3.9Å; L397-L428 HydrophobicContact CD2-CD2 4.08Å; W398-L428 HydrophobicContact CE3-CD2 3.64Å; W398-L428 HydrophobicContact CE3-CG 4.02Å; W398-L428 HydrophobicContact CH2-CD1 4.29Å; W398-L428 HydrophobicContact CH2-CD2 4.42Å; W398-L428 HydrophobicContact CH2-CG 3.89Å; W398-L428 HydrophobicContact CZ3-CD1 3.65Å; W398-L428 HydrophobicContact CZ3-CD2 3.53Å; W398-L428 HydrophobicContact CZ3-CG 3.36Å; I401-L428 HydrophobicContact CD1-CD2 4.1Å; F424-L428 VanDerWaalsContact O-CB 3.25Å; F424-L428 WeakPolarHBondContact O-CB 3.4Å; F424-L428 PolarHBondContact O-N 2.89Å; C425-L428 PolarHBondContact O-N 2.86Å; E426-L428 VanDerWaalsContact C-N 3.34Å; L428-Q430 VanDerWaalsContact C-N 3.3Å; L428-M474 HydrophobicContact CD1-CE 4.04Å; L428-F478 HydrophobicContact CB-CE1 4.26Å; L428-F478 HydrophobicContact CB-CZ 4.32Å; L428-F478 HydrophobicContact CD1-CE1 4.2Å; L428-F478 HydrophobicContact CD1-CE2 4.49Å; L428-F478 HydrophobicContact CD1-CZ 4.04Å; L428-I481 HydrophobicContact CD1-CD1 3.87Å
429	L	87.9	Confident	83.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-76.3	-17.8	172.7	-63.9	-175.3	0	0	0	112.9	W398 I401 C425 M427 R431 I433 R497 Y498	W398-L429 HydrophobicContact CZ2-CD2 4.18Å; I401-L429 HydrophobicContact CG2-CD1 3.24Å; I401-L429 HydrophobicContact CG2-CD2 3.93Å; I401-L429 HydrophobicContact CG2-CG 3.77Å; C425-L429 WeakPolarHBondContact O-CG 3.18Å; C425-L429 PolarHBondContact O-N 3.28Å; M427-L429 PolarHBondContact O-N 3.3Å; L429-R431 VanDerWaalsContact C-N 3.25Å; L429-R431 HydrophobicContact CB-CG 3.56Å; L429-R431 HydrophobicContact CD1-CG 4.22Å; L429-R431 PolarHBondContact O-N 2.92Å; L429-I433 HydrophobicContact CD1-CD1 3.93Å; L429-I433 HydrophobicContact CD1-CG1 3.76Å; L429-R497 PolarHBondContact O-NH2 2.86Å; L429-Y498 HydrophobicContact CB-CE1 4.04Å; L429-Y498 HydrophobicContact CD2-CD1 3.71Å; L429-Y498 HydrophobicContact CD2-CE1 3.94Å; L429-Y498 WeakPolarHBondContact O-CE1 3.33Å; L429-Y498 PolarHBondContact O-OH 3.04Å
430	Q	86	Confident	82.1	Confident	27 Å²	27	37.3 Å²	37.3	13%	0.126	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	39.8	-172	-58.1	172.7	-9.7	0	0	112.2	E426 M427 L428 F478 N482	E426-Q430 WeakPolarHBondContact O-CA 3.29Å; E426-Q430 PolarHBondContact O-N 3.5Å; M427-Q430 VanDerWaalsContact O-CG 3.25Å; M427-Q430 WeakPolarHBondContact O-CG 3.39Å; M427-Q430 PolarHBondContact O-N 3.43Å; L428-Q430 VanDerWaalsContact C-N 3.3Å; Q430-F478 PolarHBondContact NE2-O 3.48Å; Q430-N482 VanDerWaalsContact NE2-CA 3.27Å; Q430-N482 PolarHBondContact OE1-OD1 3.46Å
431	R	85.5	Confident	80.7	Confident	12 Å²	12	37.2 Å²	37.2	5%	0.045	18%	0.183	C	C	.	.	S	Bend	trans	-161.8	159.6	179.7	63.5	171.4	-68.1	148.8	12.9	110.9	E426 L429 S441 L444 E448 M452 Y498	E426-R431 WeakPolarHBondContact CA-O 3.4Å; E426-R431 PolarHBondContact O-N 3.42Å; E426-R431 VanDerWaalsContact O-N 3.13Å; L429-R431 VanDerWaalsContact C-N 3.25Å; L429-R431 HydrophobicContact CB-CG 3.56Å; L429-R431 HydrophobicContact CD1-CG 4.22Å; L429-R431 PolarHBondContact O-N 2.92Å; R431-S441 VanDerWaalsContact NH1-N 3.17Å; R431-S441 PolarHBondContact NH1-O 3.36Å; R431-L444 HydrophobicContact CB-CD2 3.61Å; R431-E448 IonicContact CZ-OE1 2.82Å; R431-E448 IonicContact NH2-OE1 2.93Å; R431-E448 PolarHBondContact NH2-OE1 2.82Å; R431-M452 VanDerWaalsContact C-SD 3.52Å; R431-Y498 VanDerWaalsContact CD-CZ 3.49Å; R431-Y498 VanDerWaalsContact CD-OH 3.25Å; R431-Y498 WeakPolarHBondContact CD-OH 3.2Å; R431-Y498 HydrophobicContact CG-CE1 4.47Å
432	P	84.8	Confident	79.4	Confident	20 Å²	20	36.6 Å²	36.6	13%	0.13	18%	0.182	C	C	.	.			trans	-64.7	150.4	169.3	25.9	-32.3	0	0	0	111.7	E426 E448 Y451	E426-P432 VanDerWaalsContact OE1-CA 3.3Å; E426-P432 WeakPolarHBondContact OE1-CA 3.42Å; P432-E448 HydrophobicContact CG-CB 3.74Å; P432-E448 HydrophobicContact CG-CG 3.59Å; P432-Y451 HydrophobicContact CB-CD1 3.73Å; P432-Y451 HydrophobicContact CB-CE1 3.8Å; P432-Y451 HydrophobicContact CG-CD1 4.19Å
433	I	83.4	Confident	78.3	Confident	12 Å²	12	38.7 Å²	38.7	6%	0.062	20%	0.196	C	C	.	.			trans	-106.8	119.9	174.5	-68.2	169.8	0	0	0	109	I401 M409 F422 C425 E426 L429 M435	I401-I433 HydrophobicContact CG2-CD1 4.21Å; M409-I433 HydrophobicContact CE-CD1 4.12Å; F422-I433 HydrophobicContact CE2-CB 4.35Å; F422-I433 HydrophobicContact CE2-CG2 4.19Å; F422-I433 HydrophobicContact CZ-CB 4Å; F422-I433 HydrophobicContact CZ-CG2 4.26Å; F422-I433 WeakPolarHBondContact CZ-O 3.28Å; C425-I433 HydrophobicContact CB-CD1 3.33Å; E426-I433 HydrophobicContact CG-CB 4.16Å; E426-I433 HydrophobicContact CG-CD1 4.01Å; E426-I433 HydrophobicContact CG-CG1 3.95Å; E426-I433 PolarHBondContact OE1-N 2.88Å; E426-I433 VanDerWaalsContact OE1-N 3.1Å; L429-I433 HydrophobicContact CD1-CD1 3.93Å; L429-I433 HydrophobicContact CD1-CG1 3.76Å; I433-M435 HydrophobicContact CG2-SD 3.86Å
434	N	80.7	Confident	77.2	Confident	77 Å²	77	40.5 Å²	40.5	41%	0.412	21%	0.205	S	C	.	.			trans	-102.7	116.4	167.9	-174.1	-22.9	0	0	0	109	R404 R436 T437	R404-N434 PolarHBondContact NE-O 2.9Å; R404-N434 VanDerWaalsContact NE-O 3.13Å; R404-N434 PolarHBondContact NH2-O 3.13Å; N434-R436 PolarHBondContact O-N 2.77Å; N434-R436 WeakPolarHBondContact OD1-CB 3.25Å; N434-R436 PolarHBondContact OD1-N 3.13Å; N434-T437 WeakPolarHBondContact CB-OG1 3.45Å; N434-T437 PolarHBondContact O-N 3.46Å
435	M	78.4	Confident	76.4	Confident	63 Å²	63	42.7 Å²	42.7	31%	0.31	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-15.4	-179.2	-65.3	-59.4	-70.6	0	0	113.4	R404 E406 M409 F422 I433	R404-M435 HydrophobicContact CB-CE 4.12Å; R404-M435 WeakPolarHBondContact O-CE 3.29Å; E406-M435 HydrophobicContact CB-CE 3.82Å; E406-M435 HydrophobicContact CG-CE 4.48Å; M409-M435 HydrophobicContact SD-CE 4.45Å; M409-M435 HydrophobicContact SD-SD 4.33Å; F422-M435 HydrophobicContact CE2-CG 4.26Å; F422-M435 HydrophobicContact CE2-SD 4.44Å; I433-M435 HydrophobicContact CG2-SD 3.86Å
436	R	65.9	Low	75.5	Confident	238 Å²	238	53.9 Å²	53.9	90%	0.898	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-18.4	178.9	-57.2	-178.6	-178.4	178.2	0.5	113.2	N434	N434-R436 PolarHBondContact O-N 2.77Å; N434-R436 WeakPolarHBondContact OD1-CB 3.25Å; N434-R436 PolarHBondContact OD1-N 3.13Å
437	T	63.5	Low	74.7	Confident	39 Å²	39	60 Å²	60	24%	0.239	29%	0.291	C	S	.	.			trans	-121.4	129.3	-176.9	60.4	0	0	0	0	111.1	R404 N434	R404-T437 PolarHBondContact NE-O 2.84Å; R404-T437 PolarHBondContact NH2-O 2.84Å; N434-T437 WeakPolarHBondContact CB-OG1 3.45Å; N434-T437 PolarHBondContact O-N 3.46Å
438	L	59.3	Low	74.3	Confident	48 Å²	48	61 Å²	61	25%	0.251	30%	0.295	S	S	.	.			trans	-83.6	-23.5	177.1	-125.3	102.4	0	0	0	113	R404 L440 L542 E545	R404-L438 HydrophobicContact CG-CD1 3.87Å; R404-L438 HydrophobicContact CG-CG 4.36Å; L438-L440 PolarHBondContact O-N 2.7Å; L438-L542 HydrophobicContact CD2-CD1 4.08Å; L438-E545 HydrophobicContact CD2-CB 4.12Å; L438-E545 HydrophobicContact CD2-CG 4Å
439	A	59.2	Low	73.6	Confident	33 Å²	33	63 Å²	63	27%	0.273	31%	0.307	S	S	.	.			trans	-63.7	127.5	-179.1	0	0	0	0	0	112.1	M549	A439-M549 HydrophobicContact CB-CE 3.36Å; A439-M549 HydrophobicContact CB-SD 3.33Å; A439-M549 WeakPolarHBondContact CB-SD 3.22Å
440	L	63.7	Low	72.8	Confident	16 Å²	16	65 Å²	65	8%	0.084	33%	0.325	C	S	.	.			trans	-113.1	90.8	169.2	-61.8	175.2	0	0	0	108.8	V402 L438 Y498	V402-L440 HydrophobicContact CG2-CD1 4.33Å; L438-L440 PolarHBondContact O-N 2.7Å; L440-Y498 HydrophobicContact CB-CD2 3.46Å; L440-Y498 VanDerWaalsContact CB-CD2 3.46Å; L440-Y498 HydrophobicContact CB-CE2 3.94Å; L440-Y498 HydrophobicContact CB-CG 3.96Å; L440-Y498 HydrophobicContact CD1-CD1 4.18Å; L440-Y498 HydrophobicContact CD1-CD2 4.15Å; L440-Y498 HydrophobicContact CD1-CG 3.74Å; L440-Y498 HydrophobicContact CG-CD2 4.41Å; L440-Y498 HydrophobicContact CG-CG 4.48Å
441	S	64.1	Low	72.7	Confident	57 Å²	57	67.8 Å²	67.8	40%	0.399	33%	0.334	S	S	.	.			trans	-54.6	145.1	169.5	59.1	0	0	0	0	111.1	R431 I443 Y498	R431-S441 VanDerWaalsContact NH1-N 3.17Å; R431-S441 PolarHBondContact NH1-O 3.36Å; S441-I443 VanDerWaalsContact C-N 3.31Å; S441-I443 PolarHBondContact OG-O 2.92Å; S441-Y498 WeakPolarHBondContact O-CE2 3.39Å
442	N	66.8	Low	72.4	Confident	33 Å²	33	68.9 Å²	68.9	18%	0.176	34%	0.34	C	S	.	.	S	Bend	trans	-76.7	-21.6	178.7	-69.5	-40.5	0	0	0	113.9	A493 V495 D496 R497	N442-A493 HydrophobicContact CB-CB 3.82Å; N442-A493 PolarHBondContact ND2-O 2.99Å; N442-V495 PolarHBondContact ND2-O 3.37Å; N442-V495 PolarHBondContact OD1-O 3.32Å; N442-D496 VanDerWaalsContact ND2-CA 3.34Å; N442-D496 WeakPolarHBondContact ND2-CA 3.36Å; N442-D496 PolarHBondContact ND2-N 3Å; N442-D496 VanDerWaalsContact OD1-CA 3.23Å; N442-D496 WeakPolarHBondContact OD1-CA 3.36Å; N442-R497 PolarHBondContact OD1-N 2.94Å
443	I	68.9	Low	71.9	Confident	110 Å²	110	75.8 Å²	75.8	56%	0.564	36%	0.364	S	S	*	.	S	Bend	trans	-111.7	130.7	179.4	-58.5	174.7	0	0	0	107	S441 A493	S441-I443 VanDerWaalsContact C-N 3.31Å; S441-I443 PolarHBondContact OG-O 2.92Å; I443-A493 HydrophobicContact CD1-CB 3.91Å; I443-A493 HydrophobicContact CG1-CB 3.59Å
444	L	69	Low	71.4	Confident	43 Å²	43	81 Å²	81	23%	0.225	39%	0.388	C	S	.	.			trans	-70.2	136.5	174	-73.7	159.7	0	0	0	109.7	R431 E448	R431-L444 HydrophobicContact CB-CD2 3.61Å; L444-E448 WeakPolarHBondContact CA-OE2 3.17Å; L444-E448 HydrophobicContact CB-CB 4.34Å; L444-E448 HydrophobicContact CD2-CB 3.67Å; L444-E448 HydrophobicContact CD2-CG 4.5Å
445	S	77.6	Confident	71.4	Confident	45 Å²	45	78 Å²	78	32%	0.315	37%	0.372	S	S	.	.			trans	-66.2	167	168.4	85.7	0	0	0	0	110.9	E447 E448 T449	S445-E447 VanDerWaalsContact C-N 3.25Å; S445-E447 PolarHBondContact O-N 3.48Å; S445-E447 PolarHBondContact OG-N 3.16Å; S445-E448 PolarHBondContact N-OE2 3.42Å; S445-E448 PolarHBondContact O-N 2.91Å; S445-E448 WeakPolarHBondContact OG-CG 3.25Å; S445-E448 PolarHBondContact OG-N 3.29Å; S445-T449 WeakPolarHBondContact O-CB 3.42Å; S445-T449 PolarHBondContact O-N 3.28Å; S445-T449 PolarHBondContact O-OG1 3.03Å
446	R	71.9	Confident	71	Confident	236 Å²	236	77.2 Å²	77.2	89%	0.891	38%	0.375	S	S	*	.	H	α-helix	trans	-60.4	-39.2	174.5	-74.4	-175.1	177.8	-175.8	0.5	111.5	T449 A450	R446-T449 PolarHBondContact O-N 3.12Å; R446-A450 WeakPolarHBondContact O-CB 3.09Å; R446-A450 PolarHBondContact O-N 3.37Å
447	E	74.8	Confident	71	Confident	133 Å²	133	69.5 Å²	69.5	62%	0.621	36%	0.355	S	S	*	.	H	α-helix	trans	-66.7	-47.4	177.3	-69.7	164.4	-154.9	0	0	111.7	S445 T449 A450 Y451	S445-E447 VanDerWaalsContact C-N 3.25Å; S445-E447 PolarHBondContact O-N 3.48Å; S445-E447 PolarHBondContact OG-N 3.16Å; E447-T449 VanDerWaalsContact C-N 3.26Å; E447-T449 PolarHBondContact O-N 2.92Å; E447-A450 PolarHBondContact O-N 3.02Å; E447-A450 VanDerWaalsContact O-N 3.14Å; E447-Y451 WeakPolarHBondContact O-CB 3.32Å; E447-Y451 PolarHBondContact O-N 3.38Å
448	E	79.6	Confident	71.5	Confident	38 Å²	38	73.4 Å²	73.4	18%	0.178	37%	0.374	C	S	.	.	H	α-helix	trans	-61.4	-38.9	176.9	-66.7	179.2	125.4	0	0	110.8	R431 P432 L444 S445 Y451 M452	R431-E448 IonicContact CZ-OE1 2.82Å; R431-E448 IonicContact NH2-OE1 2.93Å; R431-E448 PolarHBondContact NH2-OE1 2.82Å; P432-E448 HydrophobicContact CG-CB 3.74Å; P432-E448 HydrophobicContact CG-CG 3.59Å; L444-E448 WeakPolarHBondContact CA-OE2 3.17Å; L444-E448 HydrophobicContact CB-CB 4.34Å; L444-E448 HydrophobicContact CD2-CB 3.67Å; L444-E448 HydrophobicContact CD2-CG 4.5Å; S445-E448 PolarHBondContact N-OE2 3.42Å; S445-E448 PolarHBondContact O-N 2.91Å; S445-E448 WeakPolarHBondContact OG-CG 3.25Å; S445-E448 PolarHBondContact OG-N 3.29Å; E448-Y451 PolarHBondContact O-N 2.95Å; E448-M452 VanDerWaalsContact O-CG 3.26Å; E448-M452 WeakPolarHBondContact O-CG 3.27Å; E448-M452 PolarHBondContact O-N 2.94Å
449	T	74.1	Confident	72.3	Confident	42 Å²	42	77.2 Å²	77.2	26%	0.258	39%	0.385	S	S	.	.	H	α-helix	trans	-64.3	-42.5	175.6	-56.8	0	0	0	0	111.7	S445 R446 E447 R453	S445-T449 WeakPolarHBondContact O-CB 3.42Å; S445-T449 PolarHBondContact O-N 3.28Å; S445-T449 PolarHBondContact O-OG1 3.03Å; R446-T449 PolarHBondContact O-N 3.12Å; E447-T449 VanDerWaalsContact C-N 3.26Å; E447-T449 PolarHBondContact O-N 2.92Å; T449-R453 WeakPolarHBondContact O-CG 3.33Å; T449-R453 PolarHBondContact O-N 3.39Å; T449-R453 VanDerWaalsContact O-N 3.12Å
450	A	72.1	Confident	72.9	Confident	44 Å²	44	78.8 Å²	78.8	36%	0.364	39%	0.386	S	S	.	.	H	α-helix	trans	-64.9	-43.8	176.5	0	0	0	0	0	111.3	R446 E447 R453 Q454	R446-A450 WeakPolarHBondContact O-CB 3.09Å; R446-A450 PolarHBondContact O-N 3.37Å; E447-A450 PolarHBondContact O-N 3.02Å; E447-A450 VanDerWaalsContact O-N 3.14Å; A450-R453 PolarHBondContact O-N 3.01Å; A450-Q454 WeakPolarHBondContact O-CG 3.24Å; A450-Q454 PolarHBondContact O-N 2.75Å
451	Y	82.8	Confident	73.4	Confident	84 Å²	84	85 Å²	85	33%	0.329	41%	0.414	S	S	.	.	H	α-helix	trans	-56.6	-51.9	174.2	173.1	-91.8	0	0	0	111.4	E426 P432 E447 E448 R453 Q454 M455	E426-Y451 PolarHBondContact OE2-OH 2.86Å; P432-Y451 HydrophobicContact CB-CD1 3.73Å; P432-Y451 HydrophobicContact CB-CE1 3.8Å; P432-Y451 HydrophobicContact CG-CD1 4.19Å; E447-Y451 WeakPolarHBondContact O-CB 3.32Å; E447-Y451 PolarHBondContact O-N 3.38Å; E448-Y451 PolarHBondContact O-N 2.95Å; Y451-R453 VanDerWaalsContact C-N 3.26Å; Y451-R453 PolarHBondContact O-N 3.47Å; Y451-Q454 PolarHBondContact O-N 2.96Å; Y451-Q454 VanDerWaalsContact O-N 3.16Å; Y451-M455 HydrophobicContact CE1-CB 4.27Å; Y451-M455 VanDerWaalsContact O-CB 3.27Å; Y451-M455 WeakPolarHBondContact O-CB 3.37Å; Y451-M455 PolarHBondContact O-N 2.95Å
452	M	80.3	Confident	74.2	Confident	35 Å²	35	83.9 Å²	83.9	17%	0.172	41%	0.406	C	S	.	.	H	α-helix	trans	-60.9	-37.2	-179	-69.7	-61	-66.9	0	0	112	R431 E448 M455 A456	R431-M452 VanDerWaalsContact C-SD 3.52Å; E448-M452 VanDerWaalsContact O-CG 3.26Å; E448-M452 WeakPolarHBondContact O-CG 3.27Å; E448-M452 PolarHBondContact O-N 2.94Å; M452-M455 HydrophobicContact CE-CE 3.69Å; M452-M455 HydrophobicContact SD-CE 4.06Å; M452-A456 WeakPolarHBondContact O-CB 3.19Å; M452-A456 PolarHBondContact O-N 3.14Å
453	R	73.4	Confident	74.9	Confident	165 Å²	165	82.7 Å²	82.7	62%	0.623	40%	0.4	S	S	*	.	H	α-helix	trans	-66.1	-46.1	174.9	-73.4	174.1	-178.1	173.3	2	111.9	T449 A450 Y451 A456 V457	T449-R453 WeakPolarHBondContact O-CG 3.33Å; T449-R453 PolarHBondContact O-N 3.39Å; T449-R453 VanDerWaalsContact O-N 3.12Å; A450-R453 PolarHBondContact O-N 3.01Å; Y451-R453 VanDerWaalsContact C-N 3.26Å; Y451-R453 PolarHBondContact O-N 3.47Å; R453-A456 PolarHBondContact O-N 3.45Å; R453-V457 PolarHBondContact O-N 2.94Å
454	Q	73.3	Confident	75.3	Confident	123 Å²	123	79.2 Å²	79.2	58%	0.575	38%	0.382	S	S	*	.	H	α-helix	trans	-65.5	-40.1	177.5	-73.5	178.1	-2.3	0	0	111.7	A450 Y451 A456 V457 N458	A450-Q454 WeakPolarHBondContact O-CG 3.24Å; A450-Q454 PolarHBondContact O-N 2.75Å; Y451-Q454 PolarHBondContact O-N 2.96Å; Y451-Q454 VanDerWaalsContact O-N 3.16Å; Q454-A456 VanDerWaalsContact C-N 3.33Å; Q454-A456 PolarHBondContact O-N 3.34Å; Q454-V457 PolarHBondContact O-N 2.82Å; Q454-N458 VanDerWaalsContact O-CB 3.27Å; Q454-N458 WeakPolarHBondContact O-CB 3.45Å; Q454-N458 VanDerWaalsContact O-CG 3.24Å; Q454-N458 PolarHBondContact O-N 2.88Å; Q454-N458 PolarHBondContact O-ND2 3.14Å
455	M	80.1	Confident	75.9	Confident	13 Å²	13	82.4 Å²	82.4	6%	0.064	40%	0.395	C	S	.	.	H	α-helix	trans	-59.9	-44.5	175.1	-176.9	-81.8	-78.7	0	0	110.7	L423 Y451 M452 V457 N458 R459 I463	L423-M455 HydrophobicContact CD1-CE 4.03Å; L423-M455 HydrophobicContact CD1-CG 4.27Å; L423-M455 HydrophobicContact CD1-SD 3.42Å; L423-M455 WeakPolarHBondContact CD1-SD 3.4Å; Y451-M455 HydrophobicContact CE1-CB 4.27Å; Y451-M455 VanDerWaalsContact O-CB 3.27Å; Y451-M455 WeakPolarHBondContact O-CB 3.37Å; Y451-M455 PolarHBondContact O-N 2.95Å; M452-M455 HydrophobicContact CE-CE 3.69Å; M452-M455 HydrophobicContact SD-CE 4.06Å; M455-V457 VanDerWaalsContact C-N 3.32Å; M455-V457 PolarHBondContact O-N 2.78Å; M455-N458 PolarHBondContact O-N 3.41Å; M455-R459 HydrophobicContact CG-CG 4.45Å; M455-R459 WeakPolarHBondContact O-CA 3.41Å; M455-R459 VanDerWaalsContact O-CB 3.29Å; M455-R459 WeakPolarHBondContact O-CB 3.26Å; M455-R459 PolarHBondContact O-N 2.98Å; M455-I463 HydrophobicContact SD-CD1 3.68Å; M455-I463 HydrophobicContact SD-CG1 4.21Å
456	A	70.6	Confident	76.4	Confident	46 Å²	46	80.4 Å²	80.4	38%	0.38	38%	0.381	S	S	.	.	H	α-helix	trans	-60	-39	177	0	0	0	0	0	113.3	M452 R453 Q454	M452-A456 WeakPolarHBondContact O-CB 3.19Å; M452-A456 PolarHBondContact O-N 3.14Å; R453-A456 PolarHBondContact O-N 3.45Å; Q454-A456 VanDerWaalsContact C-N 3.33Å; Q454-A456 PolarHBondContact O-N 3.34Å
457	V	66.5	Low	77	Confident	77 Å²	77	69.2 Å²	69.2	47%	0.467	34%	0.339	S	S	.	.	H	α-helix	trans	-75.4	-50.4	178	175.9	0	0	0	0	111.2	R453 Q454 M455 R459	R453-V457 PolarHBondContact O-N 2.94Å; Q454-V457 PolarHBondContact O-N 2.82Å; M455-V457 VanDerWaalsContact C-N 3.32Å; M455-V457 PolarHBondContact O-N 2.78Å; V457-R459 PolarHBondContact O-N 3.08Å
458	N	73.8	Confident	77.4	Confident	120 Å²	120	69.9 Å²	69.9	64%	0.642	34%	0.34	S	S	*	.	H	α-helix	trans	-80.2	-20.1	-169.6	-63.3	-12.5	0	0	0	113.5	Q454 M455	Q454-N458 VanDerWaalsContact O-CB 3.27Å; Q454-N458 WeakPolarHBondContact O-CB 3.45Å; Q454-N458 VanDerWaalsContact O-CG 3.24Å; Q454-N458 PolarHBondContact O-N 2.88Å; Q454-N458 PolarHBondContact O-ND2 3.14Å; M455-N458 PolarHBondContact O-N 3.41Å
459	R	76.6	Confident	77.8	Confident	128 Å²	128	70.7 Å²	70.7	48%	0.483	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.9	22.8	-178.9	-57.8	-165.5	176.8	-137.9	0.4	112.9	M455 V457 E461 S462 I463	M455-R459 HydrophobicContact CG-CG 4.45Å; M455-R459 WeakPolarHBondContact O-CA 3.41Å; M455-R459 VanDerWaalsContact O-CB 3.29Å; M455-R459 WeakPolarHBondContact O-CB 3.26Å; M455-R459 PolarHBondContact O-N 2.98Å; V457-R459 PolarHBondContact O-N 3.08Å; R459-E461 VanDerWaalsContact C-N 3.32Å; R459-E461 PolarHBondContact O-N 3.35Å; R459-S462 PolarHBondContact O-N 3.21Å; R459-S462 VanDerWaalsContact O-N 3.13Å; R459-I463 HydrophobicContact CB-CG1 4.5Å; R459-I463 VanDerWaalsContact O-CG1 3.28Å; R459-I463 WeakPolarHBondContact O-CG1 3.37Å; R459-I463 PolarHBondContact O-N 3.42Å
460	F	72	Confident	78.6	Confident	66 Å²	66	69 Å²	69	29%	0.289	34%	0.34	S	S	.	.	H	α-helix	trans	-50.9	-48.5	-176.4	-176	-98.4	0	0	0	112.9	L155 S462 I463 M464	L155-F460 WeakPolarHBondContact O-CE2 3.37Å; L155-F460 WeakPolarHBondContact O-CZ 3.49Å; F460-S462 PolarHBondContact O-N 3.43Å; F460-I463 WeakPolarHBondContact O-CB 3.31Å; F460-I463 PolarHBondContact O-N 2.63Å; F460-M464 HydrophobicContact CD1-CG 4.09Å; F460-M464 HydrophobicContact CD2-CE 4.26Å; F460-M464 HydrophobicContact CE1-CG 3.69Å; F460-M464 HydrophobicContact CE1-SD 4.16Å; F460-M464 HydrophobicContact CE2-CE 3.9Å; F460-M464 HydrophobicContact CE2-SD 4.16Å; F460-M464 HydrophobicContact CZ-CE 4.12Å; F460-M464 HydrophobicContact CZ-CG 3.93Å; F460-M464 HydrophobicContact CZ-SD 3.75Å; F460-M464 WeakPolarHBondContact O-CG 3.47Å; F460-M464 PolarHBondContact O-N 3.04Å
461	E	72.7	Confident	79.4	Confident	147 Å²	147	68.2 Å²	68.2	69%	0.687	33%	0.33	S	S	*	.	H	α-helix	trans	-60.1	-46	178.3	-70.9	-62.5	150.9	0	0	112.9	R459 I463 M464 Q465	R459-E461 VanDerWaalsContact C-N 3.32Å; R459-E461 PolarHBondContact O-N 3.35Å; E461-I463 VanDerWaalsContact C-N 3.35Å; E461-I463 PolarHBondContact O-N 3.36Å; E461-M464 WeakPolarHBondContact O-CB 3.34Å; E461-M464 PolarHBondContact O-N 3.36Å; E461-Q465 PolarHBondContact O-N 3.46Å
462	S	80.9	Confident	79.4	Confident	33 Å²	33	69.1 Å²	69.1	23%	0.231	33%	0.333	C	S	.	.	H	α-helix	trans	-62.4	-40.7	175.3	-77.3	0	0	0	0	112.2	E420 R459 F460 M464 Q465 V466	E420-S462 WeakPolarHBondContact OE1-CB 3.32Å; E420-S462 PolarHBondContact OE1-OG 3.25Å; E420-S462 VanDerWaalsContact OE2-CB 3.28Å; E420-S462 WeakPolarHBondContact OE2-CB 3.37Å; E420-S462 PolarHBondContact OE2-OG 3.41Å; R459-S462 PolarHBondContact O-N 3.21Å; R459-S462 VanDerWaalsContact O-N 3.13Å; F460-S462 PolarHBondContact O-N 3.43Å; S462-M464 VanDerWaalsContact C-N 3.32Å; S462-M464 PolarHBondContact O-N 3.07Å; S462-Q465 WeakPolarHBondContact O-CB 3.46Å; S462-Q465 PolarHBondContact O-N 3.38Å; S462-V466 WeakPolarHBondContact O-CG2 3.29Å; S462-V466 PolarHBondContact O-N 2.93Å
463	I	82	Confident	79.8	Confident	9 Å²	9	68.7 Å²	68.7	5%	0.046	33%	0.333	C	S	.	.	H	α-helix	trans	-61	-44.3	174.4	-65.1	167.2	0	0	0	109.4	L423 M427 M455 R459 F460 E461 Q465 V466 L467	L423-I463 HydrophobicContact CD1-CG1 4.11Å; L423-I463 HydrophobicContact CD2-CG1 4Å; L423-I463 HydrophobicContact CG-CG1 4.45Å; M427-I463 HydrophobicContact CE-CG2 3.81Å; M427-I463 HydrophobicContact SD-CB 4.49Å; M427-I463 HydrophobicContact SD-CG1 4.27Å; M427-I463 HydrophobicContact SD-CG2 4.1Å; M455-I463 HydrophobicContact SD-CD1 3.68Å; M455-I463 HydrophobicContact SD-CG1 4.21Å; R459-I463 HydrophobicContact CB-CG1 4.5Å; R459-I463 VanDerWaalsContact O-CG1 3.28Å; R459-I463 WeakPolarHBondContact O-CG1 3.37Å; R459-I463 PolarHBondContact O-N 3.42Å; F460-I463 WeakPolarHBondContact O-CB 3.31Å; F460-I463 PolarHBondContact O-N 2.63Å; E461-I463 VanDerWaalsContact C-N 3.35Å; E461-I463 PolarHBondContact O-N 3.36Å; I463-Q465 VanDerWaalsContact C-N 3.3Å; I463-Q465 PolarHBondContact O-N 2.67Å; I463-V466 PolarHBondContact O-N 3.46Å; I463-L467 HydrophobicContact CG2-CD1 3.79Å; I463-L467 HydrophobicContact CG2-CG 4.47Å; I463-L467 WeakPolarHBondContact O-CD1 3.42Å; I463-L467 WeakPolarHBondContact O-CG 3.41Å; I463-L467 PolarHBondContact O-N 3.29Å
464	M	76.8	Confident	80.6	Confident	36 Å²	36	60.8 Å²	60.8	18%	0.177	30%	0.303	C	S	.	.	H	α-helix	trans	-62.7	-39.8	177.5	-67.4	-46.8	87.8	0	0	111.2	L155 F460 E461 S462 L467 K468	L155-M464 HydrophobicContact CB-SD 4.44Å; L155-M464 HydrophobicContact CD2-CE 3.58Å; L155-M464 HydrophobicContact CD2-SD 3.35Å; L155-M464 WeakPolarHBondContact CD2-SD 3.31Å; F460-M464 HydrophobicContact CD1-CG 4.09Å; F460-M464 HydrophobicContact CD2-CE 4.26Å; F460-M464 HydrophobicContact CE1-CG 3.69Å; F460-M464 HydrophobicContact CE1-SD 4.16Å; F460-M464 HydrophobicContact CE2-CE 3.9Å; F460-M464 HydrophobicContact CE2-SD 4.16Å; F460-M464 HydrophobicContact CZ-CE 4.12Å; F460-M464 HydrophobicContact CZ-CG 3.93Å; F460-M464 HydrophobicContact CZ-SD 3.75Å; F460-M464 WeakPolarHBondContact O-CG 3.47Å; F460-M464 PolarHBondContact O-N 3.04Å; E461-M464 WeakPolarHBondContact O-CB 3.34Å; E461-M464 PolarHBondContact O-N 3.36Å; S462-M464 VanDerWaalsContact C-N 3.32Å; S462-M464 PolarHBondContact O-N 3.07Å; M464-L467 HydrophobicContact CE-CD1 3.78Å; M464-L467 PolarHBondContact O-N 3.07Å; M464-K468 VanDerWaalsContact O-CB 3.25Å; M464-K468 WeakPolarHBondContact O-CB 3.45Å; M464-K468 PolarHBondContact O-N 3.5Å
465	Q	83.2	Confident	81.1	Confident	110 Å²	110	55.3 Å²	55.3	51%	0.514	28%	0.278	S	S	.	.	H	α-helix	trans	-64.3	-43.9	176.5	-175.3	173.5	-8.5	0	0	112	E461 S462 I463 K468 S469	E461-Q465 PolarHBondContact O-N 3.46Å; S462-Q465 WeakPolarHBondContact O-CB 3.46Å; S462-Q465 PolarHBondContact O-N 3.38Å; I463-Q465 VanDerWaalsContact C-N 3.3Å; I463-Q465 PolarHBondContact O-N 2.67Å; Q465-K468 PolarHBondContact O-N 3.01Å; Q465-S469 WeakPolarHBondContact O-CB 3.46Å; Q465-S469 PolarHBondContact O-N 3.14Å; Q465-S469 VanDerWaalsContact O-N 3.07Å; Q465-S469 PolarHBondContact O-OG 2.87Å
466	V	88	Confident	81.2	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.018	28%	0.279	C	S	.	.	H	α-helix	trans	-56.4	-52	174.3	165.2	0	0	0	0	110.5	V418 E420 L423 F424 M427 S462 I463 K468 S469 M470	V418-V466 HydrophobicContact CG1-CB 4.25Å; V418-V466 HydrophobicContact CG1-CG1 3.89Å; V418-V466 HydrophobicContact CG1-CG2 3.86Å; V418-V466 HydrophobicContact CG2-CG1 4.43Å; E420-V466 HydrophobicContact CB-CG2 3.93Å; L423-V466 HydrophobicContact CD2-CG2 4.05Å; L423-V466 HydrophobicContact CG-CG2 4.35Å; F424-V466 HydrophobicContact CB-CG1 4.11Å; F424-V466 HydrophobicContact CD2-CG1 3.72Å; F424-V466 HydrophobicContact CG-CG1 4.25Å; M427-V466 HydrophobicContact CE-CB 4.44Å; M427-V466 HydrophobicContact CE-CG1 3.88Å; M427-V466 HydrophobicContact SD-CB 4.19Å; M427-V466 HydrophobicContact SD-CG1 3.83Å; S462-V466 WeakPolarHBondContact O-CG2 3.29Å; S462-V466 PolarHBondContact O-N 2.93Å; I463-V466 PolarHBondContact O-N 3.46Å; V466-K468 VanDerWaalsContact C-N 3.3Å; V466-K468 PolarHBondContact O-N 3.26Å; V466-S469 PolarHBondContact O-N 3.01Å; V466-S469 VanDerWaalsContact O-N 3.14Å; V466-M470 PolarHBondContact O-N 2.91Å
467	L	84.5	Confident	82.1	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-67	-31.2	-175.9	-63	164.3	0	0	0	113.1	H154 L155 M427 I463 M464 M470 L475	H154-L467 WeakPolarHBondContact CD2-CD1 3.22Å; L155-L467 HydrophobicContact CD2-CB 4.31Å; L155-L467 HydrophobicContact CD2-CD1 3.18Å; L155-L467 HydrophobicContact CD2-CG 4.35Å; L155-L467 HydrophobicContact CG-CD1 4.11Å; M427-L467 HydrophobicContact CE-CD1 4.24Å; M427-L467 HydrophobicContact CE-CD2 3.54Å; M427-L467 HydrophobicContact CE-CG 3.77Å; I463-L467 HydrophobicContact CG2-CD1 3.79Å; I463-L467 HydrophobicContact CG2-CG 4.47Å; I463-L467 WeakPolarHBondContact O-CD1 3.42Å; I463-L467 WeakPolarHBondContact O-CG 3.41Å; I463-L467 PolarHBondContact O-N 3.29Å; M464-L467 HydrophobicContact CE-CD1 3.78Å; M464-L467 PolarHBondContact O-N 3.07Å; L467-M470 HydrophobicContact CB-CE 4.34Å; L467-M470 HydrophobicContact CD2-CE 3.42Å; L467-M470 VanDerWaalsContact CD2-CE 3.42Å; L467-M470 HydrophobicContact CD2-SD 4.18Å; L467-M470 HydrophobicContact CG-CE 4.45Å; L467-L475 HydrophobicContact CB-CD2 4.36Å; L467-L475 HydrophobicContact CD2-CD2 4.02Å
468	K	82.9	Confident	83	Confident	147 Å²	147	50.1 Å²	50.1	64%	0.639	24%	0.241	S	C	*	.	H	α-helix	trans	-73.3	-30.6	175.7	-175.2	179.9	177.3	-174.7	0	112.6	M464 Q465 V466	M464-K468 VanDerWaalsContact O-CB 3.25Å; M464-K468 WeakPolarHBondContact O-CB 3.45Å; M464-K468 PolarHBondContact O-N 3.5Å; Q465-K468 PolarHBondContact O-N 3.01Å; V466-K468 VanDerWaalsContact C-N 3.3Å; V466-K468 PolarHBondContact O-N 3.26Å
469	S	88.4	Confident	83.5	Confident	56 Å²	56	45.8 Å²	45.8	39%	0.392	22%	0.216	S	C	.	.	H	α-helix	trans	-86.4	-28.6	-172.4	-53.2	0	0	0	0	113.1	G417 Q465 V466	G417-S469 VanDerWaalsContact O-CB 3.27Å; G417-S469 WeakPolarHBondContact O-CB 3.41Å; Q465-S469 WeakPolarHBondContact O-CB 3.46Å; Q465-S469 PolarHBondContact O-N 3.14Å; Q465-S469 VanDerWaalsContact O-N 3.07Å; Q465-S469 PolarHBondContact O-OG 2.87Å; V466-S469 PolarHBondContact O-N 3.01Å; V466-S469 VanDerWaalsContact O-N 3.14Å
470	M	89.1	Confident	84.2	Confident	7 Å²	7	39.8 Å²	39.8	3%	0.034	19%	0.193	C	C	.	.	S	Bend	trans	-75.2	160.2	-178.5	69.8	-172.8	-168.9	0	0	113.9	L416 V418 F424 V466 L467 R472 M474 L475 F478	L416-M470 WeakPolarHBondContact O-CA 3.36Å; V418-M470 HydrophobicContact CG2-CB 3.67Å; F424-M470 HydrophobicContact CE2-SD 4.11Å; V466-M470 PolarHBondContact O-N 2.91Å; L467-M470 HydrophobicContact CB-CE 4.34Å; L467-M470 HydrophobicContact CD2-CE 3.42Å; L467-M470 VanDerWaalsContact CD2-CE 3.42Å; L467-M470 HydrophobicContact CD2-SD 4.18Å; L467-M470 HydrophobicContact CG-CE 4.45Å; M470-R472 PolarHBondContact O-N 3.08Å; M470-M474 HydrophobicContact CB-CB 4.48Å; M470-M474 HydrophobicContact CE-CB 4.05Å; M470-M474 HydrophobicContact CG-CB 4.1Å; M470-M474 HydrophobicContact SD-CB 3.83Å; M470-L475 HydrophobicContact CE-CB 4.3Å; M470-L475 HydrophobicContact CE-CD2 3.25Å; M470-L475 HydrophobicContact CE-CG 3.55Å; M470-F478 HydrophobicContact CE-CD2 3.78Å; M470-F478 HydrophobicContact CE-CE2 3.74Å; M470-F478 HydrophobicContact SD-CD2 4.21Å; M470-F478 HydrophobicContact SD-CE2 3.57Å; M470-F478 VanDerWaalsContact SD-CE2 3.57Å
471	P	90.3	Very high	85	Confident	26 Å²	26	36.7 Å²	36.7	17%	0.169	18%	0.179	C	C	.	.			trans	-53.5	137.5	171.6	-26.7	31.5	0	0	0	112.1	D390 L416 P473 M474	D390-P471 HydrophobicContact CB-CG 4.43Å; L416-P471 HydrophobicContact CD2-CG 4.21Å; L416-P471 WeakPolarHBondContact O-CD 3.42Å; P471-P473 VanDerWaalsContact C-CD 3.47Å; P471-M474 HydrophobicContact CB-CG 4.25Å; P471-M474 HydrophobicContact CG-CG 4.46Å; P471-M474 WeakPolarHBondContact O-CB 3.08Å; P471-M474 PolarHBondContact O-N 2.82Å
472	R	83.2	Confident	85.6	Confident	103 Å²	103	31.3 Å²	31.3	39%	0.389	16%	0.155	S	C	.	.	H	α-helix	trans	-53.1	-42.8	-178.8	-66	-74.8	167.6	-173.9	-12.2	113.8	D264 M470 M474 L475	D264-R472 IonicContact OD2-CZ 2.77Å; D264-R472 IonicContact OD2-NE 3.59Å; D264-R472 IonicContact OD2-NH1 2.82Å; D264-R472 PolarHBondContact OD2-NH1 3.07Å; M470-R472 PolarHBondContact O-N 3.08Å; R472-M474 PolarHBondContact O-N 2.66Å; R472-M474 VanDerWaalsContact O-N 3.1Å; R472-L475 WeakPolarHBondContact O-CB 3.5Å; R472-L475 PolarHBondContact O-N 3.49Å; R472-L475 VanDerWaalsContact O-N 3.11Å
473	P	87.9	Confident	85.9	Confident	26 Å²	26	30.6 Å²	30.6	17%	0.169	15%	0.15	C	C	.	.	H	α-helix	trans	-58.7	-24.6	177.6	-26.2	36.5	0	0	0	113.9	F385 L386 P471 L475 L476 V477	F385-P473 WeakPolarHBondContact O-CG 3.47Å; L386-P473 HydrophobicContact CD1-CB 4.07Å; P471-P473 VanDerWaalsContact C-CD 3.47Å; P473-L475 PolarHBondContact O-N 3.49Å; P473-L476 PolarHBondContact O-N 3.45Å; P473-L476 VanDerWaalsContact O-N 3.08Å; P473-V477 PolarHBondContact O-N 2.94Å
474	M	89.6	Confident	86.3	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.9	-30.6	177.7	-72.3	-61.8	-58.4	0	0	112.8	L386 L394 F424 L428 M470 P471 R472 L476 V477 F478	L386-M474 HydrophobicContact CD1-SD 4.16Å; L394-M474 HydrophobicContact CD1-CE 3.85Å; L394-M474 HydrophobicContact CD1-SD 4.46Å; L394-M474 HydrophobicContact CD2-CE 4.26Å; L394-M474 HydrophobicContact CD2-SD 4.04Å; F424-M474 HydrophobicContact CZ-CE 4.17Å; L428-M474 HydrophobicContact CD1-CE 4.04Å; M470-M474 HydrophobicContact CB-CB 4.48Å; M470-M474 HydrophobicContact CE-CB 4.05Å; M470-M474 HydrophobicContact CG-CB 4.1Å; M470-M474 HydrophobicContact SD-CB 3.83Å; P471-M474 HydrophobicContact CB-CG 4.25Å; P471-M474 HydrophobicContact CG-CG 4.46Å; P471-M474 WeakPolarHBondContact O-CB 3.08Å; P471-M474 PolarHBondContact O-N 2.82Å; R472-M474 PolarHBondContact O-N 2.66Å; R472-M474 VanDerWaalsContact O-N 3.1Å; M474-L476 PolarHBondContact O-N 3.35Å; M474-V477 HydrophobicContact CE-CB 4.23Å; M474-V477 HydrophobicContact CE-CG1 4.21Å; M474-V477 WeakPolarHBondContact O-CA 3.37Å; M474-V477 VanDerWaalsContact O-CB 3.32Å; M474-V477 WeakPolarHBondContact O-CB 3.22Å; M474-V477 PolarHBondContact O-N 3.37Å; M474-V477 HydrophobicContact SD-CB 4.28Å; M474-V477 HydrophobicContact SD-CG2 4.02Å; M474-F478 WeakPolarHBondContact O-CD2 3.49Å; M474-F478 PolarHBondContact O-N 3.3Å
475	L	83.8	Confident	86.9	Confident	8 Å²	8	31.3 Å²	31.3	4%	0.042	15%	0.15	C	C	.	.	H	α-helix	trans	-56.9	-38.2	175.4	-68.9	165.1	0	0	0	111.2	F152 W260 L467 M470 R472 P473 F478 R479	F152-L475 HydrophobicContact CE1-CB 4.21Å; F152-L475 HydrophobicContact CE1-CD1 4.12Å; F152-L475 HydrophobicContact CE1-CD2 4.17Å; F152-L475 HydrophobicContact CE1-CG 4.4Å; W260-L475 HydrophobicContact CZ3-CD1 4.11Å; L467-L475 HydrophobicContact CB-CD2 4.36Å; L467-L475 HydrophobicContact CD2-CD2 4.02Å; M470-L475 HydrophobicContact CE-CB 4.3Å; M470-L475 HydrophobicContact CE-CD2 3.25Å; M470-L475 HydrophobicContact CE-CG 3.55Å; R472-L475 WeakPolarHBondContact O-CB 3.5Å; R472-L475 PolarHBondContact O-N 3.49Å; R472-L475 VanDerWaalsContact O-N 3.11Å; P473-L475 PolarHBondContact O-N 3.49Å; L475-F478 WeakPolarHBondContact O-CB 3.48Å; L475-F478 PolarHBondContact O-N 3.08Å; L475-R479 PolarHBondContact O-N 3.24Å
476	L	82.1	Confident	87.1	Confident	17 Å²	17	28.6 Å²	28.6	9%	0.089	14%	0.144	C	C	.	.	H	α-helix	trans	-78.9	-27.4	177.3	-61.9	-163	0	0	0	112.7	A356 L382 E384 P473 M474 F478 R479 N480	A356-L476 HydrophobicContact CB-CB 3.63Å; A356-L476 HydrophobicContact CB-CD1 3.43Å; A356-L476 VanDerWaalsContact CB-CD1 3.43Å; A356-L476 HydrophobicContact CB-CD2 4.02Å; A356-L476 HydrophobicContact CB-CG 3.88Å; L382-L476 HydrophobicContact CD1-CD1 4.34Å; L382-L476 HydrophobicContact CD2-CD1 4.42Å; L382-L476 HydrophobicContact CG-CD1 4.3Å; E384-L476 HydrophobicContact CB-CD1 3.85Å; E384-L476 HydrophobicContact CG-CD1 3.17Å; E384-L476 HydrophobicContact CG-CG 4.26Å; P473-L476 PolarHBondContact O-N 3.45Å; P473-L476 VanDerWaalsContact O-N 3.08Å; M474-L476 PolarHBondContact O-N 3.35Å; L476-F478 VanDerWaalsContact C-N 3.34Å; L476-R479 PolarHBondContact O-N 3.49Å; L476-N480 WeakPolarHBondContact O-CB 3.28Å; L476-N480 PolarHBondContact O-N 3.2Å
477	V	89.4	Confident	87.2	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61	-45.1	168.3	-178	0	0	0	0	110.3	I348 I354 L394 P473 M474 R479 N480 I481	I348-V477 HydrophobicContact CD1-CG1 4.27Å; I348-V477 HydrophobicContact CG1-CG1 4.45Å; I348-V477 HydrophobicContact CG2-CG1 4.16Å; I354-V477 HydrophobicContact CD1-CG2 3.51Å; L394-V477 HydrophobicContact CD2-CG1 4.2Å; P473-V477 PolarHBondContact O-N 2.94Å; M474-V477 HydrophobicContact CE-CB 4.23Å; M474-V477 HydrophobicContact CE-CG1 4.21Å; M474-V477 WeakPolarHBondContact O-CA 3.37Å; M474-V477 VanDerWaalsContact O-CB 3.32Å; M474-V477 WeakPolarHBondContact O-CB 3.22Å; M474-V477 PolarHBondContact O-N 3.37Å; M474-V477 HydrophobicContact SD-CB 4.28Å; M474-V477 HydrophobicContact SD-CG2 4.02Å; V477-R479 VanDerWaalsContact C-N 3.34Å; V477-R479 PolarHBondContact O-N 3.08Å; V477-N480 PolarHBondContact O-N 3.46Å; V477-I481 HydrophobicContact CG1-CD1 3.62Å; V477-I481 HydrophobicContact CG1-CG1 4.31Å; V477-I481 WeakPolarHBondContact O-CB 3.45Å; V477-I481 WeakPolarHBondContact O-CD1 3.43Å; V477-I481 WeakPolarHBondContact O-CG1 3.48Å; V477-I481 PolarHBondContact O-N 3.37Å
478	F	86.8	Confident	87.5	Confident	9 Å²	9	28.6 Å²	28.6	4%	0.039	14%	0.143	C	C	.	.	H	α-helix	trans	-58.1	-45.7	174.2	-82.6	-78.5	0	0	0	112.4	F424 M427 L428 Q430 M470 M474 L475 L476 I481 N482	F424-F478 HydrophobicContact CD2-CZ 4.02Å; F424-F478 AromaticContact CE2-CE2 3.89Å; F424-F478 HydrophobicContact CE2-CE2 3.89Å; F424-F478 AromaticContact CE2-CZ 3.71Å; F424-F478 HydrophobicContact CE2-CZ 3.71Å; M427-F478 VanDerWaalsContact C-CE1 3.45Å; M427-F478 HydrophobicContact CB-CE1 3.75Å; M427-F478 HydrophobicContact CB-CZ 4.16Å; M427-F478 HydrophobicContact CE-CZ 4.5Å; M427-F478 WeakPolarHBondContact O-CE1 3.42Å; L428-F478 HydrophobicContact CB-CE1 4.26Å; L428-F478 HydrophobicContact CB-CZ 4.32Å; L428-F478 HydrophobicContact CD1-CE1 4.2Å; L428-F478 HydrophobicContact CD1-CE2 4.49Å; L428-F478 HydrophobicContact CD1-CZ 4.04Å; Q430-F478 PolarHBondContact NE2-O 3.48Å; M470-F478 HydrophobicContact CE-CD2 3.78Å; M470-F478 HydrophobicContact CE-CE2 3.74Å; M470-F478 HydrophobicContact SD-CD2 4.21Å; M470-F478 HydrophobicContact SD-CE2 3.57Å; M470-F478 VanDerWaalsContact SD-CE2 3.57Å; M474-F478 WeakPolarHBondContact O-CD2 3.49Å; M474-F478 PolarHBondContact O-N 3.3Å; L475-F478 WeakPolarHBondContact O-CB 3.48Å; L475-F478 PolarHBondContact O-N 3.08Å; L476-F478 VanDerWaalsContact C-N 3.34Å; F478-I481 PolarHBondContact O-N 2.92Å; F478-N482 WeakPolarHBondContact O-CB 3.37Å; F478-N482 PolarHBondContact O-N 3.4Å
479	R	83.9	Confident	87.8	Confident	30 Å²	30	25 Å²	25	11%	0.113	13%	0.131	C	C	.	.	H	α-helix	trans	-58.7	-50.9	176.6	-172.9	-176.7	178.9	162.9	1.6	110.9	A151 A356 D357 L475 L476 V477 I481 N482 T483	A151-R479 HydrophobicContact CB-CG 4.21Å; A356-R479 WeakPolarHBondContact O-CD 3.48Å; A356-R479 VanDerWaalsContact O-CG 3.26Å; A356-R479 WeakPolarHBondContact O-CG 3.46Å; D357-R479 VanDerWaalsContact CG-CZ 3.48Å; D357-R479 IonicContact OD1-CZ 3.67Å; D357-R479 IonicContact OD1-NE 2.64Å; D357-R479 PolarHBondContact OD1-NE 2.87Å; D357-R479 IonicContact OD1-NH2 3.11Å; D357-R479 PolarHBondContact OD1-NH2 3.04Å; D357-R479 IonicContact OD2-CZ 2.83Å; D357-R479 IonicContact OD2-NH2 2.98Å; D357-R479 PolarHBondContact OD2-NH2 2.92Å; L475-R479 PolarHBondContact O-N 3.24Å; L476-R479 PolarHBondContact O-N 3.49Å; V477-R479 VanDerWaalsContact C-N 3.34Å; V477-R479 PolarHBondContact O-N 3.08Å; R479-I481 PolarHBondContact O-N 3.27Å; R479-N482 WeakPolarHBondContact O-CB 3.44Å; R479-N482 PolarHBondContact O-N 3.41Å; R479-T483 PolarHBondContact O-N 3.24Å; R479-T483 PolarHBondContact O-OG1 3Å; R479-T483 VanDerWaalsContact O-OG1 3.07Å
480	N	90	Very high	87.8	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.011	13%	0.131	C	C	.	.	H	α-helix	trans	-56.5	-52	177.8	-179.5	-75.3	0	0	0	111.5	F344 I348 I354 H355 L476 V477 N482 T483 V484	F344-N480 WeakPolarHBondContact CD1-ND2 3.37Å; I348-N480 WeakPolarHBondContact CD1-OD1 3.34Å; I354-N480 HydrophobicContact CG2-CB 4.49Å; H355-N480 PolarHBondContact O-ND2 3.3Å; L476-N480 WeakPolarHBondContact O-CB 3.28Å; L476-N480 PolarHBondContact O-N 3.2Å; V477-N480 PolarHBondContact O-N 3.46Å; N480-N482 VanDerWaalsContact C-N 3.27Å; N480-N482 PolarHBondContact O-N 3.22Å; N480-T483 PolarHBondContact O-N 3.31Å; N480-T483 VanDerWaalsContact O-N 3.14Å; N480-V484 WeakPolarHBondContact O-CG2 3.5Å; N480-V484 PolarHBondContact O-N 3.17Å
481	I	89.7	Confident	87.8	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58	-42.3	179.7	-66.8	161.6	0	0	0	111	I348 W398 L428 V477 F478 R479 R485 M501	I348-I481 HydrophobicContact CD1-CG1 4.21Å; W398-I481 HydrophobicContact CH2-CD1 3.52Å; W398-I481 HydrophobicContact CH2-CG1 4.21Å; W398-I481 HydrophobicContact CZ3-CD1 3.75Å; L428-I481 HydrophobicContact CD1-CD1 3.87Å; V477-I481 HydrophobicContact CG1-CD1 3.62Å; V477-I481 HydrophobicContact CG1-CG1 4.31Å; V477-I481 WeakPolarHBondContact O-CB 3.45Å; V477-I481 WeakPolarHBondContact O-CD1 3.43Å; V477-I481 WeakPolarHBondContact O-CG1 3.48Å; V477-I481 PolarHBondContact O-N 3.37Å; F478-I481 PolarHBondContact O-N 2.92Å; R479-I481 PolarHBondContact O-N 3.27Å; I481-R485 VanDerWaalsContact O-CB 3.25Å; I481-R485 WeakPolarHBondContact O-CB 3.25Å; I481-R485 PolarHBondContact O-N 2.8Å; I481-M501 HydrophobicContact CD1-CE 4.4Å; I481-M501 HydrophobicContact CG1-CE 3.89Å
482	N	86	Confident	87.7	Confident	34 Å²	34	26.9 Å²	26.9	18%	0.182	15%	0.151	C	C	.	.	H	α-helix	trans	-61.8	-46.5	178	-171.6	48.2	0	0	0	111.7	N153 Q430 F478 R479 N480 R485 S486	N153-N482 PolarHBondContact ND2-ND2 2.9Å; Q430-N482 VanDerWaalsContact NE2-CA 3.27Å; Q430-N482 PolarHBondContact OE1-OD1 3.46Å; F478-N482 WeakPolarHBondContact O-CB 3.37Å; F478-N482 PolarHBondContact O-N 3.4Å; R479-N482 WeakPolarHBondContact O-CB 3.44Å; R479-N482 PolarHBondContact O-N 3.41Å; N480-N482 VanDerWaalsContact C-N 3.27Å; N480-N482 PolarHBondContact O-N 3.22Å; N482-R485 PolarHBondContact O-N 2.87Å; N482-R485 PolarHBondContact OD1-NH2 2.8Å; N482-S486 WeakPolarHBondContact O-CB 3.08Å; N482-S486 PolarHBondContact O-N 3.02Å
483	T	86.6	Confident	87.8	Confident	19 Å²	19	22.5 Å²	22.5	12%	0.117	14%	0.136	C	C	.	.	H	α-helix	trans	-66.9	-43.8	-178.8	-55.3	0	0	0	0	111.3	P358 R479 N480 R485 S486 I487	P358-T483 HydrophobicContact CB-CG2 4.5Å; P358-T483 HydrophobicContact CG-CG2 3.79Å; P358-T483 WeakPolarHBondContact O-CG2 3.3Å; R479-T483 PolarHBondContact O-N 3.24Å; R479-T483 PolarHBondContact O-OG1 3Å; R479-T483 VanDerWaalsContact O-OG1 3.07Å; N480-T483 PolarHBondContact O-N 3.31Å; N480-T483 VanDerWaalsContact O-N 3.14Å; T483-R485 VanDerWaalsContact C-N 3.34Å; T483-R485 PolarHBondContact O-N 3.34Å; T483-S486 PolarHBondContact O-N 3.49Å; T483-I487 HydrophobicContact CG2-CD1 4.1Å; T483-I487 WeakPolarHBondContact O-CG1 3.45Å; T483-I487 PolarHBondContact O-N 3.34Å
484	V	91.1	Very high	87.7	Confident	4 Å²	4	23.4 Å²	23.4	2%	0.024	14%	0.142	C	C	.	.	H	α-helix	trans	-60.8	-43.3	174.6	173.9	0	0	0	0	111.2	I341 F344 P358 N480 I487 N488	I341-V484 HydrophobicContact CB-CG1 4.47Å; I341-V484 HydrophobicContact CG1-CG1 3.79Å; F344-V484 HydrophobicContact CB-CG2 3.85Å; F344-V484 HydrophobicContact CD2-CG2 3.45Å; F344-V484 VanDerWaalsContact CD2-CG2 3.45Å; F344-V484 HydrophobicContact CE2-CG2 4.25Å; F344-V484 HydrophobicContact CG-CG2 3.77Å; P358-V484 HydrophobicContact CG-CG2 4.39Å; N480-V484 WeakPolarHBondContact O-CG2 3.5Å; N480-V484 PolarHBondContact O-N 3.17Å; V484-I487 PolarHBondContact O-N 3.32Å; V484-N488 WeakPolarHBondContact O-CB 3.25Å; V484-N488 PolarHBondContact O-N 3.45Å
485	R	89	Confident	87.5	Confident	56 Å²	56	23.9 Å²	23.9	21%	0.211	15%	0.145	C	C	.	.	H	α-helix	trans	-59.7	-48.3	174.1	180	-172.5	67.2	90	3.3	111	I481 N482 T483 I487 N488 I489	I481-R485 VanDerWaalsContact O-CB 3.25Å; I481-R485 WeakPolarHBondContact O-CB 3.25Å; I481-R485 PolarHBondContact O-N 2.8Å; N482-R485 PolarHBondContact O-N 2.87Å; N482-R485 PolarHBondContact OD1-NH2 2.8Å; T483-R485 VanDerWaalsContact C-N 3.34Å; T483-R485 PolarHBondContact O-N 3.34Å; R485-I487 PolarHBondContact O-N 3.1Å; R485-N488 PolarHBondContact O-N 3.49Å; R485-I489 HydrophobicContact CG-CD1 3.89Å; R485-I489 WeakPolarHBondContact O-CG1 3.36Å; R485-I489 PolarHBondContact O-N 3.17Å
486	S	87.3	Confident	87.6	Confident	53 Å²	53	26 Å²	26	37%	0.371	16%	0.156	S	C	.	.	H	α-helix	trans	-59.7	-45.1	-179.2	-168.3	0	0	0	0	111.5	N482 T483 I489 T490	N482-S486 WeakPolarHBondContact O-CB 3.08Å; N482-S486 PolarHBondContact O-N 3.02Å; T483-S486 PolarHBondContact O-N 3.49Å; S486-I489 PolarHBondContact O-N 3.45Å; S486-T490 PolarHBondContact O-N 3.1Å; S486-T490 PolarHBondContact O-OG1 2.82Å; S486-T490 VanDerWaalsContact O-OG1 3.09Å
487	I	90.2	Very high	87.9	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-63.6	-45.6	176.5	-65.3	164	0	0	0	111	I320 L340 P358 P360 T483 V484 R485 I489 T490 L491	I320-I487 HydrophobicContact CD1-CG2 3.79Å; I320-I487 HydrophobicContact CG1-CG2 3.81Å; I320-I487 HydrophobicContact CG2-CD1 4.23Å; I320-I487 HydrophobicContact CG2-CG1 4.4Å; I320-I487 HydrophobicContact CG2-CG2 4Å; L340-I487 HydrophobicContact CD2-CB 3.76Å; L340-I487 HydrophobicContact CD2-CD1 3.98Å; L340-I487 HydrophobicContact CD2-CG1 4.47Å; L340-I487 HydrophobicContact CD2-CG2 3.39Å; P358-I487 WeakPolarHBondContact O-CD1 3.32Å; P360-I487 HydrophobicContact CB-CD1 4.5Å; P360-I487 HydrophobicContact CB-CG1 4.28Å; P360-I487 HydrophobicContact CG-CD1 4.15Å; P360-I487 HydrophobicContact CG-CG1 3.76Å; T483-I487 HydrophobicContact CG2-CD1 4.1Å; T483-I487 WeakPolarHBondContact O-CG1 3.45Å; T483-I487 PolarHBondContact O-N 3.34Å; V484-I487 PolarHBondContact O-N 3.32Å; R485-I487 PolarHBondContact O-N 3.1Å; I487-I489 VanDerWaalsContact C-N 3.29Å; I487-I489 PolarHBondContact O-N 3.09Å; I487-T490 WeakPolarHBondContact O-CB 3.48Å; I487-T490 PolarHBondContact O-N 3.43Å; I487-T490 VanDerWaalsContact O-N 3.16Å; I487-L491 HydrophobicContact CG2-CD1 4Å; I487-L491 HydrophobicContact CG2-CG 4.38Å; I487-L491 WeakPolarHBondContact O-CG 3.34Å; I487-L491 PolarHBondContact O-N 2.87Å
488	N	91.4	Very high	87.8	Confident	3 Å²	3	25.6 Å²	25.6	2%	0.016	15%	0.154	C	C	.	.	H	α-helix	trans	-58.8	-41.5	177.5	-170.5	40.7	0	0	0	111.5	V484 R485 L491 G492 A493 V495	V484-N488 WeakPolarHBondContact O-CB 3.25Å; V484-N488 PolarHBondContact O-N 3.45Å; R485-N488 PolarHBondContact O-N 3.49Å; N488-L491 PolarHBondContact O-N 3.37Å; N488-G492 PolarHBondContact O-N 2.9Å; N488-A493 WeakPolarHBondContact O-CA 3.35Å; N488-A493 PolarHBondContact O-N 3.28Å; N488-V495 PolarHBondContact ND2-O 3.4Å
489	I	87.6	Confident	87.5	Confident	72 Å²	72	27.5 Å²	27.5	37%	0.369	16%	0.162	S	C	.	.	H	α-helix	trans	-62.2	-46.8	175.1	-70.2	169.2	0	0	0	111	R485 S486 I487 L491 G492	R485-I489 HydrophobicContact CG-CD1 3.89Å; R485-I489 WeakPolarHBondContact O-CG1 3.36Å; R485-I489 PolarHBondContact O-N 3.17Å; S486-I489 PolarHBondContact O-N 3.45Å; I487-I489 VanDerWaalsContact C-N 3.29Å; I487-I489 PolarHBondContact O-N 3.09Å; I489-L491 PolarHBondContact O-N 3.01Å; I489-G492 WeakPolarHBondContact O-CA 3.41Å; I489-G492 PolarHBondContact O-N 3.47Å
490	T	88.3	Confident	87.7	Confident	67 Å²	67	26.8 Å²	26.8	41%	0.411	16%	0.161	S	C	.	.	H	α-helix	trans	-58.2	-35.4	176.8	-61.4	0	0	0	0	112.2	N321 V323 S486 I487 G492	N321-T490 HydrophobicContact CB-CG2 4.07Å; V323-T490 HydrophobicContact CG2-CG2 4.31Å; V323-T490 WeakPolarHBondContact CG2-O 3.23Å; S486-T490 PolarHBondContact O-N 3.1Å; S486-T490 PolarHBondContact O-OG1 2.82Å; S486-T490 VanDerWaalsContact O-OG1 3.09Å; I487-T490 WeakPolarHBondContact O-CB 3.48Å; I487-T490 PolarHBondContact O-N 3.43Å; I487-T490 VanDerWaalsContact O-N 3.16Å; T490-G492 PolarHBondContact O-N 3.45Å
491	L	90.4	Very high	87.7	Confident	5 Å²	5	27 Å²	27	3%	0.026	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	0.6	175	-65.2	173.7	0	0	0	113.8	I320 V323 I326 L333 T336 A337 I487 N488 I489	I320-L491 HydrophobicContact CG1-CD1 4.37Å; I320-L491 WeakPolarHBondContact O-CD2 3.39Å; V323-L491 HydrophobicContact CG2-CD2 4.35Å; I326-L491 HydrophobicContact CD1-CD2 4.18Å; L333-L491 HydrophobicContact CD2-CD2 3.9Å; T336-L491 HydrophobicContact CG2-CD1 4.17Å; A337-L491 HydrophobicContact CB-CD1 3.82Å; I487-L491 HydrophobicContact CG2-CD1 4Å; I487-L491 HydrophobicContact CG2-CG 4.38Å; I487-L491 WeakPolarHBondContact O-CG 3.34Å; I487-L491 PolarHBondContact O-N 2.87Å; N488-L491 PolarHBondContact O-N 3.37Å; I489-L491 PolarHBondContact O-N 3.01Å
492	G	87.2	Confident	87.5	Confident	56 Å²	56	27 Å²	27	58%	0.577	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.2	19.5	-178.7	0	0	0	0	0	114.5	N488 I489 T490 P494	N488-G492 PolarHBondContact O-N 2.9Å; I489-G492 WeakPolarHBondContact O-CA 3.41Å; I489-G492 PolarHBondContact O-N 3.47Å; T490-G492 PolarHBondContact O-N 3.45Å; G492-P494 VanDerWaalsContact C-CD 3.41Å
493	A	85.8	Confident	87.4	Confident	11 Å²	11	28.5 Å²	28.5	9%	0.091	17%	0.167	C	C	.	.	S	Bend	trans	49.5	44.6	-177.8	0	0	0	0	0	115.6	N442 I443 N488 V495	N442-A493 HydrophobicContact CB-CB 3.82Å; N442-A493 PolarHBondContact ND2-O 2.99Å; I443-A493 HydrophobicContact CD1-CB 3.91Å; I443-A493 HydrophobicContact CG1-CB 3.59Å; N488-A493 WeakPolarHBondContact O-CA 3.35Å; N488-A493 PolarHBondContact O-N 3.28Å; A493-V495 PolarHBondContact O-N 3.47Å; A493-V495 VanDerWaalsContact O-N 3.17Å
494	P	85	Confident	87.6	Confident	45 Å²	45	28 Å²	28	29%	0.292	17%	0.165	S	C	.	.			trans	-73.5	-8.3	-171.2	32.6	-38.3	0	0	0	114.5	K334 A337 G492	K334-P494 HydrophobicContact CB-CB 3.94Å; K334-P494 HydrophobicContact CB-CG 4.4Å; K334-P494 HydrophobicContact CG-CB 4.19Å; A337-P494 HydrophobicContact CB-CG 3.82Å; G492-P494 VanDerWaalsContact C-CD 3.41Å
495	V	86.4	Confident	87.6	Confident	10 Å²	10	27.9 Å²	27.9	6%	0.061	16%	0.163	C	C	.	.	S	Bend	trans	-128.7	132.7	-174.7	178.3	0	0	0	0	111.1	K334 A337 D338 I341 N442 N488 A493 R497 V500	K334-V495 HydrophobicContact CG-CG2 3.82Å; K334-V495 WeakPolarHBondContact O-CG2 3.39Å; A337-V495 HydrophobicContact CB-CB 4.29Å; A337-V495 HydrophobicContact CB-CG2 3.81Å; D338-V495 HydrophobicContact CB-CG2 4.05Å; I341-V495 HydrophobicContact CD1-CB 3.9Å; I341-V495 HydrophobicContact CD1-CG1 3.67Å; N442-V495 PolarHBondContact ND2-O 3.37Å; N442-V495 PolarHBondContact OD1-O 3.32Å; N488-V495 PolarHBondContact ND2-O 3.4Å; A493-V495 PolarHBondContact O-N 3.47Å; A493-V495 VanDerWaalsContact O-N 3.17Å; V495-R497 PolarHBondContact O-N 3.07Å; V495-V500 HydrophobicContact CG1-CG2 3.8Å
496	D	85.9	Confident	87.5	Confident	52 Å²	52	25.3 Å²	25.3	28%	0.278	15%	0.154	S	C	.	.			trans	-66.8	93	168.6	-170.4	-23.4	0	0	0	111.3	N442 Y498 F499 V500	N442-D496 VanDerWaalsContact ND2-CA 3.34Å; N442-D496 WeakPolarHBondContact ND2-CA 3.36Å; N442-D496 PolarHBondContact ND2-N 3Å; N442-D496 VanDerWaalsContact OD1-CA 3.23Å; N442-D496 WeakPolarHBondContact OD1-CA 3.36Å; D496-Y498 VanDerWaalsContact C-N 3.31Å; D496-Y498 PolarHBondContact O-N 2.98Å; D496-Y498 PolarHBondContact OD1-N 3.17Å; D496-Y498 VanDerWaalsContact OD1-N 3.09Å; D496-F499 HydrophobicContact CB-CB 3.92Å; D496-F499 VanDerWaalsContact CG-CB 3.48Å; D496-F499 PolarHBondContact O-N 3.25Å; D496-F499 PolarHBondContact OD1-N 2.86Å; D496-V500 WeakPolarHBondContact O-CG2 3.34Å; D496-V500 PolarHBondContact O-N 2.66Å; D496-V500 VanDerWaalsContact O-N 3.1Å
497	R	88.7	Confident	87.4	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-65.9	-36.1	-177	72.5	179.5	-177.9	102.2	-2.9	111.8	I341 L429 N442 V495 F499 V500 M501	I341-R497 HydrophobicContact CD1-CB 3.81Å; I341-R497 HydrophobicContact CG1-CB 4.35Å; I341-R497 HydrophobicContact CG2-CB 4.34Å; L429-R497 PolarHBondContact O-NH2 2.86Å; N442-R497 PolarHBondContact OD1-N 2.94Å; V495-R497 PolarHBondContact O-N 3.07Å; R497-F499 VanDerWaalsContact C-N 3.32Å; R497-F499 PolarHBondContact O-N 3.41Å; R497-V500 PolarHBondContact O-N 3.34Å; R497-M501 VanDerWaalsContact O-CB 3.25Å; R497-M501 WeakPolarHBondContact O-CB 3.46Å; R497-M501 WeakPolarHBondContact O-CG 2.93Å; R497-M501 PolarHBondContact O-N 3.41Å
498	Y	86.2	Confident	87.2	Confident	6 Å²	6	28.6 Å²	28.6	2%	0.024	16%	0.158	C	C	.	.	H	α-helix	trans	-66.3	-42.6	-177.9	-55.2	-73.1	0	0	0	109.9	L429 R431 L440 S441 D496 A502	L429-Y498 HydrophobicContact CB-CE1 4.04Å; L429-Y498 HydrophobicContact CD2-CD1 3.71Å; L429-Y498 HydrophobicContact CD2-CE1 3.94Å; L429-Y498 WeakPolarHBondContact O-CE1 3.33Å; L429-Y498 PolarHBondContact O-OH 3.04Å; R431-Y498 VanDerWaalsContact CD-CZ 3.49Å; R431-Y498 VanDerWaalsContact CD-OH 3.25Å; R431-Y498 WeakPolarHBondContact CD-OH 3.2Å; R431-Y498 HydrophobicContact CG-CE1 4.47Å; L440-Y498 HydrophobicContact CB-CD2 3.46Å; L440-Y498 VanDerWaalsContact CB-CD2 3.46Å; L440-Y498 HydrophobicContact CB-CE2 3.94Å; L440-Y498 HydrophobicContact CB-CG 3.96Å; L440-Y498 HydrophobicContact CD1-CD1 4.18Å; L440-Y498 HydrophobicContact CD1-CD2 4.15Å; L440-Y498 HydrophobicContact CD1-CG 3.74Å; L440-Y498 HydrophobicContact CG-CD2 4.41Å; L440-Y498 HydrophobicContact CG-CG 4.48Å; S441-Y498 WeakPolarHBondContact O-CE2 3.39Å; D496-Y498 VanDerWaalsContact C-N 3.31Å; D496-Y498 PolarHBondContact O-N 2.98Å; D496-Y498 PolarHBondContact OD1-N 3.17Å; D496-Y498 VanDerWaalsContact OD1-N 3.09Å; Y498-A502 WeakPolarHBondContact O-CB 3.42Å; Y498-A502 PolarHBondContact O-N 3.11Å
499	F	81.3	Confident	87	Confident	50 Å²	50	30.1 Å²	30.1	22%	0.219	16%	0.164	C	C	.	.	H	α-helix	trans	-61.2	-50.7	175	177.2	-115.9	0	0	0	112.6	D496 R497 M501 A502 K503 L542	D496-F499 HydrophobicContact CB-CB 3.92Å; D496-F499 VanDerWaalsContact CG-CB 3.48Å; D496-F499 PolarHBondContact O-N 3.25Å; D496-F499 PolarHBondContact OD1-N 2.86Å; R497-F499 VanDerWaalsContact C-N 3.32Å; R497-F499 PolarHBondContact O-N 3.41Å; F499-M501 VanDerWaalsContact C-N 3.34Å; F499-M501 PolarHBondContact O-N 3.44Å; F499-A502 PolarHBondContact O-N 3.24Å; F499-K503 WeakPolarHBondContact O-CB 3.25Å; F499-K503 PolarHBondContact O-N 3.26Å; F499-L542 HydrophobicContact CD2-CD2 3.09Å; F499-L542 HydrophobicContact CE2-CD2 3.39Å; F499-L542 HydrophobicContact CG-CD2 4.16Å
500	V	87.2	Confident	86.7	Confident	14 Å²	14	27 Å²	27	9%	0.085	15%	0.149	C	C	.	.	H	α-helix	trans	-61.5	-45.8	-178.9	175.1	0	0	0	0	110.4	I341 R342 V495 D496 R497 K503 S504	I341-V500 HydrophobicContact CB-CG1 4.24Å; I341-V500 HydrophobicContact CG2-CB 3.82Å; I341-V500 HydrophobicContact CG2-CG1 3.59Å; R342-V500 HydrophobicContact CG-CG1 3.72Å; V495-V500 HydrophobicContact CG1-CG2 3.8Å; D496-V500 WeakPolarHBondContact O-CG2 3.34Å; D496-V500 PolarHBondContact O-N 2.66Å; D496-V500 VanDerWaalsContact O-N 3.1Å; R497-V500 PolarHBondContact O-N 3.34Å; V500-K503 PolarHBondContact O-N 2.94Å; V500-S504 PolarHBondContact O-N 3.03Å; V500-S504 PolarHBondContact O-OG 3.46Å
501	M	91	Very high	86.4	Confident	6 Å²	6	26.2 Å²	26.2	3%	0.03	14%	0.14	C	C	.	.	H	α-helix	trans	-63	-43.7	177.4	-71.8	-178.8	79.8	0	0	112.2	I341 A345 I348 F349 W398 I481 R497 F499 K503 S504 A505	I341-M501 HydrophobicContact CG2-CG 4.01Å; A345-M501 HydrophobicContact CB-CG 4.19Å; I348-M501 HydrophobicContact CD1-CE 4.28Å; F349-M501 HydrophobicContact CE2-CB 3.84Å; F349-M501 HydrophobicContact CE2-CE 3.85Å; F349-M501 HydrophobicContact CE2-CG 4.3Å; F349-M501 WeakPolarHBondContact CE2-O 3.09Å; F349-M501 HydrophobicContact CZ-CB 4.35Å; F349-M501 HydrophobicContact CZ-CE 3.99Å; W398-M501 HydrophobicContact CH2-CE 3.53Å; W398-M501 HydrophobicContact CH2-SD 4.32Å; W398-M501 HydrophobicContact CZ2-CB 4.29Å; W398-M501 HydrophobicContact CZ2-CE 3.46Å; W398-M501 VanDerWaalsContact CZ2-CE 3.46Å; W398-M501 HydrophobicContact CZ2-SD 3.75Å; W398-M501 HydrophobicContact CZ3-CE 4.24Å; I481-M501 HydrophobicContact CD1-CE 4.4Å; I481-M501 HydrophobicContact CG1-CE 3.89Å; R497-M501 VanDerWaalsContact O-CB 3.25Å; R497-M501 WeakPolarHBondContact O-CB 3.46Å; R497-M501 WeakPolarHBondContact O-CG 2.93Å; R497-M501 PolarHBondContact O-N 3.41Å; F499-M501 VanDerWaalsContact C-N 3.34Å; F499-M501 PolarHBondContact O-N 3.44Å; M501-K503 VanDerWaalsContact C-N 3.33Å; M501-K503 PolarHBondContact O-N 3.34Å; M501-S504 CarbonylContact O-C 3.59Å; M501-S504 WeakPolarHBondContact O-CB 3.48Å; M501-S504 PolarHBondContact O-N 3.34Å; M501-S504 VanDerWaalsContact O-N 3.17Å; M501-A505 WeakPolarHBondContact O-CB 3.48Å; M501-A505 PolarHBondContact O-N 2.84Å
502	A	85.5	Confident	86.1	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-65.5	-37.2	178	0	0	0	0	0	112.3	V402 Y498 F499 S504 A505 V506 F538	V402-A502 HydrophobicContact CB-CB 4.4Å; V402-A502 HydrophobicContact CG1-CB 4.49Å; V402-A502 HydrophobicContact CG2-CB 3.86Å; Y498-A502 WeakPolarHBondContact O-CB 3.42Å; Y498-A502 PolarHBondContact O-N 3.11Å; F499-A502 PolarHBondContact O-N 3.24Å; A502-S504 VanDerWaalsContact C-N 3.32Å; A502-S504 PolarHBondContact O-N 2.91Å; A502-A505 WeakPolarHBondContact O-CB 3.43Å; A502-A505 PolarHBondContact O-N 3.26Å; A502-V506 WeakPolarHBondContact O-CG2 3.43Å; A502-V506 PolarHBondContact O-N 3.49Å; A502-F538 HydrophobicContact CB-CE1 4.11Å; A502-F538 HydrophobicContact CB-CE2 4.49Å; A502-F538 HydrophobicContact CB-CZ 3.55Å
503	K	84.3	Confident	85.7	Confident	66 Å²	66	25.3 Å²	25.3	29%	0.287	12%	0.12	S	C	.	.	H	α-helix	trans	-61.9	-41.7	172.5	-173.7	-177.3	-179.7	-175.9	0	111.4	F499 V500 M501 R507	F499-K503 WeakPolarHBondContact O-CB 3.25Å; F499-K503 PolarHBondContact O-N 3.26Å; V500-K503 PolarHBondContact O-N 2.94Å; M501-K503 VanDerWaalsContact C-N 3.33Å; M501-K503 PolarHBondContact O-N 3.34Å; K503-R507 WeakPolarHBondContact O-CG 3.37Å; K503-R507 PolarHBondContact O-N 2.89Å
504	S	90.3	Very high	85.1	Confident	10 Å²	10	26.1 Å²	26.1	7%	0.07	13%	0.127	C	C	.	.	H	α-helix	trans	-66.7	-39.8	173.9	-65.3	0	0	0	0	112.1	V500 M501 A502 V506 R507 G508	V500-S504 PolarHBondContact O-N 3.03Å; V500-S504 PolarHBondContact O-OG 3.46Å; M501-S504 CarbonylContact O-C 3.59Å; M501-S504 WeakPolarHBondContact O-CB 3.48Å; M501-S504 PolarHBondContact O-N 3.34Å; M501-S504 VanDerWaalsContact O-N 3.17Å; A502-S504 VanDerWaalsContact C-N 3.32Å; A502-S504 PolarHBondContact O-N 2.91Å; S504-V506 PolarHBondContact O-N 3.41Å; S504-R507 PolarHBondContact O-N 3.36Å; S504-G508 PolarHBondContact O-N 2.95Å
505	A	90.6	Very high	84.8	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58.3	-46.1	175	0	0	0	0	0	112.5	F349 C395 W398 M501 A502 R507 G508 W509	F349-A505 HydrophobicContact CD1-CB 3.68Å; F349-A505 HydrophobicContact CD2-CB 4.29Å; F349-A505 HydrophobicContact CE1-CB 3.84Å; F349-A505 HydrophobicContact CE2-CB 4.47Å; F349-A505 HydrophobicContact CG-CB 3.92Å; F349-A505 HydrophobicContact CZ-CB 4.26Å; C395-A505 HydrophobicContact CB-CB 4.32Å; C395-A505 WeakPolarHBondContact CB-O 3.44Å; C395-A505 PolarHBondContact SG-O 3.27Å; W398-A505 HydrophobicContact CB-CB 3.98Å; W398-A505 HydrophobicContact CG-CB 4.49Å; M501-A505 WeakPolarHBondContact O-CB 3.48Å; M501-A505 PolarHBondContact O-N 2.84Å; A502-A505 WeakPolarHBondContact O-CB 3.43Å; A502-A505 PolarHBondContact O-N 3.26Å; A505-R507 VanDerWaalsContact C-N 3.34Å; A505-R507 PolarHBondContact O-N 3.07Å; A505-G508 PolarHBondContact O-N 2.63Å; A505-W509 WeakPolarHBondContact O-CB 3.27Å; A505-W509 PolarHBondContact O-N 2.93Å
506	V	86.6	Confident	84.3	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.018	16%	0.156	C	C	.	.	H	α-helix	trans	-63.8	-40.2	176.9	175.1	0	0	0	0	111.6	R399 A502 S504 G510 F538	R399-V506 HydrophobicContact CB-CG2 4.45Å; R399-V506 HydrophobicContact CG-CG2 4.29Å; A502-V506 WeakPolarHBondContact O-CG2 3.43Å; A502-V506 PolarHBondContact O-N 3.49Å; S504-V506 PolarHBondContact O-N 3.41Å; V506-G510 PolarHBondContact O-N 3.08Å; V506-F538 HydrophobicContact CG2-CB 4.45Å; V506-F538 HydrophobicContact CG2-CD1 4.03Å; V506-F538 HydrophobicContact CG2-CD2 4.24Å; V506-F538 HydrophobicContact CG2-CE1 4.39Å; V506-F538 HydrophobicContact CG2-CG 3.97Å
507	R	85.6	Confident	83.4	Confident	123 Å²	123	33.5 Å²	33.5	46%	0.464	16%	0.157	S	C	.	.	H	α-helix	trans	-65.8	-45	175.7	-73.4	173.2	170.7	-166.9	-7.1	112.3	K503 S504 A505 G510 K511	K503-R507 WeakPolarHBondContact O-CG 3.37Å; K503-R507 PolarHBondContact O-N 2.89Å; S504-R507 PolarHBondContact O-N 3.36Å; A505-R507 VanDerWaalsContact C-N 3.34Å; A505-R507 PolarHBondContact O-N 3.07Å; R507-G510 PolarHBondContact O-N 2.94Å; R507-K511 PolarHBondContact O-N 2.9Å; R507-K511 VanDerWaalsContact O-N 3.08Å
508	G	86.2	Confident	81.6	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.8	-47.1	177.1	0	0	0	0	0	112.1	F349 S504 A505 G510 K511 I512	F349-G508 WeakPolarHBondContact O-CA 3.37Å; S504-G508 PolarHBondContact O-N 2.95Å; A505-G508 PolarHBondContact O-N 2.63Å; G508-G510 VanDerWaalsContact C-N 3.32Å; G508-G510 PolarHBondContact O-N 3.29Å; G508-K511 PolarHBondContact O-N 3.41Å; G508-I512 WeakPolarHBondContact O-CG1 3.43Å; G508-I512 PolarHBondContact O-N 3.36Å; G508-I512 VanDerWaalsContact O-N 3.14Å
509	W	86.1	Confident	80.2	Confident	35 Å²	35	42.9 Å²	42.9	13%	0.133	22%	0.218	C	C	.	.	H	α-helix	trans	-58.8	-43.1	173.9	179.3	41.8	0	0	0	112.8	C395 K396 A505 K511 I512 Q513 E534	C395-W509 HydrophobicContact CB-CB 3.93Å; K396-W509 HydrophobicContact CG-CD2 4.37Å; K396-W509 HydrophobicContact CG-CG 4.39Å; A505-W509 WeakPolarHBondContact O-CB 3.27Å; A505-W509 PolarHBondContact O-N 2.93Å; W509-K511 VanDerWaalsContact C-N 3.33Å; W509-K511 PolarHBondContact O-N 2.96Å; W509-I512 PolarHBondContact O-N 3.19Å; W509-Q513 VanDerWaalsContact NE1-NE2 3.1Å; W509-Q513 PolarHBondContact O-N 2.97Å; W509-E534 HydrophobicContact CZ3-CB 4.42Å; W509-E534 HydrophobicContact CZ3-CG 4.31Å
510	G	81.3	Confident	79	Confident	5 Å²	5	45.1 Å²	45.1	5%	0.052	23%	0.232	C	C	.	.	H	α-helix	trans	-56.3	-43.1	175.5	0	0	0	0	0	114.2	V506 R507 G508 Q513 A514	V506-G510 PolarHBondContact O-N 3.08Å; R507-G510 PolarHBondContact O-N 2.94Å; G508-G510 VanDerWaalsContact C-N 3.32Å; G508-G510 PolarHBondContact O-N 3.29Å; G510-Q513 PolarHBondContact O-N 3.23Å; G510-A514 WeakPolarHBondContact O-CB 3.44Å; G510-A514 PolarHBondContact O-N 2.92Å
511	K	82.9	Confident	77.6	Confident	52 Å²	52	49.6 Å²	49.6	23%	0.226	26%	0.261	C	S	.	.	H	α-helix	trans	-62.1	-50.2	174.5	168.6	175.3	168.2	-164.8	0	111.8	Y350 R507 G508 W509 Q513 A514 E515	Y350-K511 HydrophobicContact CD1-CD 3.97Å; Y350-K511 HydrophobicContact CD2-CB 4.29Å; Y350-K511 HydrophobicContact CD2-CD 3.93Å; Y350-K511 HydrophobicContact CE1-CD 3.47Å; Y350-K511 VanDerWaalsContact CE1-CD 3.47Å; Y350-K511 HydrophobicContact CE2-CB 3.78Å; Y350-K511 HydrophobicContact CE2-CD 3.42Å; Y350-K511 VanDerWaalsContact CE2-CD 3.42Å; Y350-K511 HydrophobicContact CE2-CG 4.22Å; Y350-K511 HydrophobicContact CG-CD 4.19Å; Y350-K511 PolarHBondContact O-NZ 3.35Å; Y350-K511 WeakPolarHBondContact OH-CD 3.35Å; R507-K511 PolarHBondContact O-N 2.9Å; R507-K511 VanDerWaalsContact O-N 3.08Å; G508-K511 PolarHBondContact O-N 3.41Å; W509-K511 VanDerWaalsContact C-N 3.33Å; W509-K511 PolarHBondContact O-N 2.96Å; K511-Q513 PolarHBondContact O-N 3.4Å; K511-A514 WeakPolarHBondContact O-CB 3.37Å; K511-A514 PolarHBondContact O-N 3.31Å; K511-E515 WeakPolarHBondContact CE-OE1 3.4Å; K511-E515 HydrophobicContact CG-CG 4.33Å; K511-E515 WeakPolarHBondContact O-CG 3.2Å; K511-E515 PolarHBondContact O-N 2.84Å
512	I	84.1	Confident	76.1	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-57	-42.5	-179.1	-64.8	166.8	0	0	0	110.1	E388 R391 E392 G508 W509 E515 K516	E388-I512 HydrophobicContact CG-CD1 4.48Å; E388-I512 HydrophobicContact CG-CG1 4.31Å; E388-I512 HydrophobicContact CG-CG2 3.94Å; R391-I512 HydrophobicContact CG-CD1 4.31Å; E392-I512 HydrophobicContact CB-CD1 4.06Å; E392-I512 HydrophobicContact CB-CG2 4.38Å; E392-I512 HydrophobicContact CG-CG2 4.48Å; G508-I512 WeakPolarHBondContact O-CG1 3.43Å; G508-I512 PolarHBondContact O-N 3.36Å; G508-I512 VanDerWaalsContact O-N 3.14Å; W509-I512 PolarHBondContact O-N 3.19Å; I512-E515 PolarHBondContact O-N 3.33Å; I512-K516 HydrophobicContact CG2-CD 4.23Å; I512-K516 WeakPolarHBondContact O-CG 3.43Å; I512-K516 PolarHBondContact O-N 2.82Å
513	Q	78.9	Confident	75	Confident	40 Å²	40	63.2 Å²	63.2	19%	0.187	32%	0.318	C	S	.	.	H	α-helix	trans	-63.2	-44.3	174.4	-73.2	-165.2	8.4	0	0	113	W509 G510 K511 E515 K516 T517	W509-Q513 VanDerWaalsContact NE1-NE2 3.1Å; W509-Q513 PolarHBondContact O-N 2.97Å; G510-Q513 PolarHBondContact O-N 3.23Å; K511-Q513 PolarHBondContact O-N 3.4Å; Q513-E515 VanDerWaalsContact C-N 3.3Å; Q513-E515 PolarHBondContact O-N 3.03Å; Q513-K516 PolarHBondContact O-N 3.29Å; Q513-T517 WeakPolarHBondContact O-CB 3.26Å; Q513-T517 PolarHBondContact O-N 3.41Å; Q513-T517 PolarHBondContact O-OG1 2.84Å
514	A	73.3	Confident	73.9	Confident	28 Å²	28	68 Å²	68	23%	0.231	33%	0.334	C	S	.	.	H	α-helix	trans	-62.9	-37.8	-179.7	0	0	0	0	0	111.9	G510 K511 G518	G510-A514 WeakPolarHBondContact O-CB 3.44Å; G510-A514 PolarHBondContact O-N 2.92Å; K511-A514 WeakPolarHBondContact O-CB 3.37Å; K511-A514 PolarHBondContact O-N 3.31Å; A514-G518 PolarHBondContact O-N 2.85Å
515	E	78.9	Confident	72.8	Confident	103 Å²	103	72.8 Å²	72.8	48%	0.481	36%	0.358	S	S	.	.	H	α-helix	trans	-66.7	-46.7	175.3	-71.9	171.2	167.4	0	0	111.3	K511 I512 Q513 T517 G518	K511-E515 WeakPolarHBondContact CE-OE1 3.4Å; K511-E515 HydrophobicContact CG-CG 4.33Å; K511-E515 WeakPolarHBondContact O-CG 3.2Å; K511-E515 PolarHBondContact O-N 2.84Å; I512-E515 PolarHBondContact O-N 3.33Å; Q513-E515 VanDerWaalsContact C-N 3.3Å; Q513-E515 PolarHBondContact O-N 3.03Å; E515-T517 VanDerWaalsContact C-N 3.3Å; E515-T517 PolarHBondContact O-N 2.94Å; E515-G518 PolarHBondContact O-N 2.81Å; E515-G518 VanDerWaalsContact O-N 3.07Å
516	K	75.3	Confident	71.8	Confident	110 Å²	110	77.8 Å²	77.8	48%	0.478	38%	0.383	S	S	.	.	H	α-helix	trans	-63.1	-33.5	176.1	-72.2	-179.6	-177.2	-173.6	0	113.8	E388 E392 I512 Q513 G518	E388-K516 WeakPolarHBondContact OE1-CE 3.25Å; E388-K516 IonicContact OE1-NZ 2.63Å; E392-K516 IonicContact OE2-NZ 3.15Å; E392-K516 PolarHBondContact OE2-NZ 2.83Å; I512-K516 HydrophobicContact CG2-CD 4.23Å; I512-K516 WeakPolarHBondContact O-CG 3.43Å; I512-K516 PolarHBondContact O-N 2.82Å; Q513-K516 PolarHBondContact O-N 3.29Å; K516-G518 PolarHBondContact O-N 3.37Å
517	T	66.4	Low	70.7	Confident	49 Å²	49	78 Å²	78	30%	0.301	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-7.2	178.5	-44.5	0	0	0	0	112	Q513 E515 I519 L523	Q513-T517 WeakPolarHBondContact O-CB 3.26Å; Q513-T517 PolarHBondContact O-N 3.41Å; Q513-T517 PolarHBondContact O-OG1 2.84Å; E515-T517 VanDerWaalsContact C-N 3.3Å; E515-T517 PolarHBondContact O-N 2.94Å; T517-I519 PolarHBondContact O-N 2.84Å; T517-L523 HydrophobicContact CG2-CB 3.6Å; T517-L523 HydrophobicContact CG2-CD1 4.38Å
518	G	52.2	Low	69.9	Low	50 Å²	50	79.8 Å²	79.8	52%	0.515	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	32.8	-164.8	0	0	0	0	0	118.1	A514 E515 K516	A514-G518 PolarHBondContact O-N 2.85Å; E515-G518 PolarHBondContact O-N 2.81Å; E515-G518 VanDerWaalsContact O-N 3.07Å; K516-G518 PolarHBondContact O-N 3.37Å
519	I	55.6	Low	69.2	Low	155 Å²	155	84.3 Å²	84.3	80%	0.795	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-20.4	171.7	-55.9	177.1	0	0	0	111.8	T517	T517-I519 PolarHBondContact O-N 2.84Å
520	L	56.4	Low	68.5	Low	98 Å²	98	90.4 Å²	90.4	51%	0.513	44%	0.438	S	S	.	.			trans	-132.1	129.1	176.7	-81.4	116.5	0	0	0	113.8	R522 L523 R524	L520-R522 VanDerWaalsContact C-N 3.31Å; L520-R522 PolarHBondContact O-N 3.37Å; L520-L523 HydrophobicContact CB-CD1 4.15Å; L520-L523 HydrophobicContact CB-CG 4.31Å; L520-L523 HydrophobicContact CD1-CD1 4.38Å; L520-L523 PolarHBondContact O-N 3.36Å; L520-L523 VanDerWaalsContact O-N 3.11Å; L520-R524 PolarHBondContact O-N 2.9Å
521	P	59.1	Low	67.8	Low	107 Å²	107	91.3 Å²	91.3	70%	0.695	44%	0.443	S	S	*	.	H	α-helix	trans	-63.6	-28.5	-177.6	19.3	-28.6	0	0	0	114.5	R524	P521-R524 WeakPolarHBondContact O-CB 3.3Å; P521-R524 PolarHBondContact O-N 3.3Å
522	R	59.2	Low	67.3	Low	212 Å²	212	91.8 Å²	91.8	80%	0.8	45%	0.45	S	S	*	.	H	α-helix	trans	-66.7	-35	174.7	-74.7	-175.9	175.9	171.5	-0.8	112.8	L520 R524	L520-R522 VanDerWaalsContact C-N 3.31Å; L520-R522 PolarHBondContact O-N 3.37Å; R522-R524 VanDerWaalsContact C-N 3.31Å
523	L	60.7	Low	66.8	Low	80 Å²	80	99.5 Å²	99.5	42%	0.419	48%	0.479	S	S	.	.	H	α-helix	trans	-76.1	-23	177	-64.4	173.5	0	0	0	111.9	T517 L520 I526 S527	T517-L523 HydrophobicContact CG2-CB 3.6Å; T517-L523 HydrophobicContact CG2-CD1 4.38Å; L520-L523 HydrophobicContact CB-CD1 4.15Å; L520-L523 HydrophobicContact CB-CG 4.31Å; L520-L523 HydrophobicContact CD1-CD1 4.38Å; L520-L523 PolarHBondContact O-N 3.36Å; L520-L523 VanDerWaalsContact O-N 3.11Å; L523-I526 PolarHBondContact O-N 2.83Å; L523-S527 VanDerWaalsContact O-CB 3.26Å; L523-S527 WeakPolarHBondContact O-CB 3.3Å; L523-S527 PolarHBondContact O-N 2.97Å
524	R	61.8	Low	66.3	Low	168 Å²	168	99.2 Å²	99.2	63%	0.634	48%	0.478	S	S	*	.	H	α-helix	trans	-65.3	-40.2	176.7	-161.8	176.4	-179.5	-178.6	0.6	112.5	L520 P521 R522 W528	L520-R524 PolarHBondContact O-N 2.9Å; P521-R524 WeakPolarHBondContact O-CB 3.3Å; P521-R524 PolarHBondContact O-N 3.3Å; R522-R524 VanDerWaalsContact C-N 3.31Å; R524-W528 VanDerWaalsContact O-CB 3.25Å; R524-W528 WeakPolarHBondContact O-CB 3.48Å; R524-W528 PolarHBondContact O-N 2.86Å
525	I	68.6	Low	66.2	Low	110 Å²	110	98.9 Å²	98.9	56%	0.564	47%	0.474	S	S	*	.	H	α-helix	trans	-66.7	-43.1	175.6	-62.8	171.4	0	0	0	110.4	W528 L529	I525-W528 PolarHBondContact O-N 3.39Å; I525-L529 HydrophobicContact CG2-CD1 4.05Å; I525-L529 HydrophobicContact CG2-CG 4.43Å; I525-L529 WeakPolarHBondContact O-CB 3.25Å; I525-L529 WeakPolarHBondContact O-CG 3.33Å; I525-L529 PolarHBondContact O-N 3.46Å
526	I	69.2	Low	66	Low	104 Å²	104	97.9 Å²	97.9	53%	0.533	47%	0.471	S	S	.	.	H	α-helix	trans	-65.8	-43.5	178.8	-63.1	170.4	0	0	0	110.9	L523 L529 R530	L523-I526 PolarHBondContact O-N 2.83Å; I526-L529 PolarHBondContact O-N 2.93Å; I526-R530 VanDerWaalsContact O-CB 3.3Å; I526-R530 WeakPolarHBondContact O-CB 3.35Å; I526-R530 PolarHBondContact O-N 3.34Å
527	S	63.2	Low	65.8	Low	8 Å²	8	98.4 Å²	98.4	6%	0.056	47%	0.474	C	S	.	.	H	α-helix	trans	-62.8	-41.7	175.2	-178.9	0	0	0	0	111.7	L523 R530 T531	L523-S527 VanDerWaalsContact O-CB 3.26Å; L523-S527 WeakPolarHBondContact O-CB 3.3Å; L523-S527 PolarHBondContact O-N 2.97Å; S527-R530 PolarHBondContact O-N 2.85Å; S527-T531 VanDerWaalsContact O-CB 3.3Å; S527-T531 WeakPolarHBondContact O-CB 3.41Å; S527-T531 PolarHBondContact O-N 3.45Å; S527-T531 PolarHBondContact O-OG1 3.37Å
528	W	67.7	Low	66	Low	161 Å²	161	96.4 Å²	96.4	61%	0.61	46%	0.461	S	S	*	.	H	α-helix	trans	-64.2	-44.8	174.3	178.8	82.9	0	0	0	112.4	R524 I525 T531 T532	R524-W528 VanDerWaalsContact O-CB 3.25Å; R524-W528 WeakPolarHBondContact O-CB 3.48Å; R524-W528 PolarHBondContact O-N 2.86Å; I525-W528 PolarHBondContact O-N 3.39Å; W528-T531 PolarHBondContact O-N 2.73Å; W528-T532 VanDerWaalsContact O-CB 3.3Å; W528-T532 WeakPolarHBondContact O-CB 3.41Å; W528-T532 PolarHBondContact O-N 3.45Å; W528-T532 PolarHBondContact O-OG1 3.48Å
529	L	73.3	Confident	66.9	Low	94 Å²	94	96.2 Å²	96.2	49%	0.492	45%	0.447	S	S	.	.	H	α-helix	trans	-61.4	-44.9	174.9	-77.3	171	0	0	0	111.2	I525 I526 T532 W533	I525-L529 HydrophobicContact CG2-CD1 4.05Å; I525-L529 HydrophobicContact CG2-CG 4.43Å; I525-L529 WeakPolarHBondContact O-CB 3.25Å; I525-L529 WeakPolarHBondContact O-CG 3.33Å; I525-L529 PolarHBondContact O-N 3.46Å; I526-L529 PolarHBondContact O-N 2.93Å; L529-T532 PolarHBondContact O-N 2.88Å; L529-W533 VanDerWaalsContact O-CB 3.24Å; L529-W533 WeakPolarHBondContact O-CB 3.29Å; L529-W533 PolarHBondContact O-N 2.8Å
530	R	70.3	Confident	67.8	Low	163 Å²	163	92.9 Å²	92.9	62%	0.615	43%	0.433	S	S	*	.	H	α-helix	trans	-63.2	-43.5	177.6	-172.2	178	-176.6	172.1	1.2	111.9	I526 S527 W533 E534	I526-R530 VanDerWaalsContact O-CB 3.3Å; I526-R530 WeakPolarHBondContact O-CB 3.35Å; I526-R530 PolarHBondContact O-N 3.34Å; S527-R530 PolarHBondContact O-N 2.85Å; R530-W533 WeakPolarHBondContact O-CB 3.48Å; R530-W533 PolarHBondContact O-N 3.32Å; R530-E534 WeakPolarHBondContact O-CG 3.39Å; R530-E534 PolarHBondContact O-N 2.84Å
531	T	67.6	Low	68.5	Low	25 Å²	25	89.9 Å²	89.9	15%	0.153	42%	0.423	C	S	.	.	H	α-helix	trans	-62.7	-45.2	175.5	-64.2	0	0	0	0	111.3	S527 W528 W533 E534 S535	S527-T531 VanDerWaalsContact O-CB 3.3Å; S527-T531 WeakPolarHBondContact O-CB 3.41Å; S527-T531 PolarHBondContact O-N 3.45Å; S527-T531 PolarHBondContact O-OG1 3.37Å; W528-T531 PolarHBondContact O-N 2.73Å; T531-W533 VanDerWaalsContact C-N 3.28Å; T531-W533 PolarHBondContact O-N 3.24Å; T531-E534 PolarHBondContact O-N 3.28Å; T531-S535 WeakPolarHBondContact O-CB 3.3Å; T531-S535 PolarHBondContact O-N 3.46Å
532	T	70.6	Confident	68.8	Low	62 Å²	62	85.5 Å²	85.5	38%	0.38	39%	0.393	S	S	.	.	H	α-helix	trans	-64	-39	178.1	-56.5	0	0	0	0	110.4	W528 L529 S535 L536	W528-T532 VanDerWaalsContact O-CB 3.3Å; W528-T532 WeakPolarHBondContact O-CB 3.41Å; W528-T532 PolarHBondContact O-N 3.45Å; W528-T532 PolarHBondContact O-OG1 3.48Å; L529-T532 PolarHBondContact O-N 2.88Å; T532-S535 PolarHBondContact O-N 2.96Å; T532-L536 VanDerWaalsContact O-CB 3.29Å; T532-L536 WeakPolarHBondContact O-CB 3.24Å; T532-L536 PolarHBondContact O-N 3.09Å
533	W	74.5	Confident	69.4	Low	162 Å²	162	83.2 Å²	83.2	61%	0.614	39%	0.385	S	S	*	.	H	α-helix	trans	-65.5	-46.3	174.8	-177	-106.4	0	0	0	112.6	L529 R530 T531 S535 L536 K537	L529-W533 VanDerWaalsContact O-CB 3.24Å; L529-W533 WeakPolarHBondContact O-CB 3.29Å; L529-W533 PolarHBondContact O-N 2.8Å; R530-W533 WeakPolarHBondContact O-CB 3.48Å; R530-W533 PolarHBondContact O-N 3.32Å; T531-W533 VanDerWaalsContact C-N 3.28Å; T531-W533 PolarHBondContact O-N 3.24Å; W533-S535 VanDerWaalsContact C-N 3.33Å; W533-S535 PolarHBondContact O-N 3.12Å; W533-L536 HydrophobicContact CE3-CD2 4.11Å; W533-L536 HydrophobicContact CZ3-CD2 4.05Å; W533-L536 PolarHBondContact O-N 2.87Å; W533-L536 VanDerWaalsContact O-N 3.16Å; W533-K537 WeakPolarHBondContact O-CB 3.23Å; W533-K537 PolarHBondContact O-N 3.28Å
534	E	69.4	Low	69.8	Low	35 Å²	35	82 Å²	82	16%	0.164	38%	0.383	C	S	.	.	H	α-helix	trans	-62.9	-40.2	174.8	-75.9	-63.1	145.3	0	0	111.6	R399 W509 R530 T531 L536 K537 F538	R399-E534 IonicContact CZ-OE2 3.88Å; R399-E534 IonicContact NH2-OE2 3.43Å; R399-E534 PolarHBondContact NH2-OE2 3.02Å; W509-E534 HydrophobicContact CZ3-CB 4.42Å; W509-E534 HydrophobicContact CZ3-CG 4.31Å; R530-E534 WeakPolarHBondContact O-CG 3.39Å; R530-E534 PolarHBondContact O-N 2.84Å; T531-E534 PolarHBondContact O-N 3.28Å; E534-L536 VanDerWaalsContact C-N 3.34Å; E534-K537 PolarHBondContact O-N 3.16Å; E534-F538 VanDerWaalsContact O-CB 3.24Å; E534-F538 WeakPolarHBondContact O-CB 3.34Å; E534-F538 PolarHBondContact O-N 3.33Å
535	S	69.5	Low	69.9	Low	20 Å²	20	77.5 Å²	77.5	14%	0.14	37%	0.369	C	S	.	.	H	α-helix	trans	-63.7	-39.1	172.5	177	0	0	0	0	112.1	T531 T532 W533 Q539	T531-S535 WeakPolarHBondContact O-CB 3.3Å; T531-S535 PolarHBondContact O-N 3.46Å; T532-S535 PolarHBondContact O-N 2.96Å; W533-S535 VanDerWaalsContact C-N 3.33Å; W533-S535 PolarHBondContact O-N 3.12Å; S535-Q539 WeakPolarHBondContact O-CB 3.44Å; S535-Q539 VanDerWaalsContact O-CG 3.23Å; S535-Q539 WeakPolarHBondContact O-CG 3.46Å; S535-Q539 PolarHBondContact O-N 3.32Å; S535-Q539 PolarHBondContact OG-NE2 3.47Å
536	L	74.8	Confident	69.8	Low	82 Å²	82	75.2 Å²	75.2	43%	0.429	36%	0.357	S	S	.	.	H	α-helix	trans	-68.4	-47.4	177.2	-177.5	66.8	0	0	0	110.4	T532 W533 E534 F538 Q539 V540	T532-L536 VanDerWaalsContact O-CB 3.29Å; T532-L536 WeakPolarHBondContact O-CB 3.24Å; T532-L536 PolarHBondContact O-N 3.09Å; W533-L536 HydrophobicContact CE3-CD2 4.11Å; W533-L536 HydrophobicContact CZ3-CD2 4.05Å; W533-L536 PolarHBondContact O-N 2.87Å; W533-L536 VanDerWaalsContact O-N 3.16Å; E534-L536 VanDerWaalsContact C-N 3.34Å; L536-F538 VanDerWaalsContact C-N 3.31Å; L536-F538 PolarHBondContact O-N 2.98Å; L536-Q539 CarbonylContact O-C 3.59Å; L536-Q539 PolarHBondContact O-N 3.34Å; L536-Q539 VanDerWaalsContact O-N 3.12Å; L536-V540 HydrophobicContact CD1-CG2 4.24Å; L536-V540 HydrophobicContact CG-CG2 4.28Å; L536-V540 WeakPolarHBondContact O-CB 3.17Å; L536-V540 VanDerWaalsContact O-CG2 3.29Å; L536-V540 WeakPolarHBondContact O-CG2 3.29Å; L536-V540 PolarHBondContact O-N 2.96Å
537	K	72.2	Confident	69.8	Low	122 Å²	122	73 Å²	73	53%	0.53	35%	0.354	S	S	.	.	H	α-helix	trans	-56.1	-46.9	175.9	-174	-178.5	-179.8	-177.4	0	110.8	W533 E534 V540 A541	W533-K537 WeakPolarHBondContact O-CB 3.23Å; W533-K537 PolarHBondContact O-N 3.28Å; E534-K537 PolarHBondContact O-N 3.16Å; K537-V540 PolarHBondContact O-N 3.46Å; K537-A541 VanDerWaalsContact O-CB 3.31Å; K537-A541 WeakPolarHBondContact O-CB 3.24Å; K537-A541 PolarHBondContact O-N 3.24Å
538	F	70.4	Confident	70.2	Confident	6 Å²	6	76.8 Å²	76.8	3%	0.026	37%	0.372	C	S	.	.	H	α-helix	trans	-59.6	-47.8	174.7	-179.4	-100.2	0	0	0	111.8	R399 V402 L403 A502 V506 E534 L536 V540 L542	R399-F538 HydrophobicContact CG-CD2 4.19Å; R399-F538 HydrophobicContact CG-CE2 4.33Å; V402-F538 HydrophobicContact CB-CE2 4.36Å; V402-F538 HydrophobicContact CB-CZ 4.46Å; V402-F538 HydrophobicContact CG1-CE2 3.93Å; V402-F538 HydrophobicContact CG1-CZ 3.85Å; L403-F538 HydrophobicContact CD1-CD2 4.14Å; L403-F538 HydrophobicContact CD2-CD2 3.86Å; L403-F538 HydrophobicContact CD2-CE2 4.01Å; L403-F538 HydrophobicContact CG-CD2 4.04Å; L403-F538 HydrophobicContact CG-CE2 4.07Å; A502-F538 HydrophobicContact CB-CE1 4.11Å; A502-F538 HydrophobicContact CB-CE2 4.49Å; A502-F538 HydrophobicContact CB-CZ 3.55Å; V506-F538 HydrophobicContact CG2-CB 4.45Å; V506-F538 HydrophobicContact CG2-CD1 4.03Å; V506-F538 HydrophobicContact CG2-CD2 4.24Å; V506-F538 HydrophobicContact CG2-CE1 4.39Å; V506-F538 HydrophobicContact CG2-CG 3.97Å; E534-F538 VanDerWaalsContact O-CB 3.24Å; E534-F538 WeakPolarHBondContact O-CB 3.34Å; E534-F538 PolarHBondContact O-N 3.33Å; L536-F538 VanDerWaalsContact C-N 3.31Å; L536-F538 PolarHBondContact O-N 2.98Å; F538-V540 PolarHBondContact O-N 3.36Å; F538-L542 HydrophobicContact CE2-CD1 4.37Å; F538-L542 HydrophobicContact CZ-CD1 4.19Å; F538-L542 WeakPolarHBondContact O-CB 3.33Å; F538-L542 PolarHBondContact O-N 3.13Å; F538-L542 VanDerWaalsContact O-N 3.09Å
539	Q	70.5	Confident	70.1	Confident	46 Å²	46	71.5 Å²	71.5	22%	0.215	36%	0.355	C	S	.	.	H	α-helix	trans	-64.3	-39	178.4	-76.6	176.7	32.5	0	0	113	S535 L536 R543	S535-Q539 WeakPolarHBondContact O-CB 3.44Å; S535-Q539 VanDerWaalsContact O-CG 3.23Å; S535-Q539 WeakPolarHBondContact O-CG 3.46Å; S535-Q539 PolarHBondContact O-N 3.32Å; S535-Q539 PolarHBondContact OG-NE2 3.47Å; L536-Q539 CarbonylContact O-C 3.59Å; L536-Q539 PolarHBondContact O-N 3.34Å; L536-Q539 VanDerWaalsContact O-N 3.12Å; Q539-R543 VanDerWaalsContact O-CB 3.24Å; Q539-R543 WeakPolarHBondContact O-CB 3.31Å; Q539-R543 VanDerWaalsContact O-CG 3.22Å; Q539-R543 WeakPolarHBondContact O-CG 3.29Å; Q539-R543 PolarHBondContact O-N 3.23Å
540	V	75	Confident	69.9	Low	85 Å²	85	75 Å²	75	52%	0.515	36%	0.362	S	S	.	.	H	α-helix	trans	-67.4	-51.6	178.5	169.8	0	0	0	0	110	L536 K537 F538 L542 R543 S544	L536-V540 HydrophobicContact CD1-CG2 4.24Å; L536-V540 HydrophobicContact CG-CG2 4.28Å; L536-V540 WeakPolarHBondContact O-CB 3.17Å; L536-V540 VanDerWaalsContact O-CG2 3.29Å; L536-V540 WeakPolarHBondContact O-CG2 3.29Å; L536-V540 PolarHBondContact O-N 2.96Å; K537-V540 PolarHBondContact O-N 3.46Å; F538-V540 PolarHBondContact O-N 3.36Å; V540-L542 PolarHBondContact O-N 3.09Å; V540-R543 PolarHBondContact O-N 3.07Å; V540-R543 VanDerWaalsContact O-N 3.15Å; V540-S544 WeakPolarHBondContact O-CB 3.49Å; V540-S544 PolarHBondContact O-N 3.12Å; V540-S544 PolarHBondContact O-OG 3.5Å
541	A	70.9	Confident	70.2	Confident	36 Å²	36	72.7 Å²	72.7	30%	0.298	36%	0.361	S	S	.	.	H	α-helix	trans	-55.1	-42.1	178.6	0	0	0	0	0	111.8	L403 K537 S544 E545	L403-A541 HydrophobicContact CD2-CB 4.43Å; K537-A541 VanDerWaalsContact O-CB 3.31Å; K537-A541 WeakPolarHBondContact O-CB 3.24Å; K537-A541 PolarHBondContact O-N 3.24Å; A541-S544 WeakPolarHBondContact CA-OG 3.33Å; A541-S544 PolarHBondContact O-OG 3.43Å; A541-E545 WeakPolarHBondContact O-CG 3.42Å; A541-E545 PolarHBondContact O-N 3Å
542	L	66.1	Low	70.5	Confident	14 Å²	14	74.8 Å²	74.8	7%	0.073	37%	0.374	C	S	.	.	H	α-helix	trans	-74.7	-37.8	179.7	-138.6	97	0	0	0	113.3	V402 L438 F499 F538 V540 E545 M546	V402-L542 HydrophobicContact CG1-CD1 3.32Å; L438-L542 HydrophobicContact CD2-CD1 4.08Å; F499-L542 HydrophobicContact CD2-CD2 3.09Å; F499-L542 HydrophobicContact CE2-CD2 3.39Å; F499-L542 HydrophobicContact CG-CD2 4.16Å; F538-L542 HydrophobicContact CE2-CD1 4.37Å; F538-L542 HydrophobicContact CZ-CD1 4.19Å; F538-L542 WeakPolarHBondContact O-CB 3.33Å; F538-L542 PolarHBondContact O-N 3.13Å; F538-L542 VanDerWaalsContact O-N 3.09Å; V540-L542 PolarHBondContact O-N 3.09Å; L542-E545 PolarHBondContact O-N 3.08Å; L542-M546 HydrophobicContact CD2-CE 4.26Å; L542-M546 WeakPolarHBondContact O-CG 3.33Å; L542-M546 PolarHBondContact O-N 3.49Å
543	R	70.8	Confident	70.5	Confident	165 Å²	165	75.2 Å²	75.2	62%	0.623	37%	0.369	S	S	*	.	H	α-helix	trans	-68.5	-37.8	176.7	-79.5	-179.5	178.2	-173.8	1.5	111.9	Q539 V540 E545 M546 A547	Q539-R543 VanDerWaalsContact O-CB 3.24Å; Q539-R543 WeakPolarHBondContact O-CB 3.31Å; Q539-R543 VanDerWaalsContact O-CG 3.22Å; Q539-R543 WeakPolarHBondContact O-CG 3.29Å; Q539-R543 PolarHBondContact O-N 3.23Å; V540-R543 PolarHBondContact O-N 3.07Å; V540-R543 VanDerWaalsContact O-N 3.15Å; R543-E545 VanDerWaalsContact C-N 3.34Å; R543-M546 HydrophobicContact CG-CE 4.17Å; R543-A547 WeakPolarHBondContact O-CB 3.46Å; R543-A547 PolarHBondContact O-N 3.15Å
544	S	68.9	Low	70.6	Confident	54 Å²	54	71.5 Å²	71.5	38%	0.378	36%	0.364	S	S	.	.	H	α-helix	trans	-62.8	-43.7	175.1	52.3	0	0	0	0	110.7	V540 A541 A547 I548	V540-S544 WeakPolarHBondContact O-CB 3.49Å; V540-S544 PolarHBondContact O-N 3.12Å; V540-S544 PolarHBondContact O-OG 3.5Å; A541-S544 WeakPolarHBondContact CA-OG 3.33Å; A541-S544 PolarHBondContact O-OG 3.43Å; S544-A547 PolarHBondContact O-N 3.14Å; S544-I548 WeakPolarHBondContact O-CB 3.44Å; S544-I548 VanDerWaalsContact O-CG1 3.22Å; S544-I548 WeakPolarHBondContact O-CG1 3.36Å; S544-I548 PolarHBondContact O-N 3.17Å
545	E	65.1	Low	71.1	Confident	73 Å²	73	72.8 Å²	72.8	34%	0.341	38%	0.376	S	S	.	.	H	α-helix	trans	-65.7	-45.5	177.5	-77.3	-72.3	168.5	0	0	112.4	L438 A541 L542 R543 A547 I548 M549	L438-E545 HydrophobicContact CD2-CB 4.12Å; L438-E545 HydrophobicContact CD2-CG 4Å; A541-E545 WeakPolarHBondContact O-CG 3.42Å; A541-E545 PolarHBondContact O-N 3Å; L542-E545 PolarHBondContact O-N 3.08Å; R543-E545 VanDerWaalsContact C-N 3.34Å; E545-A547 VanDerWaalsContact C-N 3.27Å; E545-A547 PolarHBondContact O-N 2.8Å; E545-I548 PolarHBondContact O-N 3.17Å; E545-M549 WeakPolarHBondContact O-CG 3.33Å; E545-M549 PolarHBondContact O-N 3.39Å
546	M	65.4	Low	71.5	Confident	63 Å²	63	74 Å²	74	31%	0.31	38%	0.381	S	S	.	.	H	α-helix	trans	-60.6	-37.1	172.6	-75.9	-171.4	-73.1	0	0	112.6	L542 R543 R550	L542-M546 HydrophobicContact CD2-CE 4.26Å; L542-M546 WeakPolarHBondContact O-CG 3.33Å; L542-M546 PolarHBondContact O-N 3.49Å; R543-M546 HydrophobicContact CG-CE 4.17Å; M546-R550 WeakPolarHBondContact O-CG 3.22Å; M546-R550 PolarHBondContact O-N 3.38Å
547	A	69.3	Low	71.6	Confident	56 Å²	56	75.9 Å²	75.9	46%	0.463	38%	0.383	S	S	.	.	H	α-helix	trans	-68.9	-43.5	177.1	0	0	0	0	0	111.4	R543 S544 E545 R550 L551	R543-A547 WeakPolarHBondContact O-CB 3.46Å; R543-A547 PolarHBondContact O-N 3.15Å; S544-A547 PolarHBondContact O-N 3.14Å; E545-A547 VanDerWaalsContact C-N 3.27Å; E545-A547 PolarHBondContact O-N 2.8Å; A547-R550 PolarHBondContact O-N 3.4Å; A547-L551 WeakPolarHBondContact O-CB 3.24Å; A547-L551 PolarHBondContact O-N 2.77Å
548	I	72.3	Confident	72.1	Confident	88 Å²	88	74.8 Å²	74.8	45%	0.451	38%	0.382	S	S	.	.	H	α-helix	trans	-57.6	-50	173.5	-71.2	163.9	0	0	0	109.2	S544 E545 R550 L551 T552	S544-I548 WeakPolarHBondContact O-CB 3.44Å; S544-I548 VanDerWaalsContact O-CG1 3.22Å; S544-I548 WeakPolarHBondContact O-CG1 3.36Å; S544-I548 PolarHBondContact O-N 3.17Å; E545-I548 PolarHBondContact O-N 3.17Å; I548-R550 PolarHBondContact O-N 2.78Å; I548-L551 CarbonylContact O-C 3.6Å; I548-L551 WeakPolarHBondContact O-CB 3.49Å; I548-L551 PolarHBondContact O-N 2.9Å; I548-L551 VanDerWaalsContact O-N 3.09Å; I548-T552 WeakPolarHBondContact O-CB 3.23Å; I548-T552 PolarHBondContact O-N 3.26Å; I548-T552 PolarHBondContact O-OG1 2.82Å
549	M	65.1	Low	72.7	Confident	50 Å²	50	77.6 Å²	77.6	25%	0.246	40%	0.397	C	S	.	.	H	α-helix	trans	-60.2	-40.8	177.8	-76.8	-170.7	63.4	0	0	113.6	A439 E545 L551 R553	A439-M549 HydrophobicContact CB-CE 3.36Å; A439-M549 HydrophobicContact CB-SD 3.33Å; A439-M549 WeakPolarHBondContact CB-SD 3.22Å; E545-M549 WeakPolarHBondContact O-CG 3.33Å; E545-M549 PolarHBondContact O-N 3.39Å; M549-L551 VanDerWaalsContact C-N 3.34Å; M549-R553 VanDerWaalsContact O-CB 3.23Å; M549-R553 WeakPolarHBondContact O-CB 3.48Å; M549-R553 PolarHBondContact O-N 3.15Å
550	R	69.4	Low	73.3	Confident	167 Å²	167	78.1 Å²	78.1	63%	0.63	40%	0.399	S	S	*	.	H	α-helix	trans	-65.5	-38.5	174.6	-75.7	-179.6	-158	172	6.6	111.9	M546 A547 I548 R553 T554	M546-R550 WeakPolarHBondContact O-CG 3.22Å; M546-R550 PolarHBondContact O-N 3.38Å; A547-R550 PolarHBondContact O-N 3.4Å; I548-R550 PolarHBondContact O-N 2.78Å; R550-R553 PolarHBondContact O-N 2.95Å; R550-T554 WeakPolarHBondContact O-CB 3.47Å; R550-T554 PolarHBondContact O-N 3.48Å; R550-T554 PolarHBondContact O-OG1 3.23Å
551	L	77	Confident	73.7	Confident	115 Å²	115	82.5 Å²	82.5	60%	0.602	41%	0.412	S	S	*	.	H	α-helix	trans	-65.3	-51.5	176.7	-171.9	73.4	0	0	0	109.8	A547 I548 M549 R553 T554 C555	A547-L551 WeakPolarHBondContact O-CB 3.24Å; A547-L551 PolarHBondContact O-N 2.77Å; I548-L551 CarbonylContact O-C 3.6Å; I548-L551 WeakPolarHBondContact O-CB 3.49Å; I548-L551 PolarHBondContact O-N 2.9Å; I548-L551 VanDerWaalsContact O-N 3.09Å; M549-L551 VanDerWaalsContact C-N 3.34Å; L551-R553 VanDerWaalsContact C-N 3.29Å; L551-R553 PolarHBondContact O-N 2.87Å; L551-T554 PolarHBondContact O-N 2.82Å; L551-T554 VanDerWaalsContact O-N 3.11Å; L551-C555 WeakPolarHBondContact O-CB 3.2Å; L551-C555 PolarHBondContact O-N 3.02Å; L551-C555 PolarHBondContact O-SG 2.97Å; L551-C555 VanDerWaalsContact O-SG 3.37Å
552	T	72.7	Confident	74.5	Confident	70 Å²	70	85.7 Å²	85.7	43%	0.429	42%	0.423	S	S	.	.	H	α-helix	trans	-54.9	-44.7	175.1	-52.9	0	0	0	0	111.1	I548 C555 L556	I548-T552 WeakPolarHBondContact O-CB 3.23Å; I548-T552 PolarHBondContact O-N 3.26Å; I548-T552 PolarHBondContact O-OG1 2.82Å; T552-C555 PolarHBondContact O-N 2.82Å; T552-L556 HydrophobicContact CG2-CD1 3.97Å; T552-L556 HydrophobicContact CG2-CG 4.43Å; T552-L556 WeakPolarHBondContact O-CB 3.4Å; T552-L556 VanDerWaalsContact O-CG 3.26Å; T552-L556 WeakPolarHBondContact O-CG 3.43Å; T552-L556 PolarHBondContact O-N 2.7Å
553	R	70.2	Confident	75.3	Confident	70 Å²	70	88.1 Å²	88.1	26%	0.264	45%	0.452	S	S	.	.	H	α-helix	trans	-61.5	-46.4	176	175.3	-179.5	-61.1	-162.8	-5.8	112.6	M549 R550 L551 L556 R557 L575	M549-R553 VanDerWaalsContact O-CB 3.23Å; M549-R553 WeakPolarHBondContact O-CB 3.48Å; M549-R553 PolarHBondContact O-N 3.15Å; R550-R553 PolarHBondContact O-N 2.95Å; L551-R553 VanDerWaalsContact C-N 3.29Å; L551-R553 PolarHBondContact O-N 2.87Å; R553-L556 PolarHBondContact O-N 3.34Å; R553-R557 WeakPolarHBondContact O-CG 3.41Å; R553-R557 PolarHBondContact O-N 3.23Å; R553-L575 HydrophobicContact CB-CD2 3.73Å; R553-L575 HydrophobicContact CG-CB 4.45Å; R553-L575 HydrophobicContact CG-CD2 3.76Å; R553-L575 PolarHBondContact NE-O 3.43Å; R553-L575 VanDerWaalsContact NE-O 3.17Å; R553-L575 PolarHBondContact NH1-O 2.94Å; R553-L575 VanDerWaalsContact NH1-O 3.15Å; R553-L575 PolarHBondContact NH2-O 2.87Å
554	T	77.4	Confident	75.8	Confident	84 Å²	84	86 Å²	86	52%	0.515	45%	0.452	S	S	.	.	H	α-helix	trans	-63.7	-44.5	178.5	-51.7	0	0	0	0	110.5	R550 L551 R557 L558	R550-T554 WeakPolarHBondContact O-CB 3.47Å; R550-T554 PolarHBondContact O-N 3.48Å; R550-T554 PolarHBondContact O-OG1 3.23Å; L551-T554 PolarHBondContact O-N 2.82Å; L551-T554 VanDerWaalsContact O-N 3.11Å; T554-R557 PolarHBondContact O-N 3Å; T554-L558 VanDerWaalsContact O-CB 3.31Å; T554-L558 WeakPolarHBondContact O-CB 3.42Å; T554-L558 PolarHBondContact O-N 3.27Å
555	C	81	Confident	76.3	Confident	63 Å²	63	86.4 Å²	86.4	43%	0.426	45%	0.452	S	S	.	.	H	α-helix	trans	-60.6	-46.7	176	-72.5	0	0	0	0	112	L551 T552 R557 L558 L559	L551-C555 WeakPolarHBondContact O-CB 3.2Å; L551-C555 PolarHBondContact O-N 3.02Å; L551-C555 PolarHBondContact O-SG 2.97Å; L551-C555 VanDerWaalsContact O-SG 3.37Å; T552-C555 PolarHBondContact O-N 2.82Å; C555-R557 PolarHBondContact O-N 2.87Å; C555-L558 PolarHBondContact O-N 3.32Å; C555-L559 WeakPolarHBondContact O-CB 3.36Å; C555-L559 VanDerWaalsContact O-CG 3.29Å; C555-L559 WeakPolarHBondContact O-CG 3.49Å; C555-L559 PolarHBondContact O-N 3.48Å
556	L	76.3	Confident	76.6	Confident	45 Å²	45	89.5 Å²	89.5	24%	0.236	48%	0.476	C	S	.	.	H	α-helix	trans	-62.7	-42.8	179	-73.2	170.2	0	0	0	112.2	T552 R553 L558 L559 E560 L567 L575	T552-L556 HydrophobicContact CG2-CD1 3.97Å; T552-L556 HydrophobicContact CG2-CG 4.43Å; T552-L556 WeakPolarHBondContact O-CB 3.4Å; T552-L556 VanDerWaalsContact O-CG 3.26Å; T552-L556 WeakPolarHBondContact O-CG 3.43Å; T552-L556 PolarHBondContact O-N 2.7Å; R553-L556 PolarHBondContact O-N 3.34Å; L556-L558 VanDerWaalsContact C-N 3.29Å; L556-L558 PolarHBondContact O-N 3.35Å; L556-L559 PolarHBondContact O-N 2.94Å; L556-E560 WeakPolarHBondContact O-CB 3.49Å; L556-E560 PolarHBondContact O-N 2.78Å; L556-L567 HydrophobicContact CB-CD1 4.36Å; L556-L567 HydrophobicContact CB-CD2 4.37Å; L556-L567 HydrophobicContact CD2-CD2 4.22Å; L556-L575 HydrophobicContact CB-CD1 4.3Å; L556-L575 HydrophobicContact CD1-CD1 4.29Å; L556-L575 HydrophobicContact CD1-CD2 4.1Å
557	R	77.2	Confident	76.7	Confident	122 Å²	122	87.7 Å²	87.7	46%	0.46	47%	0.468	S	S	.	.	H	α-helix	trans	-63.7	-35.6	174.3	-73.5	-178	-177.1	-175.8	0.6	112.7	R553 T554 C555 F561 L575	R553-R557 WeakPolarHBondContact O-CG 3.41Å; R553-R557 PolarHBondContact O-N 3.23Å; T554-R557 PolarHBondContact O-N 3Å; C555-R557 PolarHBondContact O-N 2.87Å; R557-F561 WeakPolarHBondContact O-CB 3.26Å; R557-F561 PolarHBondContact O-N 2.89Å; R557-L575 PolarHBondContact NH2-O 3.36Å
558	L	82.4	Confident	76.5	Confident	99 Å²	99	91 Å²	91	52%	0.518	48%	0.478	S	S	.	.	H	α-helix	trans	-72.3	-39.7	178.6	-150.8	153.6	0	0	0	110.6	T554 C555 L556 E560 F561 L562	T554-L558 VanDerWaalsContact O-CB 3.31Å; T554-L558 WeakPolarHBondContact O-CB 3.42Å; T554-L558 PolarHBondContact O-N 3.27Å; C555-L558 PolarHBondContact O-N 3.32Å; L556-L558 VanDerWaalsContact C-N 3.29Å; L556-L558 PolarHBondContact O-N 3.35Å; L558-E560 VanDerWaalsContact C-N 3.35Å; L558-F561 PolarHBondContact O-N 3.44Å; L558-L562 HydrophobicContact CD2-CD1 3.53Å; L558-L562 HydrophobicContact CD2-CG 4.08Å; L558-L562 WeakPolarHBondContact O-CB 3.41Å; L558-L562 VanDerWaalsContact O-CG 3.23Å; L558-L562 WeakPolarHBondContact O-CG 3.29Å; L558-L562 PolarHBondContact O-N 3.03Å
559	L	83.1	Confident	75.5	Confident	64 Å²	64	90.8 Å²	90.8	34%	0.335	49%	0.489	S	S	.	.	H	α-helix	trans	-63.8	-38.3	172.6	-71.2	170.9	0	0	0	112.4	C555 L556 L562 G563 L564 V565	C555-L559 WeakPolarHBondContact O-CB 3.36Å; C555-L559 VanDerWaalsContact O-CG 3.29Å; C555-L559 WeakPolarHBondContact O-CG 3.49Å; C555-L559 PolarHBondContact O-N 3.48Å; L556-L559 PolarHBondContact O-N 2.94Å; L559-L562 PolarHBondContact O-N 2.85Å; L559-G563 PolarHBondContact O-N 3.27Å; L559-L564 HydrophobicContact CD2-CB 4.31Å; L559-L564 HydrophobicContact CD2-CD1 3.83Å; L559-L564 PolarHBondContact O-N 2.94Å; L559-V565 HydrophobicContact CB-CG2 4.27Å
560	E	82.8	Confident	74.7	Confident	57 Å²	57	94.9 Å²	94.9	27%	0.266	51%	0.507	S	S	.	.	H	α-helix	trans	-65.5	-47.3	172.4	177.6	176.2	-130.4	0	0	111.7	L556 L558 L562 G563 V565 L567 Y572	L556-E560 WeakPolarHBondContact O-CB 3.49Å; L556-E560 PolarHBondContact O-N 2.78Å; L558-E560 VanDerWaalsContact C-N 3.35Å; E560-L562 PolarHBondContact O-N 3.09Å; E560-G563 PolarHBondContact O-N 3.11Å; E560-V565 WeakPolarHBondContact CA-O 3.31Å; E560-L567 HydrophobicContact CB-CD1 3.88Å; E560-L567 HydrophobicContact CB-CG 4.29Å; E560-L567 HydrophobicContact CG-CD1 4.37Å; E560-Y572 WeakPolarHBondContact OE1-CE2 3.35Å; E560-Y572 VanDerWaalsContact OE2-CE2 3.29Å; E560-Y572 WeakPolarHBondContact OE2-CE2 3.23Å; E560-Y572 PolarHBondContact OE2-OH 3.37Å
561	F	83.8	Confident	73.8	Confident	178 Å²	178	89.4 Å²	89.4	78%	0.781	49%	0.493	S	S	*	.	H	α-helix	trans	-59.3	-35.1	176.6	178.9	-97.6	0	0	0	112.5	R557 L558 G563	R557-F561 WeakPolarHBondContact O-CB 3.26Å; R557-F561 PolarHBondContact O-N 2.89Å; L558-F561 PolarHBondContact O-N 3.44Å; F561-G563 PolarHBondContact O-N 2.81Å
562	L	89	Confident	72.4	Confident	102 Å²	102	89 Å²	89	53%	0.534	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-1.7	175.1	-68.9	174.2	0	0	0	113.7	L558 L559 E560 L564	L558-L562 HydrophobicContact CD2-CD1 3.53Å; L558-L562 HydrophobicContact CD2-CG 4.08Å; L558-L562 WeakPolarHBondContact O-CB 3.41Å; L558-L562 VanDerWaalsContact O-CG 3.23Å; L558-L562 WeakPolarHBondContact O-CG 3.29Å; L558-L562 PolarHBondContact O-N 3.03Å; L559-L562 PolarHBondContact O-N 2.85Å; E560-L562 PolarHBondContact O-N 3.09Å; L562-L564 HydrophobicContact CB-CD1 4.02Å; L562-L564 HydrophobicContact CB-CG 4.11Å; L562-L564 HydrophobicContact CD1-CD1 4.23Å; L562-L564 PolarHBondContact O-N 2.87Å
563	G	83.2	Confident	71	Confident	66 Å²	66	89.4 Å²	89.4	68%	0.68	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	14.9	179.8	0	0	0	0	0	114.6	L559 E560 F561	L559-G563 PolarHBondContact O-N 3.27Å; E560-G563 PolarHBondContact O-N 3.11Å; F561-G563 PolarHBondContact O-N 2.81Å
564	L	80.3	Confident	69.8	Low	121 Å²	121	91.9 Å²	91.9	63%	0.634	50%	0.5	S	S	*	.	S	Bend	trans	-83.3	-22.4	-177.5	-67.2	170.6	0	0	0	112.6	L559 L562	L559-L564 HydrophobicContact CD2-CB 4.31Å; L559-L564 HydrophobicContact CD2-CD1 3.83Å; L559-L564 PolarHBondContact O-N 2.94Å; L562-L564 HydrophobicContact CB-CD1 4.02Å; L562-L564 HydrophobicContact CB-CG 4.11Å; L562-L564 HydrophobicContact CD1-CD1 4.23Å; L562-L564 PolarHBondContact O-N 2.87Å
565	V	78.8	Confident	68	Low	61 Å²	61	88.2 Å²	88.2	37%	0.37	48%	0.477	S	S	.	.			trans	-143.9	132.3	179.4	-179.2	0	0	0	0	108.8	L559 E560 L567	L559-V565 HydrophobicContact CB-CG2 4.27Å; E560-V565 WeakPolarHBondContact CA-O 3.31Å; V565-L567 HydrophobicContact CG1-CD2 4.37Å
566	T	71.5	Confident	65.9	Low	139 Å²	139	92 Å²	92	85%	0.853	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-90.1	116.5	165.3	47.9	0	0	0	0	108.6
567	L	67.6	Low	65.4	Low	24 Å²	24	94.4 Å²	94.4	13%	0.126	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-80.6	121.5	178.2	-68.3	169.1	0	0	0	109.6	L556 E560 V565 V571 Y572 L575	L556-L567 HydrophobicContact CB-CD1 4.36Å; L556-L567 HydrophobicContact CB-CD2 4.37Å; L556-L567 HydrophobicContact CD2-CD2 4.22Å; E560-L567 HydrophobicContact CB-CD1 3.88Å; E560-L567 HydrophobicContact CB-CG 4.29Å; E560-L567 HydrophobicContact CG-CD1 4.37Å; V565-L567 HydrophobicContact CG1-CD2 4.37Å; L567-V571 HydrophobicContact CD2-CB 4.26Å; L567-V571 HydrophobicContact CD2-CG1 3.66Å; L567-Y572 HydrophobicContact CB-CD2 3.99Å; L567-Y572 HydrophobicContact CB-CE2 4.2Å; L567-Y572 HydrophobicContact CD1-CE2 4.33Å; L567-L575 HydrophobicContact CD1-CD1 3.97Å
568	D	65.3	Low	64.8	Low	126 Å²	126	92.9 Å²	92.9	67%	0.674	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-63.6	156.7	173.9	-111.7	-30.2	0	0	0	111.6	E570 V571 Y572	D568-E570 PolarHBondContact O-N 2.84Å; D568-E570 VanDerWaalsContact O-N 3.14Å; D568-V571 HydrophobicContact CB-CG2 4.43Å; D568-V571 PolarHBondContact O-N 3.18Å; D568-Y572 PolarHBondContact O-N 3.4Å
569	A	52.4	Low	63.8	Low	83 Å²	83	92.6 Å²	92.6	69%	0.686	51%	0.514	S	S	*	.	H	α-helix	trans	-57	-31.7	-179	0	0	0	0	0	113.1	Y572 S573	A569-Y572 PolarHBondContact O-N 2.97Å; A569-S573 PolarHBondContact O-N 3.28Å
570	E	47.5	Very low	62.6	Low	136 Å²	136	94.3 Å²	94.3	64%	0.636	52%	0.524	S	S	*	.	H	α-helix	trans	-65.3	-43	174	-78.5	-179.7	179.2	0	0	112.2	D568 Y572 S573 Y574	D568-E570 PolarHBondContact O-N 2.84Å; D568-E570 VanDerWaalsContact O-N 3.14Å; E570-Y572 VanDerWaalsContact C-N 3.32Å; E570-Y572 PolarHBondContact O-N 3.42Å; E570-S573 PolarHBondContact O-N 3.48Å; E570-S573 PolarHBondContact O-OG 3.43Å; E570-Y574 PolarHBondContact O-N 2.91Å; E570-Y574 VanDerWaalsContact O-N 3.09Å
571	V	50	Low	61.4	Low	53 Å²	53	96.6 Å²	96.6	32%	0.321	54%	0.54	S	S	.	.	H	α-helix	trans	-69.3	-34.2	177.6	-170.5	0	0	0	0	110.4	L567 D568 S573 Y574 L575	L567-V571 HydrophobicContact CD2-CB 4.26Å; L567-V571 HydrophobicContact CD2-CG1 3.66Å; D568-V571 HydrophobicContact CB-CG2 4.43Å; D568-V571 PolarHBondContact O-N 3.18Å; V571-S573 VanDerWaalsContact C-N 3.35Å; V571-S573 PolarHBondContact O-N 3.36Å; V571-Y574 WeakPolarHBondContact O-CB 3.4Å; V571-Y574 PolarHBondContact O-N 2.91Å; V571-L575 HydrophobicContact CG1-CD1 3.98Å; V571-L575 HydrophobicContact CG1-CG 4.39Å; V571-L575 WeakPolarHBondContact O-CB 3.4Å; V571-L575 WeakPolarHBondContact O-CG 3.48Å; V571-L575 PolarHBondContact O-N 3.49Å; V571-L575 VanDerWaalsContact O-N 3.08Å
572	Y	47.7	Very low	59.9	Low	107 Å²	107	91.2 Å²	91.2	42%	0.42	52%	0.524	S	S	.	.	H	α-helix	trans	-61.8	-41	171.6	-118.6	-91.2	0	0	0	112.8	E560 L567 D568 A569 E570 Y574 L575 T576	E560-Y572 WeakPolarHBondContact OE1-CE2 3.35Å; E560-Y572 VanDerWaalsContact OE2-CE2 3.29Å; E560-Y572 WeakPolarHBondContact OE2-CE2 3.23Å; E560-Y572 PolarHBondContact OE2-OH 3.37Å; L567-Y572 HydrophobicContact CB-CD2 3.99Å; L567-Y572 HydrophobicContact CB-CE2 4.2Å; L567-Y572 HydrophobicContact CD1-CE2 4.33Å; D568-Y572 PolarHBondContact O-N 3.4Å; A569-Y572 PolarHBondContact O-N 2.97Å; E570-Y572 VanDerWaalsContact C-N 3.32Å; E570-Y572 PolarHBondContact O-N 3.42Å; Y572-Y574 VanDerWaalsContact C-N 3.29Å; Y572-Y574 PolarHBondContact O-N 3.28Å; Y572-L575 PolarHBondContact O-N 2.93Å; Y572-T576 PolarHBondContact O-N 2.98Å; Y572-T576 VanDerWaalsContact O-N 3.12Å; Y572-T576 PolarHBondContact O-OG1 3.3Å
573	S	44.2	Very low	57.8	Low	77 Å²	77	90.4 Å²	90.4	54%	0.538	52%	0.524	S	S	.	.	H	α-helix	trans	-66.7	-30.5	176	89.1	0	0	0	0	112.9	A569 E570 V571 L575	A569-S573 PolarHBondContact O-N 3.28Å; E570-S573 PolarHBondContact O-N 3.48Å; E570-S573 PolarHBondContact O-OG 3.43Å; V571-S573 VanDerWaalsContact C-N 3.35Å; V571-S573 PolarHBondContact O-N 3.36Å; S573-L575 VanDerWaalsContact C-N 3.33Å
574	Y	44.4	Very low	55.9	Low	123 Å²	123	92.3 Å²	92.3	48%	0.482	51%	0.512	S	S	.	.	H	α-helix	trans	-73.5	-24.5	173.9	-175	-99.3	0	0	0	112.8	E570 V571 Y572	E570-Y574 PolarHBondContact O-N 2.91Å; E570-Y574 VanDerWaalsContact O-N 3.09Å; V571-Y574 WeakPolarHBondContact O-CB 3.4Å; V571-Y574 PolarHBondContact O-N 2.91Å; Y572-Y574 VanDerWaalsContact C-N 3.29Å; Y572-Y574 PolarHBondContact O-N 3.28Å
575	L	39.2	Very low	53.8	Low	7 Å²	7	89.9 Å²	89.9	4%	0.037	50%	0.502	C	S	.	.	H	α-helix	trans	-98.6	-5.6	-177.6	-64.9	171.8	0	0	0	114.3	R553 L556 R557 L567 V571 Y572 S573	R553-L575 HydrophobicContact CB-CD2 3.73Å; R553-L575 HydrophobicContact CG-CB 4.45Å; R553-L575 HydrophobicContact CG-CD2 3.76Å; R553-L575 PolarHBondContact NE-O 3.43Å; R553-L575 VanDerWaalsContact NE-O 3.17Å; R553-L575 PolarHBondContact NH1-O 2.94Å; R553-L575 VanDerWaalsContact NH1-O 3.15Å; R553-L575 PolarHBondContact NH2-O 2.87Å; L556-L575 HydrophobicContact CB-CD1 4.3Å; L556-L575 HydrophobicContact CD1-CD1 4.29Å; L556-L575 HydrophobicContact CD1-CD2 4.1Å; R557-L575 PolarHBondContact NH2-O 3.36Å; L567-L575 HydrophobicContact CD1-CD1 3.97Å; V571-L575 HydrophobicContact CG1-CD1 3.98Å; V571-L575 HydrophobicContact CG1-CG 4.39Å; V571-L575 WeakPolarHBondContact O-CB 3.4Å; V571-L575 WeakPolarHBondContact O-CG 3.48Å; V571-L575 PolarHBondContact O-N 3.49Å; V571-L575 VanDerWaalsContact O-N 3.08Å; Y572-L575 PolarHBondContact O-N 2.93Å; S573-L575 VanDerWaalsContact C-N 3.33Å
576	T	37.5	Very low	51.6	Low	143 Å²	143	92.5 Å²	92.5	88%	0.877	51%	0.514	S	S	*	.			trans	-92.1	0	169.6	16.1	0	0	0	0	109.8	Y572	Y572-T576 PolarHBondContact O-N 2.98Å; Y572-T576 VanDerWaalsContact O-N 3.12Å; Y572-T576 PolarHBondContact O-OG1 3.3Å

Retrieved 576 of 576 residues in 1149.9 ms (Link to these results)

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